#################################################################### # DELTA # # Database for Extended Ligand-Target Analyses # # 2025 # #################################################################### @MOLECULE 8hcq_min 5126 5188 313 0 0 SMALL USER_CHARGES File created by VEGA ZZ 3.2.4 @ATOM 1 N 122.2310 122.5090 150.3980 N.4 1 HIS1 -0.0637 2 CA 122.6370 122.9440 149.0660 C.3 1 HIS1 0.1983 3 ND1 121.6480 125.1090 150.8850 N.ar 1 HIS1 -0.2469 4 CG 121.8080 125.2720 149.5530 C.ar 1 HIS1 0.0556 5 CB 121.7740 124.1260 148.5680 C.3 1 HIS1 0.0270 6 NE2 121.8980 127.2850 150.4720 N.ar 1 HIS1 -0.2539 7 CD2 121.9560 126.6420 149.2850 C.ar 1 HIS1 0.0047 8 CE1 121.7130 126.3440 151.4150 C.ar 1 HIS1 0.0737 9 C 124.1470 123.1560 148.9860 C.2 1 HIS1 0.2319 10 O 124.9080 122.4940 149.6930 O.2 1 HIS1 -0.2773 11 H1 122.8450 121.7270 150.7080 H 1 HIS1 0.2751 12 H2 121.2350 122.2080 150.3980 H 1 HIS1 0.2751 13 H3 122.3480 123.3030 151.0640 H 1 HIS1 0.2751 14 HA 122.4480 122.1020 148.3970 H 1 HIS1 0.0694 15 HB1 120.7350 123.8070 148.4740 H 1 HIS1 0.0353 16 HB2 122.0630 124.4730 147.5750 H 1 HIS1 0.0353 17 HE2 121.9720 128.2520 150.6210 H 1 HIS1 0.1339 18 HD2 122.0920 127.1010 148.3150 H 1 HIS1 0.0764 19 HE1 121.6270 126.5610 152.4710 H 1 HIS1 0.0963 20 N 124.5660 124.0700 148.1060 N.am 2 ASN2 -0.2448 21 CA 125.9730 124.4020 147.9050 C.3 2 ASN2 0.0957 22 CB 126.6030 124.9770 149.1960 C.3 2 ASN2 0.0446 23 CG 125.6770 125.9990 149.8680 C.2 2 ASN2 0.2000 24 OD1 124.7830 125.6460 150.6240 O.2 2 ASN2 -0.2797 25 ND2 125.9400 127.2750 149.5490 N.am 2 ASN2 -0.2723 26 C 126.7550 123.1990 147.3890 C.2 2 ASN2 0.2191 27 O 126.1690 122.2520 146.8560 O.2 2 ASN2 -0.2778 28 H 123.8680 124.5600 147.5470 H 2 ASN2 0.1312 29 HA 125.9830 125.1590 147.1200 H 2 ASN2 0.0562 30 HB1 127.5620 125.4540 148.9870 H 2 ASN2 0.0375 31 HB2 126.7950 124.1880 149.9240 H 2 ASN2 0.0375 32 HD21 125.3810 128.0020 149.9480 H 2 ASN2 0.1266 33 HD22 126.6840 127.5230 148.9300 H 2 ASN2 0.1266 34 N 128.0780 123.2300 147.5390 N.am 3 TYR3 -0.2453 35 CA 128.9270 122.1940 146.9720 C.3 3 TYR3 0.0917 36 CB 130.3850 122.6980 146.9130 C.3 3 TYR3 -0.0036 37 CG 131.1190 122.2350 145.6760 C.ar 3 TYR3 -0.0453 38 CD1 130.6650 122.6010 144.4110 C.ar 3 TYR3 -0.0561 39 CD2 132.2770 121.4690 145.7740 C.ar 3 TYR3 -0.0561 40 CE1 131.3500 122.2120 143.2680 C.ar 3 TYR3 -0.0317 41 CE2 132.9570 121.0640 144.6300 C.ar 3 TYR3 -0.0317 42 CZ 132.4960 121.4410 143.3770 C.ar 3 TYR3 0.0726 43 OH 133.1770 121.0530 142.2410 O.3 3 TYR3 -0.3598 44 C 128.7470 120.8660 147.7060 C.2 3 TYR3 0.2190 45 O 127.9730 120.7330 148.6580 O.2 3 TYR3 -0.2778 46 H 128.5040 123.9950 148.0620 H 3 TYR3 0.1312 47 HA 128.5510 122.0400 145.9590 H 3 TYR3 0.0560 48 HB1 130.9350 122.4230 147.8140 H 3 TYR3 0.0333 49 HB2 130.3900 123.7880 146.8850 H 3 TYR3 0.0333 50 HD1 129.7710 123.1990 144.3090 H 3 TYR3 0.0621 51 HD2 132.6550 121.1800 146.7440 H 3 TYR3 0.0621 52 HE1 130.9900 122.5090 142.2940 H 3 TYR3 0.0643 53 HE2 133.8500 120.4640 144.7160 H 3 TYR3 0.0643 54 HH 132.8080 121.4900 141.4840 H 3 TYR3 0.2173 55 N 129.4910 119.8780 147.2360 N.am 4 CYS4 -0.2448 56 CA 129.5780 118.5350 147.7800 C.3 4 CYS4 0.0967 57 CB 128.8830 117.5810 146.7910 C.3 4 CYS4 0.0147 58 SG 127.0880 117.8160 146.7200 S.3 4 CYS4 -0.1762 59 C 131.0500 118.1780 147.9070 C.2 4 CYS4 0.2221 60 O 131.8970 118.7710 147.2310 O.2 4 CYS4 -0.2775 61 H 130.0580 120.0790 146.4120 H 4 CYS4 0.1312 62 HA 129.1050 118.5230 148.7630 H 4 CYS4 0.0565 63 HB1 129.0780 116.5370 147.0350 H 4 CYS4 0.0394 64 HB2 129.2920 117.7330 145.7910 H 4 CYS4 0.0394 65 HG 126.5790 117.1180 145.7030 H 4 CYS4 0.1017 66 N 131.3940 117.2210 148.7730 N.am 5 PRO5 -0.2315 67 CA 132.8160 116.8810 148.9550 C.3 5 PRO5 0.0907 68 CD 130.4830 116.4760 149.6280 C.3 5 PRO5 0.0071 69 CB 132.7730 115.8150 150.0600 C.3 5 PRO5 -0.0276 70 CG 131.3390 115.2830 150.0530 C.3 5 PRO5 -0.0379 71 C 133.4960 116.3780 147.6920 C.2 5 PRO5 0.2189 72 O 134.7240 116.4850 147.5880 O.2 5 PRO5 -0.2778 73 HA 133.3370 117.7790 149.2930 H 5 PRO5 0.0559 74 HD1 129.5750 116.2100 149.0960 H 5 PRO5 0.0431 75 HD2 130.2410 117.1260 150.4710 H 5 PRO5 0.0431 76 HB1 132.9690 116.2930 151.0200 H 5 PRO5 0.0285 77 HB2 133.5150 115.0240 149.9390 H 5 PRO5 0.0285 78 HG1 131.2600 114.4920 149.3060 H 5 PRO5 0.0278 79 HG2 131.0380 114.8710 151.0160 H 5 PRO5 0.0278 80 N 132.7480 115.8390 146.7320 N.am 6 GLN6 -0.2456 81 CA 133.3200 115.3610 145.4830 C.3 6 GLN6 0.0882 82 CB 133.3220 113.8190 145.5440 C.3 6 GLN6 -0.0210 83 CG 133.8590 113.0900 144.2930 C.3 6 GLN6 0.0225 84 CD 132.7210 112.5630 143.3970 C.2 6 GLN6 0.1981 85 OE1 131.8880 113.3090 142.9040 O.2 6 GLN6 -0.2798 86 NE2 132.7320 111.2340 143.2210 N.am 6 GLN6 -0.2724 87 C 132.5080 115.8990 144.3150 C.2 6 GLN6 0.2187 88 O 131.3110 116.1680 144.4430 O.2 6 GLN6 -0.2778 89 H 131.7410 115.7590 146.8770 H 6 GLN6 0.1312 90 HA 134.3400 115.7380 145.3790 H 6 GLN6 0.0557 91 HB1 132.3270 113.4540 145.8040 H 6 GLN6 0.0289 92 HB2 133.9520 113.5360 146.3890 H 6 GLN6 0.0289 93 HG1 134.4660 112.2380 144.6020 H 6 GLN6 0.0356 94 HG2 134.5120 113.7300 143.7010 H 6 GLN6 0.0356 95 HE21 132.0270 110.8050 142.6580 H 6 GLN6 0.1266 96 HE22 133.4300 110.6560 143.6410 H 6 GLN6 0.1266 97 N 133.1740 116.0540 143.1710 N.am 7 GLN7 -0.2456 98 CA 132.5140 116.5370 141.9640 C.3 7 GLN7 0.0882 99 CB 132.8700 118.0210 141.7600 C.3 7 GLN7 -0.0210 100 CG 134.2840 118.3030 141.2080 C.3 7 GLN7 0.0225 101 CD 134.2420 118.7690 139.7430 C.2 7 GLN7 0.1981 102 OE1 133.2370 118.6530 139.0540 O.2 7 GLN7 -0.2798 103 NE2 135.3940 119.3030 139.3140 N.am 7 GLN7 -0.2724 104 C 132.7970 115.6030 140.7930 C.2 7 GLN7 0.2188 105 O 133.3700 114.5250 140.9850 O.2 7 GLN7 -0.2778 106 H 134.1680 115.8300 143.1390 H 7 GLN7 0.1312 107 HA 131.4380 116.4720 142.1250 H 7 GLN7 0.0557 108 HB1 132.7850 118.5060 142.7330 H 7 GLN7 0.0289 109 HB2 132.1000 118.5070 141.1600 H 7 GLN7 0.0289 110 HG1 134.9280 117.4270 141.2860 H 7 GLN7 0.0356 111 HG2 134.7590 119.0910 141.7920 H 7 GLN7 0.0356 112 HE21 135.4570 119.6430 138.3760 H 7 GLN7 0.1266 113 HE22 136.1950 119.3730 139.9080 H 7 GLN7 0.1266 114 N 132.3850 116.0070 139.5860 N.am 8 THR8 -0.2434 115 CA 132.4490 115.1970 138.3680 C.3 8 THR8 0.1135 116 CB 133.8830 114.8130 137.9190 C.3 8 THR8 0.0763 117 OG1 134.3400 113.6860 138.6470 O.3 8 THR8 -0.3900 118 CG2 134.8750 115.9810 138.0300 C.3 8 THR8 -0.0370 119 C 131.5630 113.9590 138.4620 C.2 8 THR8 0.2212 120 O 131.2410 113.4910 139.5590 O.2 8 THR8 -0.2777 121 H 131.9980 116.9480 139.5090 H 8 THR8 0.1313 122 HA 132.0230 115.8460 137.6030 H 8 THR8 0.0583 123 HB 133.8150 114.5260 136.8630 H 8 THR8 0.0611 124 HG1 135.2280 113.4480 138.3980 H 8 THR8 0.2098 125 HG21 135.8240 115.7510 137.5450 H 8 THR8 0.0255 126 HG22 135.0900 116.2170 139.0710 H 8 THR8 0.0255 127 HG23 134.4800 116.8750 137.5480 H 8 THR8 0.0255 128 N 131.1600 113.4300 137.3180 N.am 9 LYS9 -0.2456 129 CA 130.3260 112.2340 137.2680 C.3 9 LYS9 0.0878 130 CB 128.8810 112.5960 136.8670 C.3 9 LYS9 -0.0289 131 CG 128.0850 113.2620 138.0060 C.3 9 LYS9 -0.0496 132 CD 128.2740 114.7840 138.1200 C.3 9 LYS9 -0.0278 133 CE 128.1600 115.2800 139.5690 C.3 9 LYS9 0.1103 134 NZ 129.2580 114.8050 140.4140 N.4 9 LYS9 -0.0749 135 C 130.8950 111.1510 136.3650 C.2 9 LYS9 0.2187 136 O 130.7560 109.9660 136.6760 O.2 9 LYS9 -0.2778 137 H 131.4420 113.8730 136.4430 H 9 LYS9 0.1312 138 HA 130.3190 111.7730 138.2550 H 9 LYS9 0.0557 139 HB1 128.3550 111.6790 136.5960 H 9 LYS9 0.0285 140 HB2 128.8780 113.2170 135.9710 H 9 LYS9 0.0285 141 HG1 128.3490 112.7840 138.9470 H 9 LYS9 0.0266 142 HG2 127.0220 113.0550 137.8710 H 9 LYS9 0.0266 143 HD1 127.5220 115.2770 137.5020 H 9 LYS9 0.0282 144 HD2 129.2300 115.0990 137.7080 H 9 LYS9 0.0282 145 HE1 127.2180 114.9530 140.0140 H 9 LYS9 0.0559 146 HE2 128.1680 116.3710 139.5920 H 9 LYS9 0.0559 147 HZ1 129.1740 115.1870 141.3780 H 9 LYS9 0.2742 148 HZ2 130.1830 115.0720 140.0200 H 9 LYS9 0.2742 149 HZ3 129.2550 113.7640 140.4710 H 9 LYS9 0.2742 150 N 131.5310 111.5260 135.2560 N.am 10 ILE10 -0.2454 151 CA 132.0640 110.5590 134.3040 C.3 10 ILE10 0.0903 152 CB 132.0970 111.1370 132.8690 C.3 10 ILE10 -0.0201 153 CG1 133.0140 112.3680 132.6850 C.3 10 ILE10 -0.0514 154 CG2 130.6680 111.4540 132.4010 C.3 10 ILE10 -0.0605 155 CD1 134.5010 112.0300 132.4990 C.3 10 ILE10 -0.0650 156 C 133.4220 110.0600 134.7780 C.2 10 ILE10 0.2190 157 O 134.0470 110.6600 135.6600 O.2 10 ILE10 -0.2778 158 H 131.6490 112.5210 135.0670 H 10 ILE10 0.1312 159 HA 131.3920 109.6980 134.3080 H 10 ILE10 0.0560 160 HB 132.4610 110.3540 132.2010 H 10 ILE10 0.0318 161 HG11 132.8870 113.0720 133.5070 H 10 ILE10 0.0266 162 HG12 132.6970 112.9030 131.7890 H 10 ILE10 0.0266 163 HG21 130.6560 111.7660 131.3560 H 10 ILE10 0.0233 164 HG22 130.2180 112.2530 132.9900 H 10 ILE10 0.0233 165 HG23 130.0290 110.5750 132.4830 H 10 ILE10 0.0233 166 HD11 135.0590 112.9170 132.1990 H 10 ILE10 0.0230 167 HD12 134.6400 111.2750 131.7240 H 10 ILE10 0.0230 168 HD13 134.9600 111.6610 133.4140 H 10 ILE10 0.0230 169 N 133.8840 108.9580 134.1930 N.am 11 THR11 -0.2434 170 CA 135.2110 108.4220 134.4460 C.3 11 THR11 0.1135 171 CB 135.1220 107.0050 135.0470 C.3 11 THR11 0.0763 172 OG1 134.6480 106.0920 134.0690 O.3 11 THR11 -0.3900 173 CG2 134.2340 106.9840 136.3040 C.3 11 THR11 -0.0370 174 C 136.0040 108.4160 133.1470 C.2 11 THR11 0.2213 175 O 135.4350 108.3150 132.0550 O.2 11 THR11 -0.2777 176 H 133.2780 108.4660 133.5360 H 11 THR11 0.1313 177 HA 135.7280 109.0770 135.1500 H 11 THR11 0.0583 178 HB 136.1380 106.7120 135.3360 H 11 THR11 0.0611 179 HG1 134.5410 105.2240 134.4490 H 11 THR11 0.2098 180 HG21 134.2950 106.0310 136.8290 H 11 THR11 0.0255 181 HG22 133.1860 107.1580 136.0560 H 11 THR11 0.0255 182 HG23 134.5390 107.7590 137.0080 H 11 THR11 0.0255 183 N 137.3270 108.5340 133.2750 N.am 12 SER12 -0.2435 184 CA 138.1810 108.5970 132.0920 C.3 12 SER12 0.1109 185 CB 139.6290 108.8840 132.5140 C.3 12 SER12 0.0681 186 OG 140.4070 109.2270 131.3740 O.3 12 SER12 -0.3930 187 C 138.0970 107.3130 131.2760 C.2 12 SER12 0.2209 188 O 138.0640 107.3560 130.0400 O.2 12 SER12 -0.2777 189 H 137.7440 108.5800 134.2050 H 12 SER12 0.1312 190 HA 137.8100 109.4170 131.4750 H 12 SER12 0.0580 191 HB1 140.0480 108.0130 133.0330 H 12 SER12 0.0577 192 HB2 139.6340 109.7210 133.2200 H 12 SER12 0.0577 193 HG 141.3310 109.3180 131.6010 H 12 SER12 0.2095 194 N 138.0690 106.1600 131.9490 N.am 13 ALA13 -0.2459 195 CA 138.0020 104.8890 131.2350 C.3 13 ALA13 0.0850 196 CB 138.1400 103.7430 132.2430 C.3 13 ALA13 -0.0411 197 C 136.6990 104.7550 130.4550 C.2 13 ALA13 0.2184 198 O 136.7040 104.3220 129.2970 O.2 13 ALA13 -0.2778 199 H 138.0950 106.1680 132.9690 H 13 ALA13 0.1312 200 HA 138.8320 104.8670 130.5260 H 13 ALA13 0.0554 201 HB1 138.1200 102.7730 131.7440 H 13 ALA13 0.0249 202 HB2 137.3340 103.7590 132.9790 H 13 ALA13 0.0249 203 HB3 139.0830 103.8150 132.7840 H 13 ALA13 0.0249 204 N 135.5730 105.1270 131.0690 N.am 14 PHE14 -0.2453 205 CA 134.2830 104.9790 130.4020 C.3 14 PHE14 0.0917 206 CB 133.1570 105.2570 131.4120 C.3 14 PHE14 -0.0036 207 CG 131.7940 105.1230 130.7820 C.ar 14 PHE14 -0.0454 208 CD1 130.9860 106.2410 130.5940 C.ar 14 PHE14 -0.0585 209 CD2 131.3630 103.8890 130.3070 C.ar 14 PHE14 -0.0585 210 CE1 129.7620 106.1240 129.9480 C.ar 14 PHE14 -0.0615 211 CE2 130.1480 103.7740 129.6470 C.ar 14 PHE14 -0.0615 212 CZ 129.3410 104.8890 129.4750 C.ar 14 PHE14 -0.0617 213 C 134.1550 105.9120 129.2050 C.2 14 PHE14 0.2190 214 O 133.4610 105.5810 128.2370 O.2 14 PHE14 -0.2778 215 H 135.6150 105.5170 132.0110 H 14 PHE14 0.1312 216 HA 134.2120 103.9490 130.0640 H 14 PHE14 0.0560 217 HB1 133.2700 106.2530 131.8420 H 14 PHE14 0.0333 218 HB2 133.2220 104.5510 132.2390 H 14 PHE14 0.0333 219 HD1 131.3110 107.2110 130.9400 H 14 PHE14 0.0620 220 HD2 131.9870 103.0160 130.4220 H 14 PHE14 0.0620 221 HE1 129.1380 106.9950 129.8140 H 14 PHE14 0.0618 222 HE2 129.8410 102.8150 129.2580 H 14 PHE14 0.0618 223 HZ 128.3920 104.7990 128.9650 H 14 PHE14 0.0618 224 N 134.8090 107.0740 129.2510 N.am 15 LYS15 -0.2456 225 CA 134.7160 108.0210 128.1450 C.3 15 LYS15 0.0878 226 CB 135.5450 109.1730 128.6960 C.3 15 LYS15 -0.0289 227 CG 135.6780 110.3700 127.7860 C.3 15 LYS15 -0.0496 228 CD 136.6800 111.3380 128.4080 C.3 15 LYS15 -0.0278 229 CE 136.7660 112.5620 127.5330 C.3 15 LYS15 0.1103 230 NZ 137.8490 113.4860 127.8360 N.4 15 LYS15 -0.0749 231 C 135.3100 107.4450 126.8650 C.2 15 LYS15 0.2187 232 O 134.7600 107.6430 125.7760 O.2 15 LYS15 -0.2778 233 H 135.3790 107.3020 130.0660 H 15 LYS15 0.1312 234 HA 133.6680 108.2880 127.9950 H 15 LYS15 0.0557 235 HB1 136.5450 108.8090 128.9280 H 15 LYS15 0.0285 236 HB2 135.1180 109.4990 129.6460 H 15 LYS15 0.0285 237 HG1 134.7050 110.8430 127.6480 H 15 LYS15 0.0266 238 HG2 136.0250 110.0620 126.7990 H 15 LYS15 0.0266 239 HD1 137.6480 110.8570 128.5170 H 15 LYS15 0.0282 240 HD2 136.3610 111.6190 129.4130 H 15 LYS15 0.0282 241 HE1 135.8100 113.0660 127.6710 H 15 LYS15 0.0559 242 HE2 136.8700 112.2770 126.4840 H 15 LYS15 0.0559 243 HZ1 137.7420 114.3320 127.2370 H 15 LYS15 0.2742 244 HZ2 138.7620 113.0240 127.6360 H 15 LYS15 0.2742 245 HZ3 137.8040 113.7660 128.8350 H 15 LYS15 0.2742 246 N 136.4310 106.7320 126.9740 N.am 16 TYR16 -0.2453 247 CA 137.1390 106.2310 125.8030 C.3 16 TYR16 0.0917 248 CB 138.6550 106.2770 126.0450 C.3 16 TYR16 -0.0036 249 CG 139.1020 107.6920 126.3450 C.ar 16 TYR16 -0.0453 250 CD1 138.8460 108.7270 125.4450 C.ar 16 TYR16 -0.0561 251 CD2 139.7250 108.0020 127.5500 C.ar 16 TYR16 -0.0561 252 CE1 139.1420 110.0460 125.7690 C.ar 16 TYR16 -0.0317 253 CE2 140.0390 109.3180 127.8700 C.ar 16 TYR16 -0.0317 254 CZ 139.7280 110.3450 126.9890 C.ar 16 TYR16 0.0726 255 OH 139.9560 111.6620 127.3520 O.3 16 TYR16 -0.3598 256 C 136.5850 104.8980 125.3060 C.2 16 TYR16 0.2190 257 O 136.4480 104.6970 124.0950 O.2 16 TYR16 -0.2778 258 H 136.8030 106.5320 127.9020 H 16 TYR16 0.1312 259 HA 136.9180 106.9180 124.9850 H 16 TYR16 0.0560 260 HB1 139.1920 105.9210 125.1650 H 16 TYR16 0.0333 261 HB2 138.9220 105.6160 126.8700 H 16 TYR16 0.0333 262 HD1 138.3770 108.5160 124.4940 H 16 TYR16 0.0621 263 HD2 139.9380 107.2190 128.2650 H 16 TYR16 0.0621 264 HE1 138.9050 110.8360 125.0730 H 16 TYR16 0.0643 265 HE2 140.4920 109.5410 128.8240 H 16 TYR16 0.0643 266 HH 140.7860 111.6870 127.8180 H 16 TYR16 0.2173 267 N 136.2680 103.9770 126.2200 N.am 17 ILE17 -0.2454 268 CA 135.8510 102.6370 125.8110 C.3 17 ILE17 0.0903 269 CB 135.8380 101.6630 127.0080 C.3 17 ILE17 -0.0201 270 CG1 134.7790 102.0520 128.0590 C.3 17 ILE17 -0.0514 271 CG2 137.2520 101.5240 127.5970 C.3 17 ILE17 -0.0605 272 CD1 134.8680 101.2690 129.3740 C.3 17 ILE17 -0.0650 273 C 134.5050 102.6870 125.0950 C.2 17 ILE17 0.2189 274 O 134.2510 101.9180 124.1620 O.2 17 ILE17 -0.2778 275 H 136.3170 104.2100 127.2120 H 17 ILE17 0.1312 276 HA 136.5860 102.2890 125.0820 H 17 ILE17 0.0560 277 HB 135.5660 100.6760 126.6290 H 17 ILE17 0.0318 278 HG11 133.7830 101.8980 127.6410 H 17 ILE17 0.0266 279 HG12 134.8490 103.1160 128.2600 H 17 ILE17 0.0266 280 HG21 137.2950 100.7430 128.3560 H 17 ILE17 0.0233 281 HG22 137.5980 102.4500 128.0530 H 17 ILE17 0.0233 282 HG23 137.9690 101.2540 126.8220 H 17 ILE17 0.0233 283 HD11 134.0300 101.5140 130.0260 H 17 ILE17 0.0230 284 HD12 135.7830 101.5080 129.9160 H 17 ILE17 0.0230 285 HD13 134.8470 100.1940 129.1940 H 17 ILE17 0.0230 286 N 133.6170 103.5850 125.5280 N.am 18 ASN18 -0.2452 287 CA 132.3230 103.7010 124.8650 C.3 18 ASN18 0.0957 288 CB 131.3800 104.4310 125.8370 C.3 18 ASN18 0.0446 289 CG 129.9160 104.3510 125.3800 C.2 18 ASN18 0.2000 290 OD1 129.5150 104.9880 124.4190 O.2 18 ASN18 -0.2797 291 ND2 129.1460 103.5430 126.1220 N.am 18 ASN18 -0.2723 292 C 132.4510 104.4650 123.5520 C.2 18 ASN18 0.2192 293 O 131.6640 104.2430 122.6250 O.2 18 ASN18 -0.2778 294 H 133.8430 104.1880 126.3190 H 18 ASN18 0.1312 295 HA 131.9440 102.6970 124.7060 H 18 ASN18 0.0562 296 HB1 131.6570 105.4800 125.9430 H 18 ASN18 0.0375 297 HB2 131.4570 103.9900 126.8320 H 18 ASN18 0.0375 298 HD21 128.1800 103.4630 125.8730 H 18 ASN18 0.1266 299 HD22 129.5020 103.0320 126.9020 H 18 ASN18 0.1266 300 N 133.4430 105.3530 123.4500 N.am 19 THR19 -0.2434 301 CA 133.5790 106.1890 122.2610 C.3 19 THR19 0.1135 302 CB 134.7000 107.2360 122.4480 C.3 19 THR19 0.0763 303 OG1 134.2610 108.2810 123.2930 O.3 19 THR19 -0.3900 304 CG2 135.1340 107.9310 121.1480 C.3 19 THR19 -0.0370 305 C 133.8230 105.3450 121.0150 C.2 19 THR19 0.2212 306 O 133.2440 105.6030 119.9530 O.2 19 THR19 -0.2777 307 H 134.1140 105.4480 124.2120 H 19 THR19 0.1313 308 HA 132.6260 106.7020 122.1200 H 19 THR19 0.0583 309 HB 135.5850 106.7610 122.8830 H 19 THR19 0.0611 310 HG1 133.9180 107.9230 124.1060 H 19 THR19 0.2098 311 HG21 135.8780 108.7000 121.3520 H 19 THR19 0.0255 312 HG22 134.2850 108.4090 120.6580 H 19 THR19 0.0255 313 HG23 135.5830 107.2330 120.4420 H 19 THR19 0.0255 314 N 134.6750 104.3240 121.1270 N.am 20 VAL20 -0.2453 315 CA 134.9740 103.4880 119.9690 C.3 20 VAL20 0.0901 316 CB 136.2230 102.6240 120.2480 C.3 20 VAL20 -0.0227 317 CG1 137.4760 103.5050 120.3600 C.3 20 VAL20 -0.0608 318 CG2 136.0930 101.7400 121.4990 C.3 20 VAL20 -0.0608 319 C 133.7550 102.6610 119.5720 C.2 20 VAL20 0.2189 320 O 133.4740 102.4830 118.3810 O.2 20 VAL20 -0.2778 321 H 135.1180 104.1270 122.0240 H 20 VAL20 0.1312 322 HA 135.1860 104.1590 119.1340 H 20 VAL20 0.0560 323 HB 136.3700 101.9660 119.3900 H 20 VAL20 0.0315 324 HG11 138.3720 102.8960 120.4800 H 20 VAL20 0.0233 325 HG12 137.4160 104.1760 121.2170 H 20 VAL20 0.0233 326 HG13 137.6090 104.1160 119.4660 H 20 VAL20 0.0233 327 HG21 136.9810 101.1220 121.6290 H 20 VAL20 0.0233 328 HG22 135.2400 101.0650 121.4370 H 20 VAL20 0.0233 329 HG23 135.9840 102.3420 122.4010 H 20 VAL20 0.0233 330 N 133.0120 102.1440 120.5540 N.am 21 ILE21 -0.2454 331 CA 131.7890 101.4180 120.2250 C.3 21 ILE21 0.0903 332 CB 131.3170 100.4870 121.3570 C.3 21 ILE21 -0.0201 333 CG1 131.0440 101.2520 122.6540 C.3 21 ILE21 -0.0514 334 CG2 132.3400 99.3610 121.5800 C.3 21 ILE21 -0.0605 335 CD1 130.4160 100.4040 123.7660 C.3 21 ILE21 -0.0650 336 C 130.7140 102.3820 119.7390 C.2 21 ILE21 0.2190 337 O 129.8360 101.9990 118.9560 O.2 21 ILE21 -0.2778 338 H 133.2970 102.2560 121.5270 H 21 ILE21 0.1312 339 HA 132.0340 100.7800 119.3790 H 21 ILE21 0.0560 340 HB 130.3840 100.0200 121.0370 H 21 ILE21 0.0318 341 HG11 130.3840 102.0970 122.4600 H 21 ILE21 0.0266 342 HG12 131.9940 101.6550 122.9870 H 21 ILE21 0.0266 343 HG21 131.9660 98.6130 122.2780 H 21 ILE21 0.0233 344 HG22 133.2760 99.7500 121.9820 H 21 ILE21 0.0233 345 HG23 132.5680 98.8460 120.6470 H 21 ILE21 0.0233 346 HD11 130.1850 101.0210 124.6350 H 21 ILE21 0.0230 347 HD12 131.0890 99.6130 124.0970 H 21 ILE21 0.0230 348 HD13 129.4870 99.9440 123.4310 H 21 ILE21 0.0230 349 N 130.7560 103.6400 120.1890 N.am 22 SER22 -0.2436 350 CA 129.8550 104.6500 119.6440 C.3 22 SER22 0.1109 351 CB 129.8760 105.9270 120.4910 C.3 22 SER22 0.0681 352 OG 129.2160 105.6570 121.7190 O.3 22 SER22 -0.3930 353 C 130.1880 104.9480 118.1880 C.2 22 SER22 0.2209 354 O 129.2900 105.1780 117.3700 O.2 22 SER22 -0.2777 355 H 131.4220 103.8960 120.9180 H 22 SER22 0.1312 356 HA 128.8480 104.2420 119.7000 H 22 SER22 0.0580 357 HB1 129.3400 106.7270 119.9700 H 22 SER22 0.0577 358 HB2 130.9060 106.2550 120.6570 H 22 SER22 0.0577 359 HG 129.2790 106.3870 122.3300 H 22 SER22 0.2095 360 N 131.4780 104.9690 117.8490 N.am 23 CYS23 -0.2448 361 CA 131.8680 105.1090 116.4500 C.3 23 CYS23 0.0965 362 CB 133.3640 105.4410 116.3850 C.3 23 CYS23 0.0147 363 SG 133.7740 107.0260 117.1630 S.3 23 CYS23 -0.1762 364 C 131.5800 103.8300 115.6730 C.2 23 CYS23 0.2195 365 O 131.1980 103.8810 114.4980 O.2 23 CYS23 -0.2778 366 H 132.1950 104.8870 118.5700 H 23 CYS23 0.1312 367 HA 131.2870 105.9240 116.0150 H 23 CYS23 0.0565 368 HB1 133.6960 105.4760 115.3460 H 23 CYS23 0.0394 369 HB2 133.9430 104.6560 116.8730 H 23 CYS23 0.0394 370 HG 135.0950 107.2150 117.1230 H 23 CYS23 0.1017 371 N 131.7660 102.6720 116.3120 N.am 24 THR24 -0.2434 372 CA 131.4930 101.4010 115.6480 C.3 24 THR24 0.1135 373 CB 131.9690 100.2050 116.4950 C.3 24 THR24 0.0763 374 OG1 133.3600 100.3590 116.7220 O.3 24 THR24 -0.3900 375 CG2 131.7220 98.8500 115.8040 C.3 24 THR24 -0.0370 376 C 130.0120 101.2600 115.3190 C.2 24 THR24 0.2212 377 O 129.6460 100.8030 114.2300 O.2 24 THR24 -0.2777 378 H 132.1030 102.6760 117.2750 H 24 THR24 0.1313 379 HA 132.0570 101.4080 114.7160 H 24 THR24 0.0583 380 HB 131.4220 100.2310 117.4420 H 24 THR24 0.0611 381 HG1 133.6870 99.6960 117.3210 H 24 THR24 0.2098 382 HG21 132.0660 98.0150 116.4140 H 24 THR24 0.0255 383 HG22 132.2450 98.8020 114.8480 H 24 THR24 0.0255 384 HG23 130.6630 98.6830 115.6120 H 24 THR24 0.0255 385 N 129.1410 101.6430 116.2550 N.am 25 ILE25 -0.2453 386 CA 127.7080 101.5690 115.9940 C.3 25 ILE25 0.0903 387 CB 126.8910 101.7030 117.3000 C.3 25 ILE25 -0.0201 388 CG1 125.4070 101.3610 117.0890 C.3 25 ILE25 -0.0514 389 CG2 127.0310 103.0860 117.9390 C.3 25 ILE25 -0.0605 390 CD1 124.5970 101.4020 118.3870 C.3 25 ILE25 -0.0650 391 C 127.2960 102.6260 114.9770 C.2 25 ILE25 0.2189 392 O 126.3130 102.4490 114.2470 O.2 25 ILE25 -0.2778 393 H 129.4780 101.9880 117.1540 H 25 ILE25 0.1312 394 HA 127.5150 100.5790 115.5870 H 25 ILE25 0.0560 395 HB 127.3010 100.9760 118.0030 H 25 ILE25 0.0318 396 HG11 125.3200 100.3700 116.6440 H 25 ILE25 0.0266 397 HG12 124.9580 102.0550 116.3780 H 25 ILE25 0.0266 398 HG21 126.6600 103.1070 118.9640 H 25 ILE25 0.0233 399 HG22 126.5130 103.8600 117.3720 H 25 ILE25 0.0233 400 HG23 128.0770 103.3430 117.9760 H 25 ILE25 0.0233 401 HD11 123.5700 101.1270 118.1820 H 25 ILE25 0.0230 402 HD12 124.5730 102.4000 118.8240 H 25 ILE25 0.0230 403 HD13 124.9970 100.7130 119.1300 H 25 ILE25 0.0230 404 N 128.0340 103.7370 114.9090 N.am 26 PHE26 -0.2453 405 CA 127.7240 104.7840 113.9420 C.3 26 PHE26 0.0917 406 CB 128.5750 106.0120 114.3040 C.3 26 PHE26 -0.0036 407 CG 128.2580 107.2260 113.4770 C.ar 26 PHE26 -0.0454 408 CD1 127.0240 107.8540 113.6030 C.ar 26 PHE26 -0.0585 409 CD2 129.2100 107.7710 112.6220 C.ar 26 PHE26 -0.0585 410 CE1 126.7370 108.9960 112.8710 C.ar 26 PHE26 -0.0615 411 CE2 128.9300 108.9220 111.8970 C.ar 26 PHE26 -0.0615 412 CZ 127.6860 109.5260 112.0090 C.ar 26 PHE26 -0.0617 413 C 127.9870 104.2810 112.5250 C.2 26 PHE26 0.2190 414 O 127.1220 104.3840 111.6470 O.2 26 PHE26 -0.2778 415 H 128.8250 103.8550 115.5420 H 26 PHE26 0.1312 416 HA 126.6610 105.0120 114.0400 H 26 PHE26 0.0560 417 HB1 129.6360 105.7810 114.2260 H 26 PHE26 0.0333 418 HB2 128.3980 106.2750 115.3470 H 26 PHE26 0.0333 419 HD1 126.2830 107.4580 114.2820 H 26 PHE26 0.0620 420 HD2 130.1790 107.3040 112.5220 H 26 PHE26 0.0620 421 HE1 125.7800 109.4770 112.9890 H 26 PHE26 0.0618 422 HE2 129.6740 109.3380 111.2340 H 26 PHE26 0.0618 423 HZ 127.4610 110.4170 111.4400 H 26 PHE26 0.0618 424 N 129.1660 103.6970 112.2970 N.am 27 ILE27 -0.2454 425 CA 129.5550 103.3040 110.9460 C.3 27 ILE27 0.0903 426 CB 131.0570 102.9600 110.8570 C.3 27 ILE27 -0.0201 427 CG1 131.5200 102.6860 109.4120 C.3 27 ILE27 -0.0514 428 CG2 131.4520 101.7930 111.7700 C.3 27 ILE27 -0.0605 429 CD1 131.2590 103.8480 108.4450 C.3 27 ILE27 -0.0650 430 C 128.6500 102.1950 110.4190 C.2 27 ILE27 0.2189 431 O 128.3460 102.1450 109.2210 O.2 27 ILE27 -0.2778 432 H 129.8020 103.5240 113.0750 H 27 ILE27 0.1312 433 HA 129.3670 104.1810 110.3270 H 27 ILE27 0.0560 434 HB 131.6020 103.8360 111.2100 H 27 ILE27 0.0318 435 HG11 131.0440 101.7830 109.0290 H 27 ILE27 0.0266 436 HG12 132.5910 102.4780 109.4200 H 27 ILE27 0.0266 437 HG21 132.5250 101.6070 111.7280 H 27 ILE27 0.0233 438 HG22 130.9440 100.8690 111.4930 H 27 ILE27 0.0233 439 HG23 131.2040 102.0180 112.8020 H 27 ILE27 0.0233 440 HD11 131.7090 103.6480 107.4720 H 27 ILE27 0.0230 441 HD12 131.6820 104.7790 108.8230 H 27 ILE27 0.0230 442 HD13 130.1920 104.0020 108.2800 H 27 ILE27 0.0230 443 N 128.2010 101.2910 111.2940 N.am 28 VAL28 -0.2454 444 CA 127.2920 100.2380 110.8540 C.3 28 VAL28 0.0901 445 CB 127.3990 99.0130 111.7830 C.3 28 VAL28 -0.0227 446 CG1 126.8970 99.3090 113.1970 C.3 28 VAL28 -0.0608 447 CG2 126.6870 97.7830 111.2000 C.3 28 VAL28 -0.0608 448 C 125.8680 100.7730 110.7590 C.2 28 VAL28 0.2187 449 O 125.0410 100.2500 110.0020 O.2 28 VAL28 -0.2778 450 H 128.4940 101.3370 112.2700 H 28 VAL28 0.1312 451 HA 127.6120 99.9240 109.8610 H 28 VAL28 0.0560 452 HB 128.4580 98.7660 111.8580 H 28 VAL28 0.0315 453 HG11 127.1270 98.4940 113.8830 H 28 VAL28 0.0233 454 HG12 125.8220 99.4760 113.2160 H 28 VAL28 0.0233 455 HG13 127.3720 100.2100 113.5660 H 28 VAL28 0.0233 456 HG21 126.8550 96.9040 111.8230 H 28 VAL28 0.0233 457 HG22 127.0540 97.5540 110.1990 H 28 VAL28 0.0233 458 HG23 125.6100 97.9380 111.1330 H 28 VAL28 0.0233 459 N 125.5610 101.8280 111.5170 N.am 29 GLY29 -0.2485 460 CA 124.2230 102.3930 111.4750 C.3 29 GLY29 0.0765 461 C 123.8870 103.0260 110.1380 C.2 29 GLY29 0.2155 462 O 122.7860 102.8380 109.6130 O.2 29 GLY29 -0.2781 463 H 126.2680 102.2390 112.1270 H 29 GLY29 0.1309 464 HA1 124.1730 103.1490 112.2580 H 29 GLY29 0.0521 465 HA2 123.5060 101.6040 111.7070 H 29 GLY29 0.0521 466 N 124.8240 103.7900 109.5710 N.am 30 MET30 -0.2459 467 CA 124.5530 104.4720 108.3090 C.3 30 MET30 0.0885 468 CB 125.6110 105.5620 108.0530 C.3 30 MET30 -0.0199 469 CG 127.0480 105.0500 107.8650 C.3 30 MET30 -0.0047 470 SD 128.2090 106.4080 107.6440 S.3 30 MET30 -0.1641 471 CE 128.3440 106.9500 109.3540 C.3 30 MET30 -0.0181 472 C 124.4410 103.4800 107.1590 C.2 30 MET30 0.2187 473 O 123.4890 103.5310 106.3720 O.2 30 MET30 -0.2778 474 H 125.7330 103.8980 110.0210 H 30 MET30 0.1312 475 HA 123.5800 104.9550 108.4160 H 30 MET30 0.0557 476 HB1 125.5940 106.2610 108.8900 H 30 MET30 0.0293 477 HB2 125.3250 106.1430 107.1750 H 30 MET30 0.0293 478 HG1 127.1330 104.4100 106.9900 H 30 MET30 0.0377 479 HG2 127.3570 104.4510 108.7210 H 30 MET30 0.0377 480 HE1 129.3670 107.2650 109.5540 H 30 MET30 0.0340 481 HE2 128.1100 106.1430 110.0470 H 30 MET30 0.0340 482 HE3 127.6730 107.7890 109.5360 H 30 MET30 0.0340 483 N 125.4040 102.5610 107.0490 N.am 31 VAL31 -0.2454 484 CA 125.4540 101.6740 105.8900 C.3 31 VAL31 0.0901 485 CB 126.7910 100.9030 105.8440 C.3 31 VAL31 -0.0227 486 CG1 127.9870 101.8610 105.7430 C.3 31 VAL31 -0.0608 487 CG2 126.9730 99.9510 107.0340 C.3 31 VAL31 -0.0608 488 C 124.2550 100.7330 105.8760 C.2 31 VAL31 0.2187 489 O 123.7150 100.4140 104.8110 O.2 31 VAL31 -0.2778 490 H 126.1100 102.4780 107.7800 H 31 VAL31 0.1312 491 HA 125.3790 102.3090 105.0050 H 31 VAL31 0.0560 492 HB 126.7950 100.2980 104.9360 H 31 VAL31 0.0315 493 HG11 128.9120 101.3110 105.5680 H 31 VAL31 0.0233 494 HG12 128.1220 102.4320 106.6610 H 31 VAL31 0.0233 495 HG13 127.8620 102.5670 104.9220 H 31 VAL31 0.0233 496 HG21 127.9690 99.5090 107.0410 H 31 VAL31 0.0233 497 HG22 126.2550 99.1310 107.0110 H 31 VAL31 0.0233 498 HG23 126.8370 100.4850 107.9710 H 31 VAL31 0.0233 499 N 123.8210 100.2700 107.0500 N.am 32 GLY32 -0.2485 500 CA 122.6450 99.4190 107.1030 C.3 32 GLY32 0.0765 501 C 121.3810 100.1470 106.6870 C.2 32 GLY32 0.2155 502 O 120.5560 99.6070 105.9460 O.2 32 GLY32 -0.2781 503 H 124.3140 100.5130 107.9090 H 32 GLY32 0.1309 504 HA1 122.5440 99.0780 108.1330 H 32 GLY32 0.0521 505 HA2 122.8110 98.5530 106.4600 H 32 GLY32 0.0521 506 N 121.2130 101.3840 107.1590 N.am 33 ASN33 -0.2454 507 CA 120.0300 102.1580 106.7990 C.3 33 ASN33 0.0957 508 CB 119.8230 103.3100 107.7980 C.3 33 ASN33 0.0446 509 CG 119.1020 102.7900 109.0470 C.2 33 ASN33 0.2000 510 OD1 118.0300 102.2110 108.9520 O.2 33 ASN33 -0.2797 511 ND2 119.7340 103.0250 110.2060 N.am 33 ASN33 -0.2723 512 C 120.1130 102.6750 105.3680 C.2 33 ASN33 0.2191 513 O 119.1180 102.6460 104.6350 O.2 33 ASN33 -0.2778 514 H 121.9160 101.7910 107.7760 H 33 ASN33 0.1312 515 HA 119.1710 101.4820 106.8230 H 33 ASN33 0.0562 516 HB1 119.1900 104.0910 107.3760 H 33 ASN33 0.0375 517 HB2 120.7740 103.7660 108.0710 H 33 ASN33 0.0375 518 HD21 119.2840 102.7370 111.0520 H 33 ASN33 0.1266 519 HD22 120.6270 103.4700 110.2470 H 33 ASN33 0.1266 520 N 121.2880 103.1570 104.9530 N.am 34 ALA34 -0.2459 521 CA 121.4300 103.6850 103.6000 C.3 34 ALA34 0.0850 522 CB 122.8300 104.2920 103.4560 C.3 34 ALA34 -0.0411 523 C 121.2150 102.5970 102.5580 C.2 34 ALA34 0.2185 524 O 120.7020 102.8650 101.4660 O.2 34 ALA34 -0.2778 525 H 122.0890 103.1560 105.5850 H 34 ALA34 0.1312 526 HA 120.6660 104.4530 103.4670 H 34 ALA34 0.0554 527 HB1 122.9760 104.7260 102.4670 H 34 ALA34 0.0249 528 HB2 123.6060 103.5420 103.6160 H 34 ALA34 0.0249 529 HB3 122.9830 105.0840 104.1900 H 34 ALA34 0.0249 530 N 121.6090 101.3610 102.8740 N.am 35 THR35 -0.2434 531 CA 121.3730 100.2540 101.9540 C.3 35 THR35 0.1135 532 CB 122.2680 99.0430 102.2220 C.3 35 THR35 0.0763 533 OG1 123.6230 99.4580 102.2350 O.3 35 THR35 -0.3900 534 CG2 122.2000 98.0640 101.0540 C.3 35 THR35 -0.0370 535 C 119.8810 100.0230 101.7500 C.2 35 THR35 0.2212 536 O 119.4210 99.8430 100.6180 O.2 35 THR35 -0.2777 537 H 122.0780 101.1900 103.7640 H 35 THR35 0.1313 538 HA 121.7390 100.6420 101.0080 H 35 THR35 0.0583 539 HB 122.0120 98.5370 103.1610 H 35 THR35 0.0611 540 HG1 123.7700 100.0720 102.9490 H 35 THR35 0.2098 541 HG21 123.0710 97.4110 101.0630 H 35 THR35 0.0255 542 HG22 122.2080 98.5790 100.0940 H 35 THR35 0.0255 543 HG23 121.2970 97.4640 101.1080 H 35 THR35 0.0255 544 N 119.1060 100.0430 102.8370 N.am 36 LEU36 -0.2456 545 CA 117.6730 99.7800 102.7320 C.3 36 LEU36 0.0880 546 CB 117.0670 99.6850 104.1430 C.3 36 LEU36 -0.0266 547 CG 115.5530 99.3900 104.1830 C.3 36 LEU36 -0.0449 548 CD1 115.1600 98.1620 103.3450 C.3 36 LEU36 -0.0626 549 CD2 115.0880 99.2040 105.6320 C.3 36 LEU36 -0.0626 550 C 116.9860 100.8350 101.8720 C.2 36 LEU36 0.2187 551 O 116.1150 100.5160 101.0550 O.2 36 LEU36 -0.2778 552 H 119.5180 100.2440 103.7480 H 36 LEU36 0.1312 553 HA 117.5740 98.8190 102.2260 H 36 LEU36 0.0557 554 HB1 117.2650 100.6120 104.6840 H 36 LEU36 0.0287 555 HB2 117.5960 98.9050 104.6920 H 36 LEU36 0.0287 556 HG 115.0270 100.2550 103.7760 H 36 LEU36 0.0296 557 HD11 114.0960 97.9480 103.4460 H 36 LEU36 0.0232 558 HD12 115.7090 97.2750 103.6640 H 36 LEU36 0.0232 559 HD13 115.3570 98.3150 102.2840 H 36 LEU36 0.0232 560 HD21 114.0020 99.1370 105.6950 H 36 LEU36 0.0232 561 HD22 115.4090 100.0380 106.2560 H 36 LEU36 0.0232 562 HD23 115.5040 98.2940 106.0640 H 36 LEU36 0.0232 563 N 117.3680 102.1020 102.0440 N.am 37 LEU37 -0.2456 564 CA 116.7910 103.1640 101.2250 C.3 37 LEU37 0.0880 565 CB 117.1170 104.5660 101.7780 C.3 37 LEU37 -0.0266 566 CG 116.2810 105.0140 103.0030 C.3 37 LEU37 -0.0449 567 CD1 114.7680 104.8140 102.8180 C.3 37 LEU37 -0.0626 568 CD2 116.7550 104.3980 104.3220 C.3 37 LEU37 -0.0626 569 C 117.1770 103.0070 99.7590 C.2 37 LEU37 0.2187 570 O 116.3600 103.2590 98.8650 O.2 37 LEU37 -0.2778 571 H 118.0670 102.3300 102.7510 H 37 LEU37 0.1312 572 HA 115.7120 103.0130 101.2430 H 37 LEU37 0.0557 573 HB1 116.9320 105.2990 100.9900 H 37 LEU37 0.0287 574 HB2 118.1830 104.6380 102.0020 H 37 LEU37 0.0287 575 HG 116.4400 106.0890 103.1020 H 37 LEU37 0.0296 576 HD11 114.2130 105.3140 103.6100 H 37 LEU37 0.0232 577 HD12 114.4900 103.7610 102.8580 H 37 LEU37 0.0232 578 HD13 114.4260 105.2220 101.8660 H 37 LEU37 0.0232 579 HD21 116.1750 104.7820 105.1600 H 37 LEU37 0.0232 580 HD22 117.7970 104.6510 104.5130 H 37 LEU37 0.0232 581 HD23 116.6510 103.3130 104.3230 H 37 LEU37 0.0232 582 N 118.4180 102.5950 99.4910 N.am 38 ARG38 -0.2457 583 CA 118.8980 102.5570 98.1130 C.3 38 ARG38 0.0879 584 CB 120.4300 102.5580 97.9680 C.3 38 ARG38 -0.0258 585 CG 121.1300 101.1880 98.0520 C.3 38 ARG38 -0.0154 586 CD 122.5730 101.2020 97.5180 C.3 38 ARG38 0.1045 587 NE 122.6000 100.7800 96.1100 N.pl3 38 ARG38 -0.4450 588 CZ 122.4600 101.5670 95.0430 C.cat 38 ARG38 0.5062 589 NH1 122.3550 102.8630 95.1420 N.pl3 38 ARG38 -0.4573 590 NH2 122.4230 101.0340 93.8520 N.pl3 38 ARG38 -0.4573 591 C 118.2410 101.4330 97.3170 C.2 38 ARG38 0.2187 592 O 118.0270 101.5710 96.1070 O.2 38 ARG38 -0.2778 593 H 119.0330 102.3060 100.2520 H 38 ARG38 0.1312 594 HA 118.5450 103.4890 97.6650 H 38 ARG38 0.0557 595 HB1 120.8660 103.2430 98.6970 H 38 ARG38 0.0286 596 HB2 120.6420 102.9930 96.9950 H 38 ARG38 0.0286 597 HG1 120.5830 100.4160 97.5120 H 38 ARG38 0.0299 598 HG2 121.1200 100.8680 99.0860 H 38 ARG38 0.0299 599 HD1 123.1740 100.4680 98.0610 H 38 ARG38 0.0711 600 HD2 123.0680 102.1680 97.6420 H 38 ARG38 0.0711 601 HE 122.7240 99.8060 95.9240 H 38 ARG38 0.3153 602 HH11 122.2120 103.4090 94.3150 H 38 ARG38 0.3114 603 HH12 122.4170 103.3020 96.0340 H 38 ARG38 0.3114 604 HH21 122.2730 101.6260 93.0590 H 38 ARG38 0.3114 605 HH22 122.5380 100.0520 93.7240 H 38 ARG38 0.3114 606 N 117.9120 100.3140 97.9690 N.am 39 ILE39 -0.2454 607 CA 117.2380 99.2240 97.2650 C.3 39 ILE39 0.0903 608 CB 117.1860 97.9820 98.1770 C.3 39 ILE39 -0.0201 609 CG1 118.5970 97.5050 98.5340 C.3 39 ILE39 -0.0514 610 CG2 116.3720 96.8170 97.5780 C.3 39 ILE39 -0.0605 611 CD1 118.6000 96.6770 99.8120 C.3 39 ILE39 -0.0650 612 C 115.8130 99.6250 96.9060 C.2 39 ILE39 0.2189 613 O 115.3260 99.3370 95.8080 O.2 39 ILE39 -0.2778 614 H 118.1320 100.2200 98.9610 H 39 ILE39 0.1312 615 HA 117.7890 99.0100 96.3480 H 39 ILE39 0.0560 616 HB 116.6960 98.2880 99.1040 H 39 ILE39 0.0318 617 HG11 119.2670 98.3480 98.6880 H 39 ILE39 0.0266 618 HG12 119.0320 96.9340 97.7120 H 39 ILE39 0.0266 619 HG21 116.3870 95.9460 98.2330 H 39 ILE39 0.0233 620 HG22 116.7760 96.5130 96.6120 H 39 ILE39 0.0233 621 HG23 115.3250 97.0820 97.4320 H 39 ILE39 0.0233 622 HD11 119.6210 96.6120 100.1520 H 39 ILE39 0.0230 623 HD12 118.2140 95.6700 99.6560 H 39 ILE39 0.0230 624 HD13 118.0260 97.1530 100.6070 H 39 ILE39 0.0230 625 N 115.1230 100.2970 97.8300 N.am 40 ILE40 -0.2454 626 CA 113.7420 100.7030 97.5800 C.3 40 ILE40 0.0903 627 CB 113.1170 101.2300 98.8930 C.3 40 ILE40 -0.0201 628 CG1 113.0920 100.1140 99.9640 C.3 40 ILE40 -0.0514 629 CG2 111.6990 101.7880 98.6690 C.3 40 ILE40 -0.0605 630 CD1 112.7500 100.6090 101.3750 C.3 40 ILE40 -0.0650 631 C 113.6760 101.6740 96.4070 C.2 40 ILE40 0.2189 632 O 112.7900 101.5770 95.5480 O.2 40 ILE40 -0.2778 633 H 115.5650 100.5290 98.7200 H 40 ILE40 0.1312 634 HA 113.2040 99.8040 97.2730 H 40 ILE40 0.0560 635 HB 113.7470 102.0420 99.2600 H 40 ILE40 0.0318 636 HG11 114.0610 99.6200 100.0190 H 40 ILE40 0.0266 637 HG12 112.3860 99.3370 99.6700 H 40 ILE40 0.0266 638 HG21 111.2690 102.1670 99.5950 H 40 ILE40 0.0233 639 HG22 111.0310 101.0190 98.2800 H 40 ILE40 0.0233 640 HG23 111.7010 102.6170 97.9620 H 40 ILE40 0.0233 641 HD11 112.8720 99.8080 102.1050 H 40 ILE40 0.0230 642 HD12 111.7180 100.9500 101.4400 H 40 ILE40 0.0230 643 HD13 113.4030 101.4290 101.6750 H 40 ILE40 0.0230 644 N 114.6150 102.6190 96.3480 N.am 41 TYR41 -0.2453 645 CA 114.6040 103.6180 95.2850 C.3 41 TYR41 0.0917 646 CB 115.5830 104.7380 95.6730 C.3 41 TYR41 -0.0036 647 CG 115.5900 105.8640 94.6720 C.ar 41 TYR41 -0.0453 648 CD1 114.5260 106.7590 94.6180 C.ar 41 TYR41 -0.0561 649 CD2 116.6430 106.0110 93.7720 C.ar 41 TYR41 -0.0561 650 CE1 114.5080 107.7780 93.6740 C.ar 41 TYR41 -0.0317 651 CE2 116.6280 107.0320 92.8290 C.ar 41 TYR41 -0.0317 652 CZ 115.5570 107.9120 92.7770 C.ar 41 TYR41 0.0726 653 OH 115.5290 108.9190 91.8360 O.3 41 TYR41 -0.3598 654 C 114.9800 103.0070 93.9380 C.2 41 TYR41 0.2190 655 O 114.3590 103.3160 92.9150 O.2 41 TYR41 -0.2778 656 H 115.3500 102.6440 97.0550 H 41 TYR41 0.1312 657 HA 113.5890 104.0120 95.2150 H 41 TYR41 0.0560 658 HB1 116.5920 104.3390 95.7900 H 41 TYR41 0.0333 659 HB2 115.3050 105.1430 96.6470 H 41 TYR41 0.0333 660 HD1 113.7010 106.6600 95.3080 H 41 TYR41 0.0621 661 HD2 117.4760 105.3270 93.7960 H 41 TYR41 0.0621 662 HE1 113.6800 108.4690 93.6320 H 41 TYR41 0.0643 663 HE2 117.4440 107.1390 92.1310 H 41 TYR41 0.0643 664 HH 116.3670 108.9750 91.3960 H 41 TYR41 0.2173 665 N 115.9830 102.1280 93.9180 N.am 42 GLN42 -0.2456 666 CA 116.5680 101.6730 92.6600 C.3 42 GLN42 0.0882 667 CB 118.0460 101.3270 92.9420 C.3 42 GLN42 -0.0210 668 CG 118.8820 102.4690 93.5590 C.3 42 GLN42 0.0225 669 CD 119.7590 103.2070 92.5450 C.2 42 GLN42 0.1981 670 OE1 120.9810 103.1310 92.5950 O.2 42 GLN42 -0.2798 671 NE2 119.0740 103.9190 91.6400 N.am 42 GLN42 -0.2724 672 C 115.9070 100.4260 92.0870 C.2 42 GLN42 0.2187 673 O 115.9500 100.2250 90.8670 O.2 42 GLN42 -0.2778 674 H 116.3490 101.7660 94.7990 H 42 GLN42 0.1312 675 HA 116.4980 102.4780 91.9260 H 42 GLN42 0.0557 676 HB1 118.5290 100.9440 92.0410 H 42 GLN42 0.0289 677 HB2 118.0620 100.4950 93.6490 H 42 GLN42 0.0289 678 HG1 119.5680 102.0480 94.2920 H 42 GLN42 0.0356 679 HG2 118.2730 103.1940 94.0960 H 42 GLN42 0.0356 680 HE21 119.5660 104.4320 90.9370 H 42 GLN42 0.1266 681 HE22 118.0740 103.9520 91.6480 H 42 GLN42 0.1266 682 N 115.3030 99.5790 92.9250 N.am 43 ASN43 -0.2452 683 CA 114.7550 98.3220 92.4220 C.3 43 ASN43 0.0957 684 CB 114.3890 97.4640 93.6520 C.3 43 ASN43 0.0446 685 CG 113.9110 96.0230 93.3860 C.2 43 ASN43 0.2000 686 OD1 113.2990 95.4010 94.2450 O.2 43 ASN43 -0.2797 687 ND2 114.2160 95.5170 92.1820 N.am 43 ASN43 -0.2723 688 C 113.5510 98.5670 91.5160 C.2 43 ASN43 0.2191 689 O 113.2810 97.7680 90.6110 O.2 43 ASN43 -0.2778 690 H 115.2250 99.8100 93.9150 H 43 ASN43 0.1312 691 HA 115.5410 97.8410 91.8370 H 43 ASN43 0.0562 692 HB1 113.6210 97.9650 94.2430 H 43 ASN43 0.0375 693 HB2 115.2620 97.3790 94.2970 H 43 ASN43 0.0375 694 HD21 113.9470 94.5790 91.9650 H 43 ASN43 0.1266 695 HD22 114.6960 96.0480 91.4850 H 43 ASN43 0.1266 696 N 112.8260 99.6620 91.7440 N.am 44 LYS44 -0.2456 697 CA 111.7960 100.2540 90.8850 C.3 44 LYS44 0.0878 698 CB 112.3730 100.3800 89.4580 C.3 44 LYS44 -0.0289 699 CG 111.6430 101.3590 88.5290 C.3 44 LYS44 -0.0496 700 CD 112.3760 101.4820 87.1860 C.3 44 LYS44 -0.0278 701 CE 111.6910 102.4450 86.2110 C.3 44 LYS44 0.1103 702 NZ 112.4120 102.5450 84.9390 N.4 44 LYS44 -0.0749 703 C 110.4520 99.5270 90.9050 C.2 44 LYS44 0.2187 704 O 109.4960 100.0430 90.3120 O.2 44 LYS44 -0.2778 705 H 113.0100 100.1470 92.6220 H 44 LYS44 0.1312 706 HA 111.6330 101.2490 91.3000 H 44 LYS44 0.0557 707 HB1 112.4110 99.3980 88.9840 H 44 LYS44 0.0285 708 HB2 113.4110 100.7080 89.5430 H 44 LYS44 0.0285 709 HG1 111.5770 102.3360 89.0090 H 44 LYS44 0.0266 710 HG2 110.6210 101.0220 88.3570 H 44 LYS44 0.0266 711 HD1 112.4510 100.4930 86.7300 H 44 LYS44 0.0282 712 HD2 113.4000 101.8140 87.3670 H 44 LYS44 0.0282 713 HE1 111.6260 103.4440 86.6470 H 44 LYS44 0.0559 714 HE2 110.6710 102.1130 86.0020 H 44 LYS44 0.0559 715 HZ1 111.9220 103.2070 84.3020 H 44 LYS44 0.2742 716 HZ2 112.4600 101.6080 84.4880 H 44 LYS44 0.2742 717 HZ3 113.3800 102.8870 85.1100 H 44 LYS44 0.2742 718 N 110.3300 98.3680 91.5520 N.am 45 CYS45 -0.2449 719 CA 109.0280 97.7290 91.7170 C.3 45 CYS45 0.0965 720 CB 109.0760 96.3760 90.9940 C.3 45 CYS45 0.0147 721 SG 110.3110 95.2380 91.6790 S.3 45 CYS45 -0.1762 722 C 108.6740 97.5170 93.1830 C.2 45 CYS45 0.2195 723 O 107.7890 96.7080 93.4870 O.2 45 CYS45 -0.2778 724 H 111.1610 97.9200 91.9380 H 45 CYS45 0.1312 725 HA 108.2410 98.3470 91.2830 H 45 CYS45 0.0565 726 HB1 109.3050 96.5400 89.9410 H 45 CYS45 0.0394 727 HB2 108.0980 95.8930 91.0210 H 45 CYS45 0.0394 728 HG 110.4030 94.1600 90.8960 H 45 CYS45 0.1017 729 N 109.3400 98.2190 94.0940 N.am 46 MET46 -0.2456 730 CA 109.0470 98.1420 95.5180 C.3 46 MET46 0.0885 731 CB 110.3940 98.2280 96.2700 C.3 46 MET46 -0.0199 732 CG 111.2670 96.9750 96.1330 C.3 46 MET46 -0.0047 733 SD 110.7300 95.6760 97.2680 S.3 46 MET46 -0.1641 734 CE 112.3290 94.8870 97.5520 C.3 46 MET46 -0.0181 735 C 108.1680 99.2880 96.0000 C.2 46 MET46 0.2187 736 O 107.9690 99.4290 97.2100 O.2 46 MET46 -0.2778 737 H 110.0880 98.8380 93.7820 H 46 MET46 0.1312 738 HA 108.5440 97.2000 95.7390 H 46 MET46 0.0557 739 HB1 110.2440 98.4150 97.3350 H 46 MET46 0.0293 740 HB2 110.9500 99.0900 95.8970 H 46 MET46 0.0293 741 HG1 112.2950 97.2480 96.3780 H 46 MET46 0.0377 742 HG2 111.2730 96.6010 95.1090 H 46 MET46 0.0377 743 HE1 112.2470 94.0910 98.2920 H 46 MET46 0.0340 744 HE2 113.0520 95.6200 97.9110 H 46 MET46 0.0340 745 HE3 112.7180 94.4750 96.6210 H 46 MET46 0.0340 746 N 107.6420 100.1050 95.0880 N.am 47 ARG47 -0.2457 747 CA 106.8050 101.2340 95.4710 C.3 47 ARG47 0.0879 748 CB 106.7060 102.2000 94.2750 C.3 47 ARG47 -0.0258 749 CG 105.9220 103.4860 94.5920 C.3 47 ARG47 -0.0154 750 CD 105.7650 104.4100 93.3800 C.3 47 ARG47 0.1045 751 NE 104.9490 105.5660 93.7590 N.pl3 47 ARG47 -0.4450 752 CZ 104.5580 106.5160 92.9130 C.cat 47 ARG47 0.5062 753 NH1 104.8890 106.4770 91.6490 N.pl3 47 ARG47 -0.4573 754 NH2 103.8290 107.5070 93.3510 N.pl3 47 ARG47 -0.4573 755 C 105.4280 100.7530 95.9060 C.2 47 ARG47 0.2187 756 O 104.4860 100.7320 95.1080 O.2 47 ARG47 -0.2778 757 H 107.8300 99.9360 94.1000 H 47 ARG47 0.1312 758 HA 107.2890 101.7350 96.3120 H 47 ARG47 0.0557 759 HB1 106.2460 101.6860 93.4290 H 47 ARG47 0.0286 760 HB2 107.7130 102.4670 93.9520 H 47 ARG47 0.0286 761 HG1 106.4160 104.0220 95.4020 H 47 ARG47 0.0299 762 HG2 104.9270 103.2280 94.9510 H 47 ARG47 0.0299 763 HD1 105.2640 103.8820 92.5630 H 47 ARG47 0.0711 764 HD2 106.7380 104.7670 93.0330 H 47 ARG47 0.0711 765 HE 104.6630 105.6540 94.7130 H 47 ARG47 0.3153 766 HH11 104.5920 107.1960 91.0250 H 47 ARG47 0.3114 767 HH12 105.4420 105.7200 91.3120 H 47 ARG47 0.3114 768 HH21 103.5300 108.2260 92.7260 H 47 ARG47 0.3114 769 HH22 103.5670 107.5530 94.3120 H 47 ARG47 0.3114 770 N 105.3060 100.3630 97.1730 N.am 48 ASN48 -0.2452 771 CA 104.0540 99.8640 97.7200 C.3 48 ASN48 0.0957 772 CB 104.1480 98.3430 97.9460 C.3 48 ASN48 0.0446 773 CG 104.6970 97.6100 96.7160 C.2 48 ASN48 0.2000 774 OD1 104.0280 97.4590 95.7080 O.2 48 ASN48 -0.2797 775 ND2 105.9540 97.1620 96.8530 N.am 48 ASN48 -0.2723 776 C 103.7810 100.5600 99.0440 C.2 48 ASN48 0.2189 777 O 104.6700 101.1620 99.6520 O.2 48 ASN48 -0.2778 778 H 106.1210 100.4160 97.7840 H 48 ASN48 0.1312 779 HA 103.2370 100.1000 97.0340 H 48 ASN48 0.0562 780 HB1 103.1610 97.9320 98.1520 H 48 ASN48 0.0375 781 HB2 104.7860 98.1120 98.8000 H 48 ASN48 0.0375 782 HD21 106.3560 96.6830 96.0730 H 48 ASN48 0.1266 783 HD22 106.4770 97.3150 97.6910 H 48 ASN48 0.1266 784 N 102.5280 100.4780 99.4830 N.am 49 GLY49 -0.2484 785 CA 102.1210 101.0220 100.7560 C.3 49 GLY49 0.0767 786 C 102.8950 100.4590 101.9340 C.2 49 GLY49 0.2182 787 O 103.4270 101.2080 102.7600 O.2 49 GLY49 -0.2779 788 H 101.8310 100.0150 98.9000 H 49 GLY49 0.1309 789 HA1 101.0640 100.8030 100.8980 H 49 GLY49 0.0521 790 HA2 102.2490 102.1040 100.7160 H 49 GLY49 0.0521 791 N 102.9630 99.1260 102.0470 N.am 50 PRO50 -0.2318 792 CA 103.7780 98.5380 103.1250 C.3 50 PRO50 0.0907 793 CD 102.2460 98.1480 101.2390 C.3 50 PRO50 0.0071 794 CB 103.5830 97.0280 102.9180 C.3 50 PRO50 -0.0276 795 CG 102.2810 96.9040 102.1260 C.3 50 PRO50 -0.0379 796 C 105.2410 98.9420 103.0720 C.2 50 PRO50 0.2189 797 O 105.8620 99.1400 104.1240 O.2 50 PRO50 -0.2778 798 HA 103.3390 98.8690 104.0680 H 50 PRO50 0.0559 799 HD1 102.8110 98.0000 100.3220 H 50 PRO50 0.0431 800 HD2 101.2320 98.4910 101.0290 H 50 PRO50 0.0431 801 HB1 103.5510 96.4820 103.8600 H 50 PRO50 0.0285 802 HB2 104.3930 96.6070 102.3200 H 50 PRO50 0.0285 803 HG1 102.2160 95.9780 101.5550 H 50 PRO50 0.0278 804 HG2 101.4350 96.9310 102.8150 H 50 PRO50 0.0278 805 N 105.8130 99.0710 101.8730 N.am 51 ASN51 -0.2452 806 CA 107.2130 99.4650 101.7670 C.3 51 ASN51 0.0957 807 CB 107.7120 99.1680 100.3320 C.3 51 ASN51 0.0446 808 CG 108.3290 97.7650 100.1950 C.2 51 ASN51 0.2000 809 OD1 107.7600 96.8340 99.6310 O.2 51 ASN51 -0.2797 810 ND2 109.5500 97.6840 100.7450 N.am 51 ASN51 -0.2723 811 C 107.4060 100.9490 102.0520 C.2 51 ASN51 0.2191 812 O 108.4830 101.3560 102.5010 O.2 51 ASN51 -0.2778 813 H 105.2690 98.8930 101.0280 H 51 ASN51 0.1312 814 HA 107.7870 98.9150 102.5140 H 51 ASN51 0.0562 815 HB1 108.4850 99.8740 100.0210 H 51 ASN51 0.0375 816 HB2 106.9010 99.2730 99.6110 H 51 ASN51 0.0375 817 HD21 110.0740 96.8350 100.7160 H 51 ASN51 0.1266 818 HD22 109.9600 98.4790 101.1940 H 51 ASN51 0.1266 819 N 106.3850 101.7680 101.7900 N.am 52 ALA52 -0.2459 820 CA 106.4840 103.1950 102.0840 C.3 52 ALA52 0.0850 821 CB 105.2230 103.8960 101.5630 C.3 52 ALA52 -0.0411 822 C 106.6520 103.4340 103.5790 C.2 52 ALA52 0.2184 823 O 107.4490 104.2810 103.9990 O.2 52 ALA52 -0.2778 824 H 105.5290 101.3940 101.3810 H 52 ALA52 0.1312 825 HA 107.3690 103.5750 101.5720 H 52 ALA52 0.0554 826 HB1 105.2690 104.9730 101.7330 H 52 ALA52 0.0249 827 HB2 104.3240 103.5210 102.0540 H 52 ALA52 0.0249 828 HB3 105.1020 103.7340 100.4920 H 52 ALA52 0.0249 829 N 105.8990 102.6980 104.3990 N.am 53 LEU53 -0.2457 830 CA 106.0560 102.8070 105.8460 C.3 53 LEU53 0.0880 831 CB 104.9610 101.9770 106.5400 C.3 53 LEU53 -0.0266 832 CG 103.5200 102.4390 106.2500 C.3 53 LEU53 -0.0449 833 CD1 102.5120 101.4580 106.8670 C.3 53 LEU53 -0.0626 834 CD2 103.2530 103.8630 106.7590 C.3 53 LEU53 -0.0626 835 C 107.4350 102.3310 106.2860 C.2 53 LEU53 0.2187 836 O 108.0550 102.9310 107.1720 O.2 53 LEU53 -0.2778 837 H 105.2090 102.0550 104.0120 H 53 LEU53 0.1312 838 HA 105.9670 103.8610 106.1090 H 53 LEU53 0.0557 839 HB1 105.1200 101.9860 107.6200 H 53 LEU53 0.0287 840 HB2 105.0580 100.9390 106.2220 H 53 LEU53 0.0287 841 HG 103.3570 102.4320 105.1720 H 53 LEU53 0.0296 842 HD11 101.4870 101.7570 106.6440 H 53 LEU53 0.0232 843 HD12 102.6150 101.4130 107.9520 H 53 LEU53 0.0232 844 HD13 102.6520 100.4500 106.4740 H 53 LEU53 0.0232 845 HD21 102.2150 104.1500 106.5830 H 53 LEU53 0.0232 846 HD22 103.8780 104.5980 106.2520 H 53 LEU53 0.0232 847 HD23 103.4400 103.9420 107.8300 H 53 LEU53 0.0232 848 N 107.9260 101.2460 105.6830 N.am 54 ILE54 -0.2454 849 CA 109.2580 100.7450 106.0120 C.3 54 ILE54 0.0903 850 CB 109.4700 99.3720 105.3300 C.3 54 ILE54 -0.0201 851 CG1 108.4880 98.3260 105.9010 C.3 54 ILE54 -0.0514 852 CG2 110.9230 98.8710 105.4500 C.3 54 ILE54 -0.0605 853 CD1 108.4020 97.0410 105.0700 C.3 54 ILE54 -0.0650 854 C 110.3210 101.7620 105.6160 C.2 54 ILE54 0.2189 855 O 111.2700 102.0160 106.3680 O.2 54 ILE54 -0.2778 856 H 107.3640 100.7610 104.9840 H 54 ILE54 0.1312 857 HA 109.3040 100.6330 107.0970 H 54 ILE54 0.0560 858 HB 109.2520 99.4980 104.2690 H 54 ILE54 0.0318 859 HG11 107.4860 98.7470 105.9650 H 54 ILE54 0.0266 860 HG12 108.7710 98.0840 106.9260 H 54 ILE54 0.0266 861 HG21 111.0610 97.9090 104.9590 H 54 ILE54 0.0233 862 HG22 111.2160 98.7570 106.4940 H 54 ILE54 0.0233 863 HG23 111.6290 99.5580 104.9820 H 54 ILE54 0.0233 864 HD11 107.6510 96.3670 105.4810 H 54 ILE54 0.0230 865 HD12 109.3500 96.5050 105.0560 H 54 ILE54 0.0230 866 HD13 108.1210 97.2560 104.0390 H 54 ILE54 0.0230 867 N 110.1800 102.3590 104.4300 N.am 55 ALA55 -0.2459 868 CA 111.1360 103.3700 103.9900 C.3 55 ALA55 0.0850 869 CB 110.7900 103.7840 102.5550 C.3 55 ALA55 -0.0411 870 C 111.1110 104.5890 104.9040 C.2 55 ALA55 0.2185 871 O 112.1630 105.1500 105.2320 O.2 55 ALA55 -0.2778 872 H 109.3980 102.1060 103.8260 H 55 ALA55 0.1312 873 HA 112.1310 102.9220 104.0310 H 55 ALA55 0.0554 874 HB1 111.5120 104.5020 102.1650 H 55 ALA55 0.0249 875 HB2 109.7990 104.2350 102.5000 H 55 ALA55 0.0249 876 HB3 110.7910 102.9220 101.8910 H 55 ALA55 0.0249 877 N 109.9160 105.0200 105.3170 N.am 56 SER56 -0.2436 878 CA 109.8120 106.1610 106.2210 C.3 56 SER56 0.1109 879 CB 108.3460 106.5870 106.4000 C.3 56 SER56 0.0681 880 OG 107.6090 105.6980 107.2300 O.3 56 SER56 -0.3930 881 C 110.4620 105.8610 107.5660 C.2 56 SER56 0.2209 882 O 111.1670 106.7090 108.1260 O.2 56 SER56 -0.2777 883 H 109.0700 104.5480 104.9980 H 56 SER56 0.1312 884 HA 110.3680 106.9760 105.7550 H 56 SER56 0.0580 885 HB1 107.8860 106.6140 105.4110 H 56 SER56 0.0577 886 HB2 108.3250 107.6020 106.8140 H 56 SER56 0.0577 887 HG 106.7390 106.0380 107.4330 H 56 SER56 0.2095 888 N 110.2280 104.6620 108.1040 N.am 57 LEU57 -0.2456 889 CA 110.8510 104.2850 109.3680 C.3 57 LEU57 0.0880 890 CB 110.2330 102.9740 109.8750 C.3 57 LEU57 -0.0266 891 CG 110.2260 102.8390 111.4100 C.3 57 LEU57 -0.0449 892 CD1 109.4880 101.5650 111.8250 C.3 57 LEU57 -0.0626 893 CD2 111.6270 102.8780 112.0280 C.3 57 LEU57 -0.0626 894 C 112.3670 104.2210 109.2370 C.2 57 LEU57 0.2187 895 O 113.0950 104.6840 110.1230 O.2 57 LEU57 -0.2778 896 H 109.6100 104.0050 107.6280 H 57 LEU57 0.1312 897 HA 110.6210 105.0860 110.0720 H 57 LEU57 0.0557 898 HB1 110.7250 102.1160 109.4140 H 57 LEU57 0.0287 899 HB2 109.1970 102.9320 109.5380 H 57 LEU57 0.0287 900 HG 109.6770 103.6820 111.8270 H 57 LEU57 0.0296 901 HD11 109.5180 101.4470 112.9050 H 57 LEU57 0.0232 902 HD12 109.9420 100.6790 111.3810 H 57 LEU57 0.0232 903 HD13 108.4430 101.6090 111.5230 H 57 LEU57 0.0232 904 HD21 111.6300 102.5040 113.0520 H 57 LEU57 0.0232 905 HD22 112.0130 103.8940 112.0790 H 57 LEU57 0.0232 906 HD23 112.3330 102.2860 111.4480 H 57 LEU57 0.0232 907 N 112.8620 103.6440 108.1390 N.am 58 ALA58 -0.2459 908 CA 114.3040 103.5730 107.9270 C.3 58 ALA58 0.0850 909 CB 114.5630 102.7180 106.6820 C.3 58 ALA58 -0.0411 910 C 114.9080 104.9600 107.7560 C.2 58 ALA58 0.2184 911 O 115.9720 105.2550 108.3120 O.2 58 ALA58 -0.2778 912 H 112.2280 103.2500 107.4440 H 58 ALA58 0.1312 913 HA 114.7420 103.1050 108.8120 H 58 ALA58 0.0554 914 HB1 115.6300 102.5540 106.5280 H 58 ALA58 0.0249 915 HB2 114.1560 103.1830 105.7830 H 58 ALA58 0.0249 916 HB3 114.0850 101.7460 106.7900 H 58 ALA58 0.0249 917 N 114.2460 105.8250 106.9830 N.am 59 LEU59 -0.2457 918 CA 114.7390 107.1880 106.8120 C.3 59 LEU59 0.0880 919 CB 113.9250 107.8570 105.6930 C.3 59 LEU59 -0.0266 920 CG 114.4990 109.2020 105.2000 C.3 59 LEU59 -0.0449 921 CD1 114.2150 109.3950 103.7040 C.3 59 LEU59 -0.0626 922 CD2 113.9450 110.3960 105.9910 C.3 59 LEU59 -0.0626 923 C 114.6790 107.9630 108.1220 C.2 59 LEU59 0.2185 924 O 115.6010 108.7220 108.4440 O.2 59 LEU59 -0.2778 925 H 113.3910 105.5310 106.5100 H 59 LEU59 0.1312 926 HA 115.7850 107.1080 106.5110 H 59 LEU59 0.0557 927 HB1 112.8800 107.9660 105.9880 H 59 LEU59 0.0287 928 HB2 113.9130 107.1610 104.8560 H 59 LEU59 0.0287 929 HG 115.5830 109.1820 105.3230 H 59 LEU59 0.0296 930 HD11 114.6390 110.3320 103.3410 H 59 LEU59 0.0232 931 HD12 113.1430 109.4140 103.5070 H 59 LEU59 0.0232 932 HD13 114.6490 108.5870 103.1150 H 59 LEU59 0.0232 933 HD21 114.3640 111.3340 105.6260 H 59 LEU59 0.0232 934 HD22 114.1740 110.3350 107.0530 H 59 LEU59 0.0232 935 HD23 112.8620 110.4550 105.8840 H 59 LEU59 0.0232 936 N 113.6000 107.7890 108.8890 N.am 60 GLY60 -0.2485 937 CA 113.5210 108.4270 110.1930 C.3 60 GLY60 0.0765 938 C 114.5970 107.9380 111.1430 C.2 60 GLY60 0.2155 939 O 115.1170 108.7050 111.9570 O.2 60 GLY60 -0.2781 940 H 112.8290 107.2070 108.5590 H 60 GLY60 0.1309 941 HA1 112.5470 108.1690 110.6080 H 60 GLY60 0.0521 942 HA2 113.5640 109.5060 110.0610 H 60 GLY60 0.0521 943 N 114.9360 106.6510 111.0590 N.am 61 ASP61 -0.2454 944 CA 116.0650 106.1320 111.8230 C.3 61 ASP61 0.0974 945 CB 116.1190 104.5880 111.7490 C.3 61 ASP61 0.0576 946 CG 115.2140 103.8870 112.7860 C.2 61 ASP61 0.1780 947 OD1 114.9870 104.4440 113.8590 O.co2 61 ASP61 -0.6478 948 OD2 114.7540 102.7790 112.5190 O.co2 61 ASP61 -0.6478 949 C 117.3750 106.7610 111.3630 C.2 61 ASP61 0.2192 950 O 118.2570 107.0460 112.1810 O.2 61 ASP61 -0.2778 951 H 114.4020 106.0250 110.4560 H 61 ASP61 0.1312 952 HA 115.9240 106.4520 112.8570 H 61 ASP61 0.0563 953 HB1 117.1270 104.2250 111.9460 H 61 ASP61 0.0394 954 HB2 115.8520 104.2400 110.7520 H 61 ASP61 0.0394 955 N 117.5210 106.9770 110.0530 N.am 62 LEU62 -0.2456 956 CA 118.7710 107.5070 109.5170 C.3 62 LEU62 0.0880 957 CB 118.7010 107.4440 107.9790 C.3 62 LEU62 -0.0266 958 CG 119.9960 107.7950 107.2140 C.3 62 LEU62 -0.0449 959 CD1 120.2370 109.3080 107.0900 C.3 62 LEU62 -0.0626 960 CD2 121.2320 107.0710 107.7650 C.3 62 LEU62 -0.0626 961 C 119.0410 108.9130 110.0410 C.2 62 LEU62 0.2187 962 O 120.1680 109.2350 110.4350 O.2 62 LEU62 -0.2778 963 H 116.7490 106.7690 109.4190 H 62 LEU62 0.1312 964 HA 119.5600 106.8500 109.8850 H 62 LEU62 0.0557 965 HB1 117.8840 108.0680 107.6180 H 62 LEU62 0.0287 966 HB2 118.4200 106.4240 107.7110 H 62 LEU62 0.0287 967 HG 119.8450 107.4330 106.1960 H 62 LEU62 0.0296 968 HD11 121.0210 109.5130 106.3620 H 62 LEU62 0.0232 969 HD12 120.5530 109.7550 108.0300 H 62 LEU62 0.0232 970 HD13 119.3360 109.8250 106.7580 H 62 LEU62 0.0232 971 HD21 122.0970 107.2280 107.1210 H 62 LEU62 0.0232 972 HD22 121.0610 105.9980 107.8320 H 62 LEU62 0.0232 973 HD23 121.4950 107.4320 108.7600 H 62 LEU62 0.0232 974 N 118.0150 109.7670 110.0560 N.am 63 ILE63 -0.2454 975 CA 118.2010 111.1320 110.5400 C.3 63 ILE63 0.0903 976 CB 116.9910 112.0130 110.1570 C.3 63 ILE63 -0.0201 977 CG1 115.6610 111.4570 110.6970 C.3 63 ILE63 -0.0514 978 CG2 116.9280 112.1960 108.6320 C.3 63 ILE63 -0.0605 979 CD1 114.4870 112.4360 110.5920 C.3 63 ILE63 -0.0650 980 C 118.4520 111.1350 112.0430 C.2 63 ILE63 0.2189 981 O 119.0510 112.0710 112.5860 O.2 63 ILE63 -0.2778 982 H 117.0970 109.4650 109.7280 H 63 ILE63 0.1312 983 HA 119.0800 111.5280 110.0390 H 63 ILE63 0.0560 984 HB 117.1490 112.9980 110.5980 H 63 ILE63 0.0318 985 HG11 115.7660 111.1730 111.7410 H 63 ILE63 0.0266 986 HG12 115.4210 110.5440 110.1610 H 63 ILE63 0.0266 987 HG21 116.1530 112.9070 108.3480 H 63 ILE63 0.0233 988 HG22 116.7120 111.2530 108.1270 H 63 ILE63 0.0233 989 HG23 117.8730 112.5730 108.2420 H 63 ILE63 0.0233 990 HD11 113.5930 112.0100 111.0470 H 63 ILE63 0.0230 991 HD12 114.2480 112.6700 109.5550 H 63 ILE63 0.0230 992 HD13 114.7070 113.3690 111.1110 H 63 ILE63 0.0230 993 N 117.9980 110.0910 112.7400 N.am 64 TYR64 -0.2453 994 CA 118.2490 109.9880 114.1740 C.3 64 TYR64 0.0917 995 CB 117.3590 108.9220 114.8370 C.3 64 TYR64 -0.0036 996 CG 117.6340 108.8350 116.3190 C.ar 64 TYR64 -0.0453 997 CD1 118.1730 107.6740 116.8670 C.ar 64 TYR64 -0.0561 998 CD2 117.4690 109.9510 117.1370 C.ar 64 TYR64 -0.0561 999 CE1 118.5770 107.6390 118.1950 C.ar 64 TYR64 -0.0317 1000 CE2 117.8920 109.9250 118.4600 C.ar 64 TYR64 -0.0317 1001 CZ 118.4580 108.7730 118.9840 C.ar 64 TYR64 0.0726 1002 OH 118.9350 108.7690 120.2770 O.3 64 TYR64 -0.3598 1003 C 119.7290 109.7450 114.4500 C.2 64 TYR64 0.2190 1004 O 120.3360 110.4150 115.2930 O.2 64 TYR64 -0.2778 1005 H 117.4710 109.3580 112.2660 H 64 TYR64 0.1312 1006 HA 118.0030 110.9640 114.5960 H 64 TYR64 0.0560 1007 HB1 117.5200 107.9470 114.3760 H 64 TYR64 0.0333 1008 HB2 116.3070 109.1600 114.6840 H 64 TYR64 0.0333 1009 HD1 118.3160 106.8030 116.2460 H 64 TYR64 0.0621 1010 HD2 117.0670 110.8670 116.7310 H 64 TYR64 0.0621 1011 HE1 119.0240 106.7470 118.6060 H 64 TYR64 0.0643 1012 HE2 117.8180 110.8090 119.0770 H 64 TYR64 0.0643 1013 HH 119.2510 109.6440 120.4920 H 64 TYR64 0.2173 1014 N 120.3260 108.7850 113.7420 N.am 65 VAL65 -0.2454 1015 CA 121.7160 108.4200 114.0030 C.3 65 VAL65 0.0901 1016 CB 122.0190 107.0820 113.2900 C.3 65 VAL65 -0.0227 1017 CG1 123.4880 106.6500 113.4400 C.3 65 VAL65 -0.0608 1018 CG2 121.1020 105.9630 113.8040 C.3 65 VAL65 -0.0608 1019 C 122.6600 109.5250 113.5430 C.2 65 VAL65 0.2189 1020 O 123.6270 109.8650 114.2340 O.2 65 VAL65 -0.2778 1021 H 119.8060 108.3000 113.0100 H 65 VAL65 0.1312 1022 HA 121.8150 108.2940 115.0790 H 65 VAL65 0.0560 1023 HB 121.8160 107.2080 112.2260 H 65 VAL65 0.0315 1024 HG11 123.6650 105.6870 112.9590 H 65 VAL65 0.0233 1025 HG12 123.7630 106.5530 114.4900 H 65 VAL65 0.0233 1026 HG13 124.1650 107.3680 112.9780 H 65 VAL65 0.0233 1027 HG21 121.3160 105.0150 113.3100 H 65 VAL65 0.0233 1028 HG22 120.0500 106.1860 113.6290 H 65 VAL65 0.0233 1029 HG23 121.2340 105.8200 114.8750 H 65 VAL65 0.0233 1030 N 122.3940 110.1050 112.3700 N.am 66 VAL66 -0.2454 1031 CA 123.3070 111.0900 111.8000 C.3 66 VAL66 0.0901 1032 CB 122.9890 111.2760 110.3030 C.3 66 VAL66 -0.0227 1033 CG1 121.7430 112.1390 110.0740 C.3 66 VAL66 -0.0608 1034 CG2 124.1880 111.8310 109.5220 C.3 66 VAL66 -0.0608 1035 C 123.2770 112.4010 112.5770 C.2 66 VAL66 0.2189 1036 O 124.1730 113.2370 112.4160 O.2 66 VAL66 -0.2778 1037 H 121.5430 109.8560 111.8670 H 66 VAL66 0.1312 1038 HA 124.3100 110.6760 111.8950 H 66 VAL66 0.0560 1039 HB 122.7780 110.2840 109.8980 H 66 VAL66 0.0315 1040 HG11 121.3480 112.0110 109.0660 H 66 VAL66 0.0233 1041 HG12 121.9620 113.1980 110.2170 H 66 VAL66 0.0233 1042 HG13 120.9700 111.8700 110.7880 H 66 VAL66 0.0233 1043 HG21 123.9670 111.8860 108.4550 H 66 VAL66 0.0233 1044 HG22 125.0660 111.1960 109.6460 H 66 VAL66 0.0233 1045 HG23 124.4520 112.8340 109.8570 H 66 VAL66 0.0233 1046 N 122.2720 112.6030 113.4220 N.am 67 ILE67 -0.2454 1047 CA 122.1590 113.8430 114.1860 C.3 67 ILE67 0.0903 1048 CB 120.7040 114.3760 114.0850 C.3 67 ILE67 -0.0201 1049 CG1 120.3800 114.8120 112.6410 C.3 67 ILE67 -0.0514 1050 CG2 120.4300 115.5260 115.0770 C.3 67 ILE67 -0.0605 1051 CD1 118.9140 115.2150 112.4250 C.3 67 ILE67 -0.0650 1052 C 122.5330 113.6340 115.6480 C.2 67 ILE67 0.2189 1053 O 123.3330 114.3880 116.2080 O.2 67 ILE67 -0.2778 1054 H 121.5650 111.8770 113.5400 H 67 ILE67 0.1312 1055 HA 122.8410 114.5940 113.7840 H 67 ILE67 0.0560 1056 HB 120.0300 113.5600 114.3490 H 67 ILE67 0.0318 1057 HG11 120.6070 113.9970 111.9560 H 67 ILE67 0.0266 1058 HG12 121.0300 115.6380 112.3520 H 67 ILE67 0.0266 1059 HG21 119.4290 115.9410 114.9670 H 67 ILE67 0.0233 1060 HG22 121.1510 116.3260 114.9300 H 67 ILE67 0.0233 1061 HG23 120.5070 115.1990 116.1140 H 67 ILE67 0.0233 1062 HD11 118.7110 115.3800 111.3670 H 67 ILE67 0.0230 1063 HD12 118.6710 116.1380 112.9490 H 67 ILE67 0.0230 1064 HD13 118.2300 114.4420 112.7770 H 67 ILE67 0.0230 1065 N 121.9660 112.6090 116.2870 N.am 68 ASP68 -0.2451 1066 CA 122.1860 112.4130 117.7170 C.3 68 ASP68 0.0974 1067 CB 121.1320 111.5720 118.4670 C.3 68 ASP68 0.0576 1068 CG 121.0360 111.9220 119.9890 C.2 68 ASP68 0.1780 1069 OD1 121.9680 112.4910 120.5720 O.co2 68 ASP68 -0.6478 1070 OD2 120.0090 111.6260 120.5930 O.co2 68 ASP68 -0.6478 1071 C 123.6110 111.9540 118.0060 C.2 68 ASP68 0.2192 1072 O 124.2660 112.4720 118.9180 O.2 68 ASP68 -0.2778 1073 H 121.3740 111.9570 115.7720 H 68 ASP68 0.1312 1074 HA 122.1230 113.4170 118.1400 H 68 ASP68 0.0563 1075 HB1 121.3180 110.5040 118.3590 H 68 ASP68 0.0394 1076 HB2 120.1520 111.7630 118.0310 H 68 ASP68 0.0394 1077 N 124.1070 110.9800 117.2410 N.am 69 LEU69 -0.2456 1078 CA 125.4070 110.3840 117.5480 C.3 69 LEU69 0.0883 1079 CB 125.6750 109.1360 116.6850 C.3 69 LEU69 -0.0266 1080 CG 124.9750 107.8490 117.1730 C.3 69 LEU69 -0.0449 1081 CD1 125.7370 107.1930 118.3340 C.3 69 LEU69 -0.0626 1082 CD2 123.5000 108.0630 117.5390 C.3 69 LEU69 -0.0626 1083 C 126.5680 111.3700 117.4630 C.2 69 LEU69 0.2214 1084 O 127.3730 111.4130 118.4100 O.2 69 LEU69 -0.2776 1085 H 123.5760 110.6480 116.4360 H 69 LEU69 0.1312 1086 HA 125.3550 110.0770 118.5940 H 69 LEU69 0.0557 1087 HB1 126.7460 108.9300 116.6390 H 69 LEU69 0.0287 1088 HB2 125.3900 109.3490 115.6590 H 69 LEU69 0.0287 1089 HG 125.0050 107.1420 116.3430 H 69 LEU69 0.0296 1090 HD11 125.2650 106.2570 118.6310 H 69 LEU69 0.0232 1091 HD12 125.7630 107.8430 119.2090 H 69 LEU69 0.0232 1092 HD13 126.7670 106.9680 118.0540 H 69 LEU69 0.0232 1093 HD21 122.9810 107.1130 117.6550 H 69 LEU69 0.0232 1094 HD22 122.9810 108.6300 116.7720 H 69 LEU69 0.0232 1095 HD23 123.3950 108.6090 118.4780 H 69 LEU69 0.0232 1096 N 126.7360 112.1650 116.3940 N.am 70 PRO70 -0.2316 1097 CA 127.9080 113.0640 116.3570 C.3 70 PRO70 0.0907 1098 HA 128.7985 112.4353 116.3988 H 70 PRO70 0.0559 1099 CD 125.9110 112.2283 115.1953 C.3 70 PRO70 0.0071 1100 HD1 125.0729 112.8837 115.4130 H 70 PRO70 0.0431 1101 HD2 125.5625 111.2470 114.8929 H 70 PRO70 0.0431 1102 CB 127.7774 113.7542 114.9919 C.3 70 PRO70 -0.0276 1103 HB1 128.7435 113.9169 114.5142 H 70 PRO70 0.0285 1104 HB2 127.2894 114.7263 115.0854 H 70 PRO70 0.0285 1105 CG 126.8693 112.8408 114.1747 C.3 70 PRO70 -0.0379 1106 HG1 126.3616 113.3746 113.3742 H 70 PRO70 0.0278 1107 HG2 127.4656 112.0492 113.7202 H 70 PRO70 0.0278 1108 C 127.9350 114.0790 117.4870 C.2 70 PRO70 0.2189 1109 O 129.0200 114.4440 117.9580 O.2 70 PRO70 -0.2778 1110 N 126.7720 114.5490 117.9390 N.am 71 ILE71 -0.2454 1111 CA 126.7580 115.5550 118.9950 C.3 71 ILE71 0.0903 1112 CB 125.5360 116.4900 118.8440 C.3 71 ILE71 -0.0201 1113 CG1 124.1610 115.8100 119.0360 C.3 71 ILE71 -0.0514 1114 CG2 125.5910 117.1850 117.4780 C.3 71 ILE71 -0.0605 1115 CD1 123.6700 115.7510 120.4900 C.3 71 ILE71 -0.0650 1116 C 126.8350 114.9060 120.3740 C.2 71 ILE71 0.2189 1117 O 127.3400 115.5190 121.3220 O.2 71 ILE71 -0.2778 1118 H 125.8950 114.2060 117.5480 H 71 ILE71 0.1312 1119 HA 127.6550 116.1690 118.8880 H 71 ILE71 0.0560 1120 HB 125.6230 117.2800 119.5920 H 71 ILE71 0.0318 1121 HG11 124.1690 114.8160 118.5980 H 71 ILE71 0.0266 1122 HG12 123.4060 116.3590 118.4700 H 71 ILE71 0.0266 1123 HG21 124.8140 117.9410 117.4110 H 71 ILE71 0.0233 1124 HG22 125.4350 116.4810 116.6590 H 71 ILE71 0.0233 1125 HG23 126.5490 117.6820 117.3190 H 71 ILE71 0.0233 1126 HD11 122.6930 115.2730 120.5400 H 71 ILE71 0.0230 1127 HD12 123.5730 116.7530 120.9090 H 71 ILE71 0.0230 1128 HD13 124.3300 115.1800 121.1370 H 71 ILE71 0.0230 1129 N 126.3440 113.6740 120.5150 N.am 72 ASN72 -0.2452 1130 CA 126.3970 113.0020 121.8090 C.3 72 ASN72 0.0957 1131 CB 125.4440 111.7870 121.7950 C.3 72 ASN72 0.0446 1132 CG 124.7140 111.6340 123.1320 C.2 72 ASN72 0.2000 1133 OD1 125.2480 111.9140 124.1990 O.2 72 ASN72 -0.2797 1134 ND2 123.4560 111.1930 123.0100 N.am 72 ASN72 -0.2723 1135 C 127.8240 112.6020 122.1620 C.2 72 ASN72 0.2191 1136 O 128.2480 112.7290 123.3170 O.2 72 ASN72 -0.2778 1137 H 125.9290 113.1990 119.7130 H 72 ASN72 0.1312 1138 HA 126.0730 113.7380 122.5400 H 72 ASN72 0.0562 1139 HB1 125.9500 110.8550 121.5390 H 72 ASN72 0.0375 1140 HB2 124.6660 111.9280 121.0530 H 72 ASN72 0.0375 1141 HD21 122.8950 110.9510 123.8000 H 72 ASN72 0.1266 1142 HD22 123.0290 111.0910 122.1060 H 72 ASN72 0.1266 1143 N 128.5810 112.1090 121.1790 N.am 73 VAL73 -0.2454 1144 CA 129.9520 111.6820 121.4460 C.3 73 VAL73 0.0901 1145 CB 130.5140 110.8290 120.2860 C.3 73 VAL73 -0.0227 1146 CG1 129.6900 109.5480 120.0870 C.3 73 VAL73 -0.0608 1147 CG2 130.6520 111.6000 118.9630 C.3 73 VAL73 -0.0608 1148 C 130.8380 112.8840 121.7520 C.2 73 VAL73 0.2189 1149 O 131.7240 112.8160 122.6130 O.2 73 VAL73 -0.2778 1150 H 128.2000 112.0300 120.2360 H 73 VAL73 0.1312 1151 HA 129.9210 111.0640 122.3470 H 73 VAL73 0.0560 1152 HB 131.5170 110.5090 120.5740 H 73 VAL73 0.0315 1153 HG11 130.1280 108.9210 119.3100 H 73 VAL73 0.0233 1154 HG12 128.6630 109.7660 119.7960 H 73 VAL73 0.0233 1155 HG13 129.6560 108.9590 121.0030 H 73 VAL73 0.0233 1156 HG21 130.9930 110.9420 118.1630 H 73 VAL73 0.0233 1157 HG22 131.3760 112.4100 119.0420 H 73 VAL73 0.0233 1158 HG23 129.7050 112.0330 118.6500 H 73 VAL73 0.0233 1159 N 130.6150 114.0040 121.0600 N.am 74 PHE74 -0.2453 1160 CA 131.4310 115.1920 121.2920 C.3 74 PHE74 0.0917 1161 CB 130.9990 116.2530 120.2580 C.3 74 PHE74 -0.0036 1162 CG 131.5800 117.6200 120.5240 C.ar 74 PHE74 -0.0454 1163 CD1 132.8490 117.9540 120.0610 C.ar 74 PHE74 -0.0585 1164 CD2 130.8660 118.5560 121.2700 C.ar 74 PHE74 -0.0585 1165 CE1 133.3950 119.2010 120.3410 C.ar 74 PHE74 -0.0615 1166 CE2 131.4160 119.7950 121.5660 C.ar 74 PHE74 -0.0615 1167 CZ 132.6810 120.1200 121.0980 C.ar 74 PHE74 -0.0617 1168 C 131.2310 115.7250 122.7050 C.2 74 PHE74 0.2190 1169 O 132.1880 116.1400 123.3680 O.2 74 PHE74 -0.2778 1170 H 129.8690 114.0300 120.3640 H 74 PHE74 0.1312 1171 HA 132.4790 114.9190 121.1600 H 74 PHE74 0.0560 1172 HB1 129.9110 116.3350 120.2460 H 74 PHE74 0.0333 1173 HB2 131.2840 115.9280 119.2570 H 74 PHE74 0.0333 1174 HD1 133.4190 117.2390 119.4860 H 74 PHE74 0.0620 1175 HD2 129.8850 118.3090 121.6500 H 74 PHE74 0.0620 1176 HE1 134.3800 119.4520 119.9760 H 74 PHE74 0.0618 1177 HE2 130.8610 120.5030 122.1630 H 74 PHE74 0.0618 1178 HZ 133.1050 121.0880 121.3200 H 74 PHE74 0.0618 1179 N 129.9830 115.7240 123.1800 N.am 75 LYS75 -0.2456 1180 CA 129.6990 116.2300 124.5190 C.3 75 LYS75 0.0878 1181 CB 128.1560 116.0650 124.4980 C.3 75 LYS75 -0.0289 1182 CG 127.3240 116.1690 125.7860 C.3 75 LYS75 -0.0496 1183 CD 126.0580 115.2770 125.7010 C.3 75 LYS75 -0.0278 1184 CE 125.1400 115.5390 124.4840 C.3 75 LYS75 0.1103 1185 NZ 124.1710 114.4580 124.2370 N.4 75 LYS75 -0.0749 1186 C 130.3300 115.3490 125.5890 C.2 75 LYS75 0.2187 1187 O 130.7460 115.8410 126.6450 O.2 75 LYS75 -0.2778 1188 H 129.2220 115.3670 122.6020 H 75 LYS75 0.1312 1189 HA 130.0310 117.2660 124.6060 H 75 LYS75 0.0557 1190 HB1 127.9530 115.0720 124.0930 H 75 LYS75 0.0285 1191 HB2 127.7470 116.7560 123.7600 H 75 LYS75 0.0285 1192 HG1 127.0580 117.2100 125.9740 H 75 LYS75 0.0266 1193 HG2 127.9140 115.8460 126.6440 H 75 LYS75 0.0266 1194 HD1 125.4830 115.3730 126.6230 H 75 LYS75 0.0282 1195 HD2 126.3870 114.2370 125.6650 H 75 LYS75 0.0282 1196 HE1 125.7320 115.6500 123.5740 H 75 LYS75 0.0559 1197 HE2 124.5920 116.4750 124.6100 H 75 LYS75 0.0559 1198 HZ1 123.6650 114.6030 123.3360 H 75 LYS75 0.2742 1199 HZ2 123.4830 114.3960 125.0120 H 75 LYS75 0.2742 1200 HZ3 124.6700 113.5470 124.1830 H 75 LYS75 0.2742 1201 N 130.4030 114.0390 125.3420 N.am 76 LEU76 -0.2456 1202 CA 131.0240 113.1480 126.3160 C.3 76 LEU76 0.0880 1203 CB 130.5340 111.7030 126.0950 C.3 76 LEU76 -0.0266 1204 CG 129.3120 111.3170 126.9530 C.3 76 LEU76 -0.0449 1205 CD1 129.6510 111.2280 128.4490 C.3 76 LEU76 -0.0626 1206 CD2 128.0950 112.2170 126.7050 C.3 76 LEU76 -0.0626 1207 C 132.5450 113.2340 126.2730 C.2 76 LEU76 0.2187 1208 O 133.1970 113.1340 127.3190 O.2 76 LEU76 -0.2778 1209 H 130.0250 113.6620 124.4730 H 76 LEU76 0.1312 1210 HA 130.7290 113.4870 127.3090 H 76 LEU76 0.0557 1211 HB1 131.3280 110.9880 126.3210 H 76 LEU76 0.0287 1212 HB2 130.3070 111.5520 125.0380 H 76 LEU76 0.0287 1213 HG 129.0300 110.3130 126.6490 H 76 LEU76 0.0296 1214 HD11 128.8100 110.8230 129.0120 H 76 LEU76 0.0232 1215 HD12 129.8890 112.2030 128.8730 H 76 LEU76 0.0232 1216 HD13 130.5050 110.5710 128.6190 H 76 LEU76 0.0232 1217 HD21 127.2330 111.8680 127.2740 H 76 LEU76 0.0232 1218 HD22 127.8120 112.2100 125.6540 H 76 LEU76 0.0232 1219 HD23 128.2900 113.2480 126.9980 H 76 LEU76 0.0232 1220 N 133.1280 113.4070 125.0840 N.am 77 LEU77 -0.2456 1221 CA 134.5720 113.6060 124.9920 C.3 77 LEU77 0.0880 1222 CB 135.0210 113.6570 123.5130 C.3 77 LEU77 -0.0266 1223 CG 135.4780 112.3000 122.9450 C.3 77 LEU77 -0.0449 1224 CD1 134.3040 111.3720 122.6310 C.3 77 LEU77 -0.0626 1225 CD2 136.3320 112.4950 121.6850 C.3 77 LEU77 -0.0626 1226 C 134.9900 114.8930 125.6930 C.2 77 LEU77 0.2187 1227 O 135.9400 114.9020 126.4840 O.2 77 LEU77 -0.2778 1228 H 132.5620 113.4000 124.2350 H 77 LEU77 0.1312 1229 HA 135.0300 112.7580 125.4940 H 77 LEU77 0.0557 1230 HB1 135.8670 114.3390 123.4130 H 77 LEU77 0.0287 1231 HB2 134.2340 114.0880 122.8920 H 77 LEU77 0.0287 1232 HG 136.1080 111.8090 123.6880 H 77 LEU77 0.0296 1233 HD11 134.6680 110.4080 122.2880 H 77 LEU77 0.0232 1234 HD12 133.6930 111.7750 121.8250 H 77 LEU77 0.0232 1235 HD13 133.6700 111.2000 123.5000 H 77 LEU77 0.0232 1236 HD21 136.6760 111.5370 121.2930 H 77 LEU77 0.0232 1237 HD22 137.2130 113.1020 121.8920 H 77 LEU77 0.0232 1238 HD23 135.7620 112.9910 120.8980 H 77 LEU77 0.0232 1239 N 134.2900 115.9890 125.4130 N.am 78 ALA78 -0.2459 1240 CA 134.5290 117.2650 126.0710 C.3 78 ALA78 0.0850 1241 CB 135.1510 118.2310 125.0550 C.3 78 ALA78 -0.0411 1242 C 133.2010 117.8120 126.5670 C.2 78 ALA78 0.2182 1243 O 132.2530 117.9500 125.7870 O.2 78 ALA78 -0.2778 1244 H 133.5550 115.9330 124.7080 H 78 ALA78 0.1312 1245 HA 135.1910 117.1240 126.9260 H 78 ALA78 0.0554 1246 HB1 135.3340 119.2110 125.4980 H 78 ALA78 0.0249 1247 HB2 134.4990 118.3690 124.1910 H 78 ALA78 0.0249 1248 HB3 136.1030 117.8470 124.6900 H 78 ALA78 0.0249 1249 N 133.1410 118.1450 127.8540 N.am 79 GLY79 -0.2485 1250 CA 131.9150 118.6380 128.4470 C.3 79 GLY79 0.0765 1251 C 131.6330 120.0660 128.0370 C.2 79 GLY79 0.2155 1252 O 131.7740 120.9940 128.8390 O.2 79 GLY79 -0.2781 1253 H 133.9750 118.0510 128.4340 H 79 GLY79 0.1309 1254 HA1 132.0340 118.5870 129.5290 H 79 GLY79 0.0521 1255 HA2 131.0900 117.9870 128.1530 H 79 GLY79 0.0521 1256 N 131.2440 120.2530 126.7780 N.am 80 ARG80 -0.2459 1257 CA 131.0990 121.5780 126.2000 C.3 80 ARG80 0.0879 1258 CB 132.4290 122.2320 125.7730 C.3 80 ARG80 -0.0258 1259 CG 132.4460 123.7140 126.1990 C.3 80 ARG80 -0.0154 1260 CD 133.7040 124.4950 125.8160 C.3 80 ARG80 0.1045 1261 NE 133.4710 125.9040 126.1280 N.pl3 80 ARG80 -0.4450 1262 CZ 133.7240 126.5340 127.2680 C.cat 80 ARG80 0.5062 1263 NH1 134.2880 125.9290 128.2800 N.pl3 80 ARG80 -0.4573 1264 NH2 133.3930 127.7900 127.3730 N.pl3 80 ARG80 -0.4573 1265 C 129.9900 121.5370 125.1560 C.2 80 ARG80 0.2187 1266 O 129.3280 120.5140 124.9620 O.2 80 ARG80 -0.2778 1267 H 131.0410 119.4380 126.1990 H 80 ARG80 0.1312 1268 HA 130.6640 122.1770 127.0040 H 80 ARG80 0.0557 1269 HB1 132.5900 122.1260 124.7000 H 80 ARG80 0.0286 1270 HB2 133.2590 121.7190 126.2600 H 80 ARG80 0.0286 1271 HG1 132.3130 123.7750 127.2800 H 80 ARG80 0.0299 1272 HG2 131.5890 124.2290 125.7690 H 80 ARG80 0.0299 1273 HD1 133.8830 124.4370 124.7400 H 80 ARG80 0.0711 1274 HD2 134.6000 124.1360 126.3270 H 80 ARG80 0.0711 1275 HE 133.0500 126.5100 125.4430 H 80 ARG80 0.3153 1276 HH11 134.4890 126.4300 129.1180 H 80 ARG80 0.3114 1277 HH12 134.5120 124.9630 128.2060 H 80 ARG80 0.3114 1278 HH21 133.6020 128.3370 128.1760 H 80 ARG80 0.3114 1279 HH22 132.8990 128.1980 126.5910 H 80 ARG80 0.3114 1280 N 129.7900 122.6680 124.4820 N.am 81 TRP81 -0.2453 1281 CA 128.8630 122.7870 123.3720 C.3 81 TRP81 0.0920 1282 CB 127.8830 123.9160 123.7670 C.3 81 TRP81 -0.0021 1283 CG 126.7770 124.0880 122.7470 C.ar 81 TRP81 -0.0260 1284 CD2 125.6750 123.1940 122.4930 C.ar 81 TRP81 -0.0028 1285 CD1 126.6630 125.1310 121.8240 C.ar 81 TRP81 -0.0136 1286 NE1 125.6120 124.8930 121.0030 N.ar 81 TRP81 -0.2641 1287 CE2 125.0010 123.6960 121.3550 C.ar 81 TRP81 0.0269 1288 CE3 125.2710 122.0200 123.0690 C.ar 81 TRP81 -0.0528 1289 CZ2 123.9740 122.9840 120.8040 C.ar 81 TRP81 -0.0430 1290 CZ3 124.1990 121.3090 122.5270 C.ar 81 TRP81 -0.0611 1291 CH2 123.5570 121.7860 121.3840 C.ar 81 TRP81 -0.0602 1292 C 129.6410 123.1300 122.1060 C.2 81 TRP81 0.2217 1293 O 130.6430 123.8500 122.1800 O.2 81 TRP81 -0.2776 1294 H 130.3170 123.4960 124.7610 H 81 TRP81 0.1312 1295 HA 128.3360 121.8430 123.2720 H 81 TRP81 0.0561 1296 HB1 128.4140 124.8610 123.8880 H 81 TRP81 0.0334 1297 HB2 127.4300 123.6910 124.7340 H 81 TRP81 0.0334 1298 HD1 127.3420 125.9650 121.7570 H 81 TRP81 0.0748 1299 HE1 125.3350 125.4530 120.2480 H 81 TRP81 0.1331 1300 HE3 125.7950 121.6370 123.9320 H 81 TRP81 0.0624 1301 HZ2 123.4960 123.3490 119.9070 H 81 TRP81 0.0633 1302 HZ3 123.8790 120.3820 122.9790 H 81 TRP81 0.0618 1303 HH2 122.7390 121.2310 120.9480 H 81 TRP81 0.0618 1304 N 129.2290 122.6170 120.9410 N.am 82 PRO82 -0.2316 1305 CA 130.0770 122.7710 119.7420 C.3 82 PRO82 0.0907 1306 CD 128.0350 121.8160 120.6730 C.3 82 PRO82 0.0071 1307 CB 129.2900 122.0580 118.6340 C.3 82 PRO82 -0.0276 1308 CG 128.3850 121.0850 119.3800 C.3 82 PRO82 -0.0379 1309 C 130.4040 124.2120 119.3790 C.2 82 PRO82 0.2189 1310 O 131.5670 124.5220 119.0900 O.2 82 PRO82 -0.2778 1311 HA 131.0080 122.2430 119.9490 H 82 PRO82 0.0559 1312 HD1 127.2210 122.5080 120.4860 H 82 PRO82 0.0431 1313 HD2 127.8020 121.1200 121.4760 H 82 PRO82 0.0431 1314 HB1 129.9410 121.5590 117.9160 H 82 PRO82 0.0285 1315 HB2 128.6640 122.7610 118.0800 H 82 PRO82 0.0285 1316 HG1 127.5040 120.8010 118.8040 H 82 PRO82 0.0278 1317 HG2 128.9400 120.1750 119.6120 H 82 PRO82 0.0278 1318 N 129.4160 125.1080 119.3850 N.am 83 PHE83 -0.2453 1319 CA 129.6660 126.4680 118.9170 C.3 83 PHE83 0.0917 1320 CB 128.3310 127.0970 118.4470 C.3 83 PHE83 -0.0036 1321 CG 128.1980 127.1640 116.9510 C.ar 83 PHE83 -0.0454 1322 CD1 128.9960 128.0380 116.2180 C.ar 83 PHE83 -0.0585 1323 CD2 127.2340 126.4140 116.2880 C.ar 83 PHE83 -0.0585 1324 CE1 128.8480 128.1430 114.8420 C.ar 83 PHE83 -0.0615 1325 CE2 127.0770 126.5220 114.9120 C.ar 83 PHE83 -0.0615 1326 CZ 127.8890 127.3830 114.1870 C.ar 83 PHE83 -0.0617 1327 C 130.2540 127.3510 120.0140 C.2 83 PHE83 0.2190 1328 O 131.3990 127.8050 119.9090 O.2 83 PHE83 -0.2778 1329 H 128.4880 124.8440 119.7160 H 83 PHE83 0.1312 1330 HA 130.3890 126.4320 118.0990 H 83 PHE83 0.0560 1331 HB1 128.2130 128.1250 118.7970 H 83 PHE83 0.0333 1332 HB2 127.4900 126.5500 118.8730 H 83 PHE83 0.0333 1333 HD1 129.7400 128.6410 116.7200 H 83 PHE83 0.0620 1334 HD2 126.5910 125.7510 116.8460 H 83 PHE83 0.0620 1335 HE1 129.4750 128.8230 114.2820 H 83 PHE83 0.0618 1336 HE2 126.3220 125.9390 114.4050 H 83 PHE83 0.0618 1337 HZ 127.7680 127.4700 113.1170 H 83 PHE83 0.0618 1338 N 129.4800 127.5940 121.0770 N.am 84 ASP84 -0.2451 1339 CA 129.8150 128.5280 122.1520 C.3 84 ASP84 0.0974 1340 CB 131.0900 128.0590 122.8850 C.3 84 ASP84 0.0576 1341 CG 131.1970 128.6010 124.3230 C.2 84 ASP84 0.1780 1342 OD1 131.8610 127.9800 125.1420 O.co2 84 ASP84 -0.6478 1343 OD2 130.6180 129.6340 124.6340 O.co2 84 ASP84 -0.6478 1344 C 129.9450 129.9640 121.6550 C.2 84 ASP84 0.2192 1345 O 130.3930 130.2040 120.5300 O.2 84 ASP84 -0.2778 1346 H 128.5940 127.0930 121.1430 H 84 ASP84 0.1312 1347 HA 128.9620 128.4760 122.8210 H 84 ASP84 0.0563 1348 HB1 131.9920 128.3360 122.3390 H 84 ASP84 0.0394 1349 HB2 131.0900 126.9710 122.9490 H 84 ASP84 0.0394 1350 N 129.5440 130.9220 122.4960 N.am 85 HIS85 -0.2453 1351 CA 129.6820 132.3630 122.2750 C.3 85 HIS85 0.0932 1352 ND1 132.5710 132.6260 120.6900 N.ar 85 HIS85 -0.2469 1353 CG 132.1950 132.2230 121.9220 C.ar 85 HIS85 0.0551 1354 CB 131.0770 132.8590 122.7180 C.3 85 HIS85 0.0146 1355 NE2 133.8470 130.8910 121.2710 N.ar 85 HIS85 -0.2539 1356 CD2 133.0080 131.1420 122.3010 C.ar 85 HIS85 0.0047 1357 CE1 133.5590 131.7950 120.3170 C.ar 85 HIS85 0.0737 1358 C 129.2930 132.8110 120.8680 C.2 85 HIS85 0.2191 1359 O 129.8080 133.8180 120.3710 O.2 85 HIS85 -0.2778 1360 H 129.1040 130.6240 123.3670 H 85 HIS85 0.1312 1361 HA 128.9510 132.8150 122.9410 H 85 HIS85 0.0561 1362 HB1 131.2340 132.6220 123.7700 H 85 HIS85 0.0348 1363 HB2 131.1520 133.9420 122.6240 H 85 HIS85 0.0348 1364 HE2 134.5200 130.1810 121.2200 H 85 HIS85 0.1339 1365 HD2 132.9440 130.5970 123.2320 H 85 HIS85 0.0764 1366 HE1 134.0590 131.8470 119.3600 H 85 HIS85 0.0963 1367 N 128.3860 132.0810 120.2210 N.am 86 ASN86 -0.2452 1368 CA 127.8580 132.4540 118.9150 C.3 86 ASN86 0.0957 1369 CB 128.3870 131.4660 117.8530 C.3 86 ASN86 0.0446 1370 CG 129.6980 131.9460 117.2240 C.2 86 ASN86 0.2000 1371 OD1 129.7180 132.4110 116.0940 O.2 86 ASN86 -0.2797 1372 ND2 130.7800 131.8090 118.0020 N.am 86 ASN86 -0.2723 1373 C 126.3400 132.3870 118.9470 C.2 86 ASN86 0.2191 1374 O 125.7620 131.5620 119.6600 O.2 86 ASN86 -0.2778 1375 H 128.0460 131.2240 120.6580 H 86 ASN86 0.1312 1376 HA 128.1370 133.4850 118.6830 H 86 ASN86 0.0562 1377 HB1 127.6830 131.3510 117.0270 H 86 ASN86 0.0375 1378 HB2 128.5350 130.4730 118.2770 H 86 ASN86 0.0375 1379 HD21 131.6730 132.0940 117.6580 H 86 ASN86 0.1266 1380 HD22 130.7330 131.4340 118.9280 H 86 ASN86 0.1266 1381 N 125.6990 133.2650 118.1710 N.am 87 ASP87 -0.2451 1382 CA 124.2480 133.2070 118.0360 C.3 87 ASP87 0.0974 1383 CB 123.2960 134.4030 117.7970 C.3 87 ASP87 0.0576 1384 CG 121.8790 133.9680 118.3440 C.2 87 ASP87 0.1780 1385 OD1 121.7280 133.8300 119.5590 O.co2 87 ASP87 -0.6478 1386 OD2 120.9500 133.7340 117.5680 O.co2 87 ASP87 -0.6478 1387 C 123.8080 131.9430 117.3110 C.2 87 ASP87 0.2192 1388 O 122.7110 131.4320 117.5680 O.2 87 ASP87 -0.2778 1389 H 126.2270 133.9800 117.6700 H 87 ASP87 0.1312 1390 HA 123.9810 132.9660 119.0680 H 87 ASP87 0.0563 1391 HB1 123.2240 134.6650 116.7420 H 87 ASP87 0.0394 1392 HB2 123.6210 135.2840 118.3480 H 87 ASP87 0.0394 1393 N 124.6410 131.4300 116.4010 N.am 88 PHE88 -0.2453 1394 CA 124.3220 130.1790 115.7220 C.3 88 PHE88 0.0917 1395 CB 125.3950 129.9000 114.6580 C.3 88 PHE88 -0.0036 1396 CG 125.6160 131.0780 113.7470 C.ar 88 PHE88 -0.0454 1397 CD1 124.6380 131.4540 112.8310 C.ar 88 PHE88 -0.0585 1398 CD2 126.7940 131.8160 113.8210 C.ar 88 PHE88 -0.0585 1399 CE1 124.8310 132.5550 112.0070 C.ar 88 PHE88 -0.0615 1400 CE2 126.9890 132.9170 112.9970 C.ar 88 PHE88 -0.0615 1401 CZ 126.0070 133.2880 112.0900 C.ar 88 PHE88 -0.0617 1402 C 124.2800 129.0100 116.6950 C.2 88 PHE88 0.2188 1403 O 123.5870 128.0170 116.4430 O.2 88 PHE88 -0.2778 1404 H 125.5090 131.9180 116.1790 H 88 PHE88 0.1312 1405 HA 123.3390 130.2980 115.2620 H 88 PHE88 0.0560 1406 HB1 125.1170 129.0350 114.0540 H 88 PHE88 0.0333 1407 HB2 126.3420 129.6520 115.1390 H 88 PHE88 0.0333 1408 HD1 123.7160 130.8960 112.7650 H 88 PHE88 0.0620 1409 HD2 127.5680 131.5420 114.5230 H 88 PHE88 0.0620 1410 HE1 124.0630 132.8440 111.3040 H 88 PHE88 0.0618 1411 HE2 127.9060 133.4850 113.0650 H 88 PHE88 0.0618 1412 HZ 126.1560 134.1460 111.4510 H 88 PHE88 0.0618 1413 N 125.0180 129.1030 117.8040 N.am 89 GLY89 -0.2485 1414 CA 124.9730 128.0460 118.8010 C.3 89 GLY89 0.0765 1415 C 123.5990 127.8890 119.4220 C.2 89 GLY89 0.2155 1416 O 123.1290 126.7700 119.6360 O.2 89 GLY89 -0.2781 1417 H 125.6140 129.9170 117.9520 H 89 GLY89 0.1309 1418 HA1 125.7010 128.2950 119.5720 H 89 GLY89 0.0521 1419 HA2 125.2650 127.1110 118.3240 H 89 GLY89 0.0521 1420 N 122.9390 129.0100 119.7230 N.am 90 VAL90 -0.2456 1421 CA 121.5840 128.9540 120.2650 C.3 90 VAL90 0.0901 1422 CB 121.1700 130.3800 120.7040 C.3 90 VAL90 -0.0227 1423 CG1 119.9110 130.3590 121.5830 C.3 90 VAL90 -0.0608 1424 CG2 122.2940 131.1110 121.4630 C.3 90 VAL90 -0.0608 1425 C 120.6290 128.3480 119.2450 C.2 90 VAL90 0.2189 1426 O 119.7690 127.5260 119.5870 O.2 90 VAL90 -0.2778 1427 H 123.3860 129.9150 119.5730 H 90 VAL90 0.1312 1428 HA 121.6240 128.2990 121.1370 H 90 VAL90 0.0560 1429 HB 120.9650 130.9800 119.8150 H 90 VAL90 0.0315 1430 HG11 119.6130 131.3700 121.8630 H 90 VAL90 0.0233 1431 HG12 120.0820 129.7980 122.5020 H 90 VAL90 0.0233 1432 HG13 119.0720 129.9020 121.0720 H 90 VAL90 0.0233 1433 HG21 121.9450 132.0770 121.8290 H 90 VAL90 0.0233 1434 HG22 123.1510 131.3210 120.8230 H 90 VAL90 0.0233 1435 HG23 122.6360 130.5320 122.3200 H 90 VAL90 0.0233 1436 N 120.7640 128.7440 117.9760 N.am 91 PHE91 -0.2453 1437 CA 119.9360 128.1570 116.9260 C.3 91 PHE91 0.0917 1438 CB 120.2930 128.8800 115.6150 C.3 91 PHE91 -0.0036 1439 CG 119.3850 128.4900 114.4790 C.ar 91 PHE91 -0.0454 1440 CD1 118.1830 129.1610 114.2730 C.ar 91 PHE91 -0.0585 1441 CD2 119.7390 127.4580 113.6150 C.ar 91 PHE91 -0.0585 1442 CE1 117.3430 128.7990 113.2280 C.ar 91 PHE91 -0.0615 1443 CE2 118.9030 127.0990 112.5660 C.ar 91 PHE91 -0.0615 1444 CZ 117.7020 127.7660 112.3740 C.ar 91 PHE91 -0.0617 1445 C 120.1950 126.6620 116.7920 C.2 91 PHE91 0.2190 1446 O 119.2550 125.8730 116.6440 O.2 91 PHE91 -0.2778 1447 H 121.4500 129.4610 117.7390 H 91 PHE91 0.1312 1448 HA 118.8990 128.3400 117.1510 H 91 PHE91 0.0560 1449 HB1 121.3290 128.6860 115.3340 H 91 PHE91 0.0333 1450 HB2 120.2250 129.9590 115.7580 H 91 PHE91 0.0333 1451 HD1 117.8990 129.9780 114.9190 H 91 PHE91 0.0620 1452 HD2 120.6680 126.9250 113.7580 H 91 PHE91 0.0620 1453 HE1 116.4130 129.3270 113.0720 H 91 PHE91 0.0618 1454 HE2 119.1880 126.3000 111.8970 H 91 PHE91 0.0618 1455 HZ 117.0520 127.4860 111.5580 H 91 PHE91 0.0618 1456 N 121.4650 126.2550 116.8400 N.am 92 LEU92 -0.2456 1457 CA 121.7830 124.8310 116.8300 C.3 92 LEU92 0.0880 1458 CB 123.3130 124.7250 116.6970 C.3 92 LEU92 -0.0266 1459 CG 123.8090 123.3520 116.2230 C.3 92 LEU92 -0.0449 1460 CD1 123.4120 123.1110 114.7580 C.3 92 LEU92 -0.0626 1461 CD2 125.3290 123.2360 116.3910 C.3 92 LEU92 -0.0626 1462 C 121.2990 124.1560 118.1070 C.2 92 LEU92 0.2187 1463 O 120.8810 122.9930 118.0850 O.2 92 LEU92 -0.2778 1464 H 122.2170 126.9430 116.8840 H 92 LEU92 0.1312 1465 HA 121.2740 124.3920 115.9710 H 92 LEU92 0.0557 1466 HB1 123.7830 124.9880 117.6470 H 92 LEU92 0.0287 1467 HB2 123.6660 125.4740 115.9870 H 92 LEU92 0.0287 1468 HG 123.3500 122.5850 116.8470 H 92 LEU92 0.0296 1469 HD11 123.9150 122.2380 114.3470 H 92 LEU92 0.0232 1470 HD12 123.6890 123.9590 114.1310 H 92 LEU92 0.0232 1471 HD13 122.3390 122.9510 114.6530 H 92 LEU92 0.0232 1472 HD21 125.6810 122.2360 116.1430 H 92 LEU92 0.0232 1473 HD22 125.6340 123.4470 117.4170 H 92 LEU92 0.0232 1474 HD23 125.8470 123.9290 115.7310 H 92 LEU92 0.0232 1475 N 121.3550 124.8730 119.2320 N.am 93 CYS93 -0.2449 1476 CA 120.8450 124.3330 120.4880 C.3 93 CYS93 0.0965 1477 CB 121.2150 125.2630 121.6480 C.3 93 CYS93 0.0147 1478 SG 120.7290 124.6240 123.2700 S.3 93 CYS93 -0.1762 1479 C 119.3380 124.1210 120.4360 C.2 93 CYS93 0.2195 1480 O 118.8160 123.2120 121.0920 O.2 93 CYS93 -0.2778 1481 H 121.7590 125.8090 119.2130 H 93 CYS93 0.1312 1482 HA 121.2950 123.3530 120.6350 H 93 CYS93 0.0565 1483 HB1 120.7490 126.2380 121.5100 H 93 CYS93 0.0394 1484 HB2 122.2920 125.4290 121.6560 H 93 CYS93 0.0394 1485 HG 119.4050 124.4330 123.2890 H 93 CYS93 0.1017 1486 N 118.6250 124.9400 119.6680 N.am 94 LYS94 -0.2456 1487 CA 117.1770 124.8370 119.5530 C.3 94 LYS94 0.0878 1488 CB 116.5270 126.2480 119.6690 C.3 94 LYS94 -0.0289 1489 CG 116.9320 127.3340 118.6460 C.3 94 LYS94 -0.0496 1490 CD 116.9530 128.7700 119.2530 C.3 94 LYS94 -0.0278 1491 CE 117.2580 129.9730 118.3030 C.3 94 LYS94 0.1103 1492 NZ 118.4830 130.7750 118.5540 N.4 94 LYS94 -0.0749 1493 C 116.7280 124.0170 118.3500 C.2 94 LYS94 0.2187 1494 O 115.5220 123.9270 118.0970 O.2 94 LYS94 -0.2778 1495 H 119.1100 125.6660 119.1410 H 94 LYS94 0.1312 1496 HA 116.8160 124.2760 120.4180 H 94 LYS94 0.0557 1497 HB1 116.7540 126.6130 120.6720 H 94 LYS94 0.0285 1498 HB2 115.4460 126.1540 119.6310 H 94 LYS94 0.0285 1499 HG1 116.2650 127.2910 117.7840 H 94 LYS94 0.0266 1500 HG2 117.9030 127.0530 118.2740 H 94 LYS94 0.0266 1501 HD1 117.6350 128.7750 120.0980 H 94 LYS94 0.0282 1502 HD2 115.9710 128.9400 119.6970 H 94 LYS94 0.0282 1503 HE1 116.4220 130.6730 118.3650 H 94 LYS94 0.0559 1504 HE2 117.2650 129.6490 117.2620 H 94 LYS94 0.0559 1505 HZ1 118.5700 131.5660 117.8750 H 94 LYS94 0.2742 1506 HZ2 119.3360 130.1900 118.4630 H 94 LYS94 0.2742 1507 HZ3 118.4670 131.1940 119.5070 H 94 LYS94 0.2742 1508 N 117.6570 123.4200 117.6040 N.am 95 LEU95 -0.2456 1509 CA 117.3260 122.6560 116.4080 C.3 95 LEU95 0.0880 1510 CB 118.1760 123.2590 115.2730 C.3 95 LEU95 -0.0266 1511 CG 118.0670 122.5700 113.8960 C.3 95 LEU95 -0.0449 1512 CD1 118.2130 123.5980 112.7670 C.3 95 LEU95 -0.0626 1513 CD2 119.1290 121.4730 113.7200 C.3 95 LEU95 -0.0626 1514 C 117.5750 121.1640 116.5650 C.2 95 LEU95 0.2187 1515 O 116.7150 120.3540 116.2050 O.2 95 LEU95 -0.2778 1516 H 118.6360 123.5010 117.8800 H 95 LEU95 0.1312 1517 HA 116.2690 122.7830 116.1700 H 95 LEU95 0.0557 1518 HB1 119.2230 123.3070 115.5750 H 95 LEU95 0.0287 1519 HB2 117.8630 124.2990 115.1700 H 95 LEU95 0.0287 1520 HG 117.0780 122.1200 113.8000 H 95 LEU95 0.0296 1521 HD11 118.1090 123.1270 111.7890 H 95 LEU95 0.0232 1522 HD12 119.1910 124.0790 112.8030 H 95 LEU95 0.0232 1523 HD13 117.4520 124.3760 112.8400 H 95 LEU95 0.0232 1524 HD21 119.1230 121.0780 112.7050 H 95 LEU95 0.0232 1525 HD22 118.9610 120.6340 114.3910 H 95 LEU95 0.0232 1526 HD23 120.1310 121.8570 113.9130 H 95 LEU95 0.0232 1527 N 118.7400 120.7760 117.0880 N.am 96 PHE96 -0.2453 1528 CA 119.0450 119.3540 117.2420 C.3 96 PHE96 0.0920 1529 CB 120.5170 119.0840 117.6100 C.3 96 PHE96 -0.0036 1530 CG 121.5130 119.3300 116.5010 C.ar 96 PHE96 -0.0454 1531 CD1 121.2470 118.9960 115.1720 C.ar 96 PHE96 -0.0585 1532 CD2 122.7890 119.7820 116.8230 C.ar 96 PHE96 -0.0585 1533 CE1 122.2260 119.1080 114.1950 C.ar 96 PHE96 -0.0615 1534 CE2 123.7760 119.8760 115.8510 C.ar 96 PHE96 -0.0615 1535 CZ 123.4980 119.5360 114.5370 C.ar 96 PHE96 -0.0617 1536 C 118.0750 118.6310 118.1700 C.2 96 PHE96 0.2217 1537 O 117.6020 117.5430 117.7980 O.2 96 PHE96 -0.2776 1538 H 119.4220 121.4750 117.3820 H 96 PHE96 0.1312 1539 HA 118.8270 118.9080 116.2730 H 96 PHE96 0.0560 1540 HB1 120.6360 118.0390 117.9050 H 96 PHE96 0.0333 1541 HB2 120.8040 119.6770 118.4770 H 96 PHE96 0.0333 1542 HD1 120.2920 118.5960 114.8700 H 96 PHE96 0.0620 1543 HD2 123.0340 120.0240 117.8460 H 96 PHE96 0.0620 1544 HE1 122.0040 118.8300 113.1750 H 96 PHE96 0.0618 1545 HE2 124.7700 120.1950 116.1240 H 96 PHE96 0.0618 1546 HZ 124.2690 119.6040 113.7830 H 96 PHE96 0.0618 1547 N 117.7470 119.1380 119.3680 N.am 97 PRO97 -0.2316 1548 CA 116.7270 118.4450 120.1760 C.3 97 PRO97 0.0907 1549 CD 118.2930 120.3380 119.9920 C.3 97 PRO97 0.0071 1550 CB 116.6400 119.3170 121.4410 C.3 97 PRO97 -0.0276 1551 CG 117.9320 120.1330 121.4620 C.3 97 PRO97 -0.0379 1552 C 115.3780 118.3450 119.4870 C.2 97 PRO97 0.2189 1553 O 114.6810 117.3340 119.6430 O.2 97 PRO97 -0.2778 1554 HA 117.1090 117.4500 120.3980 H 97 PRO97 0.0559 1555 HD1 117.7760 121.1970 119.5630 H 97 PRO97 0.0431 1556 HD2 119.3660 120.4170 119.8310 H 97 PRO97 0.0431 1557 HB1 116.5110 118.7250 122.3460 H 97 PRO97 0.0285 1558 HB2 115.8010 120.0150 121.3880 H 97 PRO97 0.0285 1559 HG1 117.8260 121.0730 122.0050 H 97 PRO97 0.0278 1560 HG2 118.7190 119.5560 121.9490 H 97 PRO97 0.0278 1561 N 114.9850 119.3730 118.7320 N.am 98 PHE98 -0.2453 1562 CA 113.7060 119.3290 118.0290 C.3 98 PHE98 0.0917 1563 CB 113.5160 120.7040 117.3520 C.3 98 PHE98 -0.0036 1564 CG 112.4290 120.7180 116.3020 C.ar 98 PHE98 -0.0454 1565 CD1 111.0930 120.7290 116.6750 C.ar 98 PHE98 -0.0585 1566 CD2 112.7450 120.6600 114.9470 C.ar 98 PHE98 -0.0585 1567 CE1 110.0820 120.6730 115.7250 C.ar 98 PHE98 -0.0615 1568 CE2 111.7400 120.6020 113.9890 C.ar 98 PHE98 -0.0615 1569 CZ 110.4070 120.6060 114.3780 C.ar 98 PHE98 -0.0617 1570 C 113.7010 118.2440 116.9600 C.2 98 PHE98 0.2190 1571 O 112.7150 117.5140 116.8110 O.2 98 PHE98 -0.2778 1572 H 115.5830 120.1950 118.6460 H 98 PHE98 0.1312 1573 HA 112.9130 119.1270 118.7510 H 98 PHE98 0.0560 1574 HB1 114.4460 121.0230 116.8820 H 98 PHE98 0.0333 1575 HB2 113.3070 121.4510 118.1150 H 98 PHE98 0.0333 1576 HD1 110.8520 120.7800 117.7220 H 98 PHE98 0.0620 1577 HD2 113.7790 120.6330 114.6350 H 98 PHE98 0.0620 1578 HE1 109.0470 120.6720 116.0350 H 98 PHE98 0.0618 1579 HE2 111.9970 120.5440 112.9410 H 98 PHE98 0.0618 1580 HZ 109.6230 120.5580 113.6350 H 98 PHE98 0.0618 1581 N 114.7940 118.1290 116.2020 N.am 99 LEU99 -0.2456 1582 CA 114.8740 117.0990 115.1730 C.3 99 LEU99 0.0880 1583 CB 116.1200 117.3020 114.2960 C.3 99 LEU99 -0.0266 1584 CG 116.0840 118.5770 113.4330 C.3 99 LEU99 -0.0449 1585 CD1 117.3990 118.7300 112.6610 C.3 99 LEU99 -0.0626 1586 CD2 114.8990 118.5920 112.4560 C.3 99 LEU99 -0.0626 1587 C 114.8750 115.7040 115.7870 C.2 99 LEU99 0.2187 1588 O 114.2480 114.7820 115.2520 O.2 99 LEU99 -0.2778 1589 H 115.5780 118.7660 116.3440 H 99 LEU99 0.1312 1590 HA 113.9720 117.1780 114.5720 H 99 LEU99 0.0557 1591 HB1 116.2430 116.4430 113.6330 H 99 LEU99 0.0287 1592 HB2 117.0060 117.3200 114.9340 H 99 LEU99 0.0287 1593 HG 115.9840 119.4410 114.0880 H 99 LEU99 0.0296 1594 HD11 117.4180 119.6690 112.1080 H 99 LEU99 0.0232 1595 HD12 117.5300 117.9210 111.9430 H 99 LEU99 0.0232 1596 HD13 118.2560 118.7170 113.3350 H 99 LEU99 0.0232 1597 HD21 114.9390 119.4690 111.8110 H 99 LEU99 0.0232 1598 HD22 113.9430 118.6240 112.9760 H 99 LEU99 0.0232 1599 HD23 114.9040 117.7080 111.8170 H 99 LEU99 0.0232 1600 N 115.5810 115.5290 116.9070 N.am 100 GLN100 -0.2456 1601 CA 115.6140 114.2260 117.5630 C.3 100 GLN100 0.0882 1602 CB 116.5890 114.3200 118.7490 C.3 100 GLN100 -0.0210 1603 CG 118.0580 114.4930 118.3260 C.3 100 GLN100 0.0225 1604 CD 118.9160 115.0280 119.4840 C.2 100 GLN100 0.1981 1605 OE1 118.4260 115.4500 120.5260 O.2 100 GLN100 -0.2798 1606 NE2 120.2280 114.9810 119.2290 N.am 100 GLN100 -0.2724 1607 C 114.2380 113.8330 118.0840 C.2 100 GLN100 0.2187 1608 O 113.8050 112.6880 117.9120 O.2 100 GLN100 -0.2778 1609 H 116.1000 116.3110 117.3060 H 100 GLN100 0.1312 1610 HA 115.9460 113.4830 116.8350 H 100 GLN100 0.0557 1611 HB1 116.5160 113.4310 119.3780 H 100 GLN100 0.0289 1612 HB2 116.2770 115.1620 119.3700 H 100 GLN100 0.0289 1613 HG1 118.1570 115.1850 117.4910 H 100 GLN100 0.0356 1614 HG2 118.4690 113.5390 117.9930 H 100 GLN100 0.0356 1615 HE21 120.8810 115.2420 119.9360 H 100 GLN100 0.1266 1616 HE22 120.5760 114.6570 118.3500 H 100 GLN100 0.1266 1617 N 113.5350 114.7710 118.7260 N.am 101 LYS101 -0.2457 1618 CA 112.2040 114.4720 119.2460 C.3 101 LYS101 0.0878 1619 CB 111.6470 115.7030 119.9920 C.3 101 LYS101 -0.0289 1620 CG 111.2700 115.3930 121.4410 C.3 101 LYS101 -0.0496 1621 CD 112.4780 115.0300 122.3120 C.3 101 LYS101 -0.0278 1622 CE 113.5760 116.1030 122.2700 C.3 101 LYS101 0.1103 1623 NZ 114.1140 116.3620 123.5960 N.4 101 LYS101 -0.0749 1624 C 111.2360 114.1300 118.1210 C.2 101 LYS101 0.2187 1625 O 110.4140 113.2170 118.2550 O.2 101 LYS101 -0.2778 1626 H 113.9310 115.7020 118.8540 H 101 LYS101 0.1312 1627 HA 112.2920 113.5970 119.8920 H 101 LYS101 0.0557 1628 HB1 110.7600 116.1110 119.5030 H 101 LYS101 0.0285 1629 HB2 112.3600 116.5240 119.9460 H 101 LYS101 0.0285 1630 HG1 110.5380 114.5830 121.4670 H 101 LYS101 0.0266 1631 HG2 110.7690 116.2640 121.8670 H 101 LYS101 0.0266 1632 HD1 112.8920 114.0660 122.0150 H 101 LYS101 0.0282 1633 HD2 112.1180 114.8950 123.3330 H 101 LYS101 0.0282 1634 HE1 113.1780 117.0530 121.9070 H 101 LYS101 0.0559 1635 HE2 114.3900 115.8140 121.6030 H 101 LYS101 0.0559 1636 HZ1 114.7230 117.2030 123.5850 H 101 LYS101 0.2742 1637 HZ2 114.6090 115.5340 123.9690 H 101 LYS101 0.2742 1638 HZ3 113.3160 116.6240 124.2230 H 101 LYS101 0.2742 1639 N 111.3150 114.8590 117.0050 N.am 102 SER102 -0.2436 1640 CA 110.4950 114.5230 115.8460 C.3 102 SER102 0.1109 1641 CB 110.5380 115.6250 114.7810 C.3 102 SER102 0.0681 1642 OG 111.8290 115.7300 114.1990 O.3 102 SER102 -0.3930 1643 C 110.8710 113.1560 115.2880 C.2 102 SER102 0.2210 1644 O 110.0010 112.4010 114.8380 O.2 102 SER102 -0.2777 1645 H 111.9520 115.6550 116.9630 H 102 SER102 0.1312 1646 HA 109.4710 114.4570 116.2160 H 102 SER102 0.0580 1647 HB1 110.2610 116.5770 115.2460 H 102 SER102 0.0577 1648 HB2 109.7900 115.4010 114.0110 H 102 SER102 0.0577 1649 HG 111.8440 116.3830 113.5070 H 102 SER102 0.2095 1650 N 112.1650 112.8230 115.3050 N.am 103 SER103 -0.2435 1651 CA 112.6070 111.5260 114.8030 C.3 103 SER103 0.1109 1652 CB 114.1410 111.4370 114.7830 C.3 103 SER103 0.0681 1653 OG 114.6780 112.4120 113.8970 O.3 103 SER103 -0.3930 1654 C 112.0300 110.3840 115.6300 C.2 103 SER103 0.2209 1655 O 111.6270 109.3520 115.0810 O.2 103 SER103 -0.2777 1656 H 112.8510 113.4820 115.6730 H 103 SER103 0.1312 1657 HA 112.2350 111.4340 113.7820 H 103 SER103 0.0580 1658 HB1 114.4390 110.4410 114.4370 H 103 SER103 0.0577 1659 HB2 114.5320 111.5720 115.7980 H 103 SER103 0.0577 1660 HG 115.6280 112.4600 113.9650 H 103 SER103 0.2095 1661 N 111.9920 110.5420 116.9550 N.am 104 VAL104 -0.2453 1662 CA 111.4060 109.5090 117.8060 C.3 104 VAL104 0.0901 1663 CB 111.7720 109.6850 119.2930 C.3 104 VAL104 -0.0227 1664 CG1 111.2310 108.5160 120.1340 C.3 104 VAL104 -0.0608 1665 CG2 113.2940 109.7580 119.4870 C.3 104 VAL104 -0.0608 1666 C 109.9100 109.3930 117.5430 C.2 104 VAL104 0.2187 1667 O 109.3460 108.2930 117.5310 O.2 104 VAL104 -0.2778 1668 H 112.3740 111.3890 117.3760 H 104 VAL104 0.1312 1669 HA 111.8450 108.5670 117.4750 H 104 VAL104 0.0560 1670 HB 111.3350 110.6160 119.6540 H 104 VAL104 0.0315 1671 HG11 111.5060 108.6220 121.1830 H 104 VAL104 0.0233 1672 HG12 111.6350 107.5640 119.7860 H 104 VAL104 0.0233 1673 HG13 110.1460 108.4460 120.0810 H 104 VAL104 0.0233 1674 HG21 113.5540 109.8360 120.5430 H 104 VAL104 0.0233 1675 HG22 113.7330 110.6130 118.9830 H 104 VAL104 0.0233 1676 HG23 113.7780 108.8660 119.0890 H 104 VAL104 0.0233 1677 N 109.2460 110.5310 117.3300 N.am 105 GLY105 -0.2485 1678 CA 107.8030 110.5130 117.1510 C.3 105 GLY105 0.0765 1679 C 107.3700 109.7460 115.9160 C.2 105 GLY105 0.2155 1680 O 106.4270 108.9520 115.9620 O.2 105 GLY105 -0.2781 1681 H 109.7520 111.4160 117.2930 H 105 GLY105 0.1309 1682 HA1 107.4540 111.5420 117.1180 H 105 GLY105 0.0521 1683 HA2 107.3660 110.0420 118.0320 H 105 GLY105 0.0521 1684 N 108.0510 109.9750 114.7910 N.am 106 ILE106 -0.2456 1685 CA 107.6770 109.2910 113.5570 C.3 106 ILE106 0.0903 1686 CB 108.3380 109.9240 112.3050 C.3 106 ILE106 -0.0201 1687 CG1 109.8770 110.0270 112.4020 C.3 106 ILE106 -0.0514 1688 CG2 107.7060 111.2830 111.9760 C.3 106 ILE106 -0.0605 1689 CD1 110.5540 110.5100 111.1190 C.3 106 ILE106 -0.0650 1690 C 108.0170 107.8070 113.6370 C.2 106 ILE106 0.2190 1691 O 107.2170 106.9540 113.2370 O.2 106 ILE106 -0.2778 1692 H 108.8340 110.6290 114.7940 H 106 ILE106 0.1312 1693 HA 106.5910 109.3620 113.4630 H 106 ILE106 0.0560 1694 HB 108.1060 109.2750 111.4580 H 106 ILE106 0.0318 1695 HG11 110.3120 109.0590 112.6330 H 106 ILE106 0.0266 1696 HG12 110.1530 110.6840 113.2200 H 106 ILE106 0.0266 1697 HG21 107.9340 111.5790 110.9540 H 106 ILE106 0.0233 1698 HG22 108.0840 112.0710 112.6220 H 106 ILE106 0.0233 1699 HG23 106.6210 111.2490 112.0730 H 106 ILE106 0.0233 1700 HD11 111.6340 110.5620 111.2520 H 106 ILE106 0.0230 1701 HD12 110.2110 111.5020 110.8260 H 106 ILE106 0.0230 1702 HD13 110.3560 109.8160 110.3030 H 106 ILE106 0.0230 1703 N 109.2020 107.4740 114.1550 N.am 107 THR107 -0.2434 1704 CA 109.6310 106.0780 114.2010 C.3 107 THR107 0.1135 1705 CB 111.1250 105.9260 114.5520 C.3 107 THR107 0.0763 1706 OG1 111.3760 106.5050 115.8240 O.3 107 THR107 -0.3900 1707 CG2 112.0310 106.5360 113.4640 C.3 107 THR107 -0.0370 1708 C 108.7410 105.2550 115.1240 C.2 107 THR107 0.2212 1709 O 108.3750 104.1190 114.8000 O.2 107 THR107 -0.2777 1710 H 109.8140 108.2020 114.5230 H 107 THR107 0.1313 1711 HA 109.4860 105.6810 113.1960 H 107 THR107 0.0583 1712 HB 111.3450 104.8510 114.5940 H 107 THR107 0.0611 1713 HG1 112.2980 106.4010 116.0420 H 107 THR107 0.2098 1714 HG21 113.0840 106.3160 113.6430 H 107 THR107 0.0255 1715 HG22 111.9260 107.6170 113.4060 H 107 THR107 0.0255 1716 HG23 111.7890 106.1330 112.4810 H 107 THR107 0.0255 1717 N 108.3900 105.8090 116.2860 N.am 108 VAL108 -0.2453 1718 CA 107.4950 105.1100 117.2050 C.3 108 VAL108 0.0901 1719 CB 107.4440 105.8690 118.5510 C.3 108 VAL108 -0.0227 1720 CG1 106.3720 105.3230 119.5130 C.3 108 VAL108 -0.0608 1721 CG2 108.8150 105.8410 119.2490 C.3 108 VAL108 -0.0608 1722 C 106.1180 104.9400 116.5740 C.2 108 VAL108 0.2189 1723 O 105.5100 103.8640 116.6420 O.2 108 VAL108 -0.2778 1724 H 108.7500 106.7300 116.5350 H 108 VAL108 0.1312 1725 HA 107.9120 104.1140 117.3640 H 108 VAL108 0.0560 1726 HB 107.1980 106.9120 118.3410 H 108 VAL108 0.0315 1727 HG11 106.3930 105.8560 120.4640 H 108 VAL108 0.0233 1728 HG12 106.5350 104.2650 119.7240 H 108 VAL108 0.0233 1729 HG13 105.3670 105.4330 119.1070 H 108 VAL108 0.0233 1730 HG21 108.8070 106.4460 120.1560 H 108 VAL108 0.0233 1731 HG22 109.6160 106.2120 118.6120 H 108 VAL108 0.0233 1732 HG23 109.0890 104.8270 119.5300 H 108 VAL108 0.0233 1733 N 105.6110 105.9990 115.9410 N.am 109 LEU109 -0.2456 1734 CA 104.2830 105.9360 115.3420 C.3 109 LEU109 0.0880 1735 CB 103.7940 107.3640 115.0370 C.3 109 LEU109 -0.0266 1736 CG 103.5190 108.2260 116.2830 C.3 109 LEU109 -0.0449 1737 CD1 103.3470 109.6990 115.8870 C.3 109 LEU109 -0.0626 1738 CD2 102.2850 107.7380 117.0520 C.3 109 LEU109 -0.0626 1739 C 104.2750 105.1110 114.0610 C.2 109 LEU109 0.2187 1740 O 103.2450 104.5220 113.7140 O.2 109 LEU109 -0.2778 1741 H 106.1560 106.8590 115.8750 H 109 LEU109 0.1312 1742 HA 103.6140 105.4490 116.0530 H 109 LEU109 0.0557 1743 HB1 102.8780 107.3240 114.4490 H 109 LEU109 0.0287 1744 HB2 104.5360 107.8580 114.4070 H 109 LEU109 0.0287 1745 HG 104.3720 108.1620 116.9590 H 109 LEU109 0.0296 1746 HD11 103.1930 110.3260 116.7650 H 109 LEU109 0.0232 1747 HD12 102.4900 109.8280 115.2250 H 109 LEU109 0.0232 1748 HD13 104.2250 110.0770 115.3630 H 109 LEU109 0.0232 1749 HD21 102.0760 108.3950 117.8960 H 109 LEU109 0.0232 1750 HD22 102.4270 106.7320 117.4460 H 109 LEU109 0.0232 1751 HD23 101.4010 107.7280 116.4140 H 109 LEU109 0.0232 1752 N 105.4010 105.0600 113.3420 N.am 110 ASN110 -0.2452 1753 CA 105.4920 104.1750 112.1840 C.3 110 ASN110 0.0957 1754 CB 106.8380 104.3730 111.4600 C.3 110 ASN110 0.0446 1755 CG 106.8710 105.6500 110.6070 C.2 110 ASN110 0.2000 1756 OD1 105.8610 106.1220 110.1040 O.2 110 ASN110 -0.2797 1757 ND2 108.0980 106.1760 110.4700 N.am 110 ASN110 -0.2723 1758 C 105.3630 102.7170 112.6000 C.2 110 ASN110 0.2191 1759 O 104.7540 101.9120 111.8850 O.2 110 ASN110 -0.2778 1760 H 106.1980 105.6410 113.6030 H 110 ASN110 0.1312 1761 HA 104.6540 104.4060 111.5230 H 110 ASN110 0.0562 1762 HB1 107.0450 103.5450 110.7810 H 110 ASN110 0.0375 1763 HB2 107.6460 104.4050 112.1880 H 110 ASN110 0.0375 1764 HD21 108.2250 106.9940 109.9110 H 110 ASN110 0.1266 1765 HD22 108.8940 105.7650 110.9130 H 110 ASN110 0.1266 1766 N 105.9390 102.3570 113.7500 N.am 111 LEU111 -0.2456 1767 CA 105.7690 101.0070 114.2730 C.3 111 LEU111 0.0880 1768 CB 106.5950 100.8160 115.5610 C.3 111 LEU111 -0.0266 1769 CG 108.1170 100.8240 115.3490 C.3 111 LEU111 -0.0449 1770 CD1 108.8510 100.9600 116.6900 C.3 111 LEU111 -0.0626 1771 CD2 108.5980 99.5700 114.6040 C.3 111 LEU111 -0.0626 1772 C 104.3030 100.7170 114.5700 C.2 111 LEU111 0.2187 1773 O 103.8110 99.6170 114.2940 O.2 111 LEU111 -0.2778 1774 H 106.5030 103.0320 114.2670 H 111 LEU111 0.1312 1775 HA 106.0950 100.3150 113.4980 H 111 LEU111 0.0557 1776 HB1 106.3230 99.8780 116.0470 H 111 LEU111 0.0287 1777 HB2 106.3300 101.6010 116.2680 H 111 LEU111 0.0287 1778 HG 108.3770 101.6970 114.7550 H 111 LEU111 0.0296 1779 HD11 109.9310 101.0080 116.5430 H 111 LEU111 0.0232 1780 HD12 108.6420 100.1150 117.3470 H 111 LEU111 0.0232 1781 HD13 108.5520 101.8690 117.2120 H 111 LEU111 0.0232 1782 HD21 109.6810 99.5860 114.4790 H 111 LEU111 0.0232 1783 HD22 108.1590 99.5000 113.6090 H 111 LEU111 0.0232 1784 HD23 108.3410 98.6640 115.1520 H 111 LEU111 0.0232 1785 N 103.5920 101.6930 115.1400 N.am 112 CYS112 -0.2449 1786 CA 102.1590 101.5310 115.3660 C.3 112 CYS112 0.0965 1787 CB 101.6470 102.7330 116.1700 C.3 112 CYS112 0.0147 1788 SG 99.9190 102.5840 116.6930 S.3 112 CYS112 -0.1762 1789 C 101.4060 101.3990 114.0480 C.2 112 CYS112 0.2195 1790 O 100.4840 100.5830 113.9300 O.2 112 CYS112 -0.2778 1791 H 104.0540 102.5580 115.4200 H 112 CYS112 0.1312 1792 HA 102.0220 100.6160 115.9410 H 112 CYS112 0.0565 1793 HB1 101.7590 103.6510 115.5920 H 112 CYS112 0.0394 1794 HB2 102.2630 102.8590 117.0610 H 112 CYS112 0.0394 1795 HG 99.5420 103.7040 117.3150 H 112 CYS112 0.1017 1796 N 101.7800 102.2000 113.0470 N.am 113 ALA113 -0.2459 1797 CA 101.1400 102.1020 111.7390 C.3 113 ALA113 0.0850 1798 CB 101.6410 103.2520 110.8560 C.3 113 ALA113 -0.0411 1799 C 101.4330 100.7610 111.0770 C.2 113 ALA113 0.2184 1800 O 100.5530 100.1730 110.4380 O.2 113 ALA113 -0.2778 1801 H 102.5190 102.8860 113.1980 H 113 ALA113 0.1312 1802 HA 100.0630 102.1900 111.8920 H 113 ALA113 0.0554 1803 HB1 101.1510 103.2460 109.8810 H 113 ALA113 0.0249 1804 HB2 102.7170 103.1900 110.6900 H 113 ALA113 0.0249 1805 HB3 101.4350 104.2160 111.3220 H 113 ALA113 0.0249 1806 N 102.6670 100.2670 111.2110 N.am 114 LEU114 -0.2457 1807 CA 103.0170 98.9780 110.6230 C.3 114 LEU114 0.0880 1808 CB 104.5250 98.7350 110.8020 C.3 114 LEU114 -0.0266 1809 CG 105.4100 99.5570 109.8460 C.3 114 LEU114 -0.0449 1810 CD1 106.8620 99.5770 110.3360 C.3 114 LEU114 -0.0626 1811 CD2 105.3440 99.0280 108.4060 C.3 114 LEU114 -0.0626 1812 C 102.2090 97.8470 111.2480 C.2 114 LEU114 0.2187 1813 O 101.7510 96.9400 110.5440 O.2 114 LEU114 -0.2778 1814 H 103.3700 100.7950 111.7280 H 114 LEU114 0.1312 1815 HA 102.7520 99.0260 109.5660 H 114 LEU114 0.0557 1816 HB1 104.7560 97.6810 110.6630 H 114 LEU114 0.0287 1817 HB2 104.7880 98.9650 111.8360 H 114 LEU114 0.0287 1818 HG 105.0560 100.5880 109.8360 H 114 LEU114 0.0296 1819 HD11 107.4820 100.2110 109.7010 H 114 LEU114 0.0232 1820 HD12 107.2970 98.5780 110.3390 H 114 LEU114 0.0232 1821 HD13 106.9220 99.9690 111.3510 H 114 LEU114 0.0232 1822 HD21 106.0330 99.5750 107.7630 H 114 LEU114 0.0232 1823 HD22 104.3460 99.1380 107.9830 H 114 LEU114 0.0232 1824 HD23 105.6170 97.9740 108.3560 H 114 LEU114 0.0232 1825 N 102.0300 97.8810 112.5700 N.am 115 SER115 -0.2436 1826 CA 101.2090 96.8700 113.2290 C.3 115 SER115 0.1109 1827 CB 101.3240 96.9940 114.7580 C.3 115 SER115 0.0681 1828 OG 100.7710 98.2220 115.2030 O.3 115 SER115 -0.3930 1829 C 99.7550 96.9710 112.7870 C.2 115 SER115 0.2209 1830 O 99.0790 95.9500 112.6130 O.2 115 SER115 -0.2777 1831 H 102.4690 98.6170 113.1230 H 115 SER115 0.1312 1832 HA 101.5850 95.8970 112.9160 H 115 SER115 0.0580 1833 HB1 102.3800 96.9480 115.0430 H 115 SER115 0.0577 1834 HB2 100.8090 96.1530 115.2360 H 115 SER115 0.0577 1835 HG 100.8100 98.3090 116.1510 H 115 SER115 0.2095 1836 N 99.2550 98.1950 112.6090 N.am 116 VAL116 -0.2453 1837 CA 97.8850 98.3840 112.1380 C.3 116 VAL116 0.0901 1838 CB 97.5400 99.8910 112.1900 C.3 116 VAL116 -0.0227 1839 CG1 96.2600 100.2550 111.4170 C.3 116 VAL116 -0.0608 1840 CG2 97.4200 100.3890 113.6390 C.3 116 VAL116 -0.0608 1841 C 97.7270 97.8140 110.7330 C.2 116 VAL116 0.2189 1842 O 96.7520 97.1150 110.4310 O.2 116 VAL116 -0.2778 1843 H 99.8370 99.0100 112.8040 H 116 VAL116 0.1312 1844 HA 97.2260 97.8260 112.8010 H 116 VAL116 0.0560 1845 HB 98.3640 100.4340 111.7260 H 116 VAL116 0.0315 1846 HG11 96.0300 101.3160 111.5270 H 116 VAL116 0.0233 1847 HG12 95.4040 99.6890 111.7850 H 116 VAL116 0.0233 1848 HG13 96.3610 100.0620 110.3490 H 116 VAL116 0.0233 1849 HG21 97.4680 101.4780 113.6800 H 116 VAL116 0.0233 1850 HG22 98.2080 99.9990 114.2810 H 116 VAL116 0.0233 1851 HG23 96.4720 100.0900 114.0810 H 116 VAL116 0.0233 1852 N 98.6910 98.1010 109.8540 N.am 117 ASP117 -0.2451 1853 CA 98.6200 97.6020 108.4840 C.3 117 ASP117 0.0974 1854 CB 99.2780 98.3050 107.2690 C.3 117 ASP117 0.0576 1855 CG 98.3970 98.1440 105.9550 C.2 117 ASP117 0.1780 1856 OD1 98.1400 99.1240 105.2730 O.co2 117 ASP117 -0.6478 1857 OD2 97.9200 97.0630 105.5910 O.co2 117 ASP117 -0.6478 1858 C 98.7140 96.0820 108.4380 C.2 117 ASP117 0.2192 1859 O 97.9780 95.4300 107.6880 O.2 117 ASP117 -0.2778 1860 H 99.4840 98.6740 110.1430 H 117 ASP117 0.1312 1861 HA 97.5630 97.7700 108.2680 H 117 ASP117 0.0563 1862 HB1 100.2800 97.9240 107.0790 H 117 ASP117 0.0394 1863 HB2 99.3770 99.3700 107.4770 H 117 ASP117 0.0394 1864 N 99.6200 95.5000 109.2290 N.am 118 ARG118 -0.2456 1865 CA 99.7810 94.0490 109.2250 C.3 118 ARG118 0.0879 1866 CB 100.9970 93.7180 110.1120 C.3 118 ARG118 -0.0258 1867 CG 102.3300 94.1910 109.5010 C.3 118 ARG118 -0.0154 1868 CD 103.4580 94.3240 110.5360 C.3 118 ARG118 0.1045 1869 NE 104.6430 94.8920 109.8890 N.pl3 118 ARG118 -0.4450 1870 CZ 105.7900 95.1500 110.5120 C.cat 118 ARG118 0.5062 1871 NH1 105.9380 94.9350 111.7920 N.pl3 118 ARG118 -0.4573 1872 NH2 106.7960 95.6340 109.8330 N.pl3 118 ARG118 -0.4573 1873 C 98.5310 93.3490 109.7430 C.2 118 ARG118 0.2187 1874 O 98.1000 92.3350 109.1810 O.2 118 ARG118 -0.2778 1875 H 100.2030 96.0730 109.8390 H 118 ARG118 0.1312 1876 HA 99.9490 93.7330 108.1940 H 118 ARG118 0.0557 1877 HB1 101.0540 92.6450 110.2990 H 118 ARG118 0.0286 1878 HB2 100.8530 94.1900 111.0860 H 118 ARG118 0.0286 1879 HG1 102.1960 95.1520 109.0070 H 118 ARG118 0.0299 1880 HG2 102.6280 93.5000 108.7110 H 118 ARG118 0.0299 1881 HD1 103.7190 93.3500 110.9580 H 118 ARG118 0.0711 1882 HD2 103.1610 94.9920 111.3480 H 118 ARG118 0.0711 1883 HE 104.5840 95.1040 108.9140 H 118 ARG118 0.3153 1884 HH11 106.8190 95.0790 112.2370 H 118 ARG118 0.3114 1885 HH12 105.1560 94.6300 112.3360 H 118 ARG118 0.3114 1886 HH21 107.6620 95.8300 110.2870 H 118 ARG118 0.3114 1887 HH22 106.6990 95.8130 108.8570 H 118 ARG118 0.3114 1888 N 97.9370 93.8710 110.8190 N.am 119 TYR119 -0.2453 1889 CA 96.7270 93.2630 111.3620 C.3 119 TYR119 0.0917 1890 CB 96.3980 93.9510 112.6990 C.3 119 TYR119 -0.0036 1891 CG 95.1000 93.5040 113.3300 C.ar 119 TYR119 -0.0453 1892 CD1 94.7100 92.1670 113.3310 C.ar 119 TYR119 -0.0561 1893 CD2 94.2610 94.4390 113.9270 C.ar 119 TYR119 -0.0561 1894 CE1 93.5240 91.7730 113.9340 C.ar 119 TYR119 -0.0317 1895 CE2 93.0890 94.0470 114.5570 C.ar 119 TYR119 -0.0317 1896 CZ 92.7220 92.7110 114.5670 C.ar 119 TYR119 0.0726 1897 OH 91.5650 92.3250 115.2140 O.3 119 TYR119 -0.3598 1898 C 95.5610 93.3830 110.3900 C.2 119 TYR119 0.2190 1899 O 94.7580 92.4520 110.2540 O.2 119 TYR119 -0.2778 1900 H 98.3320 94.7000 111.2640 H 119 TYR119 0.1312 1901 HA 96.9380 92.2040 111.5130 H 119 TYR119 0.0560 1902 HB1 96.3650 95.0310 112.5450 H 119 TYR119 0.0333 1903 HB2 97.2040 93.7720 113.4120 H 119 TYR119 0.0333 1904 HD1 95.3080 91.4160 112.8390 H 119 TYR119 0.0621 1905 HD2 94.5160 95.4850 113.9030 H 119 TYR119 0.0621 1906 HE1 93.2390 90.7330 113.8990 H 119 TYR119 0.0643 1907 HE2 92.4620 94.7840 115.0370 H 119 TYR119 0.0643 1908 HH 91.1340 93.1000 115.5550 H 119 TYR119 0.2173 1909 N 95.4450 94.5280 109.7120 N.am 120 ARG120 -0.2456 1910 CA 94.3230 94.7390 108.8020 C.3 120 ARG120 0.0879 1911 CB 94.5050 96.2400 108.4240 C.3 120 ARG120 -0.0258 1912 CG 93.4730 96.8960 107.4940 C.3 120 ARG120 -0.0154 1913 CD 93.2350 98.4190 107.7410 C.3 120 ARG120 0.1045 1914 NE 94.3970 99.3320 107.8010 N.pl3 120 ARG120 -0.4450 1915 CZ 95.4070 99.4340 106.9400 C.cat 120 ARG120 0.5062 1916 NH1 95.5200 98.5950 105.9610 N.pl3 120 ARG120 -0.4573 1917 NH2 96.3120 100.3720 107.0460 N.pl3 120 ARG120 -0.4573 1918 C 94.3500 93.7500 107.6440 C.2 120 ARG120 0.2187 1919 O 93.3110 93.1940 107.2700 O.2 120 ARG120 -0.2778 1920 H 96.1450 95.2600 109.8310 H 120 ARG120 0.1312 1921 HA 93.4040 94.5870 109.3710 H 120 ARG120 0.0557 1922 HB1 95.5010 96.3980 108.0080 H 120 ARG120 0.0286 1923 HB2 94.4950 96.8000 109.3600 H 120 ARG120 0.0286 1924 HG1 92.5170 96.3910 107.6360 H 120 ARG120 0.0299 1925 HG2 93.7420 96.7020 106.4560 H 120 ARG120 0.0299 1926 HD1 92.7280 98.5440 108.7010 H 120 ARG120 0.0711 1927 HD2 92.5580 98.8250 106.9860 H 120 ARG120 0.0711 1928 HE 94.5060 100.0060 108.5330 H 120 ARG120 0.3153 1929 HH11 96.3840 98.6460 105.4410 H 120 ARG120 0.3114 1930 HH12 94.8120 97.9400 105.7550 H 120 ARG120 0.3114 1931 HH21 97.1060 100.3200 106.4280 H 120 ARG120 0.3114 1932 HH22 96.2640 101.1410 107.6860 H 120 ARG120 0.3114 1933 N 95.5300 93.5160 107.0630 N.am 121 ALA121 -0.2459 1934 CA 95.6280 92.5890 105.9400 C.3 121 ALA121 0.0850 1935 CB 97.0840 92.6060 105.4480 C.3 121 ALA121 -0.0411 1936 C 95.2860 91.1660 106.3630 C.2 121 ALA121 0.2184 1937 O 94.5830 90.4480 105.6410 O.2 121 ALA121 -0.2778 1938 H 96.3670 93.9880 107.4060 H 121 ALA121 0.1312 1939 HA 94.9800 92.9050 105.1310 H 121 ALA121 0.0554 1940 HB1 97.2160 91.9610 104.5780 H 121 ALA121 0.0249 1941 HB2 97.7710 92.2680 106.2250 H 121 ALA121 0.0249 1942 HB3 97.4000 93.6080 105.1620 H 121 ALA121 0.0249 1943 N 95.7800 90.7370 107.5250 N.am 122 VAL122 -0.2454 1944 CA 95.4820 89.3930 108.0100 C.3 122 VAL122 0.0901 1945 CB 96.3410 89.1070 109.2640 C.3 122 VAL122 -0.0227 1946 CG1 95.9470 87.8050 109.9870 C.3 122 VAL122 -0.0608 1947 CG2 97.8350 89.0650 108.9060 C.3 122 VAL122 -0.0608 1948 C 93.9930 89.2510 108.3030 C.2 122 VAL122 0.2189 1949 O 93.3630 88.2530 107.9360 O.2 122 VAL122 -0.2778 1950 H 96.3720 91.3540 108.0800 H 122 VAL122 0.1312 1951 HA 95.7320 88.6910 107.2130 H 122 VAL122 0.0560 1952 HB 96.1890 89.9310 109.9640 H 122 VAL122 0.0315 1953 HG11 96.6090 87.6040 110.8300 H 122 VAL122 0.0233 1954 HG12 95.9990 86.9490 109.3140 H 122 VAL122 0.0233 1955 HG13 94.9330 87.8550 110.3860 H 122 VAL122 0.0233 1956 HG21 98.4490 88.9310 109.7970 H 122 VAL122 0.0233 1957 HG22 98.1630 89.9800 108.4170 H 122 VAL122 0.0233 1958 HG23 98.0490 88.2370 108.2290 H 122 VAL122 0.0233 1959 N 93.4090 90.2500 108.9700 N.am 123 ALA123 -0.2459 1960 CA 91.9770 90.2160 109.2460 C.3 123 ALA123 0.0850 1961 CB 91.6370 91.3900 110.1700 C.3 123 ALA123 -0.0411 1962 C 91.1620 90.2840 107.9600 C.2 123 ALA123 0.2185 1963 O 90.1770 89.5520 107.8030 O.2 123 ALA123 -0.2778 1964 H 93.9680 91.0420 109.2880 H 123 ALA123 0.1312 1965 HA 91.7600 89.2730 109.7540 H 123 ALA123 0.0554 1966 HB1 90.5850 91.3750 110.4560 H 123 ALA123 0.0249 1967 HB2 91.8530 92.3480 109.6960 H 123 ALA123 0.0249 1968 HB3 92.2250 91.3370 111.0860 H 123 ALA123 0.0249 1969 N 91.5550 91.1520 107.0280 N.am 124 SER124 -0.2436 1970 CA 90.8600 91.2830 105.7470 C.3 124 SER124 0.1109 1971 CB 90.8290 92.7280 105.2080 C.3 124 SER124 0.0681 1972 OG 92.0850 93.2800 104.8720 O.3 124 SER124 -0.3930 1973 C 91.4340 90.2710 104.7540 C.2 124 SER124 0.2209 1974 O 92.2330 90.5860 103.8690 O.2 124 SER124 -0.2777 1975 H 92.3650 91.7430 107.2130 H 124 SER124 0.1312 1976 HA 89.8200 90.9980 105.9180 H 124 SER124 0.0580 1977 HB1 90.3400 93.3820 105.9360 H 124 SER124 0.0577 1978 HB2 90.2110 92.7640 104.3080 H 124 SER124 0.0577 1979 HG 92.6960 92.9450 105.5170 H 124 SER124 0.2095 1980 N 91.0020 89.0210 104.9260 N.am 125 TRP125 -0.2453 1981 CA 91.4390 87.9360 104.0580 C.3 125 TRP125 0.0918 1982 CB 91.0040 86.5930 104.6700 C.3 125 TRP125 -0.0021 1983 CG 89.5000 86.5250 104.8710 C.ar 125 TRP125 -0.0260 1984 CD2 88.5040 86.0450 103.9410 C.ar 125 TRP125 -0.0028 1985 CD1 88.8150 86.8680 106.0400 C.ar 125 TRP125 -0.0136 1986 NE1 87.4900 86.6430 105.8670 N.ar 125 TRP125 -0.2641 1987 CE2 87.2550 86.1240 104.6000 C.ar 125 TRP125 0.0269 1988 CE3 88.5730 85.5560 102.6630 C.ar 125 TRP125 -0.0528 1989 CZ2 86.1170 85.7130 103.9620 C.ar 125 TRP125 -0.0430 1990 CZ3 87.4160 85.1260 102.0130 C.ar 125 TRP125 -0.0611 1991 CH2 86.1850 85.2070 102.6630 C.ar 125 TRP125 -0.0602 1992 C 90.9370 88.0790 102.6280 C.2 125 TRP125 0.2191 1993 O 91.4690 87.4110 101.7360 O.2 125 TRP125 -0.2778 1994 H 90.3500 88.8200 105.6840 H 125 TRP125 0.1312 1995 HA 92.5290 87.9770 104.0300 H 125 TRP125 0.0560 1996 HB1 91.4860 86.4630 105.6390 H 125 TRP125 0.0334 1997 HB2 91.3330 85.7610 104.0460 H 125 TRP125 0.0334 1998 HD1 89.2740 87.2490 106.9420 H 125 TRP125 0.0748 1999 HE1 86.8020 86.8060 106.5460 H 125 TRP125 0.1331 2000 HE3 89.5270 85.5000 102.1610 H 125 TRP125 0.0624 2001 HZ2 85.1670 85.7770 104.4710 H 125 TRP125 0.0633 2002 HZ3 87.4740 84.7420 101.0050 H 125 TRP125 0.0618 2003 HH2 85.2860 84.8810 102.1610 H 125 TRP125 0.0618 2004 N 89.9280 88.9180 102.3860 N.am 126 SER126 -0.2436 2005 CA 89.3570 89.0960 101.0550 C.3 126 SER126 0.1109 2006 CB 87.8420 89.3320 101.1920 C.3 126 SER126 0.0681 2007 OG 87.2410 88.2600 101.9020 O.3 126 SER126 -0.3930 2008 C 89.9590 90.2790 100.3090 C.2 126 SER126 0.2209 2009 O 89.3150 90.8270 99.4040 O.2 126 SER126 -0.2777 2010 H 89.5410 89.4560 103.1610 H 126 SER126 0.1312 2011 HA 89.5300 88.1890 100.4740 H 126 SER126 0.0580 2012 HB1 87.3880 89.4140 100.1980 H 126 SER126 0.0577 2013 HB2 87.6650 90.2740 101.7240 H 126 SER126 0.0577 2014 HG 86.3030 88.3900 102.0180 H 126 SER126 0.2095 2015 N 91.1760 90.6900 100.6590 N.am 127 ARG127 -0.2456 2016 CA 91.8070 91.8540 100.0440 C.3 127 ARG127 0.0879 2017 CB 92.0160 92.8880 101.2190 C.3 127 ARG127 -0.0258 2018 CG 93.0990 94.0240 101.1080 C.3 127 ARG127 -0.0154 2019 CD 93.7470 94.4240 102.4720 C.3 127 ARG127 0.1045 2020 NE 94.8050 95.4560 102.3310 N.pl3 127 ARG127 -0.4450 2021 CZ 95.6600 95.8720 103.2940 C.cat 127 ARG127 0.5062 2022 NH1 95.6390 95.4140 104.5110 N.pl3 127 ARG127 -0.4573 2023 NH2 96.5750 96.7770 103.0570 N.pl3 127 ARG127 -0.4573 2024 C 93.2100 91.4690 99.5980 C.2 127 ARG127 0.2187 2025 O 94.0940 91.2610 100.4340 O.2 127 ARG127 -0.2778 2026 H 91.6830 90.1760 101.3790 H 127 ARG127 0.1312 2027 HA 91.2240 92.2510 99.2110 H 127 ARG127 0.0557 2028 HB1 92.2850 92.3060 102.1010 H 127 ARG127 0.0286 2029 HB2 91.0540 93.3320 101.4760 H 127 ARG127 0.0286 2030 HG1 92.6500 94.8990 100.6400 H 127 ARG127 0.0299 2031 HG2 93.9150 93.7360 100.4460 H 127 ARG127 0.0299 2032 HD1 94.1990 93.5420 102.9330 H 127 ARG127 0.0711 2033 HD2 92.9900 94.8140 103.1550 H 127 ARG127 0.0711 2034 HE 94.9290 95.8840 101.4400 H 127 ARG127 0.3153 2035 HH11 96.3430 95.7620 105.1460 H 127 ARG127 0.3114 2036 HH12 94.9680 94.7370 104.7970 H 127 ARG127 0.3114 2037 HH21 97.1950 97.0440 103.8130 H 127 ARG127 0.3114 2038 HH22 96.6860 97.2070 102.1690 H 127 ARG127 0.3114 2039 N 93.4110 91.3710 98.2830 N.am 128 VAL128 -0.2454 2040 CA 94.7440 91.1340 97.7480 C.3 128 VAL128 0.0901 2041 CB 94.6380 90.2990 96.4540 C.3 128 VAL128 -0.0227 2042 CG1 96.0190 90.0190 95.8360 C.3 128 VAL128 -0.0608 2043 CG2 93.8980 88.9740 96.7010 C.3 128 VAL128 -0.0608 2044 C 95.4260 92.4700 97.4870 C.2 128 VAL128 0.2189 2045 O 94.9540 93.2850 96.6820 O.2 128 VAL128 -0.2778 2046 H 92.6210 91.4630 97.6440 H 128 VAL128 0.1312 2047 HA 95.3240 90.5710 98.4830 H 128 VAL128 0.0560 2048 HB 94.0560 90.8660 95.7240 H 128 VAL128 0.0315 2049 HG11 95.9260 89.4150 94.9330 H 128 VAL128 0.0233 2050 HG12 96.6590 89.4780 96.5330 H 128 VAL128 0.0233 2051 HG13 96.5320 90.9390 95.5570 H 128 VAL128 0.0233 2052 HG21 93.8440 88.3820 95.7870 H 128 VAL128 0.0233 2053 HG22 92.8750 89.1360 97.0410 H 128 VAL128 0.0233 2054 HG23 94.4090 88.3740 97.4550 H 128 VAL128 0.0233 2055 N 96.5400 92.7010 98.1690 N.am 129 GLN129 -0.2456 2056 CA 97.2850 93.9440 98.0520 C.3 129 GLN129 0.0882 2057 CB 97.8870 94.3650 99.4100 C.3 129 GLN129 -0.0210 2058 CG 98.4540 93.2150 100.2700 C.3 129 GLN129 0.0225 2059 CD 97.3730 92.6090 101.1840 C.2 129 GLN129 0.1981 2060 OE1 96.7210 93.3090 101.9480 O.2 129 GLN129 -0.2798 2061 NE2 97.2180 91.2840 101.0610 N.am 129 GLN129 -0.2724 2062 C 98.3630 93.8120 96.9820 C.2 129 GLN129 0.2185 2063 O 99.0310 92.7820 96.8620 O.2 129 GLN129 -0.2778 2064 H 96.8870 91.9790 98.8000 H 129 GLN129 0.1312 2065 HA 96.5950 94.7250 97.7260 H 129 GLN129 0.0557 2066 HB1 97.1320 94.9100 99.9780 H 129 GLN129 0.0289 2067 HB2 98.6770 95.0970 99.2370 H 129 GLN129 0.0289 2068 HG1 99.2370 93.5990 100.9230 H 129 GLN129 0.0356 2069 HG2 98.9110 92.4420 99.6510 H 129 GLN129 0.0356 2070 HE21 96.5080 90.8270 101.5980 H 129 GLN129 0.1266 2071 HE22 97.7860 90.7350 100.4490 H 129 GLN129 0.1266 2072 N 98.5290 94.8770 96.2010 N.am 130 GLY130 -0.2485 2073 CA 99.4270 94.8210 95.0640 C.3 130 GLY130 0.0765 2074 C 100.3690 95.9980 94.9110 C.2 130 GLY130 0.2155 2075 O 100.9800 96.4530 95.8820 O.2 130 GLY130 -0.2781 2076 H 98.0210 95.7380 96.4040 H 130 GLY130 0.1309 2077 HA1 98.7900 94.7510 94.1810 H 130 GLY130 0.0521 2078 HA2 100.0380 93.9180 95.0960 H 130 GLY130 0.0521 2079 N 100.4880 96.4970 93.6830 N.am 131 ILE131 -0.2456 2080 CA 101.4620 97.5190 93.3220 C.3 131 ILE131 0.0903 2081 CB 102.0030 97.2630 91.8970 C.3 131 ILE131 -0.0201 2082 CG1 103.1540 98.2130 91.5000 C.3 131 ILE131 -0.0514 2083 CG2 100.8940 97.2950 90.8310 C.3 131 ILE131 -0.0605 2084 CD1 104.3710 98.1510 92.4330 C.3 131 ILE131 -0.0650 2085 C 100.8060 98.8860 93.4750 C.2 131 ILE131 0.2187 2086 O 99.5950 99.0440 93.2830 O.2 131 ILE131 -0.2778 2087 H 99.8650 96.1460 92.9560 H 131 ILE131 0.1312 2088 HA 102.2800 97.4510 94.0370 H 131 ILE131 0.0560 2089 HB 102.4140 96.2520 91.8950 H 131 ILE131 0.0318 2090 HG11 102.7910 99.2390 91.4380 H 131 ILE131 0.0266 2091 HG12 103.4840 97.9550 90.4930 H 131 ILE131 0.0266 2092 HG21 101.2940 97.0500 89.8470 H 131 ILE131 0.0233 2093 HG22 100.4360 98.2820 90.7610 H 131 ILE131 0.0233 2094 HG23 100.1040 96.5750 91.0450 H 131 ILE131 0.0233 2095 HD11 105.1970 98.7390 92.0330 H 131 ILE131 0.0230 2096 HD12 104.7240 97.1270 92.5570 H 131 ILE131 0.0230 2097 HD13 104.1420 98.5510 93.4200 H 131 ILE131 0.0230 2098 N 101.6100 99.8840 93.8340 N.am 132 GLY132 -0.2485 2099 CA 101.1160 101.2360 94.0090 C.3 132 GLY132 0.0765 2100 C 100.8660 101.5890 95.4590 C.2 132 GLY132 0.2155 2101 O 100.5460 100.7150 96.2700 O.2 132 GLY132 -0.2781 2102 H 102.6000 99.6930 93.9900 H 132 GLY132 0.1309 2103 HA1 100.2010 101.3800 93.4320 H 132 GLY132 0.0521 2104 HA2 101.8820 101.8940 93.6010 H 132 GLY132 0.0521 2105 N 101.0240 102.8650 95.8000 N.am 133 ILE133 -0.2456 2106 CA 100.8050 103.3450 97.1620 C.3 133 ILE133 0.0906 2107 CB 101.7970 104.4780 97.5100 C.3 133 ILE133 -0.0201 2108 CG1 103.2490 103.9590 97.4410 C.3 133 ILE133 -0.0514 2109 CG2 101.5120 105.0710 98.9060 C.3 133 ILE133 -0.0605 2110 CD1 104.3110 105.0620 97.5270 C.3 133 ILE133 -0.0650 2111 C 99.3490 103.7710 97.3150 C.2 133 ILE133 0.2216 2112 O 98.8860 104.6590 96.5850 O.2 133 ILE133 -0.2776 2113 H 101.3090 103.5330 95.0840 H 133 ILE133 0.1312 2114 HA 101.0370 102.5170 97.8260 H 133 ILE133 0.0560 2115 HB 101.6740 105.2720 96.7720 H 133 ILE133 0.0318 2116 HG11 103.4050 103.4090 96.5150 H 133 ILE133 0.0266 2117 HG12 103.4150 103.2390 98.2430 H 133 ILE133 0.0266 2118 HG21 102.1990 105.8790 99.1520 H 133 ILE133 0.0233 2119 HG22 101.6000 104.3110 99.6830 H 133 ILE133 0.0233 2120 HG23 100.5090 105.4900 98.9710 H 133 ILE133 0.0233 2121 HD11 105.3100 104.6420 97.4120 H 133 ILE133 0.0230 2122 HD12 104.2850 105.5680 98.4920 H 133 ILE133 0.0230 2123 HD13 104.1670 105.8100 96.7480 H 133 ILE133 0.0230 2124 N 98.5940 103.1600 98.2240 N.am 134 PRO134 -0.2316 2125 CA 97.2120 103.5890 98.4480 C.3 134 PRO134 0.0907 2126 HA 96.6610 103.4141 97.5227 H 134 PRO134 0.0559 2127 CD 99.0024 102.0310 99.0579 C.3 134 PRO134 0.0071 2128 HD1 99.6449 102.4211 99.8478 H 134 PRO134 0.0431 2129 HD2 99.5181 101.2749 98.4669 H 134 PRO134 0.0431 2130 CB 96.7311 102.6813 99.5928 C.3 134 PRO134 -0.0276 2131 HB1 95.6882 102.3863 99.4785 H 134 PRO134 0.0285 2132 HB2 96.8199 103.1793 100.5596 H 134 PRO134 0.0285 2133 CG 97.6793 101.4873 99.5910 C.3 134 PRO134 -0.0379 2134 HG1 97.7823 101.0287 100.5749 H 134 PRO134 0.0278 2135 HG2 97.3002 100.7278 98.9065 H 134 PRO134 0.0278 2136 C 97.1360 105.0490 98.8700 C.2 134 PRO134 0.2189 2137 O 98.0500 105.6000 99.4880 O.2 134 PRO134 -0.2778 2138 N 96.0130 105.6780 98.5120 N.am 135 LEU135 -0.2456 2139 CA 95.7650 107.0480 98.9510 C.3 135 LEU135 0.0880 2140 CB 94.4820 107.5680 98.2800 C.3 135 LEU135 -0.0266 2141 CG 94.1030 109.0160 98.6490 C.3 135 LEU135 -0.0449 2142 CD1 95.2190 110.0130 98.3080 C.3 135 LEU135 -0.0626 2143 CD2 92.7920 109.4200 97.9620 C.3 135 LEU135 -0.0626 2144 C 95.6680 107.1280 100.4690 C.2 135 LEU135 0.2187 2145 O 96.1060 108.1120 101.0770 O.2 135 LEU135 -0.2778 2146 H 95.3260 105.1990 97.9300 H 135 LEU135 0.1312 2147 HA 96.6250 107.6380 98.6320 H 135 LEU135 0.0557 2148 HB1 93.6530 106.9070 98.5360 H 135 LEU135 0.0287 2149 HB2 94.5990 107.4960 97.1990 H 135 LEU135 0.0287 2150 HG 93.9280 109.0680 99.7250 H 135 LEU135 0.0296 2151 HD11 94.9100 111.0350 98.5330 H 135 LEU135 0.0232 2152 HD12 95.4780 109.9700 97.2500 H 135 LEU135 0.0232 2153 HD13 96.1220 109.8180 98.8860 H 135 LEU135 0.0232 2154 HD21 92.4920 110.4270 98.2500 H 135 LEU135 0.0232 2155 HD22 91.9810 108.7440 98.2340 H 135 LEU135 0.0232 2156 HD23 92.8940 109.3990 96.8760 H 135 LEU135 0.0232 2157 N 95.0880 106.1030 101.0980 N.am 136 VAL136 -0.2454 2158 CA 95.0040 106.0700 102.5560 C.3 136 VAL136 0.0901 2159 CB 94.1730 104.8440 102.9930 C.3 136 VAL136 -0.0227 2160 CG1 94.0780 104.7240 104.5250 C.3 136 VAL136 -0.0608 2161 CG2 92.7620 104.8770 102.3840 C.3 136 VAL136 -0.0608 2162 C 96.3990 106.0200 103.1660 C.2 136 VAL136 0.2190 2163 O 96.7050 106.7400 104.1240 O.2 136 VAL136 -0.2778 2164 H 94.6990 105.3330 100.5540 H 136 VAL136 0.1312 2165 HA 94.5000 106.9800 102.8780 H 136 VAL136 0.0560 2166 HB 94.6680 103.9440 102.6250 H 136 VAL136 0.0315 2167 HG11 93.4570 103.8780 104.8180 H 136 VAL136 0.0233 2168 HG12 93.6480 105.6230 104.9660 H 136 VAL136 0.0233 2169 HG13 95.0580 104.5710 104.9790 H 136 VAL136 0.0233 2170 HG21 92.1780 104.0160 102.7090 H 136 VAL136 0.0233 2171 HG22 92.7890 104.8580 101.2950 H 136 VAL136 0.0233 2172 HG23 92.2260 105.7760 102.6900 H 136 VAL136 0.0233 2173 N 97.2660 105.1630 102.6210 N.am 137 THR137 -0.2434 2174 CA 98.6410 105.0930 103.1060 C.3 137 THR137 0.1135 2175 CB 99.3730 103.8920 102.4730 C.3 137 THR137 0.0763 2176 OG1 98.5810 102.7190 102.5010 O.3 137 THR137 -0.3900 2177 CG2 100.7280 103.6170 103.1470 C.3 137 THR137 -0.0370 2178 C 99.3850 106.3960 102.8350 C.2 137 THR137 0.2212 2179 O 100.1310 106.8850 103.6930 O.2 137 THR137 -0.2777 2180 H 96.9650 104.5530 101.8610 H 137 THR137 0.1313 2181 HA 98.5850 104.9640 104.1870 H 137 THR137 0.0583 2182 HB 99.5450 104.1050 101.4160 H 137 THR137 0.0611 2183 HG1 98.3500 102.5320 103.4090 H 137 THR137 0.2098 2184 HG21 101.1850 102.7140 102.7490 H 137 THR137 0.0255 2185 HG22 100.6190 103.4830 104.2240 H 137 THR137 0.0255 2186 HG23 101.4240 104.4400 102.9890 H 137 THR137 0.0255 2187 N 99.1800 106.9810 101.6520 N.am 138 ALA138 -0.2458 2188 CA 99.8600 108.2260 101.3070 C.3 138 ALA138 0.0850 2189 CB 99.5250 108.5740 99.8530 C.3 138 ALA138 -0.0411 2190 C 99.4420 109.3620 102.2320 C.2 138 ALA138 0.2184 2191 O 100.2680 110.2050 102.6040 O.2 138 ALA138 -0.2778 2192 H 98.5410 106.5530 100.9820 H 138 ALA138 0.1312 2193 HA 100.9310 108.0550 101.4240 H 138 ALA138 0.0554 2194 HB1 100.0390 109.4810 99.5330 H 138 ALA138 0.0249 2195 HB2 98.4530 108.7290 99.7210 H 138 ALA138 0.0249 2196 HB3 99.8240 107.7680 99.1830 H 138 ALA138 0.0249 2197 N 98.1620 109.4140 102.6040 N.am 139 ILE139 -0.2454 2198 CA 97.7050 110.4670 103.5050 C.3 139 ILE139 0.0903 2199 CB 96.1940 110.7530 103.3430 C.3 139 ILE139 -0.0201 2200 CG1 95.7510 112.0790 103.9950 C.3 139 ILE139 -0.0514 2201 CG2 95.3200 109.6100 103.8670 C.3 139 ILE139 -0.0605 2202 CD1 96.4090 113.3250 103.3900 C.3 139 ILE139 -0.0650 2203 C 98.1040 110.1540 104.9430 C.2 139 ILE139 0.2189 2204 O 98.1600 111.0500 105.7930 O.2 139 ILE139 -0.2778 2205 H 97.5020 108.7170 102.2580 H 139 ILE139 0.1312 2206 HA 98.2380 111.3680 103.2090 H 139 ILE139 0.0560 2207 HB 95.9990 110.8390 102.2730 H 139 ILE139 0.0318 2208 HG11 95.9330 112.0520 105.0690 H 139 ILE139 0.0266 2209 HG12 94.6710 112.1790 103.8810 H 139 ILE139 0.0266 2210 HG21 94.2650 109.7850 103.6540 H 139 ILE139 0.0233 2211 HG22 95.4270 109.4730 104.9430 H 139 ILE139 0.0233 2212 HG23 95.6020 108.6850 103.3850 H 139 ILE139 0.0233 2213 HD11 95.9630 114.2310 103.7990 H 139 ILE139 0.0230 2214 HD12 96.2840 113.3510 102.3070 H 139 ILE139 0.0230 2215 HD13 97.4740 113.3630 103.6100 H 139 ILE139 0.0230 2216 N 98.3840 108.8830 105.2400 N.am 140 GLU140 -0.2456 2217 CA 98.7640 108.5140 106.6010 C.3 140 GLU140 0.0883 2218 CB 98.6350 106.9680 106.7750 C.3 140 GLU140 -0.0193 2219 CG 97.2130 106.4390 107.1000 C.3 140 GLU140 0.0356 2220 CD 97.0600 104.8880 107.0430 C.2 140 GLU140 0.1760 2221 OE1 97.8570 104.2140 106.3940 O.co2 140 GLU140 -0.6478 2222 OE2 96.1310 104.3520 107.6520 O.co2 140 GLU140 -0.6478 2223 C 100.1910 108.9430 106.9180 C.2 140 GLU140 0.2187 2224 O 100.4610 109.4630 108.0070 O.2 140 GLU140 -0.2778 2225 H 98.3320 108.1680 104.5150 H 140 GLU140 0.1312 2226 HA 98.0930 109.0200 107.2970 H 140 GLU140 0.0557 2227 HB1 99.2870 106.6220 107.5780 H 140 GLU140 0.0290 2228 HB2 99.0080 106.4830 105.8750 H 140 GLU140 0.0290 2229 HG1 96.4710 106.8690 106.4330 H 140 GLU140 0.0374 2230 HG2 96.9320 106.7600 108.1020 H 140 GLU140 0.0374 2231 N 101.1200 108.7340 105.9810 N.am 141 ILE141 -0.2454 2232 CA 102.5270 109.0310 106.2460 C.3 141 ILE141 0.0903 2233 CB 103.4250 108.4460 105.1290 C.3 141 ILE141 -0.0201 2234 CG1 104.9140 108.7630 105.3790 C.3 141 ILE141 -0.0514 2235 CG2 102.9900 108.8800 103.7170 C.3 141 ILE141 -0.0605 2236 CD1 105.8670 108.0820 104.3920 C.3 141 ILE141 -0.0650 2237 C 102.7330 110.5300 106.4340 C.2 141 ILE141 0.2189 2238 O 103.4500 110.9660 107.3420 O.2 141 ILE141 -0.2778 2239 H 100.8450 108.3630 105.0710 H 141 ILE141 0.1312 2240 HA 102.7760 108.5410 107.1890 H 141 ILE141 0.0560 2241 HB 103.3070 107.3630 105.1740 H 141 ILE141 0.0318 2242 HG11 105.1820 108.4610 106.3930 H 141 ILE141 0.0266 2243 HG12 105.0800 109.8400 105.3310 H 141 ILE141 0.0266 2244 HG21 103.5350 108.3370 102.9470 H 141 ILE141 0.0233 2245 HG22 103.1570 109.9430 103.5520 H 141 ILE141 0.0233 2246 HG23 101.9380 108.6720 103.5430 H 141 ILE141 0.0233 2247 HD11 106.8970 108.3600 104.6110 H 141 ILE141 0.0230 2248 HD12 105.6750 108.3880 103.3640 H 141 ILE141 0.0230 2249 HD13 105.7820 106.9960 104.4440 H 141 ILE141 0.0230 2250 N 102.1040 111.3430 105.5810 N.am 142 VAL142 -0.2454 2251 CA 102.2540 112.7900 105.7000 C.3 142 VAL142 0.0901 2252 CB 101.7050 113.5010 104.4450 C.3 142 VAL142 -0.0227 2253 CG1 102.4780 113.0740 103.1890 C.3 142 VAL142 -0.0608 2254 CG2 100.2000 113.2830 104.2410 C.3 142 VAL142 -0.0608 2255 C 101.6030 113.2930 106.9820 C.2 142 VAL142 0.2190 2256 O 102.1170 114.2080 107.6370 O.2 142 VAL142 -0.2778 2257 H 101.5170 110.9510 104.8440 H 142 VAL142 0.1312 2258 HA 103.3240 112.9920 105.7810 H 142 VAL142 0.0560 2259 HB 101.8680 114.5720 104.5720 H 142 VAL142 0.0315 2260 HG11 102.1660 113.6580 102.3230 H 142 VAL142 0.0233 2261 HG12 102.3060 112.0240 102.9530 H 142 VAL142 0.0233 2262 HG13 103.5510 113.2180 103.3170 H 142 VAL142 0.0233 2263 HG21 99.8610 113.7320 103.3070 H 142 VAL142 0.0233 2264 HG22 99.6100 113.7250 105.0440 H 142 VAL142 0.0233 2265 HG23 99.9680 112.2210 104.2020 H 142 VAL142 0.0233 2266 N 100.4630 112.7110 107.3620 N.am 143 SER143 -0.2436 2267 CA 99.8490 113.0590 108.6390 C.3 143 SER143 0.1109 2268 CB 98.4550 112.4180 108.6930 C.3 143 SER143 0.0681 2269 OG 97.7560 112.8470 109.8550 O.3 143 SER143 -0.3930 2270 C 100.6980 112.5690 109.8030 C.2 143 SER143 0.2209 2271 O 100.7380 113.2030 110.8640 O.2 143 SER143 -0.2777 2272 H 100.0200 112.0200 106.7570 H 143 SER143 0.1312 2273 HA 99.7670 114.1450 108.6910 H 143 SER143 0.0580 2274 HB1 98.5500 111.3250 108.6720 H 143 SER143 0.0577 2275 HB2 97.8960 112.7140 107.7990 H 143 SER143 0.0577 2276 HG 96.9120 112.4070 109.9300 H 143 SER143 0.2095 2277 N 101.3780 111.4350 109.6240 N.am 144 ILE144 -0.2453 2278 CA 102.2410 110.9030 110.6750 C.3 144 ILE144 0.0903 2279 CB 102.7070 109.4660 110.3280 C.3 144 ILE144 -0.0201 2280 CG1 101.5840 108.4340 110.5670 C.3 144 ILE144 -0.0514 2281 CG2 104.0110 109.0300 111.0320 C.3 144 ILE144 -0.0605 2282 CD1 101.4720 107.9460 112.0170 C.3 144 ILE144 -0.0650 2283 C 103.4080 111.8520 110.9260 C.2 144 ILE144 0.2189 2284 O 103.7550 112.1530 112.0740 O.2 144 ILE144 -0.2778 2285 H 101.2940 110.9330 108.7400 H 144 ILE144 0.1312 2286 HA 101.6510 110.8800 111.5930 H 144 ILE144 0.0560 2287 HB 102.9230 109.4570 109.2610 H 144 ILE144 0.0318 2288 HG11 101.7460 107.5690 109.9230 H 144 ILE144 0.0266 2289 HG12 100.6210 108.8500 110.2740 H 144 ILE144 0.0266 2290 HG21 104.2390 107.9870 110.8150 H 144 ILE144 0.0233 2291 HG22 103.9360 109.1360 112.1150 H 144 ILE144 0.0233 2292 HG23 104.8680 109.6170 110.7020 H 144 ILE144 0.0233 2293 HD11 100.5950 107.3110 112.1430 H 144 ILE144 0.0230 2294 HD12 101.3850 108.7790 112.7150 H 144 ILE144 0.0230 2295 HD13 102.3410 107.3520 112.2960 H 144 ILE144 0.0230 2296 N 104.0270 112.3390 109.8480 N.am 145 TRP145 -0.2453 2297 CA 105.1420 113.2730 109.9790 C.3 145 TRP145 0.0918 2298 CB 105.8350 113.4450 108.6160 C.3 145 TRP145 -0.0021 2299 CG 106.7770 112.2780 108.3490 C.ar 145 TRP145 -0.0260 2300 CD2 108.2060 112.3390 108.1430 C.ar 145 TRP145 -0.0028 2301 CD1 106.4430 110.9180 108.3160 C.ar 145 TRP145 -0.0136 2302 NE1 107.5540 110.1800 108.0780 N.ar 145 TRP145 -0.2641 2303 CE2 108.6600 111.0090 107.9690 C.ar 145 TRP145 0.0269 2304 CE3 109.1020 113.3730 108.1130 C.ar 145 TRP145 -0.0528 2305 CZ2 109.9900 110.7590 107.7640 C.ar 145 TRP145 -0.0430 2306 CZ3 110.4610 113.1210 107.9280 C.ar 145 TRP145 -0.0611 2307 CH2 110.9070 111.8110 107.7570 C.ar 145 TRP145 -0.0602 2308 C 104.6870 114.5910 110.5950 C.2 145 TRP145 0.2190 2309 O 105.3740 115.1600 111.4510 O.2 145 TRP145 -0.2778 2310 H 103.7160 112.0540 108.9190 H 145 TRP145 0.1312 2311 HA 105.8450 112.8370 110.6880 H 145 TRP145 0.0560 2312 HB1 106.4080 114.3720 108.5960 H 145 TRP145 0.0334 2313 HB2 105.0980 113.5140 107.8150 H 145 TRP145 0.0334 2314 HD1 105.4620 110.4990 108.4780 H 145 TRP145 0.0748 2315 HE1 107.5780 109.2020 108.0200 H 145 TRP145 0.1331 2316 HE3 108.7590 114.3860 108.2520 H 145 TRP145 0.0624 2317 HZ2 110.3340 109.7410 107.6500 H 145 TRP145 0.0633 2318 HZ3 111.1680 113.9380 107.9250 H 145 TRP145 0.0618 2319 HH2 111.9610 111.6120 107.6370 H 145 TRP145 0.0618 2320 N 103.5290 115.0950 110.1620 N.am 146 ILE146 -0.2454 2321 CA 103.0600 116.3980 110.6260 C.3 146 ILE146 0.0903 2322 CB 101.8510 116.8390 109.7670 C.3 146 ILE146 -0.0201 2323 CG1 102.2990 117.1560 108.3250 C.3 146 ILE146 -0.0514 2324 CG2 101.1060 118.0500 110.3610 C.3 146 ILE146 -0.0605 2325 CD1 101.1380 117.1980 107.3230 C.3 146 ILE146 -0.0650 2326 C 102.7370 116.3580 112.1160 C.2 146 ILE146 0.2189 2327 O 103.0820 117.2820 112.8630 O.2 146 ILE146 -0.2778 2328 H 102.9650 114.5640 109.4990 H 146 ILE146 0.1312 2329 HA 103.8760 117.1080 110.4920 H 146 ILE146 0.0560 2330 HB 101.1520 116.0010 109.7340 H 146 ILE146 0.0318 2331 HG11 103.0190 116.4150 107.9790 H 146 ILE146 0.0266 2332 HG12 102.8330 118.1060 108.3070 H 146 ILE146 0.0266 2333 HG21 100.2600 118.3410 109.7400 H 146 ILE146 0.0233 2334 HG22 101.7670 118.9130 110.4460 H 146 ILE146 0.0233 2335 HG23 100.7040 117.8370 111.3520 H 146 ILE146 0.0233 2336 HD11 101.5100 117.3430 106.3080 H 146 ILE146 0.0230 2337 HD12 100.4490 118.0130 107.5390 H 146 ILE146 0.0230 2338 HD13 100.5710 116.2670 107.3360 H 146 ILE146 0.0230 2339 N 102.0790 115.2890 112.5740 N.am 147 LEU147 -0.2456 2340 CA 101.7030 115.1980 113.9820 C.3 147 LEU147 0.0880 2341 CB 100.8140 113.9460 114.1200 C.3 147 LEU147 -0.0266 2342 CG 100.2610 113.6280 115.5260 C.3 147 LEU147 -0.0449 2343 CD1 101.2520 112.8320 116.3870 C.3 147 LEU147 -0.0626 2344 CD2 99.7260 114.8670 116.2580 C.3 147 LEU147 -0.0626 2345 C 102.9370 115.1460 114.8760 C.2 147 LEU147 0.2187 2346 O 102.9700 115.7800 115.9370 O.2 147 LEU147 -0.2778 2347 H 101.8380 114.5310 111.9350 H 147 LEU147 0.1312 2348 HA 101.1370 116.0990 114.2240 H 147 LEU147 0.0557 2349 HB1 101.3440 113.0740 113.7330 H 147 LEU147 0.0287 2350 HB2 99.9640 114.0810 113.4500 H 147 LEU147 0.0287 2351 HG 99.4090 112.9640 115.3710 H 147 LEU147 0.0296 2352 HD11 100.7810 112.4950 117.3100 H 147 LEU147 0.0232 2353 HD12 102.1230 113.4210 116.6600 H 147 LEU147 0.0232 2354 HD13 101.6030 111.9480 115.8560 H 147 LEU147 0.0232 2355 HD21 99.2420 114.5860 117.1940 H 147 LEU147 0.0232 2356 HD22 98.9910 115.3940 115.6500 H 147 LEU147 0.0232 2357 HD23 100.5210 115.5690 116.5030 H 147 LEU147 0.0232 2358 N 103.9590 114.3910 114.4660 N.am 148 SER148 -0.2436 2359 CA 105.1930 114.3340 115.2430 C.3 148 SER148 0.1109 2360 CB 106.1440 113.3070 114.6100 C.3 148 SER148 0.0681 2361 OG 107.3420 113.2350 115.3740 O.3 148 SER148 -0.3930 2362 C 105.8780 115.6940 115.2910 C.2 148 SER148 0.2209 2363 O 106.3940 116.1010 116.3390 O.2 148 SER148 -0.2777 2364 H 103.8770 113.8510 113.6050 H 148 SER148 0.1312 2365 HA 104.9350 114.0350 116.2600 H 148 SER148 0.0580 2366 HB1 106.3580 113.5950 113.5740 H 148 SER148 0.0577 2367 HB2 105.6590 112.3260 114.5880 H 148 SER148 0.0577 2368 HG 107.9940 112.6760 114.9580 H 148 SER148 0.2095 2369 N 105.8990 116.4090 114.1630 N.am 149 PHE149 -0.2453 2370 CA 106.4940 117.7410 114.1420 C.3 149 PHE149 0.0917 2371 CB 106.4830 118.3340 112.7170 C.3 149 PHE149 -0.0036 2372 CG 107.5050 117.7490 111.7730 C.ar 149 PHE149 -0.0454 2373 CD1 108.8590 117.7340 112.0980 C.ar 149 PHE149 -0.0585 2374 CD2 107.1200 117.3380 110.5000 C.ar 149 PHE149 -0.0585 2375 CE1 109.8010 117.2910 111.1770 C.ar 149 PHE149 -0.0615 2376 CE2 108.0560 116.8770 109.5860 C.ar 149 PHE149 -0.0615 2377 CZ 109.3990 116.8500 109.9250 C.ar 149 PHE149 -0.0617 2378 C 105.7290 118.7020 115.0450 C.2 149 PHE149 0.2190 2379 O 106.3350 119.5290 115.7360 O.2 149 PHE149 -0.2778 2380 H 105.4960 116.0210 113.3100 H 149 PHE149 0.1312 2381 HA 107.5080 117.6560 114.5340 H 149 PHE149 0.0560 2382 HB1 106.6860 119.4060 112.7540 H 149 PHE149 0.0333 2383 HB2 105.4860 118.2320 112.2870 H 149 PHE149 0.0333 2384 HD1 109.1930 118.0940 113.0600 H 149 PHE149 0.0620 2385 HD2 106.0820 117.3780 110.2090 H 149 PHE149 0.0620 2386 HE1 110.8520 117.3080 111.4180 H 149 PHE149 0.0618 2387 HE2 107.7370 116.5550 108.6060 H 149 PHE149 0.0618 2388 HZ 110.1330 116.5050 109.2110 H 149 PHE149 0.0618 2389 N 104.3970 118.6110 115.0470 N.am 150 ILE150 -0.2454 2390 CA 103.5890 119.4880 115.8920 C.3 150 ILE150 0.0903 2391 CB 102.0980 119.3620 115.4740 C.3 150 ILE150 -0.0201 2392 CG1 101.7020 120.4770 114.4860 C.3 150 ILE150 -0.0514 2393 CG2 101.1040 119.3530 116.6520 C.3 150 ILE150 -0.0605 2394 CD1 102.5150 120.4940 113.1860 C.3 150 ILE150 -0.0650 2395 C 103.8620 119.2100 117.3650 C.2 150 ILE150 0.2189 2396 O 104.0160 120.1390 118.1690 O.2 150 ILE150 -0.2778 2397 H 103.9380 117.9210 114.4520 H 150 ILE150 0.1312 2398 HA 103.9360 120.5050 115.7120 H 150 ILE150 0.0560 2399 HB 101.9690 118.4040 114.9670 H 150 ILE150 0.0318 2400 HG11 101.8000 121.4460 114.9790 H 150 ILE150 0.0266 2401 HG12 100.6470 120.3750 114.2300 H 150 ILE150 0.0266 2402 HG21 100.0760 119.2980 116.2950 H 150 ILE150 0.0233 2403 HG22 101.1970 120.2570 117.2560 H 150 ILE150 0.0233 2404 HG23 101.2580 118.4920 117.3030 H 150 ILE150 0.0233 2405 HD11 102.1890 121.3090 112.5400 H 150 ILE150 0.0230 2406 HD12 102.3840 119.5680 112.6300 H 150 ILE150 0.0230 2407 HD13 103.5800 120.6310 113.3720 H 150 ILE150 0.0230 2408 N 103.9350 117.9320 117.7440 N.am 151 LEU151 -0.2456 2409 CA 104.2230 117.5900 119.1320 C.3 151 LEU151 0.0880 2410 CB 103.9430 116.0960 119.3750 C.3 151 LEU151 -0.0266 2411 CG 102.4700 115.6810 119.2180 C.3 151 LEU151 -0.0449 2412 CD1 102.3320 114.1630 119.3900 C.3 151 LEU151 -0.0626 2413 CD2 101.5480 116.4100 120.2040 C.3 151 LEU151 -0.0626 2414 C 105.6630 117.8970 119.5180 C.2 151 LEU151 0.2187 2415 O 105.9370 118.1340 120.6990 O.2 151 LEU151 -0.2778 2416 H 103.7880 117.1910 117.0590 H 151 LEU151 0.1312 2417 HA 103.5840 118.2050 119.7660 H 151 LEU151 0.0557 2418 HB1 104.2690 115.8220 120.3790 H 151 LEU151 0.0287 2419 HB2 104.5540 115.5080 118.6880 H 151 LEU151 0.0287 2420 HG 102.1400 115.9310 118.2110 H 151 LEU151 0.0296 2421 HD11 101.3090 113.8370 119.2040 H 151 LEU151 0.0232 2422 HD12 102.6010 113.8550 120.3990 H 151 LEU151 0.0232 2423 HD13 102.9870 113.6280 118.7020 H 151 LEU151 0.0232 2424 HD21 100.5230 116.0480 120.1180 H 151 LEU151 0.0232 2425 HD22 101.5250 117.4830 120.0150 H 151 LEU151 0.0232 2426 HD23 101.8700 116.2540 121.2340 H 151 LEU151 0.0232 2427 N 106.5860 117.8940 118.5550 N.am 152 ALA152 -0.2459 2428 CA 107.9640 118.2720 118.8370 C.3 152 ALA152 0.0850 2429 CB 108.8600 117.6470 117.7580 C.3 152 ALA152 -0.0411 2430 C 108.1610 119.7810 118.8590 C.2 152 ALA152 0.2184 2431 O 109.2450 120.2440 119.2320 O.2 152 ALA152 -0.2778 2432 H 106.3230 117.6230 117.6070 H 152 ALA152 0.1312 2433 HA 108.2380 117.8740 119.8150 H 152 ALA152 0.0554 2434 HB1 109.9140 117.8740 117.9270 H 152 ALA152 0.0249 2435 HB2 108.5940 118.0100 116.7640 H 152 ALA152 0.0249 2436 HB3 108.7560 116.5620 117.7490 H 152 ALA152 0.0249 2437 N 107.1470 120.5520 118.4590 N.am 153 ILE153 -0.2454 2438 CA 107.2680 122.0110 118.4740 C.3 153 ILE153 0.0906 2439 CB 106.1170 122.7180 117.7040 C.3 153 ILE153 -0.0201 2440 CG1 106.4400 122.7760 116.1980 C.3 153 ILE153 -0.0514 2441 CG2 105.7980 124.1340 118.2290 C.3 153 ILE153 -0.0605 2442 CD1 105.2610 123.2160 115.3210 C.3 153 ILE153 -0.0650 2443 C 107.5070 122.5570 119.8810 C.2 153 ILE153 0.2216 2444 O 108.4070 123.3900 120.0480 O.2 153 ILE153 -0.2776 2445 H 106.2800 120.1200 118.1400 H 153 ILE153 0.1312 2446 HA 108.1950 122.2270 117.9390 H 153 ILE153 0.0560 2447 HB 105.2130 122.1290 117.8300 H 153 ILE153 0.0318 2448 HG11 106.7770 121.8000 115.8610 H 153 ILE153 0.0266 2449 HG12 107.2850 123.4460 116.0290 H 153 ILE153 0.0266 2450 HG21 104.9910 124.5990 117.6650 H 153 ILE153 0.0233 2451 HG22 106.6700 124.7850 118.1620 H 153 ILE153 0.0233 2452 HG23 105.4710 124.1130 119.2690 H 153 ILE153 0.0233 2453 HD11 105.4980 123.0860 114.2650 H 153 ILE153 0.0230 2454 HD12 105.0200 124.2680 115.4720 H 153 ILE153 0.0230 2455 HD13 104.3650 122.6360 115.5350 H 153 ILE153 0.0230 2456 N 106.7630 122.1360 120.9290 N.am 154 PRO154 -0.2316 2457 CA 107.0440 122.6860 122.2630 C.3 154 PRO154 0.0907 2458 CD 105.6050 121.2730 120.8870 C.3 154 PRO154 0.0071 2459 CB 105.7520 122.3520 123.0440 C.3 154 PRO154 -0.0276 2460 CG 104.7460 121.8590 122.0010 C.3 154 PRO154 -0.0379 2461 C 108.2680 122.0570 122.9100 C.2 154 PRO154 0.2189 2462 O 108.2510 121.7230 124.0990 O.2 154 PRO154 -0.2778 2463 HA 107.1770 123.7640 122.1740 H 154 PRO154 0.0559 2464 HD1 105.9680 120.2880 121.1400 H 154 PRO154 0.0431 2465 HD2 105.1170 121.3000 119.9170 H 154 PRO154 0.0431 2466 HB1 105.3760 123.2110 123.5980 H 154 PRO154 0.0285 2467 HB2 105.8990 121.5480 123.7670 H 154 PRO154 0.0285 2468 HG1 104.0350 121.1390 122.4050 H 154 PRO154 0.0278 2469 HG2 104.1810 122.7060 121.6110 H 154 PRO154 0.0278 2470 N 109.3360 121.8900 122.1320 N.am 155 GLU155 -0.2456 2471 CA 110.6300 121.4880 122.6660 C.3 155 GLU155 0.0883 2472 CB 110.9300 119.9790 122.6990 C.3 155 GLU155 -0.0193 2473 CG 112.2570 119.7200 123.4610 C.3 155 GLU155 0.0356 2474 CD 112.3570 118.3990 124.2520 C.2 155 GLU155 0.1760 2475 OE1 113.2290 118.2510 125.0980 O.co2 155 GLU155 -0.6478 2476 OE2 111.5920 117.4660 124.0740 O.co2 155 GLU155 -0.6478 2477 C 111.7220 122.3600 122.0610 C.2 155 GLU155 0.2187 2478 O 112.7490 122.6190 122.6970 O.2 155 GLU155 -0.2778 2479 H 109.2450 122.0490 121.1290 H 155 GLU155 0.1312 2480 HA 110.6230 121.8160 123.7080 H 155 GLU155 0.0557 2481 HB1 110.9710 119.5620 121.6920 H 155 GLU155 0.0290 2482 HB2 110.1020 119.4840 123.2070 H 155 GLU155 0.0290 2483 HG1 112.4200 120.5100 124.1950 H 155 GLU155 0.0374 2484 HG2 113.1000 119.7760 122.7720 H 155 GLU155 0.0374 2485 N 111.5030 122.8130 120.8250 N.am 156 ALA156 -0.2459 2486 CA 112.4670 123.6420 120.1130 C.3 156 ALA156 0.0850 2487 CB 111.9570 123.8570 118.6820 C.3 156 ALA156 -0.0411 2488 C 112.6200 125.0020 120.7790 C.2 156 ALA156 0.2184 2489 O 113.7420 125.4670 121.0030 O.2 156 ALA156 -0.2778 2490 H 110.6280 122.5700 120.3610 H 156 ALA156 0.1312 2491 HA 113.4270 123.1230 120.1180 H 156 ALA156 0.0554 2492 HB1 112.6970 124.3740 118.0700 H 156 ALA156 0.0249 2493 HB2 111.0350 124.4410 118.6640 H 156 ALA156 0.0249 2494 HB3 111.7300 122.9110 118.2010 H 156 ALA156 0.0249 2495 N 111.5020 125.6450 121.0980 N.am 157 ILE157 -0.2454 2496 CA 111.5220 126.9230 121.7830 C.3 157 ILE157 0.0903 2497 CB 110.3340 127.7970 121.3120 C.3 157 ILE157 -0.0201 2498 CG1 108.9890 127.0510 121.1420 C.3 157 ILE157 -0.0514 2499 CG2 110.6920 128.4920 119.9900 C.3 157 ILE157 -0.0605 2500 CD1 108.4590 126.3560 122.4000 C.3 157 ILE157 -0.0650 2501 C 111.5230 126.6780 123.2870 C.2 157 ILE157 0.2187 2502 O 111.0720 125.6390 123.7790 O.2 157 ILE157 -0.2778 2503 H 110.6040 125.2280 120.8540 H 157 ILE157 0.1312 2504 HA 112.4590 127.4300 121.5420 H 157 ILE157 0.0560 2505 HB 110.1800 128.5900 122.0450 H 157 ILE157 0.0318 2506 HG11 109.0510 126.3240 120.3300 H 157 ILE157 0.0266 2507 HG12 108.2400 127.7760 120.8230 H 157 ILE157 0.0266 2508 HG21 109.8900 129.1550 119.6640 H 157 ILE157 0.0233 2509 HG22 110.8630 127.7630 119.1970 H 157 ILE157 0.0233 2510 HG23 111.5950 129.0940 120.0910 H 157 ILE157 0.0233 2511 HD11 107.4100 126.0900 122.2760 H 157 ILE157 0.0230 2512 HD12 108.5360 126.9990 123.2770 H 157 ILE157 0.0230 2513 HD13 108.9980 125.4300 122.5990 H 157 ILE157 0.0230 2514 N 112.0740 127.6360 124.0270 N.am 158 GLY158 -0.2485 2515 CA 112.3250 127.4570 125.4390 C.3 158 GLY158 0.0765 2516 C 113.5720 126.6630 125.7580 C.2 158 GLY158 0.2155 2517 O 113.8820 126.4720 126.9410 O.2 158 GLY158 -0.2781 2518 H 112.3260 128.5210 123.5860 H 158 GLY158 0.1309 2519 HA1 111.4600 126.9770 125.8980 H 158 GLY158 0.0521 2520 HA2 112.4240 128.4510 125.8730 H 158 GLY158 0.0521 2521 N 114.2950 126.1950 124.7410 N.am 159 PHE159 -0.2456 2522 CA 115.5480 125.4620 124.9270 C.3 159 PHE159 0.0917 2523 CB 115.5490 124.2770 123.9350 C.3 159 PHE159 -0.0036 2524 CG 116.3510 123.0830 124.3990 C.ar 159 PHE159 -0.0454 2525 CD1 117.6630 123.2150 124.8460 C.ar 159 PHE159 -0.0585 2526 CD2 115.7780 121.8130 124.3820 C.ar 159 PHE159 -0.0585 2527 CE1 118.3770 122.1100 125.2910 C.ar 159 PHE159 -0.0615 2528 CE2 116.4850 120.7060 124.8310 C.ar 159 PHE159 -0.0615 2529 CZ 117.7870 120.8540 125.2880 C.ar 159 PHE159 -0.0617 2530 C 116.7150 126.4210 124.6830 C.2 159 PHE159 0.2190 2531 O 117.3170 126.4720 123.6100 O.2 159 PHE159 -0.2778 2532 H 113.9600 126.3550 123.7910 H 159 PHE159 0.1312 2533 HA 115.5890 125.0890 125.9510 H 159 PHE159 0.0560 2534 HB1 115.8800 124.5740 122.9390 H 159 PHE159 0.0333 2535 HB2 114.5180 123.9500 123.8030 H 159 PHE159 0.0333 2536 HD1 118.1430 124.1820 124.8710 H 159 PHE159 0.0620 2537 HD2 114.7640 121.6820 124.0330 H 159 PHE159 0.0620 2538 HE1 119.3880 122.2370 125.6500 H 159 PHE159 0.0618 2539 HE2 116.0150 119.7340 124.8290 H 159 PHE159 0.0618 2540 HZ 118.3420 119.9980 125.6410 H 159 PHE159 0.0618 2541 N 117.0260 127.1980 125.7170 N.am 160 VAL160 -0.2454 2542 CA 117.9790 128.2890 125.6020 C.3 160 VAL160 0.0901 2543 CB 117.2670 129.6390 125.8380 C.3 160 VAL160 -0.0227 2544 CG1 116.1710 129.8740 124.7870 C.3 160 VAL160 -0.0608 2545 CG2 116.6900 129.7750 127.2540 C.3 160 VAL160 -0.0608 2546 C 119.1420 128.0610 126.5580 C.2 160 VAL160 0.2189 2547 O 119.0780 127.2490 127.4840 O.2 160 VAL160 -0.2778 2548 H 116.5820 127.0230 126.6180 H 160 VAL160 0.1312 2549 HA 118.4030 128.2880 124.5970 H 160 VAL160 0.0560 2550 HB 118.0050 130.4320 125.7100 H 160 VAL160 0.0315 2551 HG11 115.7410 130.8710 124.8890 H 160 VAL160 0.0233 2552 HG12 115.3580 129.1540 124.8880 H 160 VAL160 0.0233 2553 HG13 116.5700 129.7860 123.7760 H 160 VAL160 0.0233 2554 HG21 116.1950 130.7380 127.3840 H 160 VAL160 0.0233 2555 HG22 117.4760 129.7150 128.0070 H 160 VAL160 0.0233 2556 HG23 115.9540 128.9980 127.4620 H 160 VAL160 0.0233 2557 N 120.2260 128.7990 126.3270 N.am 161 MET161 -0.2456 2558 CA 121.4450 128.6770 127.1160 C.3 161 MET161 0.0885 2559 CB 122.6120 128.7700 126.1130 C.3 161 MET161 -0.0199 2560 CG 124.0070 128.9540 126.7270 C.3 161 MET161 -0.0047 2561 SD 124.5590 130.6690 126.6140 S.3 161 MET161 -0.1641 2562 CE 125.3260 130.7770 128.2380 C.3 161 MET161 -0.0181 2563 C 121.4840 129.7700 128.1770 C.2 161 MET161 0.2187 2564 O 121.2240 130.9410 127.8820 O.2 161 MET161 -0.2778 2565 H 120.2020 129.4780 125.5660 H 161 MET161 0.1312 2566 HA 121.4600 127.7030 127.6110 H 161 MET161 0.0557 2567 HB1 122.4260 129.5770 125.4030 H 161 MET161 0.0293 2568 HB2 122.6070 127.8550 125.5200 H 161 MET161 0.0293 2569 HG1 124.7260 128.3170 126.2120 H 161 MET161 0.0377 2570 HG2 123.9940 128.6480 127.7710 H 161 MET161 0.0377 2571 HE1 125.6460 131.7950 128.4610 H 161 MET161 0.0340 2572 HE2 126.1670 130.0910 128.3310 H 161 MET161 0.0340 2573 HE3 124.5980 130.4630 128.9760 H 161 MET161 0.0340 2574 N 121.7870 129.3800 129.4110 N.am 162 VAL162 -0.2454 2575 CA 121.8960 130.3000 130.5360 C.3 162 VAL162 0.0903 2576 CB 120.7140 130.0530 131.5010 C.3 162 VAL162 -0.0227 2577 CG1 120.7390 131.0270 132.6900 C.3 162 VAL162 -0.0608 2578 CG2 119.3570 130.1410 130.7790 C.3 162 VAL162 -0.0608 2579 C 123.2290 130.0500 131.2340 C.2 162 VAL162 0.2216 2580 O 123.4980 128.9270 131.6730 O.2 162 VAL162 -0.2776 2581 H 121.9510 128.3880 129.5790 H 162 VAL162 0.1312 2582 HA 121.8320 131.3150 130.1500 H 162 VAL162 0.0560 2583 HB 120.7990 129.0410 131.8990 H 162 VAL162 0.0315 2584 HG11 119.9020 130.8440 133.3630 H 162 VAL162 0.0233 2585 HG12 120.6740 132.0620 132.3520 H 162 VAL162 0.0233 2586 HG13 121.6530 130.9240 133.2750 H 162 VAL162 0.0233 2587 HG21 118.5330 130.0140 131.4810 H 162 VAL162 0.0233 2588 HG22 119.2480 129.3670 130.0190 H 162 VAL162 0.0233 2589 HG23 119.2310 131.1090 130.2920 H 162 VAL162 0.0233 2590 N 124.1020 131.0460 131.3370 N.am 163 PRO163 -0.2316 2591 CA 125.4020 130.8450 131.9850 C.3 163 PRO163 0.0907 2592 CD 123.8590 132.4230 130.9090 C.3 163 PRO163 0.0071 2593 CB 126.1400 132.1610 131.7090 C.3 163 PRO163 -0.0276 2594 CG 125.0370 133.1970 131.5040 C.3 163 PRO163 -0.0379 2595 C 125.2560 130.5420 133.4720 C.2 163 PRO163 0.2189 2596 O 124.1650 130.5560 134.0430 O.2 163 PRO163 -0.2778 2597 HA 125.9000 130.0020 131.5030 H 163 PRO163 0.0559 2598 HD1 122.9090 132.7710 131.3180 H 163 PRO163 0.0431 2599 HD2 123.8400 132.4500 129.8200 H 163 PRO163 0.0431 2600 HB1 126.7090 132.0600 130.7840 H 163 PRO163 0.0285 2601 HB2 126.8480 132.4470 132.4890 H 163 PRO163 0.0285 2602 HG1 124.7480 133.6020 132.4750 H 163 PRO163 0.0278 2603 HG2 125.3540 134.0320 130.8780 H 163 PRO163 0.0278 2604 N 126.4000 130.2700 134.0960 N.am 164 PHE164 -0.2453 2605 CA 126.4740 130.1040 135.5400 C.3 164 PHE164 0.0917 2606 CB 126.1390 128.6710 135.9900 C.3 164 PHE164 -0.0036 2607 CG 127.1900 127.6570 135.6160 C.ar 164 PHE164 -0.0454 2608 CD1 128.2460 127.3750 136.4790 C.ar 164 PHE164 -0.0585 2609 CD2 127.1150 126.9890 134.4010 C.ar 164 PHE164 -0.0585 2610 CE1 129.2140 126.4430 136.1280 C.ar 164 PHE164 -0.0615 2611 CE2 128.0660 126.0390 134.0570 C.ar 164 PHE164 -0.0615 2612 CZ 129.1190 125.7670 134.9210 C.ar 164 PHE164 -0.0617 2613 C 127.8540 130.5440 136.0080 C.2 164 PHE164 0.2190 2614 O 128.8170 130.5520 135.2370 O.2 164 PHE164 -0.2778 2615 H 127.2530 130.1750 133.5440 H 164 PHE164 0.1312 2616 HA 125.7550 130.7990 135.9770 H 164 PHE164 0.0560 2617 HB1 125.1800 128.3680 135.5690 H 164 PHE164 0.0333 2618 HB2 126.0110 128.6490 137.0730 H 164 PHE164 0.0333 2619 HD1 128.3360 127.9000 137.4190 H 164 PHE164 0.0620 2620 HD2 126.3110 127.2240 133.7210 H 164 PHE164 0.0620 2621 HE1 130.0460 126.2540 136.7920 H 164 PHE164 0.0618 2622 HE2 128.0000 125.5260 133.1090 H 164 PHE164 0.0618 2623 HZ 129.8770 125.0480 134.6450 H 164 PHE164 0.0618 2624 N 127.9390 130.9070 137.2860 N.am 165 GLU165 -0.2456 2625 CA 129.1960 131.3260 137.9000 C.3 165 GLU165 0.0883 2626 CB 129.2750 132.8460 138.1320 C.3 165 GLU165 -0.0193 2627 CG 130.4570 133.3010 139.0270 C.3 165 GLU165 0.0356 2628 CD 131.8120 132.6600 138.6650 C.2 165 GLU165 0.1760 2629 OE1 132.2760 132.8610 137.5460 O.co2 165 GLU165 -0.6478 2630 OE2 132.3890 131.9680 139.5070 O.co2 165 GLU165 -0.6478 2631 C 129.3420 130.5880 139.2220 C.2 165 GLU165 0.2187 2632 O 128.5590 130.8150 140.1500 O.2 165 GLU165 -0.2778 2633 H 127.0940 130.8920 137.8580 H 165 GLU165 0.1312 2634 HA 130.0280 131.0170 137.2610 H 165 GLU165 0.0557 2635 HB1 128.3460 133.1940 138.5830 H 165 GLU165 0.0290 2636 HB2 129.3420 133.3480 137.1690 H 165 GLU165 0.0290 2637 HG1 130.2430 133.0700 140.0700 H 165 GLU165 0.0374 2638 HG2 130.5750 134.3820 138.9710 H 165 GLU165 0.0374 2639 N 130.3380 129.7080 139.3060 N.am 166 TYR166 -0.2453 2640 CA 130.5670 128.9330 140.5160 C.3 166 TYR166 0.0917 2641 CB 129.4400 127.9060 140.7490 C.3 166 TYR166 -0.0036 2642 CG 129.2700 127.5910 142.2130 C.ar 166 TYR166 -0.0453 2643 CD1 129.9230 126.5110 142.8000 C.ar 166 TYR166 -0.0561 2644 CD2 128.4620 128.4010 143.0050 C.ar 166 TYR166 -0.0561 2645 CE1 129.7600 126.2420 144.1540 C.ar 166 TYR166 -0.0317 2646 CE2 128.2920 128.1290 144.3560 C.ar 166 TYR166 -0.0317 2647 CZ 128.9340 127.0420 144.9310 C.ar 166 TYR166 0.0726 2648 OH 128.7620 126.7670 146.2730 O.3 166 TYR166 -0.3598 2649 C 131.9150 128.2400 140.3630 C.2 166 TYR166 0.2190 2650 O 132.2540 127.7540 139.2790 O.2 166 TYR166 -0.2778 2651 H 130.9540 129.5740 138.5040 H 166 TYR166 0.1312 2652 HA 130.6310 129.6610 141.3270 H 166 TYR166 0.0560 2653 HB1 129.6110 126.9910 140.1790 H 166 TYR166 0.0333 2654 HB2 128.4910 128.2970 140.3850 H 166 TYR166 0.0333 2655 HD1 130.5670 125.8830 142.2010 H 166 TYR166 0.0621 2656 HD2 127.9650 129.2550 142.5640 H 166 TYR166 0.0621 2657 HE1 130.2810 125.4180 144.6140 H 166 TYR166 0.0643 2658 HE2 127.6600 128.7650 144.9570 H 166 TYR166 0.0643 2659 HH 128.4800 127.5580 146.7120 H 166 TYR166 0.2173 2660 N 132.6820 128.2170 141.4570 N.am 167 ARG167 -0.2456 2661 CA 134.0030 127.5810 141.5050 C.3 167 ARG167 0.0879 2662 CB 133.8820 126.0540 141.2090 C.3 167 ARG167 -0.0258 2663 CG 134.2090 125.5660 139.7670 C.3 167 ARG167 -0.0154 2664 CD 135.5810 124.8740 139.6780 C.3 167 ARG167 0.1045 2665 NE 136.1570 124.9330 138.3310 N.pl3 167 ARG167 -0.4450 2666 CZ 137.3250 125.4830 138.0030 C.cat 167 ARG167 0.5062 2667 NH1 137.9650 126.2730 138.8180 N.pl3 167 ARG167 -0.4573 2668 NH2 137.8480 125.2460 136.8380 N.pl3 167 ARG167 -0.4573 2669 C 135.0020 128.2920 140.5930 C.2 167 ARG167 0.2185 2670 O 135.9590 127.6850 140.1050 O.2 167 ARG167 -0.2778 2671 H 132.3300 128.6650 142.3030 H 167 ARG167 0.1312 2672 HA 134.3370 127.7300 142.5310 H 167 ARG167 0.0557 2673 HB1 132.8690 125.7380 141.4600 H 167 ARG167 0.0286 2674 HB2 134.5120 125.5120 141.9150 H 167 ARG167 0.0286 2675 HG1 134.1600 126.3790 139.0450 H 167 ARG167 0.0299 2676 HG2 133.4450 124.8630 139.4350 H 167 ARG167 0.0299 2677 HD1 135.4840 123.8160 139.9290 H 167 ARG167 0.0711 2678 HD2 136.2820 125.2960 140.3990 H 167 ARG167 0.0711 2679 HE 135.7010 124.5510 137.5160 H 167 ARG167 0.3153 2680 HH11 138.8710 126.6080 138.5830 H 167 ARG167 0.3114 2681 HH12 137.5060 126.5490 139.6590 H 167 ARG167 0.3114 2682 HH21 138.7540 125.5420 136.5670 H 167 ARG167 0.3114 2683 HH22 137.2810 124.7580 136.1540 H 167 ARG167 0.3114 2684 N 134.7850 129.5830 140.3630 N.am 168 GLY168 -0.2485 2685 CA 135.7280 130.3860 139.5990 C.3 168 GLY168 0.0765 2686 C 135.9440 129.9150 138.1780 C.2 168 GLY168 0.2155 2687 O 137.0740 129.9610 137.6760 O.2 168 GLY168 -0.2781 2688 H 133.9400 130.0200 140.7300 H 168 GLY168 0.1309 2689 HA1 136.6750 130.4110 140.1360 H 168 GLY168 0.0521 2690 HA2 135.3130 131.3950 139.5680 H 168 GLY168 0.0521 2691 N 134.8840 129.4600 137.5150 N.am 169 GLU169 -0.2459 2692 CA 134.9860 129.0040 136.1380 C.3 169 GLU169 0.0883 2693 CB 135.2250 127.4900 136.1550 C.3 169 GLU169 -0.0193 2694 CG 135.1550 126.7860 134.7870 C.3 169 GLU169 0.0356 2695 CD 135.8570 125.4190 134.8640 C.2 169 GLU169 0.1760 2696 OE1 136.8720 125.2240 134.2040 O.co2 169 GLU169 -0.6478 2697 OE2 135.4180 124.5430 135.6070 O.co2 169 GLU169 -0.6478 2698 C 133.7130 129.3760 135.3960 C.2 169 GLU169 0.2187 2699 O 132.6100 129.2930 135.9440 O.2 169 GLU169 -0.2778 2700 H 133.9780 129.4300 137.9840 H 169 GLU169 0.1312 2701 HA 135.8160 129.5220 135.6540 H 169 GLU169 0.0557 2702 HB1 134.5250 127.0090 136.8380 H 169 GLU169 0.0290 2703 HB2 136.2150 127.3590 136.5810 H 169 GLU169 0.0290 2704 HG1 135.6430 127.3850 134.0180 H 169 GLU169 0.0374 2705 HG2 134.1200 126.6410 134.4820 H 169 GLU169 0.0374 2706 N 133.8770 129.7830 134.1400 N.am 170 GLN170 -0.2456 2707 CA 132.7660 130.1680 133.2810 C.3 170 GLN170 0.0882 2708 CB 133.0480 131.5720 132.7170 C.3 170 GLN170 -0.0210 2709 CG 132.6540 132.6930 133.6920 C.3 170 GLN170 0.0225 2710 CD 131.1260 132.8400 133.7340 C.2 170 GLN170 0.1981 2711 OE1 130.4620 132.9710 132.7120 O.2 170 GLN170 -0.2798 2712 NE2 130.6190 132.8020 134.9700 N.am 170 GLN170 -0.2724 2713 C 132.6310 129.1540 132.1570 C.2 170 GLN170 0.2187 2714 O 133.6070 128.8630 131.4570 O.2 170 GLN170 -0.2778 2715 H 134.8230 129.8270 133.7620 H 170 GLN170 0.1312 2716 HA 131.8380 130.1660 133.8590 H 170 GLN170 0.0557 2717 HB1 132.5260 131.7240 131.7700 H 170 GLN170 0.0289 2718 HB2 134.1100 131.6540 132.4790 H 170 GLN170 0.0289 2719 HG1 133.0690 133.6450 133.3660 H 170 GLN170 0.0356 2720 HG2 133.0390 132.4980 134.6950 H 170 GLN170 0.0356 2721 HE21 129.6330 132.8390 135.1200 H 170 GLN170 0.1266 2722 HE22 131.2160 132.7250 135.7730 H 170 GLN170 0.1266 2723 N 131.4250 128.6190 131.9860 N.am 171 HIS171 -0.2453 2724 CA 131.1600 127.6210 130.9620 C.3 171 HIS171 0.0932 2725 ND1 132.1430 124.4590 132.8680 N.ar 171 HIS171 -0.2469 2726 CG 132.1860 125.5350 132.0560 C.ar 171 HIS171 0.0551 2727 CB 130.9300 126.2260 131.5780 C.3 171 HIS171 0.0146 2728 NE2 134.2740 124.8490 132.3570 N.ar 171 HIS171 -0.2539 2729 CD2 133.5270 125.7620 131.7020 C.ar 171 HIS171 0.0047 2730 CE1 133.4200 124.0980 133.0720 C.ar 171 HIS171 0.0737 2731 C 129.8660 127.9640 130.2410 C.2 171 HIS171 0.2190 2732 O 128.9250 128.4930 130.8370 O.2 171 HIS171 -0.2778 2733 H 130.6620 128.9190 132.5930 H 171 HIS171 0.1312 2734 HA 131.9650 127.6150 130.2270 H 171 HIS171 0.0561 2735 HB1 130.4660 125.5490 130.8590 H 171 HIS171 0.0348 2736 HB2 130.2430 126.3060 132.4170 H 171 HIS171 0.0348 2737 HE2 135.2540 124.8030 132.4210 H 171 HIS171 0.1339 2738 HD2 133.9100 126.5410 131.0670 H 171 HIS171 0.0764 2739 HE1 133.7400 123.3390 133.7720 H 171 HIS171 0.0963 2740 N 129.8320 127.6590 128.9470 N.am 172 LYS172 -0.2456 2741 CA 128.6230 127.7990 128.1460 C.3 172 LYS172 0.0878 2742 CB 129.0700 128.1340 126.7250 C.3 172 LYS172 -0.0289 2743 CG 127.9410 128.3730 125.7070 C.3 172 LYS172 -0.0496 2744 CD 127.6050 129.8590 125.5230 C.3 172 LYS172 -0.0278 2745 CE 126.6770 130.1190 124.3310 C.3 172 LYS172 0.1103 2746 NZ 126.2930 131.5280 124.2370 N.4 172 LYS172 -0.0749 2747 C 127.8750 126.4720 128.1610 C.2 172 LYS172 0.2187 2748 O 128.3080 125.5030 127.5270 O.2 172 LYS172 -0.2778 2749 H 130.6820 127.3150 128.5000 H 172 LYS172 0.1312 2750 HA 128.0030 128.5960 128.5600 H 172 LYS172 0.0557 2751 HB1 129.7000 127.3210 126.3620 H 172 LYS172 0.0285 2752 HB2 129.7220 129.0050 126.7780 H 172 LYS172 0.0285 2753 HG1 127.0470 127.8060 125.9680 H 172 LYS172 0.0266 2754 HG2 128.2690 127.9670 124.7530 H 172 LYS172 0.0266 2755 HD1 128.5130 130.4420 125.3880 H 172 LYS172 0.0282 2756 HD2 127.1700 130.2380 126.4420 H 172 LYS172 0.0282 2757 HE1 125.7700 129.5180 124.4050 H 172 LYS172 0.0559 2758 HE2 127.1710 129.8360 123.3990 H 172 LYS172 0.0559 2759 HZ1 125.7140 131.6880 123.3870 H 172 LYS172 0.2742 2760 HZ2 127.1480 132.1200 124.1900 H 172 LYS172 0.2742 2761 HZ3 125.7440 131.7940 125.0810 H 172 LYS172 0.2742 2762 N 126.7570 126.4290 128.8790 N.am 173 THR173 -0.2434 2763 CA 126.0070 125.2010 129.0950 C.3 173 THR173 0.1135 2764 CB 125.9430 124.9000 130.6050 C.3 173 THR173 0.0763 2765 OG1 125.2300 123.6860 130.7820 O.3 173 THR173 -0.3900 2766 CG2 125.3100 126.0520 131.4110 C.3 173 THR173 -0.0370 2767 C 124.6050 125.3400 128.5180 C.2 173 THR173 0.2212 2768 O 124.0630 126.4480 128.4370 O.2 173 THR173 -0.2777 2769 H 126.4100 127.2930 129.2960 H 173 THR173 0.1313 2770 HA 126.5020 124.3730 128.5830 H 173 THR173 0.0583 2771 HB 126.9750 124.7580 130.9470 H 173 THR173 0.0611 2772 HG1 125.1870 123.4470 131.7030 H 173 THR173 0.2098 2773 HG21 125.1890 125.7940 132.4620 H 173 THR173 0.0255 2774 HG22 124.3260 126.3200 131.0300 H 173 THR173 0.0255 2775 HG23 125.9260 126.9500 131.3680 H 173 THR173 0.0255 2776 N 124.0250 124.2140 128.1110 N.am 174 CYS174 -0.2448 2777 CA 122.7400 124.1900 127.4250 C.3 174 CYS174 0.0965 2778 CB 122.9340 123.7210 125.9780 C.3 174 CYS174 0.0147 2779 SG 123.9130 124.8820 124.9840 S.3 174 CYS174 -0.1762 2780 C 121.7580 123.2890 128.1600 C.2 174 CYS174 0.2195 2781 O 122.0430 122.1080 128.3880 O.2 174 CYS174 -0.2778 2782 H 124.5010 123.3290 128.2870 H 174 CYS174 0.1312 2783 HA 122.3200 125.1980 127.4160 H 174 CYS174 0.0565 2784 HB1 121.9640 123.5980 125.4960 H 174 CYS174 0.0394 2785 HB2 123.4190 122.7440 125.9580 H 174 CYS174 0.0394 2786 HG 123.8970 124.4870 123.7090 H 174 CYS174 0.1017 2787 N 120.6080 123.8510 128.5320 N.am 175 MET175 -0.2456 2788 CA 119.4860 123.0780 129.0450 C.3 175 MET175 0.0885 2789 CB 119.5670 123.0210 130.5860 C.3 175 MET175 -0.0199 2790 CG 119.2870 124.3490 131.3210 C.3 175 MET175 -0.0047 2791 SD 120.4290 125.6790 130.8910 S.3 175 MET175 -0.1641 2792 CE 121.9380 125.0210 131.6230 C.3 175 MET175 -0.0181 2793 C 118.2010 123.7270 128.5480 C.2 175 MET175 0.2187 2794 O 118.2150 124.5790 127.6550 O.2 175 MET175 -0.2778 2795 H 120.5100 124.8630 128.4540 H 175 MET175 0.1312 2796 HA 119.5380 122.0760 128.6150 H 175 MET175 0.0557 2797 HB1 120.5530 122.6540 130.8700 H 175 MET175 0.0293 2798 HB2 118.8640 122.2720 130.9520 H 175 MET175 0.0293 2799 HG1 119.3630 124.1750 132.3940 H 175 MET175 0.0377 2800 HG2 118.2670 124.6970 131.1530 H 175 MET175 0.0377 2801 HE1 122.4430 125.8110 132.1790 H 175 MET175 0.0340 2802 HE2 122.6130 124.6690 130.8420 H 175 MET175 0.0340 2803 HE3 121.7270 124.2100 132.3190 H 175 MET175 0.0340 2804 N 117.0830 123.3230 129.1440 N.am 176 LEU176 -0.2456 2805 CA 115.7770 123.8910 128.8430 C.3 176 LEU176 0.0880 2806 CB 114.8900 122.7950 128.2180 C.3 176 LEU176 -0.0266 2807 CG 113.4390 123.2200 127.8930 C.3 176 LEU176 -0.0449 2808 CD1 112.9430 122.5900 126.5830 C.3 176 LEU176 -0.0626 2809 CD2 112.4740 122.8770 129.0350 C.3 176 LEU176 -0.0626 2810 C 115.2030 124.4780 130.1250 C.2 176 LEU176 0.2187 2811 O 115.4290 123.9380 131.2130 O.2 176 LEU176 -0.2778 2812 H 117.1430 122.5820 129.8430 H 176 LEU176 0.1312 2813 HA 115.8970 124.7140 128.1360 H 176 LEU176 0.0557 2814 HB1 114.8830 121.9090 128.8540 H 176 LEU176 0.0287 2815 HB2 115.3830 122.4830 127.2970 H 176 LEU176 0.0287 2816 HG 113.4130 124.2970 127.7490 H 176 LEU176 0.0296 2817 HD11 111.9100 122.8720 126.3780 H 176 LEU176 0.0232 2818 HD12 112.9940 121.5020 126.6180 H 176 LEU176 0.0232 2819 HD13 113.5400 122.9300 125.7390 H 176 LEU176 0.0232 2820 HD21 111.4580 123.1920 128.7990 H 176 LEU176 0.0232 2821 HD22 112.7530 123.3630 129.9680 H 176 LEU176 0.0232 2822 HD23 112.4530 121.8020 129.2150 H 176 LEU176 0.0232 2823 N 114.4660 125.5780 129.9950 N.am 177 ASN177 -0.2452 2824 CA 113.8690 126.2480 131.1400 C.3 177 ASN177 0.0957 2825 CB 114.7780 127.3880 131.6340 C.3 177 ASN177 0.0446 2826 CG 115.2640 128.2940 130.4930 C.2 177 ASN177 0.2000 2827 OD1 114.6000 129.2380 130.0920 O.2 177 ASN177 -0.2797 2828 ND2 116.4660 127.9440 130.0070 N.am 177 ASN177 -0.2723 2829 C 112.4680 126.7160 130.7760 C.2 177 ASN177 0.2191 2830 O 112.1160 126.8400 129.6000 O.2 177 ASN177 -0.2778 2831 H 114.3150 125.9640 129.0630 H 177 ASN177 0.1312 2832 HA 113.7430 125.5130 131.9380 H 177 ASN177 0.0562 2833 HB1 115.6530 126.9660 132.1280 H 177 ASN177 0.0375 2834 HB2 114.2710 128.0060 132.3750 H 177 ASN177 0.0375 2835 HD21 116.8760 128.4790 129.2710 H 177 ASN177 0.1266 2836 HD22 116.9700 127.1550 130.3580 H 177 ASN177 0.1266 2837 N 111.6680 126.9740 131.8070 N.am 178 ALA178 -0.2459 2838 CA 110.2900 127.4150 131.6420 C.3 178 ALA178 0.0850 2839 CB 109.3860 126.6180 132.5920 C.3 178 ALA178 -0.0411 2840 C 110.1920 128.9080 131.9240 C.2 178 ALA178 0.2185 2841 O 110.6230 129.3740 132.9840 O.2 178 ALA178 -0.2778 2842 H 112.0350 126.8580 132.7520 H 178 ALA178 0.1312 2843 HA 109.9890 127.2400 130.6140 H 178 ALA178 0.0554 2844 HB1 108.3460 126.9350 132.5160 H 178 ALA178 0.0249 2845 HB2 109.6940 126.7420 133.6310 H 178 ALA178 0.0249 2846 HB3 109.4230 125.5530 132.3610 H 178 ALA178 0.0249 2847 N 109.6270 129.6520 130.9720 N.am 179 THR179 -0.2434 2848 CA 109.4590 131.0940 131.1040 C.3 179 THR179 0.1135 2849 CB 110.3010 131.7780 130.0080 C.3 179 THR179 0.0763 2850 OG1 109.8180 131.3660 128.7370 O.3 179 THR179 -0.3900 2851 CG2 111.7970 131.4380 130.1530 C.3 179 THR179 -0.0370 2852 C 108.0000 131.5240 131.0060 C.2 179 THR179 0.2213 2853 O 107.7290 132.7130 130.8060 O.2 179 THR179 -0.2777 2854 H 109.3000 129.1960 130.1200 H 179 THR179 0.1313 2855 HA 109.8130 131.4130 132.0850 H 179 THR179 0.0583 2856 HB 110.1780 132.8630 130.1130 H 179 THR179 0.0611 2857 HG1 110.3280 131.7670 128.0400 H 179 THR179 0.2098 2858 HG21 112.4130 132.0250 129.4720 H 179 THR179 0.0255 2859 HG22 111.9920 130.3850 129.9470 H 179 THR179 0.0255 2860 HG23 112.1470 131.6450 131.1640 H 179 THR179 0.0255 2861 N 107.0580 130.5940 131.1420 N.am 180 SER180 -0.2435 2862 CA 105.6440 130.9210 131.0290 C.3 180 SER180 0.1109 2863 CB 105.2150 130.9410 129.5510 C.3 180 SER180 0.0681 2864 OG 105.1810 129.6270 129.0010 O.3 180 SER180 -0.3930 2865 C 104.8380 129.8990 131.8160 C.2 180 SER180 0.2209 2866 O 105.3460 128.8420 132.1990 O.2 180 SER180 -0.2777 2867 H 107.3330 129.6300 131.3300 H 180 SER180 0.1312 2868 HA 105.4900 131.8980 131.4920 H 180 SER180 0.0580 2869 HB1 105.9110 131.5790 128.9930 H 180 SER180 0.0577 2870 HB2 104.2210 131.3930 129.4700 H 180 SER180 0.0577 2871 HG 105.0240 129.6480 128.0590 H 180 SER180 0.2095 2872 N 103.5700 130.2390 132.0580 N.am 181 LYS181 -0.2456 2873 CA 102.6870 129.3370 132.7910 C.3 181 LYS181 0.0878 2874 CB 101.3560 130.0290 133.1390 C.3 181 LYS181 -0.0289 2875 CG 100.6220 129.3270 134.2960 C.3 181 LYS181 -0.0496 2876 CD 101.2680 129.6130 135.6650 C.3 181 LYS181 -0.0278 2877 CE 101.1460 128.4410 136.6480 C.3 181 LYS181 0.1103 2878 NZ 101.9350 128.6400 137.8600 N.4 181 LYS181 -0.0749 2879 C 102.4800 128.0300 132.0360 C.2 181 LYS181 0.2187 2880 O 102.4540 126.9520 132.6410 O.2 181 LYS181 -0.2778 2881 H 103.2150 131.1370 131.7280 H 181 LYS181 0.1312 2882 HA 103.2250 129.0880 133.7080 H 181 LYS181 0.0557 2883 HB1 100.7160 130.0640 132.2560 H 181 LYS181 0.0285 2884 HB2 101.5410 131.0670 133.4160 H 181 LYS181 0.0285 2885 HG1 100.5990 128.2530 134.1030 H 181 LYS181 0.0266 2886 HG2 99.5790 129.6450 134.3220 H 181 LYS181 0.0266 2887 HD1 100.8380 130.5180 136.0960 H 181 LYS181 0.0282 2888 HD2 102.3270 129.8330 135.5320 H 181 LYS181 0.0282 2889 HE1 101.5250 127.5320 136.1730 H 181 LYS181 0.0559 2890 HE2 100.1090 128.2530 136.9290 H 181 LYS181 0.0559 2891 HZ1 102.0850 127.7270 138.3430 H 181 LYS181 0.2742 2892 HZ2 101.5470 129.3650 138.4840 H 181 LYS181 0.2742 2893 HZ3 102.9160 128.8750 137.5910 H 181 LYS181 0.2742 2894 N 102.3220 128.1070 130.7120 N.am 182 PHE182 -0.2453 2895 CA 102.1700 126.8940 129.9140 C.3 182 PHE182 0.0917 2896 CB 101.8510 127.2830 128.4600 C.3 182 PHE182 -0.0036 2897 CG 101.7140 126.0800 127.5630 C.ar 182 PHE182 -0.0454 2898 CD1 100.5340 125.3430 127.5460 C.ar 182 PHE182 -0.0585 2899 CD2 102.7830 125.6600 126.7750 C.ar 182 PHE182 -0.0585 2900 CE1 100.4240 124.2060 126.7550 C.ar 182 PHE182 -0.0615 2901 CE2 102.6770 124.5210 125.9870 C.ar 182 PHE182 -0.0615 2902 CZ 101.4960 123.7940 125.9760 C.ar 182 PHE182 -0.0617 2903 C 103.4290 126.0370 129.9700 C.2 182 PHE182 0.2190 2904 O 103.3480 124.8060 130.0520 O.2 182 PHE182 -0.2778 2905 H 102.3070 129.0190 130.2550 H 182 PHE182 0.1312 2906 HA 101.3460 126.3200 130.3420 H 182 PHE182 0.0560 2907 HB1 102.6280 127.9400 128.0660 H 182 PHE182 0.0333 2908 HB2 100.9230 127.8550 128.4280 H 182 PHE182 0.0333 2909 HD1 99.6990 125.6450 128.1600 H 182 PHE182 0.0620 2910 HD2 103.7150 126.2070 126.7910 H 182 PHE182 0.0620 2911 HE1 99.5050 123.6370 126.7520 H 182 PHE182 0.0618 2912 HE2 103.5170 124.1980 125.3880 H 182 PHE182 0.0618 2913 HZ 101.4120 122.9070 125.3650 H 182 PHE182 0.0618 2914 N 104.6030 126.6710 129.9190 N.am 183 MET183 -0.2456 2915 CA 105.8520 125.9250 130.0340 C.3 183 MET183 0.0885 2916 CB 107.0360 126.8230 129.6430 C.3 183 MET183 -0.0199 2917 CG 108.2350 126.0340 129.0940 C.3 183 MET183 -0.0047 2918 SD 107.8090 125.0910 127.6160 S.3 183 MET183 -0.1641 2919 CE 109.4660 124.7920 126.9650 C.3 183 MET183 -0.0181 2920 C 105.9860 125.2700 131.4020 C.2 183 MET183 0.2187 2921 O 106.4620 124.1330 131.5090 O.2 183 MET183 -0.2778 2922 H 104.6270 127.6840 129.7990 H 183 MET183 0.1312 2923 HA 105.7710 125.1210 129.3020 H 183 MET183 0.0557 2924 HB1 107.3330 127.4550 130.4800 H 183 MET183 0.0293 2925 HB2 106.7120 127.5080 128.8590 H 183 MET183 0.0293 2926 HG1 108.6560 125.3630 129.8440 H 183 MET183 0.0377 2927 HG2 109.0200 126.7350 128.8120 H 183 MET183 0.0377 2928 HE1 109.5510 123.7550 126.6420 H 183 MET183 0.0340 2929 HE2 110.2310 124.9700 127.7210 H 183 MET183 0.0340 2930 HE3 109.6520 125.4240 126.0970 H 183 MET183 0.0340 2931 N 105.5840 125.9750 132.4630 N.am 184 GLU184 -0.2456 2932 CA 105.6710 125.4050 133.8030 C.3 184 GLU184 0.0883 2933 CB 105.1450 126.5150 134.7280 C.3 184 GLU184 -0.0193 2934 CG 105.1200 126.2000 136.2340 C.3 184 GLU184 0.0356 2935 CD 104.2710 127.2460 136.9840 C.2 184 GLU184 0.1760 2936 OE1 103.6790 126.9260 138.0100 O.co2 184 GLU184 -0.6478 2937 OE2 104.1730 128.3930 136.5470 O.co2 184 GLU184 -0.6478 2938 C 104.8130 124.1520 133.9240 C.2 184 GLU184 0.2187 2939 O 105.2310 123.1590 134.5320 O.2 184 GLU184 -0.2778 2940 H 105.2140 126.9170 132.3350 H 184 GLU184 0.1312 2941 HA 106.7140 125.1630 134.0100 H 184 GLU184 0.0557 2942 HB1 104.1350 126.7720 134.4090 H 184 GLU184 0.0290 2943 HB2 105.7360 127.4180 134.5700 H 184 GLU184 0.0290 2944 HG1 106.1260 126.1950 136.6510 H 184 GLU184 0.0374 2945 HG2 104.6840 125.2180 136.4210 H 184 GLU184 0.0374 2946 N 103.6050 124.1810 133.3560 N.am 185 PHE185 -0.2453 2947 CA 102.7640 122.9890 133.3440 C.3 185 PHE185 0.0917 2948 CB 101.3900 123.3910 132.7830 C.3 185 PHE185 -0.0036 2949 CG 100.4500 122.2210 132.6580 C.ar 185 PHE185 -0.0454 2950 CD1 99.8320 121.6890 133.7850 C.ar 185 PHE185 -0.0585 2951 CD2 100.2200 121.6300 131.4180 C.ar 185 PHE185 -0.0585 2952 CE1 98.9970 120.5850 133.6760 C.ar 185 PHE185 -0.0615 2953 CE2 99.3860 120.5250 131.3070 C.ar 185 PHE185 -0.0615 2954 CZ 98.7730 120.0020 132.4370 C.ar 185 PHE185 -0.0617 2955 C 103.3890 121.8810 132.5050 C.2 185 PHE185 0.2190 2956 O 103.3640 120.7080 132.8940 O.2 185 PHE185 -0.2778 2957 H 103.2680 125.0430 132.9270 H 185 PHE185 0.1312 2958 HA 102.6730 122.6360 134.3730 H 185 PHE185 0.0560 2959 HB1 101.5070 123.8670 131.8080 H 185 PHE185 0.0333 2960 HB2 100.9360 124.1400 133.4320 H 185 PHE185 0.0333 2961 HD1 100.0160 122.1240 134.7560 H 185 PHE185 0.0620 2962 HD2 100.7080 122.0190 130.5360 H 185 PHE185 0.0620 2963 HE1 98.5300 120.1730 134.5600 H 185 PHE185 0.0618 2964 HE2 99.2220 120.0670 130.3420 H 185 PHE185 0.0618 2965 HZ 98.1300 119.1380 132.3540 H 185 PHE185 0.0618 2966 N 103.9500 122.2340 131.3450 N.am 186 TYR186 -0.2453 2967 CA 104.5620 121.2300 130.4810 C.3 186 TYR186 0.0917 2968 CB 104.8770 121.9500 129.1450 C.3 186 TYR186 -0.0036 2969 CG 105.9740 121.3240 128.3110 C.ar 186 TYR186 -0.0453 2970 CD1 105.6900 120.3460 127.3630 C.ar 186 TYR186 -0.0561 2971 CD2 107.2960 121.7350 128.4770 C.ar 186 TYR186 -0.0561 2972 CE1 106.7100 119.7910 126.5970 C.ar 186 TYR186 -0.0317 2973 CE2 108.3190 121.1660 127.7310 C.ar 186 TYR186 -0.0317 2974 CZ 108.0260 120.1960 126.7860 C.ar 186 TYR186 0.0726 2975 OH 109.0370 119.6510 126.0180 O.3 186 TYR186 -0.3598 2976 C 105.8430 120.6680 131.0850 C.2 186 TYR186 0.2190 2977 O 106.1210 119.4720 130.9400 O.2 186 TYR186 -0.2778 2978 H 103.9510 123.2140 131.0610 H 186 TYR186 0.1312 2979 HA 103.8460 120.4270 130.3150 H 186 TYR186 0.0560 2980 HB1 105.1830 122.9740 129.3570 H 186 TYR186 0.0333 2981 HB2 103.9680 122.0380 128.5490 H 186 TYR186 0.0333 2982 HD1 104.6720 120.0190 127.2140 H 186 TYR186 0.0621 2983 HD2 107.5360 122.4970 129.2070 H 186 TYR186 0.0621 2984 HE1 106.4810 119.0430 125.8530 H 186 TYR186 0.0643 2985 HE2 109.3380 121.4940 127.8750 H 186 TYR186 0.0643 2986 HH 108.8630 119.8910 125.1120 H 186 TYR186 0.2173 2987 N 106.6330 121.5100 131.7570 N.am 187 GLN187 -0.2456 2988 CA 107.8830 121.0460 132.3520 C.3 187 GLN187 0.0882 2989 CB 108.6350 122.2700 132.9040 C.3 187 GLN187 -0.0210 2990 CG 110.0930 121.9830 133.3020 C.3 187 GLN187 0.0225 2991 CD 110.9880 121.7490 132.0740 C.2 187 GLN187 0.1981 2992 OE1 110.5330 121.6430 130.9430 O.2 187 GLN187 -0.2798 2993 NE2 112.2940 121.6820 132.3700 N.am 187 GLN187 -0.2724 2994 C 107.6340 120.0080 133.4390 C.2 187 GLN187 0.2187 2995 O 108.3580 119.0100 133.5300 O.2 187 GLN187 -0.2778 2996 H 106.3600 122.4880 131.8550 H 187 GLN187 0.1312 2997 HA 108.4470 120.5710 131.5500 H 187 GLN187 0.0557 2998 HB1 108.0930 122.6690 133.7620 H 187 GLN187 0.0289 2999 HB2 108.6250 123.0670 132.1600 H 187 GLN187 0.0289 3000 HG1 110.1580 121.1170 133.9600 H 187 GLN187 0.0356 3001 HG2 110.4940 122.8340 133.8520 H 187 GLN187 0.0356 3002 HE21 112.9560 121.5560 131.6310 H 187 GLN187 0.1266 3003 HE22 112.6190 121.7550 133.3110 H 187 GLN187 0.1266 3004 N 106.6140 120.2220 134.2720 N.am 188 ASP188 -0.2451 3005 CA 106.3170 119.2960 135.3570 C.3 188 ASP188 0.0974 3006 CB 105.5490 119.9290 136.5320 C.3 188 ASP188 0.0576 3007 CG 105.9900 119.1830 137.8080 C.2 188 ASP188 0.1780 3008 OD1 107.1070 119.4030 138.2680 O.co2 188 ASP188 -0.6478 3009 OD2 105.2600 118.3500 138.3360 O.co2 188 ASP188 -0.6478 3010 C 105.7040 117.9880 134.8720 C.2 188 ASP188 0.2192 3011 O 105.5700 117.0560 135.6710 O.2 188 ASP188 -0.2778 3012 H 106.0310 121.0500 134.1470 H 188 ASP188 0.1312 3013 HA 107.3080 119.0200 135.7270 H 188 ASP188 0.0563 3014 HB1 104.4680 119.8690 136.4060 H 188 ASP188 0.0394 3015 HB2 105.8140 120.9790 136.6470 H 188 ASP188 0.0394 3016 N 105.3330 117.8950 133.5960 N.am 189 VAL189 -0.2454 3017 CA 104.6790 116.7040 133.0660 C.3 189 VAL189 0.0901 3018 CB 103.1960 116.9980 132.7530 C.3 189 VAL189 -0.0227 3019 CG1 103.0130 117.8570 131.4960 C.3 189 VAL189 -0.0608 3020 CG2 102.3550 115.7160 132.6630 C.3 189 VAL189 -0.0608 3021 C 105.4540 116.1820 131.8610 C.2 189 VAL189 0.2189 3022 O 105.0420 115.2090 131.2170 O.2 189 VAL189 -0.2778 3023 H 105.5120 118.6810 132.9710 H 189 VAL189 0.1312 3024 HA 104.7290 115.9150 133.8180 H 189 VAL189 0.0560 3025 HB 102.8070 117.5710 133.5970 H 189 VAL189 0.0315 3026 HG11 101.9900 118.2240 131.4130 H 189 VAL189 0.0233 3027 HG12 103.2460 117.2990 130.5890 H 189 VAL189 0.0233 3028 HG13 103.6760 118.7150 131.5330 H 189 VAL189 0.0233 3029 HG21 101.2970 115.9540 132.5500 H 189 VAL189 0.0233 3030 HG22 102.4620 115.1120 133.5650 H 189 VAL189 0.0233 3031 HG23 102.6450 115.0990 131.8130 H 189 VAL189 0.0233 3032 N 106.5960 116.8070 131.5680 N.am 190 LYS190 -0.2456 3033 CA 107.3660 116.4490 130.3800 C.3 190 LYS190 0.0878 3034 CB 108.5690 117.4100 130.3540 C.3 190 LYS190 -0.0289 3035 CG 109.1960 117.6370 128.9760 C.3 190 LYS190 -0.0496 3036 CD 110.0310 116.4600 128.4550 C.3 190 LYS190 -0.0278 3037 CE 111.2480 116.9470 127.6600 C.3 190 LYS190 0.1103 3038 NZ 110.9320 117.8690 126.5710 N.4 190 LYS190 -0.0749 3039 C 107.8250 114.9960 130.4320 C.2 190 LYS190 0.2187 3040 O 107.7370 114.2660 129.4380 O.2 190 LYS190 -0.2778 3041 H 106.9360 117.5460 132.1830 H 190 LYS190 0.1312 3042 HA 106.7140 116.6010 129.5190 H 190 LYS190 0.0557 3043 HB1 109.3300 117.1050 131.0740 H 190 LYS190 0.0285 3044 HB2 108.2370 118.3850 130.7050 H 190 LYS190 0.0285 3045 HG1 109.8300 118.5200 129.0610 H 190 LYS190 0.0266 3046 HG2 108.4210 117.8910 128.2540 H 190 LYS190 0.0266 3047 HD1 109.4090 115.7980 127.8510 H 190 LYS190 0.0282 3048 HD2 110.3890 115.8570 129.2920 H 190 LYS190 0.0282 3049 HE1 111.8030 116.1040 127.2450 H 190 LYS190 0.0559 3050 HE2 111.9270 117.4680 128.3390 H 190 LYS190 0.0559 3051 HZ1 111.8050 118.3320 126.2350 H 190 LYS190 0.2742 3052 HZ2 110.2480 118.5940 126.8680 H 190 LYS190 0.2742 3053 HZ3 110.5680 117.3660 125.7350 H 190 LYS190 0.2742 3054 N 108.3210 114.5560 131.5890 N.am 191 ASP191 -0.2451 3055 CA 108.7990 113.1820 131.7120 C.3 191 ASP191 0.0974 3056 CB 109.8760 113.0490 132.8040 C.3 191 ASP191 0.0576 3057 CG 111.2340 113.6740 132.3530 C.2 191 ASP191 0.1780 3058 OD1 111.3990 114.0420 131.1870 O.co2 191 ASP191 -0.6478 3059 OD2 112.1390 113.7780 133.1770 O.co2 191 ASP191 -0.6478 3060 C 107.6440 112.1890 131.6710 C.2 191 ASP191 0.2192 3061 O 107.7390 111.1320 131.0370 O.2 191 ASP191 -0.2778 3062 H 108.3670 115.1830 132.3920 H 191 ASP191 0.1312 3063 HA 109.3050 112.9610 130.7700 H 191 ASP191 0.0563 3064 HB1 110.0620 112.0000 133.0290 H 191 ASP191 0.0394 3065 HB2 109.5550 113.5260 133.7290 H 191 ASP191 0.0394 3066 N 106.5420 112.5120 132.3510 N.am 192 TRP192 -0.2453 3067 CA 105.3730 111.6370 132.3250 C.3 192 TRP192 0.0918 3068 CB 104.3520 112.1220 133.3740 C.3 192 TRP192 -0.0021 3069 CG 104.5690 111.3720 134.6750 C.ar 192 TRP192 -0.0260 3070 CD2 105.7480 111.3540 135.5110 C.ar 192 TRP192 -0.0028 3071 CD1 103.6750 110.4550 135.2370 C.ar 192 TRP192 -0.0136 3072 NE1 104.2420 109.8830 136.3260 N.ar 192 TRP192 -0.2641 3073 CE2 105.5240 110.3800 136.5140 C.ar 192 TRP192 0.0269 3074 CE3 106.9430 112.0220 135.4700 C.ar 192 TRP192 -0.0528 3075 CZ2 106.5070 110.0900 137.4210 C.ar 192 TRP192 -0.0430 3076 CZ3 107.9570 111.7050 136.3680 C.ar 192 TRP192 -0.0611 3077 CH2 107.7400 110.7350 137.3460 C.ar 192 TRP192 -0.0602 3078 C 104.7810 111.5520 130.9240 C.2 192 TRP192 0.2190 3079 O 104.4060 110.4700 130.4590 O.2 192 TRP192 -0.2778 3080 H 106.5160 113.3760 132.8930 H 192 TRP192 0.1312 3081 HA 105.7210 110.6310 132.5720 H 192 TRP192 0.0560 3082 HB1 103.3290 111.9320 133.0460 H 192 TRP192 0.0334 3083 HB2 104.4320 113.1980 133.5380 H 192 TRP192 0.0334 3084 HD1 102.6990 110.2160 134.8400 H 192 TRP192 0.0748 3085 HE1 103.8230 109.1930 136.8830 H 192 TRP192 0.1331 3086 HE3 107.1260 112.7900 134.7370 H 192 TRP192 0.0624 3087 HZ2 106.3360 109.3370 138.1760 H 192 TRP192 0.0633 3088 HZ3 108.9140 112.1990 136.2830 H 192 TRP192 0.0618 3089 HH2 108.5310 110.4810 138.0360 H 192 TRP192 0.0618 3090 N 104.6820 112.6930 130.2350 N.am 193 TRP193 -0.2453 3091 CA 104.1340 112.6940 128.8830 C.3 193 TRP193 0.0918 3092 CB 103.9640 114.1580 128.4360 C.3 193 TRP193 -0.0021 3093 CG 103.4340 114.2280 127.0160 C.ar 193 TRP193 -0.0260 3094 CD2 104.2010 114.3360 125.7980 C.ar 193 TRP193 -0.0028 3095 CD1 102.0920 114.1400 126.6340 C.ar 193 TRP193 -0.0136 3096 NE1 102.0100 114.1820 125.2810 N.ar 193 TRP193 -0.2641 3097 CE2 103.2790 114.2920 124.7270 C.ar 193 TRP193 0.0269 3098 CE3 105.5440 114.4400 125.5410 C.ar 193 TRP193 -0.0528 3099 CZ2 103.7260 114.3520 123.4350 C.ar 193 TRP193 -0.0430 3100 CZ3 106.0030 114.4970 124.2250 C.ar 193 TRP193 -0.0611 3101 CH2 105.0920 114.4530 123.1690 C.ar 193 TRP193 -0.0602 3102 C 105.0460 111.9510 127.9140 C.2 193 TRP193 0.2190 3103 O 104.5710 111.1870 127.0660 O.2 193 TRP193 -0.2778 3104 H 104.9920 113.5690 130.6570 H 193 TRP193 0.1312 3105 HA 103.1680 112.1870 128.9130 H 193 TRP193 0.0560 3106 HB1 104.9120 114.6940 128.5020 H 193 TRP193 0.0334 3107 HB2 103.2710 114.6740 129.1020 H 193 TRP193 0.0334 3108 HD1 101.2570 114.0370 127.3120 H 193 TRP193 0.0748 3109 HE1 101.1790 114.1310 124.7640 H 193 TRP193 0.1331 3110 HE3 106.2470 114.4650 126.3610 H 193 TRP193 0.0624 3111 HZ2 103.0170 114.3150 122.6220 H 193 TRP193 0.0633 3112 HZ3 107.0610 114.5710 124.0220 H 193 TRP193 0.0618 3113 HH2 105.4430 114.4950 122.1480 H 193 TRP193 0.0618 3114 N 106.3590 112.1700 128.0180 N.am 194 LEU194 -0.2456 3115 CA 107.2960 111.4860 127.1320 C.3 194 LEU194 0.0880 3116 CB 108.6940 112.0770 127.3890 C.3 194 LEU194 -0.0266 3117 CG 109.7060 111.8350 126.2580 C.3 194 LEU194 -0.0449 3118 CD1 109.4040 112.7390 125.0520 C.3 194 LEU194 -0.0626 3119 CD2 111.1360 112.0680 126.7590 C.3 194 LEU194 -0.0626 3120 C 107.2750 109.9820 127.3690 C.2 194 LEU194 0.2187 3121 O 107.2820 109.1910 126.4200 O.2 194 LEU194 -0.2778 3122 H 106.7100 112.8200 128.7220 H 194 LEU194 0.1312 3123 HA 106.9680 111.6850 126.1110 H 194 LEU194 0.0557 3124 HB1 109.0800 111.7010 128.3380 H 194 LEU194 0.0287 3125 HB2 108.6080 113.1550 127.5220 H 194 LEU194 0.0287 3126 HG 109.6340 110.7950 125.9420 H 194 LEU194 0.0296 3127 HD11 110.1770 112.6580 124.2890 H 194 LEU194 0.0232 3128 HD12 109.3530 113.7870 125.3490 H 194 LEU194 0.0232 3129 HD13 108.4530 112.4780 124.5880 H 194 LEU194 0.0232 3130 HD21 111.8640 111.8800 125.9700 H 194 LEU194 0.0232 3131 HD22 111.3710 111.4030 127.5910 H 194 LEU194 0.0232 3132 HD23 111.2690 113.0930 127.1070 H 194 LEU194 0.0232 3133 N 107.2530 109.5670 128.6380 N.am 195 PHE195 -0.2453 3134 CA 107.1440 108.1460 128.9480 C.3 195 PHE195 0.0917 3135 CB 107.3610 107.9830 130.4640 C.3 195 PHE195 -0.0036 3136 CG 107.3180 106.5590 130.9630 C.ar 195 PHE195 -0.0454 3137 CD1 107.9850 105.5340 130.2950 C.ar 195 PHE195 -0.0585 3138 CD2 106.6490 106.2580 132.1460 C.ar 195 PHE195 -0.0585 3139 CE1 107.9880 104.2400 130.7990 C.ar 195 PHE195 -0.0615 3140 CE2 106.6430 104.9630 132.6490 C.ar 195 PHE195 -0.0615 3141 CZ 107.3140 103.9520 131.9760 C.ar 195 PHE195 -0.0617 3142 C 105.8000 107.5880 128.5000 C.2 195 PHE195 0.2188 3143 O 105.7260 106.4720 127.9720 O.2 195 PHE195 -0.2778 3144 H 107.3130 110.2480 129.3950 H 195 PHE195 0.1312 3145 HA 107.9190 107.6320 128.3820 H 195 PHE195 0.0560 3146 HB1 106.6170 108.5760 130.9990 H 195 PHE195 0.0333 3147 HB2 108.3290 108.4040 130.7380 H 195 PHE195 0.0333 3148 HD1 108.5170 105.7320 129.3770 H 195 PHE195 0.0620 3149 HD2 106.1360 107.0380 132.6900 H 195 PHE195 0.0620 3150 HE1 108.5140 103.4570 130.2720 H 195 PHE195 0.0618 3151 HE2 106.1210 104.7450 133.5700 H 195 PHE195 0.0618 3152 HZ 107.3140 102.9460 132.3680 H 195 PHE195 0.0618 3153 N 104.7240 108.3500 128.7060 N.am 196 GLY196 -0.2485 3154 CA 103.4100 107.8840 128.2960 C.3 196 GLY196 0.0765 3155 C 103.2660 107.7660 126.7900 C.2 196 GLY196 0.2155 3156 O 102.7060 106.7890 126.2860 O.2 196 GLY196 -0.2781 3157 H 104.8240 109.2620 129.1520 H 196 GLY196 0.1309 3158 HA1 102.6840 108.6010 128.6770 H 196 GLY196 0.0521 3159 HA2 103.2370 106.9200 128.7680 H 196 GLY196 0.0521 3160 N 103.7670 108.7560 126.0500 N.am 197 PHE197 -0.2456 3161 CA 103.6340 108.7300 124.5990 C.3 197 PHE197 0.0917 3162 CB 103.8780 110.1620 124.0830 C.3 197 PHE197 -0.0036 3163 CG 103.3610 110.3800 122.6820 C.ar 197 PHE197 -0.0454 3164 CD1 102.0250 110.7010 122.4650 C.ar 197 PHE197 -0.0585 3165 CD2 104.2110 110.2740 121.5870 C.ar 197 PHE197 -0.0585 3166 CE1 101.5470 110.9020 121.1750 C.ar 197 PHE197 -0.0615 3167 CE2 103.7380 110.4700 120.2960 C.ar 197 PHE197 -0.0615 3168 CZ 102.4030 110.7830 120.0890 C.ar 197 PHE197 -0.0617 3169 C 104.5790 107.7330 123.9420 C.2 197 PHE197 0.2190 3170 O 104.3300 107.3250 122.8030 O.2 197 PHE197 -0.2778 3171 H 104.2460 109.5350 126.5020 H 197 PHE197 0.1312 3172 HA 102.6070 108.4410 124.3760 H 197 PHE197 0.0560 3173 HB1 104.9370 110.4200 124.1370 H 197 PHE197 0.0333 3174 HB2 103.3680 110.8730 124.7350 H 197 PHE197 0.0333 3175 HD1 101.3510 110.7950 123.3040 H 197 PHE197 0.0620 3176 HD2 105.2480 110.0270 121.7430 H 197 PHE197 0.0620 3177 HE1 100.5080 111.1520 121.0180 H 197 PHE197 0.0618 3178 HE2 104.4080 110.3760 119.4530 H 197 PHE197 0.0618 3179 HZ 102.0320 110.9390 119.0860 H 197 PHE197 0.0618 3180 N 105.6540 107.3350 124.6230 N.am 198 TYR198 -0.2453 3181 CA 106.6330 106.4250 124.0410 C.3 198 TYR198 0.0917 3182 CB 108.0640 106.9910 124.1410 C.3 198 TYR198 -0.0036 3183 CG 108.3440 108.2270 123.3010 C.ar 198 TYR198 -0.0453 3184 CD1 107.6250 108.5550 122.1490 C.ar 198 TYR198 -0.0561 3185 CD2 109.4250 109.0350 123.6380 C.ar 198 TYR198 -0.0561 3186 CE1 107.9540 109.6770 121.3930 C.ar 198 TYR198 -0.0317 3187 CE2 109.7580 110.1520 122.8870 C.ar 198 TYR198 -0.0317 3188 CZ 109.0140 110.4860 121.7710 C.ar 198 TYR198 0.0726 3189 OH 109.3630 111.5950 121.0260 O.3 198 TYR198 -0.3598 3190 C 106.5290 105.0020 124.5710 C.2 198 TYR198 0.2190 3191 O 106.9910 104.0750 123.8970 O.2 198 TYR198 -0.2778 3192 H 105.7950 107.6750 125.5740 H 198 TYR198 0.1312 3193 HA 106.4050 106.2950 122.9850 H 198 TYR198 0.0560 3194 HB1 108.7800 106.2300 123.8280 H 198 TYR198 0.0333 3195 HB2 108.2890 107.2070 125.1850 H 198 TYR198 0.0333 3196 HD1 106.7970 107.9540 121.8070 H 198 TYR198 0.0621 3197 HD2 110.0370 108.7900 124.4870 H 198 TYR198 0.0621 3198 HE1 107.3880 109.9150 120.5050 H 198 TYR198 0.0643 3199 HE2 110.6120 110.7540 123.1580 H 198 TYR198 0.0643 3200 HH 108.9040 111.5830 120.1950 H 198 TYR198 0.2173 3201 N 105.9460 104.8050 125.7530 N.am 199 PHE199 -0.2453 3202 CA 105.7740 103.4730 126.3190 C.3 199 PHE199 0.0917 3203 CB 106.5630 103.3390 127.6320 C.3 199 PHE199 -0.0036 3204 CG 107.9290 102.7900 127.3590 C.ar 199 PHE199 -0.0454 3205 CD1 108.9750 103.6390 127.0240 C.ar 199 PHE199 -0.0585 3206 CD2 108.1340 101.4140 127.3580 C.ar 199 PHE199 -0.0585 3207 CE1 110.2090 103.1160 126.6740 C.ar 199 PHE199 -0.0615 3208 CE2 109.3680 100.8890 127.0100 C.ar 199 PHE199 -0.0615 3209 CZ 110.4010 101.7420 126.6540 C.ar 199 PHE199 -0.0617 3210 C 104.3190 103.1170 126.5750 C.2 199 PHE199 0.2190 3211 O 103.8880 102.0150 126.2180 O.2 199 PHE199 -0.2778 3212 H 105.6100 105.6120 126.2780 H 199 PHE199 0.1312 3213 HA 106.1490 102.7360 125.6160 H 199 PHE199 0.0560 3214 HB1 106.0740 102.6630 128.3370 H 199 PHE199 0.0333 3215 HB2 106.6430 104.2950 128.1430 H 199 PHE199 0.0333 3216 HD1 108.8220 104.7090 127.0060 H 199 PHE199 0.0620 3217 HD2 107.3220 100.7440 127.6010 H 199 PHE199 0.0620 3218 HE1 111.0110 103.7830 126.4040 H 199 PHE199 0.0618 3219 HE2 109.5220 99.8210 127.0000 H 199 PHE199 0.0618 3220 HZ 111.3490 101.3290 126.3520 H 199 PHE199 0.0618 3221 N 103.5470 104.0140 127.1920 N.am 200 CYS200 -0.2449 3222 CA 102.1870 103.6630 127.5880 C.3 200 CYS200 0.0965 3223 CB 101.5720 104.6920 128.5440 C.3 200 CYS200 0.0147 3224 SG 102.4930 104.8390 130.0990 S.3 200 CYS200 -0.1762 3225 C 101.2980 103.4200 126.3740 C.2 200 CYS200 0.2195 3226 O 100.6260 102.3870 126.2820 O.2 200 CYS200 -0.2778 3227 H 103.9090 104.9480 127.3870 H 200 CYS200 0.1312 3228 HA 102.2590 102.7130 128.1210 H 200 CYS200 0.0565 3229 HB1 100.5510 104.3970 128.7880 H 200 CYS200 0.0394 3230 HB2 101.4980 105.6690 128.0720 H 200 CYS200 0.0394 3231 HG 101.8710 105.6980 130.9110 H 200 CYS200 0.1017 3232 N 101.2860 104.3570 125.4240 N.am 201 MET201 -0.2456 3233 CA 100.3810 104.2460 124.2830 C.3 201 MET201 0.0888 3234 CB 99.8670 105.6170 123.7930 C.3 201 MET201 -0.0199 3235 CG 100.8130 106.4830 122.9500 C.3 201 MET201 -0.0047 3236 SD 101.0500 105.8300 121.2860 S.3 201 MET201 -0.1641 3237 CE 101.9450 107.2180 120.5700 C.3 201 MET201 -0.0181 3238 C 100.9070 103.3050 123.1940 C.2 201 MET201 0.2214 3239 O 100.1050 102.5610 122.6160 O.2 201 MET201 -0.2776 3240 H 101.9140 105.1580 125.4950 H 201 MET201 0.1312 3241 HA 99.4880 103.7460 124.6650 H 201 MET201 0.0557 3242 HB1 99.5620 106.1920 124.6680 H 201 MET201 0.0293 3243 HB2 98.9550 105.4620 123.2160 H 201 MET201 0.0293 3244 HG1 101.7700 106.6430 123.4370 H 201 MET201 0.0377 3245 HG2 100.3810 107.4800 122.8480 H 201 MET201 0.0377 3246 HE1 101.2740 107.8320 119.9710 H 201 MET201 0.0340 3247 HE2 102.7480 106.8510 119.9310 H 201 MET201 0.0340 3248 HE3 102.3990 107.8310 121.3460 H 201 MET201 0.0340 3249 N 102.2270 103.2840 122.8580 N.am 202 PRO202 -0.2316 3250 CA 102.6550 102.4090 121.7550 C.3 202 PRO202 0.0907 3251 CD 103.3230 104.1000 123.3640 C.3 202 PRO202 0.0071 3252 CB 104.0530 102.9340 121.3840 C.3 202 PRO202 -0.0276 3253 CG 104.1690 104.2720 122.1030 C.3 202 PRO202 -0.0379 3254 C 102.6870 100.9350 122.1260 C.2 202 PRO202 0.2189 3255 O 102.2420 100.0890 121.3440 O.2 202 PRO202 -0.2778 3256 HA 101.9630 102.5600 120.9240 H 202 PRO202 0.0559 3257 HD1 103.8430 103.5070 124.1080 H 202 PRO202 0.0431 3258 HD2 102.9980 105.0460 123.7810 H 202 PRO202 0.0431 3259 HB1 104.1850 103.0350 120.3070 H 202 PRO202 0.0285 3260 HB2 104.8430 102.2760 121.7460 H 202 PRO202 0.0285 3261 HG1 105.2020 104.5420 122.2980 H 202 PRO202 0.0278 3262 HG2 103.7430 105.0590 121.4820 H 202 PRO202 0.0278 3263 N 103.2170 100.6160 123.3100 N.am 203 LEU203 -0.2456 3264 CA 103.4270 99.2180 123.6760 C.3 203 LEU203 0.0880 3265 CB 104.3130 99.0750 124.9230 C.3 203 LEU203 -0.0266 3266 CG 105.8130 99.3300 124.6520 C.3 203 LEU203 -0.0449 3267 CD1 106.4710 98.1380 123.9440 C.3 203 LEU203 -0.0626 3268 CD2 106.0880 100.6120 123.8570 C.3 203 LEU203 -0.0626 3269 C 102.1080 98.4630 123.7820 C.2 203 LEU203 0.2187 3270 O 101.9720 97.3550 123.2510 O.2 203 LEU203 -0.2778 3271 H 103.4770 101.3550 123.9630 H 203 LEU203 0.1312 3272 HA 103.9530 98.7680 122.8350 H 203 LEU203 0.0557 3273 HB1 104.2130 98.0700 125.3350 H 203 LEU203 0.0287 3274 HB2 103.9470 99.7370 125.7040 H 203 LEU203 0.0287 3275 HG 106.2970 99.4390 125.6230 H 203 LEU203 0.0296 3276 HD11 107.5150 98.3590 123.7230 H 203 LEU203 0.0232 3277 HD12 105.9880 97.9140 122.9930 H 203 LEU203 0.0232 3278 HD13 106.4330 97.2390 124.5590 H 203 LEU203 0.0232 3279 HD21 107.1340 100.9090 123.9400 H 203 LEU203 0.0232 3280 HD22 105.4770 101.4410 124.2010 H 203 LEU203 0.0232 3281 HD23 105.8650 100.4680 122.8000 H 203 LEU203 0.0232 3282 N 101.1210 99.0450 124.4650 N.am 204 VAL204 -0.2454 3283 CA 99.8490 98.3500 124.6520 C.3 204 VAL204 0.0901 3284 CB 99.0010 99.0810 125.7160 C.3 204 VAL204 -0.0227 3285 CG1 99.7710 99.2210 127.0390 C.3 204 VAL204 -0.0608 3286 CG2 98.4780 100.4490 125.2400 C.3 204 VAL204 -0.0608 3287 C 99.1030 98.2420 123.3270 C.2 204 VAL204 0.2189 3288 O 98.3980 97.2600 123.0700 O.2 204 VAL204 -0.2778 3289 H 101.2540 99.9770 124.8580 H 204 VAL204 0.1312 3290 HA 100.0780 97.3400 124.9970 H 204 VAL204 0.0560 3291 HB 98.1280 98.4610 125.9240 H 204 VAL204 0.0315 3292 HG11 99.1360 99.6490 127.8150 H 204 VAL204 0.0233 3293 HG12 100.6410 99.8700 126.9360 H 204 VAL204 0.0233 3294 HG13 100.1190 98.2510 127.3950 H 204 VAL204 0.0233 3295 HG21 98.0330 101.0110 126.0610 H 204 VAL204 0.0233 3296 HG22 97.7090 100.3360 124.4750 H 204 VAL204 0.0233 3297 HG23 99.2740 101.0560 124.8100 H 204 VAL204 0.0233 3298 N 99.2500 99.2500 122.4620 N.am 205 CYS205 -0.2449 3299 CA 98.5390 99.2380 121.1880 C.3 205 CYS205 0.0965 3300 CB 98.6320 100.6330 120.5570 C.3 205 CYS205 0.0147 3301 SG 97.7630 100.7680 118.9710 S.3 205 CYS205 -0.1762 3302 C 99.1250 98.1980 120.2400 C.2 205 CYS205 0.2195 3303 O 98.3870 97.4680 119.5680 O.2 205 CYS205 -0.2778 3304 H 99.8630 100.0320 122.6940 H 205 CYS205 0.1312 3305 HA 97.4960 98.9850 121.3850 H 205 CYS205 0.0565 3306 HB1 99.6770 100.9090 120.4080 H 205 CYS205 0.0394 3307 HB2 98.2150 101.3710 121.2420 H 205 CYS205 0.0394 3308 HG 98.0690 101.9290 118.3870 H 205 CYS205 0.1017 3309 N 100.4550 98.1170 120.1710 N.am 206 THR206 -0.2434 3310 CA 101.0820 97.1600 119.2650 C.3 206 THR206 0.1135 3311 CB 102.5260 97.6200 118.9710 C.3 206 THR206 0.0763 3312 OG1 102.9700 97.0480 117.7500 O.3 206 THR206 -0.3900 3313 CG2 103.5140 97.3020 120.1080 C.3 206 THR206 -0.0370 3314 C 100.9870 95.7390 119.8090 C.2 206 THR206 0.2212 3315 O 101.0030 94.7720 119.0400 O.2 206 THR206 -0.2777 3316 H 101.0340 98.7240 120.7520 H 206 THR206 0.1313 3317 HA 100.5130 97.1810 118.3370 H 206 THR206 0.0583 3318 HB 102.4730 98.7100 118.8510 H 206 THR206 0.0611 3319 HG1 103.8340 97.3840 117.5310 H 206 THR206 0.2098 3320 HG21 104.4770 97.7900 119.9580 H 206 THR206 0.0255 3321 HG22 103.6940 96.2300 120.1900 H 206 THR206 0.0255 3322 HG23 103.1250 97.6470 121.0630 H 206 THR206 0.0255 3323 N 100.8870 95.5910 121.1320 N.am 207 ALA207 -0.2458 3324 CA 100.7890 94.2590 121.7200 C.3 207 ALA207 0.0850 3325 CB 101.0230 94.3710 123.2310 C.3 207 ALA207 -0.0411 3326 C 99.4300 93.6320 121.4380 C.2 207 ALA207 0.2184 3327 O 99.3440 92.4660 121.0350 O.2 207 ALA207 -0.2778 3328 H 100.8790 96.4140 121.7350 H 207 ALA207 0.1312 3329 HA 101.5610 93.6330 121.2670 H 207 ALA207 0.0554 3330 HB1 100.9480 93.3980 123.7180 H 207 ALA207 0.0249 3331 HB2 100.2990 95.0410 123.6970 H 207 ALA207 0.0249 3332 HB3 102.0180 94.7660 123.4370 H 207 ALA207 0.0249 3333 N 98.3530 94.3920 121.6470 N.am 208 ILE208 -0.2454 3334 CA 97.0150 93.8440 121.4420 C.3 208 ILE208 0.0903 3335 CB 95.9390 94.7160 122.1240 C.3 208 ILE208 -0.0201 3336 CG1 95.7940 96.1030 121.4690 C.3 208 ILE208 -0.0514 3337 CG2 96.2000 94.7950 123.6380 C.3 208 ILE208 -0.0605 3338 CD1 94.8680 97.0670 122.2180 C.3 208 ILE208 -0.0650 3339 C 96.7560 93.5950 119.9600 C.2 208 ILE208 0.2189 3340 O 96.1110 92.6080 119.5890 O.2 208 ILE208 -0.2778 3341 H 98.4650 95.3590 121.9510 H 208 ILE208 0.1312 3342 HA 97.0060 92.8660 121.9260 H 208 ILE208 0.0560 3343 HB 94.9820 94.2060 122.0030 H 208 ILE208 0.0318 3344 HG11 95.3860 95.9630 120.4700 H 208 ILE208 0.0266 3345 HG12 96.7690 96.5710 121.3440 H 208 ILE208 0.0266 3346 HG21 95.3760 95.2780 124.1620 H 208 ILE208 0.0233 3347 HG22 97.1090 95.3490 123.8660 H 208 ILE208 0.0233 3348 HG23 96.3090 93.7980 124.0660 H 208 ILE208 0.0233 3349 HD11 94.7250 97.9830 121.6460 H 208 ILE208 0.0230 3350 HD12 95.2870 97.3510 123.1840 H 208 ILE208 0.0230 3351 HD13 93.8880 96.6210 122.3880 H 208 ILE208 0.0230 3352 N 97.2490 94.4820 119.0910 N.am 209 PHE209 -0.2453 3353 CA 97.0500 94.2940 117.6580 C.3 209 PHE209 0.0917 3354 CB 97.5710 95.5440 116.9110 C.3 209 PHE209 -0.0036 3355 CG 96.5120 96.5950 116.6900 C.ar 209 PHE209 -0.0454 3356 CD1 95.8820 97.2240 117.7580 C.ar 209 PHE209 -0.0585 3357 CD2 96.1690 96.9750 115.3970 C.ar 209 PHE209 -0.0585 3358 CE1 94.9130 98.1930 117.5430 C.ar 209 PHE209 -0.0615 3359 CE2 95.1900 97.9340 115.1750 C.ar 209 PHE209 -0.0615 3360 CZ 94.5600 98.5460 116.2490 C.ar 209 PHE209 -0.0617 3361 C 97.8150 93.0790 117.1480 C.2 209 PHE209 0.2190 3362 O 97.2890 92.3000 116.3450 O.2 209 PHE209 -0.2778 3363 H 97.7660 95.2930 119.4310 H 209 PHE209 0.1312 3364 HA 95.9860 94.1360 117.4720 H 209 PHE209 0.0560 3365 HB1 97.9690 95.2740 115.9300 H 209 PHE209 0.0333 3366 HB2 98.4100 95.9880 117.4480 H 209 PHE209 0.0333 3367 HD1 96.1570 96.9740 118.7680 H 209 PHE209 0.0620 3368 HD2 96.6580 96.5110 114.5540 H 209 PHE209 0.0620 3369 HE1 94.4410 98.6780 118.3850 H 209 PHE209 0.0618 3370 HE2 94.9300 98.2140 114.1650 H 209 PHE209 0.0618 3371 HZ 93.8100 99.3050 116.0790 H 209 PHE209 0.0618 3372 N 99.0590 92.9020 117.6000 N.am 210 TYR210 -0.2453 3373 CA 99.8190 91.7170 117.2190 C.3 210 TYR210 0.0917 3374 CB 101.3270 91.8500 117.4950 C.3 210 TYR210 -0.0036 3375 CG 102.0460 92.7470 116.5110 C.ar 210 TYR210 -0.0453 3376 CD1 101.8360 92.6400 115.1350 C.ar 210 TYR210 -0.0561 3377 CD2 103.0040 93.6480 116.9640 C.ar 210 TYR210 -0.0561 3378 CE1 102.5290 93.4430 114.2410 C.ar 210 TYR210 -0.0317 3379 CE2 103.7140 94.4400 116.0710 C.ar 210 TYR210 -0.0317 3380 CZ 103.4670 94.3480 114.7090 C.ar 210 TYR210 0.0726 3381 OH 104.1310 95.1750 113.8250 O.3 210 TYR210 -0.3598 3382 C 99.2040 90.4540 117.8070 C.2 210 TYR210 0.2191 3383 O 99.1430 89.4170 117.1360 O.2 210 TYR210 -0.2778 3384 H 99.4800 93.5990 118.2150 H 210 TYR210 0.1312 3385 HA 99.6560 91.5960 116.1510 H 210 TYR210 0.0560 3386 HB1 101.8040 90.8710 117.4270 H 210 TYR210 0.0333 3387 HB2 101.4840 92.2020 118.5150 H 210 TYR210 0.0333 3388 HD1 101.1400 91.9200 114.7340 H 210 TYR210 0.0621 3389 HD2 103.2010 93.7370 118.0230 H 210 TYR210 0.0621 3390 HE1 102.3320 93.3630 113.1840 H 210 TYR210 0.0643 3391 HE2 104.4580 95.1280 116.4410 H 210 TYR210 0.0643 3392 HH 104.4210 95.9430 114.3070 H 210 TYR210 0.2173 3393 N 98.7480 90.5180 119.0610 N.am 211 THR211 -0.2434 3394 CA 98.0920 89.3640 119.6680 C.3 211 THR211 0.1135 3395 CB 97.8750 89.6410 121.1660 C.3 211 THR211 0.0763 3396 OG1 99.1650 89.7420 121.7470 O.3 211 THR211 -0.3900 3397 CG2 97.0860 88.5310 121.8830 C.3 211 THR211 -0.0370 3398 C 96.7900 89.0310 118.9500 C.2 211 THR211 0.2212 3399 O 96.4830 87.8550 118.7200 O.2 211 THR211 -0.2777 3400 H 98.8590 91.3790 119.5970 H 211 THR211 0.1313 3401 HA 98.7600 88.5110 119.5550 H 211 THR211 0.0583 3402 HB 97.3420 90.5950 121.2580 H 211 THR211 0.0611 3403 HG1 99.1140 90.0460 122.6480 H 211 THR211 0.2098 3404 HG21 96.9680 88.7430 122.9460 H 211 THR211 0.0255 3405 HG22 97.5950 87.5710 121.7900 H 211 THR211 0.0255 3406 HG23 96.0840 88.4200 121.4700 H 211 THR211 0.0255 3407 N 96.0080 90.0530 118.5940 N.am 212 LEU212 -0.2456 3408 CA 94.7800 89.8160 117.8440 C.3 212 LEU212 0.0880 3409 CB 94.0400 91.1570 117.6890 C.3 212 LEU212 -0.0266 3410 CG 93.2980 91.6140 118.9560 C.3 212 LEU212 -0.0449 3411 CD1 92.9530 93.1060 118.8660 C.3 212 LEU212 -0.0626 3412 CD2 92.0270 90.7840 119.1910 C.3 212 LEU212 -0.0626 3413 C 95.0800 89.2420 116.4650 C.2 212 LEU212 0.2187 3414 O 94.3800 88.3390 115.9940 O.2 212 LEU212 -0.2778 3415 H 96.2710 91.0050 118.8480 H 212 LEU212 0.1312 3416 HA 94.1850 89.0940 118.3990 H 212 LEU212 0.0557 3417 HB1 93.3180 91.1100 116.8760 H 212 LEU212 0.0287 3418 HB2 94.7620 91.9190 117.3880 H 212 LEU212 0.0287 3419 HG 93.9510 91.4780 119.8180 H 212 LEU212 0.0296 3420 HD11 92.4490 93.4490 119.7690 H 212 LEU212 0.0232 3421 HD12 92.2990 93.3090 118.0170 H 212 LEU212 0.0232 3422 HD13 93.8520 93.7120 118.7420 H 212 LEU212 0.0232 3423 HD21 91.5080 91.1170 120.0910 H 212 LEU212 0.0232 3424 HD22 92.2540 89.7270 119.3180 H 212 LEU212 0.0232 3425 HD23 91.3350 90.8810 118.3540 H 212 LEU212 0.0232 3426 N 96.1140 89.7620 115.8000 N.am 213 MET213 -0.2456 3427 CA 96.5010 89.2310 114.4970 C.3 213 MET213 0.0886 3428 CB 97.6320 90.1460 113.9870 C.3 213 MET213 -0.0199 3429 CG 98.1870 89.7970 112.6010 C.3 213 MET213 -0.0047 3430 SD 99.3750 88.4400 112.6520 S.3 213 MET213 -0.1641 3431 CE 100.7840 89.3040 113.3710 C.3 213 MET213 -0.0181 3432 C 96.9640 87.7830 114.6120 C.2 213 MET213 0.2188 3433 O 96.6050 86.9360 113.7850 O.2 213 MET213 -0.2778 3434 H 96.6380 90.5370 116.2060 H 213 MET213 0.1312 3435 HA 95.6300 89.2730 113.8410 H 213 MET213 0.0557 3436 HB1 98.4430 90.1690 114.7130 H 213 MET213 0.0293 3437 HB2 97.2580 91.1690 113.9570 H 213 MET213 0.0293 3438 HG1 98.6940 90.6680 112.1860 H 213 MET213 0.0377 3439 HG2 97.3830 89.5590 111.9060 H 213 MET213 0.0377 3440 HE1 101.6800 88.6860 113.3110 H 213 MET213 0.0340 3441 HE2 100.5900 89.5580 114.4130 H 213 MET213 0.0340 3442 HE3 100.9710 90.2310 112.8290 H 213 MET213 0.0340 3443 N 97.7670 87.4820 115.6350 N.am 214 THR214 -0.2434 3444 CA 98.2360 86.1140 115.8320 C.3 214 THR214 0.1135 3445 CB 99.3090 86.1030 116.9410 C.3 214 THR214 0.0763 3446 OG1 100.4340 86.8740 116.5590 O.3 214 THR214 -0.3900 3447 CG2 99.8520 84.6990 117.2350 C.3 214 THR214 -0.0370 3448 C 97.0810 85.1800 116.1750 C.2 214 THR214 0.2212 3449 O 96.9940 84.0630 115.6530 O.2 214 THR214 -0.2777 3450 H 98.0550 88.2140 116.2840 H 214 THR214 0.1313 3451 HA 98.6750 85.7850 114.8890 H 214 THR214 0.0583 3452 HB 98.8900 86.5060 117.8720 H 214 THR214 0.0611 3453 HG1 100.1650 87.7740 116.3860 H 214 THR214 0.2098 3454 HG21 100.6640 84.7460 117.9610 H 214 THR214 0.0255 3455 HG22 100.2390 84.2340 116.3280 H 214 THR214 0.0255 3456 HG23 99.0790 84.0530 117.6490 H 214 THR214 0.0255 3457 N 96.1810 85.6240 117.0570 N.am 215 CYS215 -0.2448 3458 CA 95.0430 84.7900 117.4360 C.3 215 CYS215 0.0965 3459 CB 94.3150 85.3850 118.6530 C.3 215 CYS215 0.0147 3460 SG 93.1200 86.7090 118.3170 S.3 215 CYS215 -0.1762 3461 C 94.1050 84.5610 116.2570 C.2 215 CYS215 0.2195 3462 O 93.6030 83.4480 116.0640 O.2 215 CYS215 -0.2778 3463 H 96.2890 86.5510 117.4680 H 215 CYS215 0.1312 3464 HA 95.4600 83.8210 117.7180 H 215 CYS215 0.0565 3465 HB1 95.0550 85.7580 119.3610 H 215 CYS215 0.0394 3466 HB2 93.7870 84.5890 119.1770 H 215 CYS215 0.0394 3467 HG 92.9500 87.4390 119.4220 H 215 CYS215 0.1017 3468 N 93.8530 85.6040 115.4610 N.am 216 GLU216 -0.2456 3469 CA 93.0020 85.4480 114.2860 C.3 216 GLU216 0.0883 3470 CB 92.7720 86.8440 113.7010 C.3 216 GLU216 -0.0193 3471 CG 91.7340 86.9060 112.5640 C.3 216 GLU216 0.0356 3472 CD 90.9210 88.2020 112.6840 C.2 216 GLU216 0.1760 3473 OE1 91.5110 89.2820 112.6790 O.co2 216 GLU216 -0.6478 3474 OE2 89.7000 88.1270 112.8130 O.co2 216 GLU216 -0.6478 3475 C 93.6410 84.5160 113.2650 C.2 216 GLU216 0.2187 3476 O 92.9480 83.7200 112.6190 O.2 216 GLU216 -0.2778 3477 H 94.2580 86.5150 115.6760 H 216 GLU216 0.1312 3478 HA 92.0560 85.0150 114.6150 H 216 GLU216 0.0557 3479 HB1 93.7110 87.2930 113.3720 H 216 GLU216 0.0290 3480 HB2 92.4390 87.4560 114.5350 H 216 GLU216 0.0290 3481 HG1 91.0450 86.0630 112.6170 H 216 GLU216 0.0374 3482 HG2 92.2130 86.8740 111.5860 H 216 GLU216 0.0374 3483 N 94.9620 84.6060 113.1000 N.am 217 MET217 -0.2456 3484 CA 95.6610 83.7240 112.1720 C.3 217 MET217 0.0885 3485 CB 97.1330 84.1640 112.1100 C.3 217 MET217 -0.0199 3486 CG 97.9370 83.4650 111.0020 C.3 217 MET217 -0.0047 3487 SD 99.7200 83.6210 111.2400 S.3 217 MET217 -0.1641 3488 CE 99.8390 85.4050 111.4700 C.3 217 MET217 -0.0181 3489 C 95.5730 82.2660 112.6090 C.2 217 MET217 0.2187 3490 O 95.4490 81.3730 111.7620 O.2 217 MET217 -0.2778 3491 H 95.4890 85.3000 113.6290 H 217 MET217 0.1312 3492 HA 95.1810 83.8390 111.1980 H 217 MET217 0.0557 3493 HB1 97.6060 83.9930 113.0770 H 217 MET217 0.0293 3494 HB2 97.1710 85.2420 111.9470 H 217 MET217 0.0293 3495 HG1 97.6630 83.8910 110.0360 H 217 MET217 0.0377 3496 HG2 97.7030 82.4010 110.9700 H 217 MET217 0.0377 3497 HE1 100.8590 85.7440 111.2930 H 217 MET217 0.0340 3498 HE2 99.5350 85.6780 112.4800 H 217 MET217 0.0340 3499 HE3 99.1890 85.9240 110.7640 H 217 MET217 0.0340 3500 N 95.6190 82.0060 113.9150 N.am 218 LEU218 -0.2456 3501 CA 95.5680 80.6510 114.4480 C.3 218 LEU218 0.0880 3502 CB 96.4660 80.6090 115.6980 C.3 218 LEU218 -0.0266 3503 CG 97.9370 80.9960 115.4310 C.3 218 LEU218 -0.0449 3504 CD1 98.6700 81.2440 116.7530 C.3 218 LEU218 -0.0626 3505 CD2 98.6680 79.9450 114.5830 C.3 218 LEU218 -0.0626 3506 C 94.1540 80.2090 114.8000 C.2 218 LEU218 0.2187 3507 O 93.9760 79.1180 115.3520 O.2 218 LEU218 -0.2778 3508 H 95.6930 82.7870 114.5670 H 218 LEU218 0.1312 3509 HA 95.9460 79.9610 113.6940 H 218 LEU218 0.0557 3510 HB1 96.4330 79.6190 116.1540 H 218 LEU218 0.0287 3511 HB2 96.0500 81.2960 116.4370 H 218 LEU218 0.0287 3512 HG 97.9640 81.9350 114.8790 H 218 LEU218 0.0296 3513 HD11 99.6650 81.6490 116.5770 H 218 LEU218 0.0232 3514 HD12 98.7640 80.3260 117.3350 H 218 LEU218 0.0232 3515 HD13 98.1290 81.9680 117.3640 H 218 LEU218 0.0232 3516 HD21 99.7020 80.2390 114.4020 H 218 LEU218 0.0232 3517 HD22 98.1940 79.8220 113.6100 H 218 LEU218 0.0232 3518 HD23 98.6740 78.9730 115.0770 H 218 LEU218 0.0232 3519 N 93.1660 80.9950 114.2860 N.am 219 ASN219 -0.2452 3520 CA 91.7150 80.9390 114.3070 C.3 219 ASN219 0.0957 3521 CB 91.2410 79.7510 113.4520 C.3 219 ASN219 0.0446 3522 CG 91.9840 79.6840 112.1080 C.2 219 ASN219 0.2000 3523 OD1 92.4770 78.6380 111.7020 O.2 219 ASN219 -0.2797 3524 ND2 92.0400 80.8500 111.4420 N.am 219 ASN219 -0.2723 3525 C 90.9930 80.9790 115.6380 C.2 219 ASN219 0.2191 3526 O 90.1980 80.0810 115.9180 O.2 219 ASN219 -0.2778 3527 H 93.5250 81.8000 113.7730 H 219 ASN219 0.1312 3528 HA 91.4170 81.8630 113.8090 H 219 ASN219 0.0562 3529 HB1 90.1710 79.8180 113.2510 H 219 ASN219 0.0375 3530 HB2 91.4180 78.8110 113.9750 H 219 ASN219 0.0375 3531 HD21 92.4940 80.9180 110.5550 H 219 ASN219 0.1266 3532 HD22 91.6290 81.6850 111.8120 H 219 ASN219 0.1266 3533 N 91.2330 82.0080 116.4900 N.am 220 ARG220 -0.2456 3534 CA 90.4220 82.2080 117.6690 C.3 220 ARG220 0.0879 3535 CB 91.0870 83.2190 118.6270 C.3 220 ARG220 -0.0258 3536 CG 91.1100 82.7740 120.1070 C.3 220 ARG220 -0.0154 3537 CD 89.8100 82.9890 120.9040 C.3 220 ARG220 0.1045 3538 NE 88.7240 82.1810 120.3580 N.pl3 220 ARG220 -0.4450 3539 CZ 87.5120 82.0350 120.8810 C.cat 220 ARG220 0.5062 3540 NH1 87.2010 82.5460 122.0430 N.pl3 220 ARG220 -0.4573 3541 NH2 86.6170 81.3650 120.2070 N.pl3 220 ARG220 -0.4573 3542 C 89.0500 82.6200 117.2100 C.2 220 ARG220 0.2187 3543 O 88.0500 82.1370 117.7390 O.2 220 ARG220 -0.2778 3544 H 92.0000 82.6510 116.2940 H 220 ARG220 0.1312 3545 HA 90.3490 81.2300 118.1470 H 220 ARG220 0.0557 3546 HB1 90.6660 84.2200 118.5240 H 220 ARG220 0.0286 3547 HB2 92.1270 83.3190 118.3160 H 220 ARG220 0.0286 3548 HG1 91.8980 83.3350 120.6120 H 220 ARG220 0.0299 3549 HG2 91.4140 81.7290 120.1730 H 220 ARG220 0.0299 3550 HD1 89.5020 84.0370 120.8720 H 220 ARG220 0.0711 3551 HD2 89.9600 82.7010 121.9480 H 220 ARG220 0.0711 3552 HE 88.8550 81.6840 119.5000 H 220 ARG220 0.3153 3553 HH11 86.2810 82.4320 122.4120 H 220 ARG220 0.3114 3554 HH12 87.8880 83.0490 122.5600 H 220 ARG220 0.3114 3555 HH21 85.7110 81.1910 120.5830 H 220 ARG220 0.3114 3556 HH22 86.8470 81.0260 119.2940 H 220 ARG220 0.3114 3557 N 88.9990 83.5160 116.1900 N.am 221 ARG221 -0.2457 3558 CA 87.7970 84.0750 115.6170 C.3 221 ARG221 0.0879 3559 CB 88.0930 85.4870 115.0750 C.3 221 ARG221 -0.0258 3560 CG 88.0170 86.5450 116.1880 C.3 221 ARG221 -0.0154 3561 CD 88.3460 87.9650 115.7090 C.3 221 ARG221 0.1045 3562 NE 89.7690 88.2430 115.8960 N.pl3 221 ARG221 -0.4450 3563 CZ 90.3460 89.3460 115.4300 C.cat 221 ARG221 0.5062 3564 NH1 89.6960 90.2210 114.7210 N.pl3 221 ARG221 -0.4573 3565 NH2 91.6040 89.5650 115.6650 N.pl3 221 ARG221 -0.4573 3566 C 87.2780 83.1470 114.5540 C.2 221 ARG221 0.2187 3567 O 88.0230 82.3990 113.9170 O.2 221 ARG221 -0.2778 3568 H 89.8880 83.8210 115.7940 H 221 ARG221 0.1312 3569 HA 87.0430 84.1230 116.4050 H 221 ARG221 0.0557 3570 HB1 87.3690 85.7560 114.3040 H 221 ARG221 0.0286 3571 HB2 89.0680 85.5100 114.5860 H 221 ARG221 0.0286 3572 HG1 88.6660 86.2730 117.0210 H 221 ARG221 0.0299 3573 HG2 87.0010 86.5430 116.5840 H 221 ARG221 0.0299 3574 HD1 87.7960 88.7080 116.2900 H 221 ARG221 0.0711 3575 HD2 88.0820 88.0930 114.6550 H 221 ARG221 0.0711 3576 HE 90.3910 87.6130 116.3450 H 221 ARG221 0.3153 3577 HH11 90.1680 91.0440 114.4170 H 221 ARG221 0.3114 3578 HH12 88.7640 90.0310 114.4380 H 221 ARG221 0.3114 3579 HH21 91.9790 90.3980 115.2620 H 221 ARG221 0.3114 3580 HH22 92.1780 88.9390 116.1790 H 221 ARG221 0.3114 3581 N 85.9460 83.1720 114.3430 N.am 222 ASN222 -0.2452 3582 CA 85.3130 82.2950 113.3950 C.3 222 ASN222 0.0957 3583 CB 83.7870 82.3900 113.5520 C.3 222 ASN222 0.0446 3584 CG 83.3430 81.8840 114.9350 C.2 222 ASN222 0.2000 3585 OD1 83.7420 82.3970 115.9730 O.2 222 ASN222 -0.2797 3586 ND2 82.4930 80.8470 114.8880 N.am 222 ASN222 -0.2723 3587 C 85.7130 82.6760 112.0060 C.2 222 ASN222 0.2189 3588 O 85.6600 83.8400 111.6110 O.2 222 ASN222 -0.2778 3589 H 85.3720 83.8300 114.8700 H 222 ASN222 0.1312 3590 HA 85.6610 81.2810 113.6040 H 222 ASN222 0.0562 3591 HB1 83.2830 81.8050 112.7810 H 222 ASN222 0.0375 3592 HB2 83.4510 83.4220 113.4410 H 222 ASN222 0.0375 3593 HD21 82.1480 80.4580 115.7420 H 222 ASN222 0.1266 3594 HD22 82.1910 80.4530 114.0210 H 222 ASN222 0.1266 3595 N 86.1250 81.6720 111.2140 N.am 223 GLY223 -0.2485 3596 CA 86.4940 81.9510 109.8620 C.3 223 GLY223 0.0765 3597 C 87.9510 81.7100 109.6760 C.2 223 GLY223 0.2156 3598 O 88.8050 82.1400 110.4530 O.2 223 GLY223 -0.2781 3599 H 86.1740 80.7190 111.5750 H 223 GLY223 0.1309 3600 HA1 86.2590 82.9750 109.5660 H 223 GLY223 0.0521 3601 HA2 85.9120 81.2760 109.2340 H 223 GLY223 0.0521 3602 N 88.2530 80.9850 108.5870 N.am 224 SER224 -0.2439 3603 CA 89.6060 80.7000 108.2370 C.3 224 SER224 0.1109 3604 CB 90.1160 79.6000 109.1780 C.3 224 SER224 0.0681 3605 OG 91.4970 79.3270 108.9660 O.3 224 SER224 -0.3930 3606 C 89.6040 80.2120 106.8360 C.2 224 SER224 0.2209 3607 O 88.6110 79.6870 106.3370 O.2 224 SER224 -0.2777 3608 H 87.4990 80.6310 107.9980 H 224 SER224 0.1312 3609 HA 90.1890 81.6200 108.3140 H 224 SER224 0.0580 3610 HB1 89.5410 78.6810 109.0250 H 224 SER224 0.0577 3611 HB2 89.9190 79.9180 110.2090 H 224 SER224 0.0577 3612 HG 91.8650 78.8920 109.7330 H 224 SER224 0.2095 3613 N 90.7550 80.3870 106.1680 N.am 225 LEU225 -0.2456 3614 CA 90.9780 79.7940 104.8880 C.3 225 LEU225 0.0880 3615 CB 91.6960 80.7770 103.9460 C.3 225 LEU225 -0.0266 3616 CG 90.8280 81.9500 103.4560 C.3 225 LEU225 -0.0449 3617 CD1 90.4610 82.9250 104.5830 C.3 225 LEU225 -0.0626 3618 CD2 91.5440 82.7070 102.3290 C.3 225 LEU225 -0.0626 3619 C 91.8870 78.6640 105.2350 C.2 225 LEU225 0.2187 3620 O 92.5500 78.7200 106.2740 O.2 225 LEU225 -0.2778 3621 H 91.4900 80.9580 106.5850 H 225 LEU225 0.1312 3622 HA 90.0490 79.4180 104.4540 H 225 LEU225 0.0557 3623 HB1 92.0390 80.2260 103.0690 H 225 LEU225 0.0287 3624 HB2 92.5950 81.1690 104.4240 H 225 LEU225 0.0287 3625 HG 89.9030 81.5480 103.0410 H 225 LEU225 0.0296 3626 HD11 90.0120 83.8200 104.1700 H 225 LEU225 0.0232 3627 HD12 91.3370 83.2310 105.1550 H 225 LEU225 0.0232 3628 HD13 89.7250 82.5090 105.2680 H 225 LEU225 0.0232 3629 HD21 90.9210 83.5120 101.9380 H 225 LEU225 0.0232 3630 HD22 91.7820 82.0440 101.4970 H 225 LEU225 0.0232 3631 HD23 92.4760 83.1500 102.6810 H 225 LEU225 0.0232 3632 N 91.8850 77.5680 104.4510 N.am 226 ARG226 -0.2457 3633 CA 92.7910 76.5300 104.8440 C.3 226 ARG226 0.0879 3634 CB 91.9730 75.3150 105.3440 C.3 226 ARG226 -0.0258 3635 CG 91.1030 75.5310 106.5990 C.3 226 ARG226 -0.0154 3636 CD 91.8510 75.3900 107.9330 C.3 226 ARG226 0.1045 3637 NE 92.5850 76.6150 108.2200 N.pl3 226 ARG226 -0.4450 3638 CZ 93.2700 76.8630 109.3270 C.cat 226 ARG226 0.5062 3639 NH1 93.3270 76.0010 110.3060 N.pl3 226 ARG226 -0.4573 3640 NH2 93.8890 78.0050 109.4320 N.pl3 226 ARG226 -0.4573 3641 C 93.5640 76.0670 103.6590 C.2 226 ARG226 0.2187 3642 O 93.0290 75.7610 102.5940 O.2 226 ARG226 -0.2778 3643 H 91.2800 77.4830 103.6340 H 226 ARG226 0.1312 3644 HA 93.5120 76.8410 105.6010 H 226 ARG226 0.0557 3645 HB1 92.6310 74.4610 105.5180 H 226 ARG226 0.0286 3646 HB2 91.3050 75.0030 104.5380 H 226 ARG226 0.0286 3647 HG1 90.3270 74.7640 106.5860 H 226 ARG226 0.0299 3648 HG2 90.5670 76.4800 106.5540 H 226 ARG226 0.0299 3649 HD1 92.5510 74.5500 107.9160 H 226 ARG226 0.0711 3650 HD2 91.1360 75.2360 108.7450 H 226 ARG226 0.0711 3651 HE 92.5610 77.3570 107.5520 H 226 ARG226 0.3153 3652 HH11 93.8040 76.2360 111.1500 H 226 ARG226 0.3114 3653 HH12 92.8830 75.1150 110.2100 H 226 ARG226 0.3114 3654 HH21 94.3880 78.2340 110.2650 H 226 ARG226 0.3114 3655 HH22 93.8340 78.6590 108.6790 H 226 ARG226 0.3114 3656 N 94.8900 75.9850 103.8620 N.am 227 ILE227 -0.2454 3657 CA 95.8430 75.4750 102.9150 C.3 227 ILE227 0.0903 3658 CB 96.8750 76.5750 102.5610 C.3 227 ILE227 -0.0201 3659 CG1 96.1820 77.7910 101.9090 C.3 227 ILE227 -0.0514 3660 CG2 98.0030 76.0410 101.6560 C.3 227 ILE227 -0.0605 3661 CD1 97.0920 79.0180 101.7690 C.3 227 ILE227 -0.0650 3662 C 96.4180 74.3440 103.7140 C.2 227 ILE227 0.2189 3663 O 96.1160 74.2540 104.9040 O.2 227 ILE227 -0.2778 3664 H 95.2490 76.3110 104.7600 H 227 ILE227 0.1312 3665 HA 95.3300 75.0830 102.0350 H 227 ILE227 0.0560 3666 HB 97.3340 76.9190 103.4890 H 227 ILE227 0.0318 3667 HG11 95.3200 78.0950 102.5020 H 227 ILE227 0.0266 3668 HG12 95.7880 77.5110 100.9320 H 227 ILE227 0.0266 3669 HG21 98.6700 76.8340 101.3250 H 227 ILE227 0.0233 3670 HG22 97.6000 75.5590 100.7660 H 227 ILE227 0.0233 3671 HG23 98.6340 75.3210 102.1760 H 227 ILE227 0.0233 3672 HD11 96.5260 79.8760 101.4050 H 227 ILE227 0.0230 3673 HD12 97.9020 78.8450 101.0610 H 227 ILE227 0.0230 3674 HD13 97.5340 79.2920 102.7270 H 227 ILE227 0.0230 3675 N 97.2230 73.4280 103.1180 N.am 228 ALA228 -0.2459 3676 CA 97.8140 72.3440 103.8740 C.3 228 ALA228 0.0850 3677 CB 98.6870 71.4960 102.9420 C.3 228 ALA228 -0.0411 3678 C 98.6390 72.9420 104.9780 C.2 228 ALA228 0.2184 3679 O 99.5780 73.7000 104.7300 O.2 228 ALA228 -0.2778 3680 H 97.4150 73.5050 102.1190 H 228 ALA228 0.1312 3681 HA 96.9980 71.7510 104.2890 H 228 ALA228 0.0554 3682 HB1 99.1510 70.6670 103.4770 H 228 ALA228 0.0249 3683 HB2 99.4830 72.0900 102.4900 H 228 ALA228 0.0249 3684 HB3 98.0920 71.0740 102.1320 H 228 ALA228 0.0249 3685 N 98.2460 72.6250 106.2380 N.am 229 LEU229 -0.2457 3686 CA 98.7820 73.1610 107.4690 C.3 229 LEU229 0.0880 3687 CB 97.7600 72.8820 108.5900 C.3 229 LEU229 -0.0266 3688 CG 96.3460 73.4400 108.3150 C.3 229 LEU229 -0.0449 3689 CD1 95.3870 73.0530 109.4490 C.3 229 LEU229 -0.0626 3690 CD2 96.3390 74.9630 108.1110 C.3 229 LEU229 -0.0626 3691 C 100.1720 72.7280 107.8950 C.2 229 LEU229 0.2187 3692 O 100.9390 73.5900 108.3460 O.2 229 LEU229 -0.2778 3693 H 97.4960 71.9390 106.3250 H 229 LEU229 0.1312 3694 HA 98.8500 74.2360 107.3100 H 229 LEU229 0.0557 3695 HB1 98.1180 73.2830 109.5370 H 229 LEU229 0.0287 3696 HB2 97.6890 71.8030 108.7370 H 229 LEU229 0.0287 3697 HG 95.9600 72.9820 107.4040 H 229 LEU229 0.0296 3698 HD11 94.3730 73.3920 109.2390 H 229 LEU229 0.0232 3699 HD12 95.7000 73.4920 110.3970 H 229 LEU229 0.0232 3700 HD13 95.3520 71.9710 109.5790 H 229 LEU229 0.0232 3701 HD21 95.3250 75.3240 107.9410 H 229 LEU229 0.0232 3702 HD22 96.9260 75.2550 107.2410 H 229 LEU229 0.0232 3703 HD23 96.7410 75.4810 108.9810 H 229 LEU229 0.0232 3704 N 100.5650 71.4400 107.7320 N.am 230 SER230 -0.2436 3705 CA 101.7810 70.9350 108.3570 C.3 230 SER230 0.1109 3706 CB 101.9800 69.4680 107.9510 C.3 230 SER230 0.0681 3707 OG 100.8150 68.7250 108.2910 O.3 230 SER230 -0.3930 3708 C 103.0180 71.7430 108.0060 C.2 230 SER230 0.2209 3709 O 103.8430 72.0100 108.8830 O.2 230 SER230 -0.2777 3710 H 99.9980 70.8130 107.1610 H 230 SER230 0.1312 3711 HA 101.6260 70.9990 109.4340 H 230 SER230 0.0580 3712 HB1 102.8550 69.0600 108.4690 H 230 SER230 0.0577 3713 HB2 102.1620 69.4040 106.8720 H 230 SER230 0.0577 3714 HG 100.9160 67.8020 108.0720 H 230 SER230 0.2095 3715 N 103.1710 72.1430 106.7460 N.am 231 GLU231 -0.2456 3716 CA 104.3180 72.9270 106.3110 C.3 231 GLU231 0.0883 3717 CB 104.5800 72.5070 104.8440 C.3 231 GLU231 -0.0193 3718 CG 105.8130 73.1230 104.1410 C.3 231 GLU231 0.0356 3719 CD 105.5840 74.5330 103.5630 C.2 231 GLU231 0.1760 3720 OE1 104.4750 74.8290 103.1270 O.co2 231 GLU231 -0.6478 3721 OE2 106.5230 75.3250 103.5650 O.co2 231 GLU231 -0.6478 3722 C 104.0820 74.4290 106.4080 C.2 231 GLU231 0.2187 3723 O 105.0010 75.2050 106.1270 O.2 231 GLU231 -0.2778 3724 H 102.4590 71.8910 106.0600 H 231 GLU231 0.1312 3725 HA 105.1820 72.6720 106.9260 H 231 GLU231 0.0557 3726 HB1 103.6860 72.6770 104.2420 H 231 GLU231 0.0290 3727 HB2 104.7190 71.4250 104.8410 H 231 GLU231 0.0290 3728 HG1 106.1020 72.4970 103.2980 H 231 GLU231 0.0374 3729 HG2 106.6650 73.1510 104.8190 H 231 GLU231 0.0374 3730 N 102.8820 74.8550 106.7970 N.am 232 HIS232 -0.2453 3731 CA 102.5660 76.2720 106.9240 C.3 232 HIS232 0.0932 3732 ND1 100.7340 77.8490 104.2750 N.ar 232 HIS232 -0.2469 3733 CG 101.1830 76.7110 104.8580 C.ar 232 HIS232 0.0551 3734 CB 101.1440 76.4600 106.3490 C.3 232 HIS232 0.0146 3735 NE2 101.4820 76.4920 102.6740 N.ar 232 HIS232 -0.2539 3736 CD2 101.6520 75.8540 103.8520 C.ar 232 HIS232 0.0047 3737 CE1 100.9350 77.6840 102.9540 C.ar 232 HIS232 0.0737 3738 C 102.5620 76.7590 108.3650 C.2 232 HIS232 0.2190 3739 O 102.7940 77.9490 108.6040 O.2 232 HIS232 -0.2778 3740 H 102.1600 74.1670 107.0130 H 232 HIS232 0.1312 3741 HA 103.2940 76.8610 106.3620 H 232 HIS232 0.0561 3742 HB1 100.6140 77.2930 106.8120 H 232 HIS232 0.0348 3743 HB2 100.5340 75.5770 106.5380 H 232 HIS232 0.0348 3744 HE2 101.7620 76.1480 101.7980 H 232 HIS232 0.1339 3745 HD2 102.0900 74.8750 103.9890 H 232 HIS232 0.0764 3746 HE1 100.6980 78.4140 102.1940 H 232 HIS232 0.0963 3747 N 102.3030 75.8710 109.3270 N.am 233 LEU233 -0.2456 3748 CA 102.2820 76.2790 110.7280 C.3 233 LEU233 0.0880 3749 CB 101.6860 75.1570 111.5970 C.3 233 LEU233 -0.0266 3750 CG 100.1930 75.3670 111.9230 C.3 233 LEU233 -0.0449 3751 CD1 99.9900 76.4770 112.9660 C.3 233 LEU233 -0.0626 3752 CD2 99.3430 75.6250 110.6710 C.3 233 LEU233 -0.0626 3753 C 103.6610 76.7290 111.1950 C.2 233 LEU233 0.2187 3754 O 103.7790 77.6660 111.9930 O.2 233 LEU233 -0.2778 3755 H 102.1180 74.8990 109.0810 H 233 LEU233 0.1312 3756 HA 101.6520 77.1660 110.7850 H 233 LEU233 0.0557 3757 HB1 102.2300 75.0600 112.5380 H 233 LEU233 0.0287 3758 HB2 101.8200 74.2000 111.0900 H 233 LEU233 0.0287 3759 HG 99.8370 74.4380 112.3710 H 233 LEU233 0.0296 3760 HD11 98.9390 76.5620 113.2440 H 233 LEU233 0.0232 3761 HD12 100.3110 77.4480 112.5900 H 233 LEU233 0.0232 3762 HD13 100.5540 76.2680 113.8740 H 233 LEU233 0.0232 3763 HD21 98.2790 75.5760 110.9060 H 233 LEU233 0.0232 3764 HD22 99.5480 74.8830 109.9030 H 233 LEU233 0.0232 3765 HD23 99.5400 76.6050 110.2390 H 233 LEU233 0.0232 3766 N 104.7170 76.0660 110.7150 N.am 234 LYS234 -0.2457 3767 CA 106.0710 76.4470 111.1040 C.3 234 LYS234 0.0878 3768 CB 107.0440 75.4830 110.3960 C.3 234 LYS234 -0.0289 3769 CG 108.5390 75.7660 110.6620 C.3 234 LYS234 -0.0496 3770 CD 109.4660 75.2690 109.5410 C.3 234 LYS234 -0.0278 3771 CE 109.3700 76.0920 108.2430 C.3 234 LYS234 0.1103 3772 NZ 109.8100 77.4760 108.3960 N.4 234 LYS234 -0.0749 3773 C 106.3990 77.8630 110.6460 C.2 234 LYS234 0.2187 3774 O 107.0240 78.6340 111.3840 O.2 234 LYS234 -0.2778 3775 H 104.5760 75.2870 110.0720 H 234 LYS234 0.1312 3776 HA 106.1550 76.3800 112.1900 H 234 LYS234 0.0557 3777 HB1 106.8440 75.5230 109.3250 H 234 LYS234 0.0285 3778 HB2 106.8190 74.4560 110.6860 H 234 LYS234 0.0285 3779 HG1 108.8210 75.2940 111.6040 H 234 LYS234 0.0266 3780 HG2 108.7320 76.8260 110.8100 H 234 LYS234 0.0266 3781 HD1 109.2490 74.2210 109.3290 H 234 LYS234 0.0282 3782 HD2 110.4970 75.2980 109.8960 H 234 LYS234 0.0282 3783 HE1 108.3520 76.1010 107.8540 H 234 LYS234 0.0559 3784 HE2 109.9930 75.6360 107.4710 H 234 LYS234 0.0559 3785 HZ1 109.7610 78.0200 107.5150 H 234 LYS234 0.2742 3786 HZ2 110.7590 77.5490 108.8210 H 234 LYS234 0.2742 3787 HZ3 109.2430 77.9990 109.0970 H 234 LYS234 0.2742 3788 N 105.9910 78.2210 109.4260 N.am 235 GLN235 -0.2456 3789 CA 106.2140 79.5790 108.9410 C.3 235 GLN235 0.0882 3790 CB 105.7270 79.6620 107.4700 C.3 235 GLN235 -0.0210 3791 CG 106.0480 78.4590 106.5510 C.3 235 GLN235 0.0225 3792 CD 107.5360 78.3090 106.2240 C.2 235 GLN235 0.1981 3793 OE1 108.3960 78.9950 106.7570 O.2 235 GLN235 -0.2798 3794 NE2 107.7850 77.3640 105.3100 N.am 235 GLN235 -0.2724 3795 C 105.4330 80.5930 109.7670 C.2 235 GLN235 0.2187 3796 O 105.9280 81.6910 110.0470 O.2 235 GLN235 -0.2778 3797 H 105.5200 77.5410 108.8290 H 235 GLN235 0.1312 3798 HA 107.2830 79.7900 109.0170 H 235 GLN235 0.0557 3799 HB1 106.1050 80.5800 107.0170 H 235 GLN235 0.0289 3800 HB2 104.6410 79.7590 107.4610 H 235 GLN235 0.0289 3801 HG1 105.5260 78.5810 105.6010 H 235 GLN235 0.0356 3802 HG2 105.6880 77.5190 106.9660 H 235 GLN235 0.0356 3803 HE21 108.7030 77.1750 104.9670 H 235 GLN235 0.1266 3804 HE22 107.0490 76.8050 104.9130 H 235 GLN235 0.1266 3805 N 104.2040 80.2460 110.1600 N.am 236 ARG236 -0.2457 3806 CA 103.4080 81.1480 110.9870 C.3 236 ARG236 0.0879 3807 CB 101.9480 80.6930 110.8680 C.3 236 ARG236 -0.0258 3808 CG 101.4620 81.0370 109.4360 C.3 236 ARG236 -0.0154 3809 CD 100.3690 80.1370 108.8540 C.3 236 ARG236 0.1045 3810 NE 100.0920 80.5310 107.4660 N.pl3 236 ARG236 -0.4450 3811 CZ 100.8490 80.2240 106.4060 C.cat 236 ARG236 0.5062 3812 NH1 101.9620 79.5520 106.5090 N.pl3 236 ARG236 -0.4573 3813 NH2 100.4700 80.6020 105.2160 N.pl3 236 ARG236 -0.4573 3814 C 104.0470 81.3530 112.3550 C.2 236 ARG236 0.2187 3815 O 103.9900 82.4530 112.9170 O.2 236 ARG236 -0.2778 3816 H 103.8190 79.3440 109.8800 H 236 ARG236 0.1312 3817 HA 103.4660 82.1240 110.5050 H 236 ARG236 0.0557 3818 HB1 101.3190 81.1890 111.6070 H 236 ARG236 0.0286 3819 HB2 101.8850 79.6210 111.0590 H 236 ARG236 0.0286 3820 HG1 102.3000 81.0010 108.7410 H 236 ARG236 0.0299 3821 HG2 101.1320 82.0750 109.4110 H 236 ARG236 0.0299 3822 HD1 99.4400 80.2480 109.4170 H 236 ARG236 0.0711 3823 HD2 100.6400 79.0790 108.8760 H 236 ARG236 0.0711 3824 HE 99.2810 81.0760 107.2640 H 236 ARG236 0.3153 3825 HH11 102.4740 79.3020 105.6870 H 236 ARG236 0.3114 3826 HH12 102.3060 79.2740 107.4040 H 236 ARG236 0.3114 3827 HH21 101.0070 80.3020 104.4270 H 236 ARG236 0.3114 3828 HH22 99.6640 81.1680 105.0810 H 236 ARG236 0.3114 3829 N 104.6440 80.3000 112.9180 N.am 237 ARG237 -0.2457 3830 CA 105.3190 80.4400 114.2040 C.3 237 ARG237 0.0879 3831 CB 105.6960 79.0430 114.7270 C.3 237 ARG237 -0.0258 3832 CG 104.4960 78.2300 115.2440 C.3 237 ARG237 -0.0154 3833 CD 104.1910 78.4700 116.7340 C.3 237 ARG237 0.1045 3834 NE 103.8340 79.8690 116.9940 N.pl3 237 ARG237 -0.4450 3835 CZ 102.6120 80.3800 116.8590 C.cat 237 ARG237 0.5062 3836 NH1 101.6000 79.6330 116.5050 N.pl3 237 ARG237 -0.4573 3837 NH2 102.4210 81.6530 117.0830 N.pl3 237 ARG237 -0.4573 3838 C 106.5570 81.3200 114.0870 C.2 237 ARG237 0.2187 3839 O 106.8430 82.1240 114.9820 O.2 237 ARG237 -0.2778 3840 H 104.6280 79.3950 112.4480 H 237 ARG237 0.1312 3841 HA 104.6330 80.9510 114.8750 H 237 ARG237 0.0557 3842 HB1 106.4480 79.1110 115.5150 H 237 ARG237 0.0286 3843 HB2 106.1770 78.4930 113.9150 H 237 ARG237 0.0286 3844 HG1 104.7230 77.1700 115.1180 H 237 ARG237 0.0299 3845 HG2 103.6130 78.4160 114.6320 H 237 ARG237 0.0299 3846 HD1 105.0750 78.2530 117.3380 H 237 ARG237 0.0711 3847 HD2 103.3990 77.8130 117.1010 H 237 ARG237 0.0711 3848 HE 104.5570 80.4930 117.2890 H 237 ARG237 0.3153 3849 HH11 100.6880 80.0260 116.4140 H 237 ARG237 0.3114 3850 HH12 101.7500 78.6640 116.3290 H 237 ARG237 0.3114 3851 HH21 101.5110 82.0500 116.9940 H 237 ARG237 0.3114 3852 HH22 103.1860 82.2370 117.3460 H 237 ARG237 0.3114 3853 N 107.3060 81.1790 112.9920 N.am 238 GLU238 -0.2456 3854 CA 108.5310 81.9560 112.8250 C.3 238 GLU238 0.0883 3855 CB 109.2470 81.4420 111.5670 C.3 238 GLU238 -0.0193 3856 CG 109.8630 80.0430 111.7740 C.3 238 GLU238 0.0356 3857 CD 110.2250 79.3360 110.4580 C.2 238 GLU238 0.1760 3858 OE1 109.8290 79.7770 109.3850 O.co2 238 GLU238 -0.6478 3859 OE2 110.9020 78.3130 110.4890 O.co2 238 GLU238 -0.6478 3860 C 108.2310 83.4460 112.7100 C.2 238 GLU238 0.2187 3861 O 108.9080 84.2760 113.3280 O.2 238 GLU238 -0.2778 3862 H 107.0200 80.5230 112.2650 H 238 GLU238 0.1312 3863 HA 109.1530 81.7990 113.7070 H 238 GLU238 0.0557 3864 HB1 110.0390 82.1280 111.2620 H 238 GLU238 0.0290 3865 HB2 108.5270 81.4250 110.7480 H 238 GLU238 0.0290 3866 HG1 109.1750 79.3890 112.3050 H 238 GLU238 0.0374 3867 HG2 110.7610 80.1130 112.3860 H 238 GLU238 0.0374 3868 N 107.2180 83.8060 111.9190 N.am 239 VAL239 -0.2454 3869 CA 106.8780 85.2170 111.7580 C.3 239 VAL239 0.0901 3870 CB 105.9690 85.4450 110.5340 C.3 239 VAL239 -0.0227 3871 CG1 104.5850 84.8060 110.6840 C.3 239 VAL239 -0.0608 3872 CG2 105.8430 86.9380 110.1940 C.3 239 VAL239 -0.0608 3873 C 106.2890 85.7790 113.0480 C.2 239 VAL239 0.2189 3874 O 106.5480 86.9320 113.4120 O.2 239 VAL239 -0.2778 3875 H 106.6800 83.0930 111.4260 H 239 VAL239 0.1312 3876 HA 107.8180 85.7320 111.5640 H 239 VAL239 0.0560 3877 HB 106.4570 84.9620 109.6870 H 239 VAL239 0.0315 3878 HG11 104.0220 84.8610 109.7530 H 239 VAL239 0.0233 3879 HG12 103.9940 85.2910 111.4610 H 239 VAL239 0.0233 3880 HG13 104.6920 83.7600 110.9480 H 239 VAL239 0.0233 3881 HG21 105.2740 87.0830 109.2750 H 239 VAL239 0.0233 3882 HG22 106.8250 87.3910 110.0510 H 239 VAL239 0.0233 3883 HG23 105.3360 87.4860 110.9880 H 239 VAL239 0.0233 3884 N 105.4930 84.9790 113.7620 N.am 240 ALA240 -0.2459 3885 CA 104.9220 85.4440 115.0220 C.3 240 ALA240 0.0850 3886 CB 103.9160 84.4030 115.5240 C.3 240 ALA240 -0.0411 3887 C 106.0060 85.6960 116.0610 C.2 240 ALA240 0.2184 3888 O 105.9430 86.6780 116.8110 O.2 240 ALA240 -0.2778 3889 H 105.2830 84.0390 113.4250 H 240 ALA240 0.1312 3890 HA 104.4130 86.3890 114.8200 H 240 ALA240 0.0554 3891 HB1 103.4460 84.7250 116.4550 H 240 ALA240 0.0249 3892 HB2 104.3970 83.4390 115.6940 H 240 ALA240 0.0249 3893 HB3 103.1240 84.2530 114.7900 H 240 ALA240 0.0249 3894 N 107.0060 84.8140 116.1270 N.am 241 LYS241 -0.2457 3895 CA 108.0740 84.9730 117.1100 C.3 241 LYS241 0.0878 3896 CB 108.9710 83.7160 117.0610 C.3 241 LYS241 -0.0289 3897 CG 109.9810 83.5380 118.2200 C.3 241 LYS241 -0.0496 3898 CD 111.0880 84.6060 118.3080 C.3 241 LYS241 -0.0278 3899 CE 112.2840 84.2020 119.1790 C.3 241 LYS241 0.1103 3900 NZ 113.2560 85.2930 119.3280 N.4 241 LYS241 -0.0749 3901 C 108.9050 86.2200 116.8310 C.2 241 LYS241 0.2187 3902 O 109.2440 86.9720 117.7520 O.2 241 LYS241 -0.2778 3903 H 107.0240 84.0220 115.4850 H 241 LYS241 0.1312 3904 HA 107.6010 85.0730 118.0890 H 241 LYS241 0.0557 3905 HB1 109.4950 83.6710 116.1040 H 241 LYS241 0.0285 3906 HB2 108.3180 82.8430 117.0640 H 241 LYS241 0.0285 3907 HG1 110.4520 82.5620 118.0940 H 241 LYS241 0.0266 3908 HG2 109.4450 83.4880 119.1690 H 241 LYS241 0.0266 3909 HD1 110.6710 85.5070 118.7480 H 241 LYS241 0.0282 3910 HD2 111.4350 84.8630 117.3050 H 241 LYS241 0.0282 3911 HE1 112.7960 83.3390 118.7480 H 241 LYS241 0.0559 3912 HE2 111.9440 83.9130 120.1760 H 241 LYS241 0.0559 3913 HZ1 114.0450 84.9890 119.9350 H 241 LYS241 0.2742 3914 HZ2 112.7990 86.1240 119.7590 H 241 LYS241 0.2742 3915 HZ3 113.6300 85.5650 118.3950 H 241 LYS241 0.2742 3916 N 109.2440 86.4580 115.5610 N.am 242 THR242 -0.2434 3917 CA 110.1000 87.5960 115.2360 C.3 242 THR242 0.1135 3918 CB 110.7760 87.3800 113.8750 C.3 242 THR242 0.0763 3919 OG1 111.8670 88.2790 113.7710 O.3 242 THR242 -0.3900 3920 CG2 109.7990 87.5230 112.7060 C.3 242 THR242 -0.0370 3921 C 109.3350 88.9120 115.3230 C.2 242 THR242 0.2212 3922 O 109.9320 89.9670 115.5680 O.2 242 THR242 -0.2777 3923 H 108.9050 85.8460 114.8190 H 242 THR242 0.1313 3924 HA 110.8860 87.6320 115.9910 H 242 THR242 0.0583 3925 HB 111.1690 86.3580 113.8760 H 242 THR242 0.0611 3926 HG1 112.2560 88.2340 112.9030 H 242 THR242 0.2098 3927 HG21 110.2140 87.0860 111.8040 H 242 THR242 0.0255 3928 HG22 109.5440 88.5650 112.5080 H 242 THR242 0.0255 3929 HG23 108.8800 86.9900 112.9200 H 242 THR242 0.0255 3930 N 108.0160 88.8750 115.1190 N.am 243 VAL243 -0.2453 3931 CA 107.2100 90.0800 115.2890 C.3 243 VAL243 0.0901 3932 CB 105.8080 89.8140 114.6930 C.3 243 VAL243 -0.0227 3933 CG1 104.7240 90.7790 115.1970 C.3 243 VAL243 -0.0608 3934 CG2 105.8590 89.8600 113.1570 C.3 243 VAL243 -0.0608 3935 C 107.1670 90.4860 116.7560 C.2 243 VAL243 0.2189 3936 O 107.3410 91.6630 117.0980 O.2 243 VAL243 -0.2778 3937 H 107.5700 88.0000 114.8430 H 243 VAL243 0.1312 3938 HA 107.6980 90.8880 114.7430 H 243 VAL243 0.0560 3939 HB 105.5030 88.8100 114.9930 H 243 VAL243 0.0315 3940 HG11 103.7740 90.5810 114.7000 H 243 VAL243 0.0233 3941 HG12 105.0010 91.8140 115.0010 H 243 VAL243 0.0233 3942 HG13 104.5500 90.6730 116.2680 H 243 VAL243 0.0233 3943 HG21 104.9220 89.5090 112.7250 H 243 VAL243 0.0233 3944 HG22 106.6610 89.2410 112.7560 H 243 VAL243 0.0233 3945 HG23 106.0320 90.8760 112.8040 H 243 VAL243 0.0233 3946 N 106.9460 89.5180 117.6490 N.am 244 PHE244 -0.2453 3947 CA 106.9250 89.8180 119.0760 C.3 244 PHE244 0.0917 3948 CB 106.2790 88.6710 119.8740 C.3 244 PHE244 -0.0036 3949 CG 104.7850 88.5920 119.6700 C.ar 244 PHE244 -0.0454 3950 CD1 103.9620 89.6540 120.0390 C.ar 244 PHE244 -0.0585 3951 CD2 104.1970 87.4400 119.1540 C.ar 244 PHE244 -0.0585 3952 CE1 102.5860 89.5800 119.8640 C.ar 244 PHE244 -0.0615 3953 CE2 102.8250 87.3730 118.9530 C.ar 244 PHE244 -0.0615 3954 CZ 102.0190 88.4450 119.3050 C.ar 244 PHE244 -0.0617 3955 C 108.3160 90.1430 119.6050 C.2 244 PHE244 0.2190 3956 O 108.4500 90.9550 120.5280 O.2 244 PHE244 -0.2778 3957 H 106.7910 88.5610 117.3300 H 244 PHE244 0.1312 3958 HA 106.3350 90.7280 119.2020 H 244 PHE244 0.0560 3959 HB1 106.4490 88.8130 120.9420 H 244 PHE244 0.0333 3960 HB2 106.7450 87.7220 119.6080 H 244 PHE244 0.0333 3961 HD1 104.3900 90.5460 120.4730 H 244 PHE244 0.0620 3962 HD2 104.8070 86.5870 118.9060 H 244 PHE244 0.0620 3963 HE1 101.9550 90.4070 120.1570 H 244 PHE244 0.0618 3964 HE2 102.3810 86.4850 118.5280 H 244 PHE244 0.0618 3965 HZ 100.9530 88.3920 119.1540 H 244 PHE244 0.0618 3966 N 109.3560 89.5200 119.0460 N.am 245 CYS245 -0.2449 3967 CA 110.7150 89.8030 119.4970 C.3 245 CYS245 0.0965 3968 CB 111.6590 88.8100 118.8060 C.3 245 CYS245 0.0147 3969 SG 113.3170 88.7040 119.5300 S.3 245 CYS245 -0.1762 3970 C 111.1120 91.2390 119.1800 C.2 245 CYS245 0.2195 3971 O 111.8370 91.8750 119.9540 O.2 245 CYS245 -0.2778 3972 H 109.2000 88.8420 118.2990 H 245 CYS245 0.1312 3973 HA 110.7340 89.6610 120.5780 H 245 CYS245 0.0565 3974 HB1 111.7450 89.0480 117.7440 H 245 CYS245 0.0394 3975 HB2 111.2210 87.8160 118.8590 H 245 CYS245 0.0394 3976 HG 113.8600 89.9280 119.5500 H 245 CYS245 0.1017 3977 N 110.6510 91.7640 118.0430 N.am 246 LEU246 -0.2456 3978 CA 110.9420 93.1520 117.6940 C.3 246 LEU246 0.0880 3979 CB 110.4040 93.4440 116.2830 C.3 246 LEU246 -0.0266 3980 CG 111.2650 92.8270 115.1630 C.3 246 LEU246 -0.0449 3981 CD1 110.4780 92.7430 113.8490 C.3 246 LEU246 -0.0626 3982 CD2 112.5670 93.6140 114.9550 C.3 246 LEU246 -0.0626 3983 C 110.3350 94.1090 118.7120 C.2 246 LEU246 0.2187 3984 O 110.9520 95.1140 119.0840 O.2 246 LEU246 -0.2778 3985 H 110.0910 91.1910 117.4120 H 246 LEU246 0.1312 3986 HA 112.0220 93.2770 117.7120 H 246 LEU246 0.0557 3987 HB1 110.3370 94.5200 116.1130 H 246 LEU246 0.0287 3988 HB2 109.3820 93.0660 116.2160 H 246 LEU246 0.0287 3989 HG 111.5350 91.8110 115.4470 H 246 LEU246 0.0296 3990 HD11 111.0770 92.2760 113.0660 H 246 LEU246 0.0232 3991 HD12 110.1850 93.7330 113.5020 H 246 LEU246 0.0232 3992 HD13 109.5740 92.1460 113.9710 H 246 LEU246 0.0232 3993 HD21 113.1650 93.1740 114.1580 H 246 LEU246 0.0232 3994 HD22 113.1820 93.6220 115.8540 H 246 LEU246 0.0232 3995 HD23 112.3650 94.6500 114.6810 H 246 LEU246 0.0232 3996 N 109.1140 93.8190 119.1640 N.am 247 VAL247 -0.2454 3997 CA 108.4900 94.6350 120.2030 C.3 247 VAL247 0.0901 3998 CB 107.0040 94.2440 120.3680 C.3 247 VAL247 -0.0227 3999 CG1 106.3040 95.0680 121.4650 C.3 247 VAL247 -0.0608 4000 CG2 106.2290 94.3940 119.0500 C.3 247 VAL247 -0.0608 4001 C 109.2560 94.5060 121.5140 C.2 247 VAL247 0.2189 4002 O 109.4680 95.4950 122.2270 O.2 247 VAL247 -0.2778 4003 H 108.6110 93.0190 118.7800 H 247 VAL247 0.1312 4004 HA 108.5580 95.6750 119.8780 H 247 VAL247 0.0560 4005 HB 106.9570 93.1930 120.6590 H 247 VAL247 0.0315 4006 HG11 105.2530 94.7930 121.5510 H 247 VAL247 0.0233 4007 HG12 106.3500 96.1350 121.2430 H 247 VAL247 0.0233 4008 HG13 106.7590 94.9120 122.4430 H 247 VAL247 0.0233 4009 HG21 105.1870 94.1070 119.1810 H 247 VAL247 0.0233 4010 HG22 106.6410 93.7650 118.2610 H 247 VAL247 0.0233 4011 HG23 106.2470 95.4260 118.6980 H 247 VAL247 0.0233 4012 N 109.6820 93.2860 121.8520 N.am 248 VAL248 -0.2454 4013 CA 110.3580 93.0520 123.1260 C.3 248 VAL248 0.0901 4014 CB 110.5430 91.5340 123.3430 C.3 248 VAL248 -0.0227 4015 CG1 111.5430 91.1960 124.4640 C.3 248 VAL248 -0.0608 4016 CG2 109.1940 90.8620 123.6460 C.3 248 VAL248 -0.0608 4017 C 111.6740 93.8200 123.1840 C.2 248 VAL248 0.2189 4018 O 111.9810 94.4860 124.1790 O.2 248 VAL248 -0.2778 4019 H 109.5330 92.5060 121.2110 H 248 VAL248 0.1312 4020 HA 109.7160 93.4600 123.9090 H 248 VAL248 0.0560 4021 HB 110.9330 91.1100 122.4180 H 248 VAL248 0.0315 4022 HG11 111.5860 90.1210 124.6390 H 248 VAL248 0.0233 4023 HG12 111.2600 91.6750 125.4010 H 248 VAL248 0.0233 4024 HG13 112.5530 91.5190 124.2130 H 248 VAL248 0.0233 4025 HG21 109.2910 89.7770 123.6640 H 248 VAL248 0.0233 4026 HG22 108.4350 91.1150 122.9090 H 248 VAL248 0.0233 4027 HG23 108.8130 91.1770 124.6180 H 248 VAL248 0.0233 4028 N 112.4710 93.7410 122.1150 N.am 249 ILE249 -0.2454 4029 CA 113.7460 94.4500 122.0990 C.3 249 ILE249 0.0903 4030 CB 114.6820 93.9740 120.9660 C.3 249 ILE249 -0.0201 4031 CG1 114.1430 94.2720 119.5540 C.3 249 ILE249 -0.0514 4032 CG2 115.0180 92.4840 121.1420 C.3 249 ILE249 -0.0605 4033 CD1 115.1520 93.9910 118.4340 C.3 249 ILE249 -0.0650 4034 C 113.5230 95.9580 122.0700 C.2 249 ILE249 0.2189 4035 O 114.2980 96.7220 122.6570 O.2 249 ILE249 -0.2778 4036 H 112.1880 93.1840 121.3090 H 249 ILE249 0.1312 4037 HA 114.2330 94.2310 123.0510 H 249 ILE249 0.0560 4038 HB 115.6170 94.5250 121.0760 H 249 ILE249 0.0318 4039 HG11 113.8470 95.3160 119.4710 H 249 ILE249 0.0266 4040 HG12 113.2380 93.7000 119.3880 H 249 ILE249 0.0266 4041 HG21 115.7920 92.1640 120.4460 H 249 ILE249 0.0233 4042 HG22 114.1440 91.8540 120.9820 H 249 ILE249 0.0233 4043 HG23 115.3890 92.2860 122.1480 H 249 ILE249 0.0233 4044 HD11 114.7540 94.3040 117.4690 H 249 ILE249 0.0230 4045 HD12 115.3890 92.9300 118.3620 H 249 ILE249 0.0230 4046 HD13 116.0820 94.5360 118.5970 H 249 ILE249 0.0230 4047 N 112.4670 96.4120 121.3910 N.am 250 PHE250 -0.2453 4048 CA 112.1850 97.8430 121.3310 C.3 250 PHE250 0.0917 4049 CB 111.0230 98.0380 120.3380 C.3 250 PHE250 -0.0036 4050 CG 110.4020 99.4120 120.3780 C.ar 250 PHE250 -0.0454 4051 CD1 111.0070 100.4880 119.7350 C.ar 250 PHE250 -0.0585 4052 CD2 109.2100 99.6210 121.0650 C.ar 250 PHE250 -0.0585 4053 CE1 110.4410 101.7550 119.7930 C.ar 250 PHE250 -0.0615 4054 CE2 108.6380 100.8840 121.1170 C.ar 250 PHE250 -0.0615 4055 CZ 109.2550 101.9520 120.4860 C.ar 250 PHE250 -0.0617 4056 C 111.8540 98.3940 122.7130 C.2 250 PHE250 0.2190 4057 O 112.3110 99.4800 123.0890 O.2 250 PHE250 -0.2778 4058 H 111.8530 95.7540 120.9110 H 250 PHE250 0.1312 4059 HA 113.0770 98.3540 120.9760 H 250 PHE250 0.0560 4060 HB1 110.2430 97.3030 120.5360 H 250 PHE250 0.0333 4061 HB2 111.3730 97.8360 119.3250 H 250 PHE250 0.0333 4062 HD1 111.9300 100.3480 119.1930 H 250 PHE250 0.0620 4063 HD2 108.7280 98.7980 121.5740 H 250 PHE250 0.0620 4064 HE1 110.9260 102.5850 119.3000 H 250 PHE250 0.0618 4065 HE2 107.7170 101.0450 121.6530 H 250 PHE250 0.0618 4066 HZ 108.8100 102.9330 120.5440 H 250 PHE250 0.0618 4067 N 111.0520 97.6560 123.4840 N.am 251 ALA251 -0.2459 4068 CA 110.7060 98.0980 124.8310 C.3 251 ALA251 0.0850 4069 CB 109.6660 97.1180 125.3910 C.3 251 ALA251 -0.0411 4070 C 111.9250 98.0860 125.7460 C.2 251 ALA251 0.2184 4071 O 112.1210 99.0030 126.5510 O.2 251 ALA251 -0.2778 4072 H 110.6780 96.7760 123.1290 H 251 ALA251 0.1312 4073 HA 110.3040 99.1100 124.7590 H 251 ALA251 0.0554 4074 HB1 109.2680 97.4600 126.3460 H 251 ALA251 0.0249 4075 HB2 110.0920 96.1240 125.5380 H 251 ALA251 0.0249 4076 HB3 108.8330 96.9950 124.7030 H 251 ALA251 0.0249 4077 N 112.7560 97.0470 125.6370 N.am 252 LEU252 -0.2457 4078 CA 113.9390 96.9540 126.4870 C.3 252 LEU252 0.0880 4079 CB 114.5720 95.5650 126.2930 C.3 252 LEU252 -0.0266 4080 CG 113.7090 94.4110 126.8370 C.3 252 LEU252 -0.0449 4081 CD1 114.1830 93.0670 126.2700 C.3 252 LEU252 -0.0626 4082 CD2 113.7080 94.3760 128.3720 C.3 252 LEU252 -0.0626 4083 C 114.9490 98.0450 126.1560 C.2 252 LEU252 0.2187 4084 O 115.5960 98.5970 127.0550 O.2 252 LEU252 -0.2778 4085 H 112.5630 96.3130 124.9550 H 252 LEU252 0.1312 4086 HA 113.6190 97.0980 127.5200 H 252 LEU252 0.0557 4087 HB1 115.5530 95.5250 126.7680 H 252 LEU252 0.0287 4088 HB2 114.7470 95.4140 125.2270 H 252 LEU252 0.0287 4089 HG 112.6790 94.5530 126.5120 H 252 LEU252 0.0296 4090 HD11 113.5520 92.2490 126.6200 H 252 LEU252 0.0232 4091 HD12 115.2090 92.8520 126.5690 H 252 LEU252 0.0232 4092 HD13 114.1460 93.0680 125.1800 H 252 LEU252 0.0232 4093 HD21 113.1030 93.5480 128.7420 H 252 LEU252 0.0232 4094 HD22 113.2960 95.2930 128.7930 H 252 LEU252 0.0232 4095 HD23 114.7170 94.2510 128.7640 H 252 LEU252 0.0232 4096 N 115.1040 98.3630 124.8700 N.am 253 CYS253 -0.2449 4097 CA 116.1160 99.3310 124.4590 C.3 253 CYS253 0.0965 4098 CB 116.3150 99.2810 122.9420 C.3 253 CYS253 0.0147 4099 SG 117.2060 97.7900 122.4200 S.3 253 CYS253 -0.1762 4100 C 115.7750 100.7390 124.9310 C.2 253 CYS253 0.2195 4101 O 116.6580 101.4800 125.3770 O.2 253 CYS253 -0.2778 4102 H 114.5090 97.9250 124.1670 H 253 CYS253 0.1312 4103 HA 117.0500 99.0460 124.9450 H 253 CYS253 0.0565 4104 HB1 116.8940 100.1450 122.6190 H 253 CYS253 0.0394 4105 HB2 115.3550 99.3330 122.4240 H 253 CYS253 0.0394 4106 HG 117.7010 97.9680 121.1920 H 253 CYS253 0.1017 4107 N 114.5060 101.1270 124.8410 N.am 254 TRP254 -0.2453 4108 CA 114.0830 102.4780 125.1830 C.3 254 TRP254 0.0918 4109 CB 112.9050 102.8680 124.2740 C.3 254 TRP254 -0.0021 4110 CG 113.4050 103.1870 122.8780 C.ar 254 TRP254 -0.0260 4111 CD2 113.8640 104.4670 122.3950 C.ar 254 TRP254 -0.0028 4112 CD1 113.4940 102.3040 121.7970 C.ar 254 TRP254 -0.0136 4113 NE1 113.9500 102.9700 120.7090 N.ar 254 TRP254 -0.2641 4114 CE2 114.1740 104.3030 121.0240 C.ar 254 TRP254 0.0269 4115 CE3 114.0180 105.6910 122.9910 C.ar 254 TRP254 -0.0528 4116 CZ2 114.6130 105.3700 120.2880 C.ar 254 TRP254 -0.0430 4117 CZ3 114.4830 106.7770 122.2490 C.ar 254 TRP254 -0.0611 4118 CH2 114.7800 106.6160 120.8950 C.ar 254 TRP254 -0.0602 4119 C 113.7350 102.6400 126.6570 C.2 254 TRP254 0.2190 4120 O 113.4390 103.7590 127.0890 O.2 254 TRP254 -0.2778 4121 H 113.8070 100.4560 124.5220 H 254 TRP254 0.1312 4122 HA 114.9120 103.1520 124.9720 H 254 TRP254 0.0560 4123 HB1 112.3940 103.7540 124.6520 H 254 TRP254 0.0334 4124 HB2 112.1660 102.0680 124.2240 H 254 TRP254 0.0334 4125 HD1 113.2270 101.2590 121.8080 H 254 TRP254 0.0748 4126 HE1 114.0850 102.5760 119.8210 H 254 TRP254 0.1331 4127 HE3 113.7870 105.8090 124.0400 H 254 TRP254 0.0624 4128 HZ2 114.8530 105.2390 119.2430 H 254 TRP254 0.0633 4129 HZ3 114.6200 107.7390 122.7190 H 254 TRP254 0.0618 4130 HH2 115.1560 107.4490 120.3180 H 254 TRP254 0.0618 4131 N 113.7540 101.5560 127.4320 N.am 255 PHE255 -0.2453 4132 CA 113.4500 101.6540 128.8590 C.3 255 PHE255 0.0920 4133 CB 113.2610 100.2660 129.4910 C.3 255 PHE255 -0.0036 4134 CG 112.5300 100.3610 130.8050 C.ar 255 PHE255 -0.0454 4135 CD1 111.1670 100.6450 130.8250 C.ar 255 PHE255 -0.0585 4136 CD2 113.2030 100.1970 132.0120 C.ar 255 PHE255 -0.0585 4137 CE1 110.4880 100.7730 132.0290 C.ar 255 PHE255 -0.0615 4138 CE2 112.5230 100.3100 133.2170 C.ar 255 PHE255 -0.0615 4139 CZ 111.1660 100.6040 133.2270 C.ar 255 PHE255 -0.0617 4140 C 114.4360 102.5280 129.6270 C.2 255 PHE255 0.2217 4141 O 113.9840 103.3620 130.4310 O.2 255 PHE255 -0.2776 4142 H 113.9830 100.6490 127.0260 H 255 PHE255 0.1312 4143 HA 112.4900 102.1730 128.8980 H 255 PHE255 0.0560 4144 HB1 114.2090 99.7460 129.6240 H 255 PHE255 0.0333 4145 HB2 112.6650 99.6420 128.8280 H 255 PHE255 0.0333 4146 HD1 110.6320 100.7830 129.8960 H 255 PHE255 0.0620 4147 HD2 114.2630 99.9870 132.0160 H 255 PHE255 0.0620 4148 HE1 109.4330 101.0040 132.0310 H 255 PHE255 0.0618 4149 HE2 113.0490 100.1760 134.1510 H 255 PHE255 0.0618 4150 HZ 110.6400 100.7010 134.1650 H 255 PHE255 0.0618 4151 N 115.7620 102.3970 129.4590 N.am 256 PRO256 -0.2316 4152 CA 116.6710 103.2460 130.2550 C.3 256 PRO256 0.0907 4153 CD 116.4390 101.4640 128.5790 C.3 256 PRO256 0.0071 4154 CB 118.0610 102.7790 129.7960 C.3 256 PRO256 -0.0276 4155 CG 117.8420 101.4000 129.1750 C.3 256 PRO256 -0.0379 4156 C 116.4870 104.7380 130.0250 C.2 256 PRO256 0.2189 4157 O 116.7270 105.5290 130.9450 O.2 256 PRO256 -0.2778 4158 HA 116.5040 103.0000 131.3030 H 256 PRO256 0.0559 4159 HD1 116.4400 101.9290 127.5980 H 256 PRO256 0.0431 4160 HD2 115.9390 100.4980 128.5610 H 256 PRO256 0.0431 4161 HB1 118.7880 102.7640 130.6080 H 256 PRO256 0.0285 4162 HB2 118.4500 103.4380 129.0220 H 256 PRO256 0.0285 4163 HG1 118.5950 101.1470 128.4300 H 256 PRO256 0.0278 4164 HG2 117.8700 100.6380 129.9550 H 256 PRO256 0.0278 4165 N 116.0790 105.1480 128.8210 N.am 257 LEU257 -0.2456 4166 CA 115.8910 106.5710 128.5490 C.3 257 LEU257 0.0880 4167 CB 115.5370 106.7750 127.0640 C.3 257 LEU257 -0.0266 4168 CG 116.6820 106.4750 126.0750 C.3 257 LEU257 -0.0449 4169 CD1 117.8960 107.3910 126.2840 C.3 257 LEU257 -0.0626 4170 CD2 117.1070 105.0030 126.0640 C.3 257 LEU257 -0.0626 4171 C 114.8190 107.1700 129.4500 C.2 257 LEU257 0.2187 4172 O 114.9970 108.2570 130.0100 O.2 257 LEU257 -0.2778 4173 H 115.8980 104.4630 128.0870 H 257 LEU257 0.1312 4174 HA 116.8310 107.0680 128.7880 H 257 LEU257 0.0557 4175 HB1 115.2240 107.8080 126.9070 H 257 LEU257 0.0287 4176 HB2 114.6710 106.1620 126.8100 H 257 LEU257 0.0287 4177 HG 116.2870 106.6900 125.0800 H 257 LEU257 0.0296 4178 HD11 118.6330 107.2340 125.4990 H 257 LEU257 0.0232 4179 HD12 118.3960 107.1930 127.2320 H 257 LEU257 0.0232 4180 HD13 117.6090 108.4420 126.2640 H 257 LEU257 0.0232 4181 HD21 117.6710 104.7770 125.1630 H 257 LEU257 0.0232 4182 HD22 116.2460 104.3400 126.0900 H 257 LEU257 0.0232 4183 HD23 117.7430 104.7550 126.9120 H 257 LEU257 0.0232 4184 N 113.6930 106.4710 129.6010 N.am 258 HIS258 -0.2453 4185 CA 112.6170 106.9780 130.4420 C.3 258 HIS258 0.0932 4186 ND1 111.3170 106.2650 127.4460 N.ar 258 HIS258 -0.2469 4187 CG 111.0260 106.9420 128.5750 C.ar 258 HIS258 0.0551 4188 CB 111.2830 106.4150 129.9620 C.3 258 HIS258 0.0146 4189 NE2 110.4910 108.2520 126.8760 N.ar 258 HIS258 -0.2539 4190 CD2 110.5420 108.2100 128.2240 C.ar 258 HIS258 0.0047 4191 CE1 110.9670 107.0720 126.4360 C.ar 258 HIS258 0.0737 4192 C 112.8220 106.6310 131.9100 C.2 258 HIS258 0.2190 4193 O 112.3610 107.3720 132.7850 O.2 258 HIS258 -0.2778 4194 H 113.5850 105.5760 129.1240 H 258 HIS258 0.1312 4195 HA 112.5950 108.0670 130.3640 H 258 HIS258 0.0561 4196 HB1 110.4730 106.7390 130.6150 H 258 HIS258 0.0348 4197 HB2 111.2870 105.3240 129.9500 H 258 HIS258 0.0348 4198 HE2 110.1500 108.9920 126.3320 H 258 HIS258 0.1339 4199 HD2 110.2340 108.9900 128.9060 H 258 HIS258 0.0764 4200 HE1 111.0460 106.7890 125.3950 H 258 HIS258 0.0963 4201 N 113.5070 105.5220 132.2000 N.am 259 LEU259 -0.2456 4202 CA 113.7230 105.1280 133.5890 C.3 259 LEU259 0.0880 4203 CB 114.4480 103.7710 133.5940 C.3 259 LEU259 -0.0266 4204 CG 114.8580 103.2520 134.9880 C.3 259 LEU259 -0.0449 4205 CD1 113.6440 103.0350 135.8990 C.3 259 LEU259 -0.0626 4206 CD2 115.6910 101.9700 134.8620 C.3 259 LEU259 -0.0626 4207 C 114.5540 106.1650 134.3360 C.2 259 LEU259 0.2187 4208 O 114.2630 106.4860 135.4950 O.2 259 LEU259 -0.2778 4209 H 113.8820 104.9460 131.4460 H 259 LEU259 0.1312 4210 HA 112.7430 105.0500 134.0640 H 259 LEU259 0.0557 4211 HB1 115.3440 103.8570 132.9790 H 259 LEU259 0.0287 4212 HB2 113.8190 103.0300 133.1000 H 259 LEU259 0.0287 4213 HG 115.5030 103.9910 135.4650 H 259 LEU259 0.0296 4214 HD11 113.9490 102.6440 136.8700 H 259 LEU259 0.0232 4215 HD12 112.9400 102.3280 135.4600 H 259 LEU259 0.0232 4216 HD13 113.1120 103.9690 136.0810 H 259 LEU259 0.0232 4217 HD21 116.0080 101.6100 135.8410 H 259 LEU259 0.0232 4218 HD22 116.5880 102.1450 134.2680 H 259 LEU259 0.0232 4219 HD23 115.1250 101.1740 134.3810 H 259 LEU259 0.0232 4220 N 115.5950 106.6950 133.6920 N.am 260 SER260 -0.2436 4221 CA 116.4170 107.7170 134.3310 C.3 260 SER260 0.1109 4222 CB 117.6090 107.9940 133.4000 C.3 260 SER260 0.0681 4223 OG 118.4590 109.0340 133.8810 O.3 260 SER260 -0.3930 4224 C 115.6220 108.9930 134.5790 C.2 260 SER260 0.2209 4225 O 115.7500 109.6180 135.6390 O.2 260 SER260 -0.2777 4226 H 115.8180 106.3840 132.7470 H 260 SER260 0.1312 4227 HA 116.7640 107.3240 135.2880 H 260 SER260 0.0580 4228 HB1 117.2390 108.2570 132.4030 H 260 SER260 0.0577 4229 HB2 118.1650 107.0580 133.2920 H 260 SER260 0.0577 4230 HG 119.2520 109.0900 133.3380 H 260 SER260 0.2095 4231 N 114.7950 109.3970 133.6120 N.am 261 ARG261 -0.2456 4232 CA 114.0100 110.6160 133.7620 C.3 261 ARG261 0.0879 4233 CB 113.2180 110.8610 132.4480 C.3 261 ARG261 -0.0258 4234 CG 113.9060 111.7950 131.4570 C.3 261 ARG261 -0.0154 4235 CD 114.8490 111.0240 130.5570 C.3 261 ARG261 0.1045 4236 NE 115.8210 111.9400 129.9810 N.pl3 261 ARG261 -0.4450 4237 CZ 117.0650 111.5630 129.7240 C.cat 261 ARG261 0.5062 4238 NH1 117.4380 110.3220 129.8500 N.pl3 261 ARG261 -0.4573 4239 NH2 117.9410 112.4470 129.3520 N.pl3 261 ARG261 -0.4573 4240 C 112.9040 110.4730 134.8000 C.2 261 ARG261 0.2187 4241 O 112.5850 111.4520 135.4830 O.2 261 ARG261 -0.2778 4242 H 114.7120 108.8460 132.7580 H 261 ARG261 0.1312 4243 HA 114.6460 111.4520 134.0240 H 261 ARG261 0.0557 4244 HB1 112.2450 111.3090 132.6440 H 261 ARG261 0.0286 4245 HB2 112.9670 109.9110 131.9720 H 261 ARG261 0.0286 4246 HG1 114.4190 112.5920 131.9960 H 261 ARG261 0.0299 4247 HG2 113.1640 112.2840 130.8270 H 261 ARG261 0.0299 4248 HD1 114.3070 110.5350 129.7450 H 261 ARG261 0.0711 4249 HD2 115.3620 110.2760 131.1630 H 261 ARG261 0.0711 4250 HE 115.5250 112.8780 129.8060 H 261 ARG261 0.3153 4251 HH11 118.4310 110.1430 129.8040 H 261 ARG261 0.3114 4252 HH12 116.7880 109.5830 129.9940 H 261 ARG261 0.3114 4253 HH21 118.8840 112.1040 129.2530 H 261 ARG261 0.3114 4254 HH22 117.7120 113.3960 129.1810 H 261 ARG261 0.3114 4255 N 112.3090 109.2860 134.9290 N.am 262 ILE262 -0.2454 4256 CA 111.2860 109.0750 135.9490 C.3 262 ILE262 0.0903 4257 CB 110.5580 107.7330 135.7020 C.3 262 ILE262 -0.0201 4258 CG1 109.7080 107.7560 134.4080 C.3 262 ILE262 -0.0514 4259 CG2 109.7050 107.2750 136.9000 C.3 262 ILE262 -0.0605 4260 CD1 108.4870 108.6830 134.4450 C.3 262 ILE262 -0.0650 4261 C 111.8840 109.2010 137.3450 C.2 262 ILE262 0.2189 4262 O 111.2640 109.7730 138.2490 O.2 262 ILE262 -0.2778 4263 H 112.5710 108.5190 134.3100 H 262 ILE262 0.1312 4264 HA 110.5720 109.8940 135.8520 H 262 ILE262 0.0560 4265 HB 111.3300 106.9750 135.5600 H 262 ILE262 0.0318 4266 HG11 109.3730 106.7430 134.1840 H 262 ILE262 0.0266 4267 HG12 110.3150 108.0620 133.5610 H 262 ILE262 0.0266 4268 HG21 109.1520 106.3660 136.6610 H 262 ILE262 0.0233 4269 HG22 108.9840 108.0380 137.1910 H 262 ILE262 0.0233 4270 HG23 110.3220 107.0560 137.7710 H 262 ILE262 0.0233 4271 HD11 107.9340 108.6260 133.5070 H 262 ILE262 0.0230 4272 HD12 108.7830 109.7230 134.5720 H 262 ILE262 0.0230 4273 HD13 107.7990 108.4170 135.2460 H 262 ILE262 0.0230 4274 N 113.1000 108.6850 137.5410 N.am 263 LEU263 -0.2456 4275 CA 113.7470 108.7640 138.8460 C.3 263 LEU263 0.0880 4276 CB 115.0240 107.9070 138.7960 C.3 263 LEU263 -0.0266 4277 CG 114.7410 106.3960 138.6680 C.3 263 LEU263 -0.0449 4278 CD1 115.9750 105.6390 138.1580 C.3 263 LEU263 -0.0626 4279 CD2 114.2650 105.7940 139.9960 C.3 263 LEU263 -0.0626 4280 C 114.0570 110.1980 139.2560 C.2 263 LEU263 0.2187 4281 O 114.2780 110.4560 140.4450 O.2 263 LEU263 -0.2778 4282 H 113.5830 108.2290 136.7670 H 263 LEU263 0.1312 4283 HA 113.0540 108.3600 139.5780 H 263 LEU263 0.0557 4284 HB1 115.6400 108.0800 139.6790 H 263 LEU263 0.0287 4285 HB2 115.6160 108.2340 137.9410 H 263 LEU263 0.0287 4286 HG 113.9500 106.2460 137.9340 H 263 LEU263 0.0296 4287 HD11 115.7410 104.5900 137.9790 H 263 LEU263 0.0232 4288 HD12 116.7850 105.6790 138.8840 H 263 LEU263 0.0232 4289 HD13 116.3390 106.0590 137.2210 H 263 LEU263 0.0232 4290 HD21 114.0340 104.7350 139.8830 H 263 LEU263 0.0232 4291 HD22 113.3670 106.2870 140.3630 H 263 LEU263 0.0232 4292 HD23 115.0310 105.8850 140.7660 H 263 LEU263 0.0232 4293 N 114.0850 111.1330 138.3040 N.am 264 LYS264 -0.2457 4294 CA 114.3330 112.5310 138.6440 C.3 264 LYS264 0.0878 4295 CB 114.8880 113.2340 137.3770 C.3 264 LYS264 -0.0289 4296 CG 116.2710 112.6080 136.9890 C.3 264 LYS264 -0.0496 4297 CD 116.8140 112.8470 135.5560 C.3 264 LYS264 -0.0278 4298 CE 117.9860 111.8870 135.1870 C.3 264 LYS264 0.1103 4299 NZ 118.2510 111.6710 133.7520 N.4 264 LYS264 -0.0749 4300 C 113.2080 113.1060 139.4950 C.2 264 LYS264 0.2187 4301 O 113.4530 113.9150 140.3970 O.2 264 LYS264 -0.2778 4302 H 113.9320 110.8690 137.3310 H 264 LYS264 0.1312 4303 HA 115.1740 112.5120 139.3400 H 264 LYS264 0.0557 4304 HB1 115.0020 114.3040 137.5520 H 264 LYS264 0.0285 4305 HB2 114.1760 113.1240 136.5590 H 264 LYS264 0.0285 4306 HG1 116.2140 111.5300 137.1200 H 264 LYS264 0.0266 4307 HG2 117.0200 112.9320 137.7140 H 264 LYS264 0.0266 4308 HD1 117.1270 113.8850 135.4460 H 264 LYS264 0.0282 4309 HD2 116.0000 112.7160 134.8510 H 264 LYS264 0.0282 4310 HE1 117.7940 110.9020 135.6080 H 264 LYS264 0.0559 4311 HE2 118.9100 112.2310 135.6550 H 264 LYS264 0.0559 4312 HZ1 119.0090 110.9640 133.5980 H 264 LYS264 0.2742 4313 HZ2 118.5450 112.5480 133.2840 H 264 LYS264 0.2742 4314 HZ3 117.4080 111.2850 133.2880 H 264 LYS264 0.2742 4315 N 111.9680 112.7120 139.2180 N.am 265 LYS265 -0.2457 4316 CA 110.8080 113.2500 139.9150 C.3 265 LYS265 0.0878 4317 CB 109.6600 113.4800 138.9160 C.3 265 LYS265 -0.0289 4318 CG 109.8310 114.7050 137.9980 C.3 265 LYS265 -0.0496 4319 CD 109.7660 116.0670 138.7210 C.3 265 LYS265 -0.0278 4320 CE 108.4000 116.4220 139.3420 C.3 265 LYS265 0.1103 4321 NZ 107.4160 116.9100 138.3800 N.4 265 LYS265 -0.0749 4322 C 110.3340 112.3680 141.0620 C.2 265 LYS265 0.2187 4323 O 109.3090 112.6790 141.6770 O.2 265 LYS265 -0.2778 4324 H 111.8250 112.0090 138.4930 H 265 LYS265 0.1312 4325 HA 111.0860 114.1990 140.3740 H 265 LYS265 0.0557 4326 HB1 108.7000 113.5590 139.4260 H 265 LYS265 0.0285 4327 HB2 109.5960 112.5820 138.3100 H 265 LYS265 0.0285 4328 HG1 109.0680 114.6790 137.2200 H 265 LYS265 0.0266 4329 HG2 110.7860 114.6240 137.4770 H 265 LYS265 0.0266 4330 HD1 110.0500 116.8560 138.0240 H 265 LYS265 0.0282 4331 HD2 110.5250 116.0940 139.5020 H 265 LYS265 0.0282 4332 HE1 108.5390 117.2250 140.0690 H 265 LYS265 0.0559 4333 HE2 107.9690 115.5830 139.8880 H 265 LYS265 0.0559 4334 HZ1 106.5510 117.2560 138.8560 H 265 LYS265 0.2742 4335 HZ2 107.1600 116.2130 137.6590 H 265 LYS265 0.2742 4336 HZ3 107.7540 117.7850 137.9250 H 265 LYS265 0.2742 4337 N 111.0430 111.2830 141.3690 N.am 266 THR266 -0.2434 4338 CA 110.6090 110.3630 142.4140 C.3 266 THR266 0.1135 4339 CB 110.2230 108.9830 141.8470 C.3 266 THR266 0.0763 4340 OG1 111.3530 108.3420 141.2800 O.3 266 THR266 -0.3900 4341 CG2 109.0940 109.1050 140.8100 C.3 266 THR266 -0.0370 4342 C 111.6040 110.2430 143.5570 C.2 266 THR266 0.2212 4343 O 111.2110 110.3460 144.7250 O.2 266 THR266 -0.2777 4344 H 111.9080 111.0920 140.8630 H 266 THR266 0.1313 4345 HA 109.7140 110.7700 142.8850 H 266 THR266 0.0583 4346 HB 109.8560 108.3840 142.6900 H 266 THR266 0.0611 4347 HG1 111.1100 107.4800 140.9530 H 266 THR266 0.2098 4348 HG21 108.7240 108.1300 140.4910 H 266 THR266 0.0255 4349 HG22 109.4340 109.6360 139.9230 H 266 THR266 0.0255 4350 HG23 108.2470 109.6560 141.2190 H 266 THR266 0.0255 4351 N 112.8860 110.0290 143.2600 N.am 267 VAL267 -0.2453 4352 CA 113.8840 109.7420 144.2860 C.3 267 VAL267 0.0901 4353 CB 114.5150 108.3610 143.9930 C.3 267 VAL267 -0.0227 4354 CG1 113.4790 107.2360 144.1370 C.3 267 VAL267 -0.0608 4355 CG2 115.1880 108.2890 142.6120 C.3 267 VAL267 -0.0608 4356 C 114.9480 110.8200 144.3920 C.2 267 VAL267 0.2189 4357 O 115.9760 110.5930 145.0470 O.2 267 VAL267 -0.2778 4358 H 113.1790 110.0670 142.2840 H 267 VAL267 0.1312 4359 HA 113.3980 109.7070 145.2630 H 267 VAL267 0.0560 4360 HB 115.2850 108.1750 144.7440 H 267 VAL267 0.0315 4361 HG11 113.9450 106.2580 144.0110 H 267 VAL267 0.0233 4362 HG12 112.6890 107.3220 143.3920 H 267 VAL267 0.0233 4363 HG13 113.0120 107.2570 145.1220 H 267 VAL267 0.0233 4364 HG21 115.7270 107.3500 142.4940 H 267 VAL267 0.0233 4365 HG22 115.9050 109.0960 142.4660 H 267 VAL267 0.0233 4366 HG23 114.4500 108.3430 141.8110 H 267 VAL267 0.0233 4367 N 114.7040 111.9690 143.7180 N.am 268 TYR268 -0.2453 4368 CA 115.4070 113.2160 143.8480 C.3 268 TYR268 0.0917 4369 CB 115.9290 113.8070 142.5340 C.3 268 TYR268 -0.0036 4370 CG 117.1660 113.1680 141.9870 C.ar 268 TYR268 -0.0453 4371 CD1 117.1030 111.8950 141.4410 C.ar 268 TYR268 -0.0561 4372 CD2 118.3450 113.8980 141.8850 C.ar 268 TYR268 -0.0561 4373 CE1 118.1860 111.3770 140.7550 C.ar 268 TYR268 -0.0317 4374 CE2 119.4280 113.3800 141.1920 C.ar 268 TYR268 -0.0317 4375 CZ 119.3350 112.1330 140.5970 C.ar 268 TYR268 0.0726 4376 OH 120.3770 111.6510 139.8390 O.3 268 TYR268 -0.3598 4377 C 114.2990 114.1010 144.2960 C.2 268 TYR268 0.2190 4378 O 113.3450 114.3430 143.5600 O.2 268 TYR268 -0.2778 4379 H 113.9380 111.9470 143.0450 H 268 TYR268 0.1312 4380 HA 116.1730 113.1380 144.6210 H 268 TYR268 0.0560 4381 HB1 116.1200 114.8760 142.6500 H 268 TYR268 0.0333 4382 HB2 115.1690 113.7220 141.7720 H 268 TYR268 0.0333 4383 HD1 116.2000 111.3150 141.5280 H 268 TYR268 0.0621 4384 HD2 118.4050 114.8950 142.2980 H 268 TYR268 0.0621 4385 HE1 118.1300 110.3810 140.3530 H 268 TYR268 0.0643 4386 HE2 120.3320 113.9580 141.0990 H 268 TYR268 0.0643 4387 HH 120.3420 110.7030 139.8120 H 268 TYR268 0.2173 4388 N 114.3570 114.6190 145.5220 N.am 269 ASN269 -0.2452 4389 CA 113.3470 115.5610 145.8900 C.3 269 ASN269 0.0957 4390 CB 112.6340 115.0960 147.1710 C.3 269 ASN269 0.0446 4391 CG 111.9210 113.7650 146.9070 C.2 269 ASN269 0.2000 4392 OD1 112.4250 112.6900 147.2060 O.2 269 ASN269 -0.2797 4393 ND2 110.7210 113.9020 146.3250 N.am 269 ASN269 -0.2723 4394 C 114.1980 116.7440 146.0830 C.2 269 ASN269 0.2191 4395 O 115.1340 116.9500 145.3070 O.2 269 ASN269 -0.2778 4396 H 115.0950 114.3530 146.1740 H 269 ASN269 0.1312 4397 HA 112.6330 115.7920 145.0980 H 269 ASN269 0.0562 4398 HB1 111.8990 115.8320 147.5050 H 269 ASN269 0.0375 4399 HB2 113.3420 114.9480 147.9870 H 269 ASN269 0.0375 4400 HD21 110.1930 113.0860 146.0950 H 269 ASN269 0.1266 4401 HD22 110.3540 114.8090 146.1190 H 269 ASN269 0.1266 4402 N 113.9200 117.5670 147.1000 N.am 270 GLU270 -0.2456 4403 CA 114.9140 118.5690 147.3450 C.3 270 GLU270 0.0883 4404 CB 114.4310 119.4820 148.4880 C.3 270 GLU270 -0.0193 4405 CG 113.2570 120.4050 148.1030 C.3 270 GLU270 0.0356 4406 CD 112.0030 119.6290 147.6770 C.2 270 GLU270 0.1760 4407 OE1 111.5860 119.7720 146.5310 O.co2 270 GLU270 -0.6478 4408 OE2 111.4650 118.8830 148.4910 O.co2 270 GLU270 -0.6478 4409 C 116.1040 117.7420 147.7500 C.2 270 GLU270 0.2187 4410 O 116.0050 117.0300 148.7620 O.2 270 GLU270 -0.2778 4411 H 113.0690 117.4880 147.6560 H 270 GLU270 0.1312 4412 HA 115.1020 119.1350 146.4300 H 270 GLU270 0.0557 4413 HB1 115.2590 120.1060 148.8250 H 270 GLU270 0.0290 4414 HB2 114.1400 118.8760 149.3480 H 270 GLU270 0.0290 4415 HG1 113.5500 121.0710 147.2910 H 270 GLU270 0.0374 4416 HG2 112.9810 121.0350 148.9470 H 270 GLU270 0.0374 4417 N 117.2330 117.8070 146.9600 N.am 271 MET271 -0.2456 4418 CA 118.3690 116.9470 147.2700 C.3 271 MET271 0.0885 4419 CB 119.5770 117.3440 146.4050 C.3 271 MET271 -0.0199 4420 CG 119.9570 118.8310 146.5080 C.3 271 MET271 -0.0047 4421 SD 121.4980 119.1970 145.6440 S.3 271 MET271 -0.1641 4422 CE 120.9710 118.8410 143.9560 C.3 271 MET271 -0.0181 4423 C 118.7210 116.9930 148.7540 C.2 271 MET271 0.2187 4424 O 118.7600 118.0640 149.3660 O.2 271 MET271 -0.2778 4425 H 117.2730 118.4490 146.1680 H 271 MET271 0.1312 4426 HA 118.0510 115.9330 147.0220 H 271 MET271 0.0557 4427 HB1 119.3560 117.1010 145.3660 H 271 MET271 0.0293 4428 HB2 120.4360 116.7320 146.6800 H 271 MET271 0.0293 4429 HG1 120.0670 119.1430 147.5450 H 271 MET271 0.0377 4430 HG2 119.1630 119.4430 146.0780 H 271 MET271 0.0377 4431 HE1 121.5940 119.3840 143.2460 H 271 MET271 0.0340 4432 HE2 119.9410 119.1640 143.8030 H 271 MET271 0.0340 4433 HE3 121.0360 117.7720 143.7520 H 271 MET271 0.0340 4434 N 118.9680 115.8210 149.3360 N.am 272 ASP272 -0.2451 4435 CA 119.4540 115.7050 150.7110 C.3 272 ASP272 0.0974 4436 CB 118.4470 115.0270 151.6570 C.3 272 ASP272 0.0576 4437 CG 119.0330 114.8910 153.0840 C.2 272 ASP272 0.1780 4438 OD1 119.8010 115.7470 153.5310 O.co2 272 ASP272 -0.6478 4439 OD2 118.7510 113.9100 153.7640 O.co2 272 ASP272 -0.6478 4440 C 120.7960 114.9810 150.6780 C.2 272 ASP272 0.2192 4441 O 120.8690 113.7710 150.9060 O.2 272 ASP272 -0.2778 4442 H 118.8120 114.9670 148.8000 H 272 ASP272 0.1312 4443 HA 119.6470 116.7080 151.0960 H 272 ASP272 0.0563 4444 HB1 118.1780 114.0360 151.2890 H 272 ASP272 0.0394 4445 HB2 117.5290 115.6090 151.7180 H 272 ASP272 0.0394 4446 N 121.8600 115.7400 150.4060 N.am 273 LYS273 -0.2456 4447 CA 123.2400 115.2500 150.4740 C.3 273 LYS273 0.0878 4448 CB 123.7420 115.1750 151.9420 C.3 273 LYS273 -0.0289 4449 CG 122.9340 114.2570 152.8800 C.3 273 LYS273 -0.0496 4450 CD 123.2770 114.3810 154.3680 C.3 273 LYS273 -0.0278 4451 CE 122.2620 113.6310 155.2540 C.3 273 LYS273 0.1103 4452 NZ 120.8720 114.0220 155.0160 N.4 273 LYS273 -0.0749 4453 C 123.4430 113.9670 149.6680 C.2 273 LYS273 0.2187 4454 O 124.2400 113.1050 150.0440 O.2 273 LYS273 -0.2778 4455 H 121.7050 116.7110 150.1370 H 273 LYS273 0.1312 4456 HA 123.8230 116.0110 149.9570 H 273 LYS273 0.0557 4457 HB1 123.7170 116.1850 152.3520 H 273 LYS273 0.0285 4458 HB2 124.7900 114.8750 151.9580 H 273 LYS273 0.0285 4459 HG1 122.9990 113.2190 152.5510 H 273 LYS273 0.0266 4460 HG2 121.8940 114.5400 152.8280 H 273 LYS273 0.0266 4461 HD1 123.2780 115.4350 154.6490 H 273 LYS273 0.0282 4462 HD2 124.2850 114.0090 154.5520 H 273 LYS273 0.0282 4463 HE1 122.4840 113.8080 156.3070 H 273 LYS273 0.0559 4464 HE2 122.3340 112.5550 155.0830 H 273 LYS273 0.0559 4465 HZ1 120.1910 113.5780 155.6580 H 273 LYS273 0.2742 4466 HZ2 120.5500 113.7650 154.0550 H 273 LYS273 0.2742 4467 HZ3 120.7230 115.0540 155.0110 H 273 LYS273 0.2742 4468 N 122.7230 113.8230 148.5520 N.am 274 ASN274 -0.2452 4469 CA 122.8830 112.6200 147.7410 C.3 274 ASN274 0.0957 4470 CB 121.6490 112.4100 146.8430 C.3 274 ASN274 0.0446 4471 CG 121.3150 113.5960 145.9130 C.2 274 ASN274 0.2000 4472 OD1 121.7860 114.7150 146.0700 O.2 274 ASN274 -0.2797 4473 ND2 120.4630 113.2720 144.9300 N.am 274 ASN274 -0.2723 4474 C 124.1770 112.6620 146.9360 C.2 274 ASN274 0.2191 4475 O 124.6780 111.6170 146.5030 O.2 274 ASN274 -0.2778 4476 H 122.0650 114.5490 148.2680 H 274 ASN274 0.1312 4477 HA 122.9570 111.7680 148.4210 H 274 ASN274 0.0562 4478 HB1 120.7750 112.2350 147.4700 H 274 ASN274 0.0375 4479 HB2 121.7780 111.5150 146.2340 H 274 ASN274 0.0375 4480 HD21 120.1780 113.9690 144.2740 H 274 ASN274 0.1266 4481 HD22 120.1040 112.3440 144.8430 H 274 ASN274 0.1266 4482 N 124.5370 113.8980 146.5590 N.am 275 ARG275 -0.2456 4483 CA 125.8300 114.1470 145.8730 C.3 275 ARG275 0.0879 4484 CB 127.0190 113.7460 146.7780 C.3 275 ARG275 -0.0258 4485 CG 126.9630 114.2270 148.2310 C.3 275 ARG275 -0.0154 4486 CD 128.2080 113.7950 149.0190 C.3 275 ARG275 0.1045 4487 NE 128.3720 112.3510 148.9590 N.pl3 275 ARG275 -0.4450 4488 CZ 129.1930 111.6060 149.6780 C.cat 275 ARG275 0.5062 4489 NH1 129.9620 112.1220 150.5970 N.pl3 275 ARG275 -0.4573 4490 NH2 129.2300 110.3300 149.4540 N.pl3 275 ARG275 -0.4573 4491 C 125.9170 113.3960 144.5460 C.2 275 ARG275 0.2187 4492 O 124.8850 113.2940 143.8900 O.2 275 ARG275 -0.2778 4493 H 123.9110 114.6810 146.7470 H 275 ARG275 0.1312 4494 HA 125.8490 115.2150 145.6650 H 275 ARG275 0.0557 4495 HB1 127.9520 114.1030 146.3400 H 275 ARG275 0.0286 4496 HB2 127.0780 112.6580 146.7920 H 275 ARG275 0.0286 4497 HG1 126.0860 113.8140 148.7200 H 275 ARG275 0.0299 4498 HG2 126.8620 115.3120 148.2630 H 275 ARG275 0.0299 4499 HD1 128.1350 114.1020 150.0640 H 275 ARG275 0.0711 4500 HD2 129.1040 114.2170 148.5680 H 275 ARG275 0.0711 4501 HE 127.8430 111.7720 148.3150 H 275 ARG275 0.3153 4502 HH11 130.5730 111.5280 151.1090 H 275 ARG275 0.3114 4503 HH12 129.9160 113.0990 150.7640 H 275 ARG275 0.3114 4504 HH21 129.8100 109.6830 149.9290 H 275 ARG275 0.3114 4505 HH22 128.5970 110.0190 148.7300 H 275 ARG275 0.3114 4506 N 127.1170 112.8960 144.2000 N.am 276 CYS276 -0.2449 4507 CA 127.2160 112.2360 142.9050 C.3 276 CYS276 0.0965 4508 CB 128.6990 112.3490 142.5550 C.3 276 CYS276 0.0147 4509 SG 129.2860 114.0190 142.9630 S.3 276 CYS276 -0.1762 4510 C 126.7560 110.7850 142.9480 C.2 276 CYS276 0.2195 4511 O 126.7520 110.1270 141.9030 O.2 276 CYS276 -0.2778 4512 H 127.9240 112.9760 144.8190 H 276 CYS276 0.1312 4513 HA 126.6150 112.7850 142.1820 H 276 CYS276 0.0565 4514 HB1 128.8700 112.1440 141.5010 H 276 CYS276 0.0394 4515 HB2 129.2890 111.6300 143.1280 H 276 CYS276 0.0394 4516 HG 130.2020 113.9420 143.9370 H 276 CYS276 0.1017 4517 N 126.3800 110.2740 144.1220 N.am 277 GLU277 -0.2456 4518 CA 125.9190 108.8920 144.2170 C.3 277 GLU277 0.0883 4519 CB 125.7190 108.4860 145.6820 C.3 277 GLU277 -0.0193 4520 CG 127.0420 108.4370 146.4690 C.3 277 GLU277 0.0356 4521 CD 127.4240 109.7760 147.1190 C.2 277 GLU277 0.1760 4522 OE1 126.8410 110.1250 148.1350 O.co2 277 GLU277 -0.6478 4523 OE2 128.3180 110.4760 146.6500 O.co2 277 GLU277 -0.6478 4524 C 124.6690 108.6690 143.3750 C.2 277 GLU277 0.2187 4525 O 124.5330 107.6330 142.7130 O.2 277 GLU277 -0.2778 4526 H 126.4150 110.8540 144.9600 H 277 GLU277 0.1312 4527 HA 126.7060 108.2730 143.7840 H 277 GLU277 0.0557 4528 HB1 125.2860 107.4850 145.7030 H 277 GLU277 0.0290 4529 HB2 124.9930 109.1330 146.1770 H 277 GLU277 0.0290 4530 HG1 127.8640 108.0920 145.8420 H 277 GLU277 0.0374 4531 HG2 126.9500 107.7130 147.2780 H 277 GLU277 0.0374 4532 N 123.7460 109.6280 143.3870 N.am 278 LEU278 -0.2456 4533 CA 122.5350 109.5330 142.5830 C.3 278 LEU278 0.0880 4534 CB 121.3760 110.1380 143.3910 C.3 278 LEU278 -0.0266 4535 CG 119.9940 109.5450 143.0630 C.3 278 LEU278 -0.0449 4536 CD1 119.8880 108.0490 143.3980 C.3 278 LEU278 -0.0626 4537 CD2 118.8990 110.3090 143.8180 C.3 278 LEU278 -0.0626 4538 C 122.7020 110.1400 141.1960 C.2 278 LEU278 0.2187 4539 O 122.1210 109.6290 140.2320 O.2 278 LEU278 -0.2778 4540 H 123.8900 110.4500 143.9740 H 278 LEU278 0.1312 4541 HA 122.3410 108.4720 142.4310 H 278 LEU278 0.0557 4542 HB1 121.3660 111.2210 143.2610 H 278 LEU278 0.0287 4543 HB2 121.5610 109.9730 144.4540 H 278 LEU278 0.0287 4544 HG 119.8250 109.6530 141.9940 H 278 LEU278 0.0296 4545 HD11 118.8700 107.6900 143.2450 H 278 LEU278 0.0232 4546 HD12 120.1510 107.8590 144.4390 H 278 LEU278 0.0232 4547 HD13 120.5330 107.4370 142.7700 H 278 LEU278 0.0232 4548 HD21 117.9110 109.9440 143.5420 H 278 LEU278 0.0232 4549 HD22 118.9330 111.3750 143.6000 H 278 LEU278 0.0232 4550 HD23 119.0070 110.1920 144.8960 H 278 LEU278 0.0232 4551 N 123.4870 111.2130 141.0720 N.am 279 LEU279 -0.2456 4552 CA 123.6120 111.8920 139.7870 C.3 279 LEU279 0.0880 4553 CB 124.3350 113.2370 139.9930 C.3 279 LEU279 -0.0266 4554 CG 123.5050 114.2950 140.7360 C.3 279 LEU279 -0.0449 4555 CD1 124.4100 115.3930 141.3110 C.3 279 LEU279 -0.0626 4556 CD2 122.4530 114.9150 139.8060 C.3 279 LEU279 -0.0626 4557 C 124.4290 111.0730 138.7930 C.2 279 LEU279 0.2187 4558 O 124.0440 110.9450 137.6260 O.2 279 LEU279 -0.2778 4559 H 124.0020 111.5600 141.8810 H 279 LEU279 0.1312 4560 HA 122.6200 112.0430 139.3670 H 279 LEU279 0.0557 4561 HB1 124.6440 113.6560 139.0330 H 279 LEU279 0.0287 4562 HB2 125.2570 113.0480 140.5400 H 279 LEU279 0.0287 4563 HG 122.9940 113.8190 141.5750 H 279 LEU279 0.0296 4564 HD11 123.8290 116.1160 141.8840 H 279 LEU279 0.0232 4565 HD12 124.9280 115.9330 140.5190 H 279 LEU279 0.0232 4566 HD13 125.1630 114.9760 141.9800 H 279 LEU279 0.0232 4567 HD21 121.8320 115.6340 140.3420 H 279 LEU279 0.0232 4568 HD22 121.7960 114.1570 139.3810 H 279 LEU279 0.0232 4569 HD23 122.9240 115.4420 138.9750 H 279 LEU279 0.0232 4570 N 125.5610 110.5180 139.2340 N.am 280 SER280 -0.2436 4571 CA 126.4270 109.7800 138.3170 C.3 280 SER280 0.1109 4572 CB 127.7210 109.3520 139.0290 C.3 280 SER280 0.0681 4573 OG 128.4670 110.4730 139.4930 O.3 280 SER280 -0.3930 4574 C 125.7460 108.5190 137.8000 C.2 280 SER280 0.2209 4575 O 125.8700 108.1810 136.6170 O.2 280 SER280 -0.2777 4576 H 125.8220 110.6100 140.2160 H 280 SER280 0.1312 4577 HA 126.6540 110.4320 137.4750 H 280 SER280 0.0580 4578 HB1 128.3360 108.7690 138.3320 H 280 SER280 0.0577 4579 HB2 127.4650 108.6950 139.8710 H 280 SER280 0.0577 4580 HG 129.2440 110.1710 139.9640 H 280 SER280 0.2095 4581 N 125.0300 107.8060 138.6720 N.am 281 PHE281 -0.2453 4582 CA 124.3670 106.5730 138.2570 C.3 281 PHE281 0.0917 4583 CB 123.7130 105.9770 139.5170 C.3 281 PHE281 -0.0036 4584 CG 122.9040 104.7290 139.2640 C.ar 281 PHE281 -0.0454 4585 CD1 123.4520 103.6480 138.5800 C.ar 281 PHE281 -0.0585 4586 CD2 121.6000 104.6330 139.7430 C.ar 281 PHE281 -0.0585 4587 CE1 122.7070 102.4950 138.3690 C.ar 281 PHE281 -0.0615 4588 CE2 120.8560 103.4790 139.5390 C.ar 281 PHE281 -0.0615 4589 CZ 121.4090 102.4090 138.8510 C.ar 281 PHE281 -0.0617 4590 C 123.3310 106.8460 137.1740 C.2 281 PHE281 0.2190 4591 O 123.2340 106.1050 136.1890 O.2 281 PHE281 -0.2778 4592 H 124.9450 108.1250 139.6370 H 281 PHE281 0.1312 4593 HA 125.1320 105.9090 137.8540 H 281 PHE281 0.0560 4594 HB1 123.0750 106.7290 139.9860 H 281 PHE281 0.0333 4595 HB2 124.4830 105.7410 140.2530 H 281 PHE281 0.0333 4596 HD1 124.4650 103.6960 138.2080 H 281 PHE281 0.0620 4597 HD2 121.1590 105.4580 140.2830 H 281 PHE281 0.0620 4598 HE1 123.1410 101.6630 137.8340 H 281 PHE281 0.0618 4599 HE2 119.8450 103.4150 139.9140 H 281 PHE281 0.0618 4600 HZ 120.8290 101.5110 138.6890 H 281 PHE281 0.0618 4601 N 122.5430 107.9100 137.3410 N.am 282 LEU282 -0.2456 4602 CA 121.5640 108.2670 136.3200 C.3 282 LEU282 0.0880 4603 CB 120.4920 109.2290 136.8530 C.3 282 LEU282 -0.0266 4604 CG 119.5920 108.6650 137.9730 C.3 282 LEU282 -0.0449 4605 CD1 118.2390 109.3820 137.9560 C.3 282 LEU282 -0.0626 4606 CD2 119.3510 107.1510 137.8890 C.3 282 LEU282 -0.0626 4607 C 122.2420 108.8430 135.0820 C.2 282 LEU282 0.2187 4608 O 121.7800 108.6230 133.9560 O.2 282 LEU282 -0.2778 4609 H 122.6260 108.4760 138.1860 H 282 LEU282 0.1312 4610 HA 121.0770 107.3460 136.0150 H 282 LEU282 0.0557 4611 HB1 119.8550 109.5080 136.0140 H 282 LEU282 0.0287 4612 HB2 120.9560 110.1560 137.1950 H 282 LEU282 0.0287 4613 HG 120.0770 108.8600 138.9300 H 282 LEU282 0.0296 4614 HD11 117.6090 109.0470 138.7780 H 282 LEU282 0.0232 4615 HD12 117.7040 109.1580 137.0360 H 282 LEU282 0.0232 4616 HD13 118.3560 110.4640 138.0240 H 282 LEU282 0.0232 4617 HD21 118.6900 106.8240 138.6890 H 282 LEU282 0.0232 4618 HD22 120.2760 106.5890 138.0010 H 282 LEU282 0.0232 4619 HD23 118.8920 106.8730 136.9400 H 282 LEU282 0.0232 4620 N 123.3340 109.5900 135.2700 N.am 283 LEU283 -0.2456 4621 CA 124.1020 110.0720 134.1260 C.3 283 LEU283 0.0880 4622 CB 125.1640 111.0540 134.6490 C.3 283 LEU283 -0.0266 4623 CG 125.9780 111.7750 133.5540 C.3 283 LEU283 -0.0449 4624 CD1 126.3150 113.2090 133.9840 C.3 283 LEU283 -0.0626 4625 CD2 127.2670 111.0200 133.1970 C.3 283 LEU283 -0.0626 4626 C 124.7220 108.9150 133.3530 C.2 283 LEU283 0.2187 4627 O 124.7420 108.9240 132.1160 O.2 283 LEU283 -0.2778 4628 H 123.6320 109.8240 136.2170 H 283 LEU283 0.1312 4629 HA 123.4070 110.5940 133.4660 H 283 LEU283 0.0557 4630 HB1 125.8350 110.5530 135.3460 H 283 LEU283 0.0287 4631 HB2 124.6360 111.8020 135.2420 H 283 LEU283 0.0287 4632 HG 125.3640 111.8460 132.6550 H 283 LEU283 0.0296 4633 HD11 126.9050 113.7200 133.2230 H 283 LEU283 0.0232 4634 HD12 126.8850 113.2150 134.9130 H 283 LEU283 0.0232 4635 HD13 125.4090 113.7920 134.1470 H 283 LEU283 0.0232 4636 HD21 127.8180 111.5490 132.4200 H 283 LEU283 0.0232 4637 HD22 127.0670 110.0190 132.8180 H 283 LEU283 0.0232 4638 HD23 127.9220 110.9220 134.0630 H 283 LEU283 0.0232 4639 N 125.2430 107.9140 134.0660 N.am 284 LEU284 -0.2456 4640 CA 125.8630 106.7710 133.4030 C.3 284 LEU284 0.0880 4641 CB 126.5770 105.8790 134.4430 C.3 284 LEU284 -0.0266 4642 CG 128.0970 106.1250 134.5630 C.3 284 LEU284 -0.0449 4643 CD1 128.8370 105.6720 133.2980 C.3 284 LEU284 -0.0626 4644 CD2 128.4670 107.5720 134.9240 C.3 284 LEU284 -0.0626 4645 C 124.8430 105.9900 132.5850 C.2 284 LEU284 0.2187 4646 O 125.1220 105.5750 131.4540 O.2 284 LEU284 -0.2778 4647 H 125.2070 107.9480 135.0850 H 284 LEU284 0.1312 4648 HA 126.5820 107.1760 132.6910 H 284 LEU284 0.0557 4649 HB1 126.4400 104.8250 134.1950 H 284 LEU284 0.0287 4650 HB2 126.1010 105.9980 135.4170 H 284 LEU284 0.0287 4651 HG 128.4560 105.4930 135.3760 H 284 LEU284 0.0296 4652 HD11 129.9170 105.7400 133.4310 H 284 LEU284 0.0232 4653 HD12 128.5700 106.2910 132.4440 H 284 LEU284 0.0232 4654 HD13 128.6000 104.6380 133.0480 H 284 LEU284 0.0232 4655 HD21 129.5490 107.7030 134.9450 H 284 LEU284 0.0232 4656 HD22 128.1000 107.8420 135.9120 H 284 LEU284 0.0232 4657 HD23 128.0650 108.2850 134.2040 H 284 LEU284 0.0232 4658 N 123.6470 105.7800 133.1410 N.am 285 MET285 -0.2456 4659 CA 122.6210 105.0410 132.4140 C.3 285 MET285 0.0885 4660 CB 121.5340 104.4770 133.3490 C.3 285 MET285 -0.0199 4661 CG 120.4360 105.4780 133.7320 C.3 285 MET285 -0.0047 4662 SD 119.1470 104.7370 134.7540 S.3 285 MET285 -0.1641 4663 CE 120.1260 104.2930 136.1990 C.3 285 MET285 -0.0181 4664 C 122.0170 105.8740 131.2910 C.2 285 MET285 0.2187 4665 O 121.4420 105.3160 130.3490 O.2 285 MET285 -0.2778 4666 H 123.4510 106.1370 134.0760 H 285 MET285 0.1312 4667 HA 123.1260 104.1900 131.9570 H 285 MET285 0.0557 4668 HB1 122.0080 104.0740 134.2440 H 285 MET285 0.0293 4669 HB2 121.0570 103.6300 132.8550 H 285 MET285 0.0293 4670 HG1 119.9560 105.8880 132.8450 H 285 MET285 0.0377 4671 HG2 120.8880 106.3100 134.2590 H 285 MET285 0.0377 4672 HE1 119.4960 104.3120 137.0890 H 285 MET285 0.0340 4673 HE2 120.9330 105.0080 136.3550 H 285 MET285 0.0340 4674 HE3 120.5520 103.2980 136.0820 H 285 MET285 0.0340 4675 N 122.1280 107.2020 131.3710 N.am 286 ASP286 -0.2451 4676 CA 121.6270 108.0540 130.2980 C.3 286 ASP286 0.0974 4677 CB 121.7290 109.5250 130.8100 C.3 286 ASP286 0.0576 4678 CG 120.4070 110.3380 130.8030 C.2 286 ASP286 0.1780 4679 OD1 119.6950 110.4460 131.8120 O.co2 286 ASP286 -0.6478 4680 OD2 120.0830 110.8900 129.7620 O.co2 286 ASP286 -0.6478 4681 C 122.4120 107.8330 129.0120 C.2 286 ASP286 0.2192 4682 O 121.8310 107.6990 127.9290 O.2 286 ASP286 -0.2778 4683 H 122.5670 107.6240 132.1890 H 286 ASP286 0.1312 4684 HA 120.5870 107.7740 130.1240 H 286 ASP286 0.0563 4685 HB1 122.4600 110.0900 130.2310 H 286 ASP286 0.0394 4686 HB2 122.1140 109.5530 131.8240 H 286 ASP286 0.0394 4687 N 123.7420 107.7890 129.1130 N.am 287 TYR287 -0.2453 4688 CA 124.5680 107.5580 127.9360 C.3 287 TYR287 0.0917 4689 CB 125.9960 108.0700 128.1840 C.3 287 TYR287 -0.0036 4690 CG 126.8080 108.1960 126.9150 C.ar 287 TYR287 -0.0453 4691 CD1 126.3860 109.0170 125.8700 C.ar 287 TYR287 -0.0561 4692 CD2 128.0170 107.5200 126.7830 C.ar 287 TYR287 -0.0561 4693 CE1 127.1500 109.1480 124.7160 C.ar 287 TYR287 -0.0317 4694 CE2 128.7960 107.6760 125.6440 C.ar 287 TYR287 -0.0317 4695 CZ 128.3590 108.4800 124.6040 C.ar 287 TYR287 0.0726 4696 OH 129.1390 108.6350 123.4770 O.3 287 TYR287 -0.3598 4697 C 124.5450 106.1010 127.4910 C.2 287 TYR287 0.2190 4698 O 124.6390 105.8320 126.2890 O.2 287 TYR287 -0.2778 4699 H 124.1840 107.9180 130.0230 H 287 TYR287 0.1312 4700 HA 124.1180 108.1420 127.1320 H 287 TYR287 0.0560 4701 HB1 126.5090 107.4270 128.9010 H 287 TYR287 0.0333 4702 HB2 125.9500 109.0580 128.6440 H 287 TYR287 0.0333 4703 HD1 125.4570 109.5620 125.9460 H 287 TYR287 0.0621 4704 HD2 128.3670 106.8740 127.5720 H 287 TYR287 0.0621 4705 HE1 126.8200 109.7830 123.9080 H 287 TYR287 0.0643 4706 HE2 129.7470 107.1740 125.5670 H 287 TYR287 0.0643 4707 HH 129.8840 108.0510 123.5350 H 287 TYR287 0.2173 4708 N 124.4380 105.1590 128.4300 N.am 288 ILE288 -0.2454 4709 CA 124.3010 103.7550 128.0570 C.3 288 ILE288 0.0903 4710 CB 124.4010 102.8680 129.3180 C.3 288 ILE288 -0.0201 4711 CG1 125.8250 102.8610 129.9090 C.3 288 ILE288 -0.0514 4712 CG2 123.8900 101.4280 129.1080 C.3 288 ILE288 -0.0605 4713 CD1 126.8510 102.1000 129.0600 C.3 288 ILE288 -0.0650 4714 C 122.9850 103.5250 127.3240 C.2 288 ILE288 0.2187 4715 O 122.9390 102.8180 126.3090 O.2 288 ILE288 -0.2778 4716 H 124.4520 105.4220 129.4150 H 288 ILE288 0.1312 4717 HA 125.1060 103.5210 127.3580 H 288 ILE288 0.0560 4718 HB 123.7500 103.3160 130.0670 H 288 ILE288 0.0318 4719 HG11 125.7910 102.4120 130.9020 H 288 ILE288 0.0266 4720 HG12 126.1790 103.8800 130.0550 H 288 ILE288 0.0266 4721 HG21 124.0820 100.8110 129.9860 H 288 ILE288 0.0233 4722 HG22 124.3690 100.9540 128.2510 H 288 ILE288 0.0233 4723 HG23 122.8140 101.4060 128.9340 H 288 ILE288 0.0233 4724 HD11 127.8050 102.0520 129.5800 H 288 ILE288 0.0230 4725 HD12 127.0190 102.5870 128.0990 H 288 ILE288 0.0230 4726 HD13 126.5420 101.0730 128.8710 H 288 ILE288 0.0230 4727 N 121.8990 104.1230 127.8190 N.am 289 GLY289 -0.2485 4728 CA 120.6020 103.9280 127.1960 C.3 289 GLY289 0.0765 4729 C 120.5110 104.4860 125.7900 C.2 289 GLY289 0.2155 4730 O 119.8970 103.8670 124.9160 O.2 289 GLY289 -0.2781 4731 H 121.9810 104.7210 128.6410 H 289 GLY289 0.1309 4732 HA1 119.8890 104.4630 127.8190 H 289 GLY289 0.0521 4733 HA2 120.3590 102.8670 127.2020 H 289 GLY289 0.0521 4734 N 121.1040 105.6590 125.5520 N.am 290 ILE290 -0.2456 4735 CA 121.0340 106.2640 124.2240 C.3 290 ILE290 0.0903 4736 CB 121.4820 107.7440 124.2560 C.3 290 ILE290 -0.0201 4737 CG1 120.8500 108.5760 123.1220 C.3 290 ILE290 -0.0514 4738 CG2 123.0070 107.9140 124.2560 C.3 290 ILE290 -0.0605 4739 CD1 119.3500 108.8330 123.3180 C.3 290 ILE290 -0.0650 4740 C 121.7730 105.4020 123.2070 C.2 290 ILE290 0.2189 4741 O 121.4410 105.3990 122.0150 O.2 290 ILE290 -0.2778 4742 H 121.6080 106.1340 126.3010 H 290 ILE290 0.1312 4743 HA 119.9810 106.2270 123.9450 H 290 ILE290 0.0560 4744 HB 121.1220 108.1670 125.1950 H 290 ILE290 0.0318 4745 HG11 121.0260 108.1040 122.1540 H 290 ILE290 0.0266 4746 HG12 121.3410 109.5470 123.0710 H 290 ILE290 0.0266 4747 HG21 123.2870 108.9510 124.4330 H 290 ILE290 0.0233 4748 HG22 123.4500 107.6040 123.3100 H 290 ILE290 0.0233 4749 HG23 123.4540 107.3260 125.0460 H 290 ILE290 0.0233 4750 HD11 118.9890 109.5650 122.5960 H 290 ILE290 0.0230 4751 HD12 119.1480 109.2360 124.3100 H 290 ILE290 0.0230 4752 HD13 118.7630 107.9240 123.1880 H 290 ILE290 0.0230 4753 N 122.7870 104.6590 123.6580 N.am 291 ASN291 -0.2452 4754 CA 123.4180 103.6720 122.7900 C.3 291 ASN291 0.0957 4755 CB 124.7210 103.1430 123.4260 C.3 291 ASN291 0.0446 4756 CG 125.7190 104.2200 123.8740 C.2 291 ASN291 0.2000 4757 OD1 126.3730 104.0740 124.8980 O.2 291 ASN291 -0.2797 4758 ND2 125.8150 105.2900 123.0700 N.am 291 ASN291 -0.2723 4759 C 122.4980 102.4780 122.5700 C.2 291 ASN291 0.2191 4760 O 122.4440 101.9190 121.4680 O.2 291 ASN291 -0.2778 4761 H 123.1220 104.7820 124.6140 H 291 ASN291 0.1312 4762 HA 123.6190 104.1460 121.8270 H 291 ASN291 0.0562 4763 HB1 125.2400 102.4840 122.7300 H 291 ASN291 0.0375 4764 HB2 124.4970 102.5470 124.3110 H 291 ASN291 0.0375 4765 HD21 126.4750 106.0010 123.3100 H 291 ASN291 0.1266 4766 HD22 125.2560 105.4000 122.2490 H 291 ASN291 0.1266 4767 N 121.7720 102.0690 123.6140 N.am 292 LEU292 -0.2456 4768 CA 120.8190 100.9730 123.4750 C.3 292 LEU292 0.0880 4769 CB 120.2860 100.5440 124.8540 C.3 292 LEU292 -0.0266 4770 CG 121.3570 99.8850 125.7460 C.3 292 LEU292 -0.0449 4771 CD1 120.8620 99.7490 127.1910 C.3 292 LEU292 -0.0626 4772 CD2 121.7880 98.5140 125.2040 C.3 292 LEU292 -0.0626 4773 C 119.6860 101.3440 122.5260 C.2 292 LEU292 0.2187 4774 O 119.2640 100.5250 121.7010 O.2 292 LEU292 -0.2778 4775 H 121.8850 102.5280 124.5180 H 292 LEU292 0.1312 4776 HA 121.3550 100.1470 123.0090 H 292 LEU292 0.0557 4777 HB1 119.4560 99.8460 124.7320 H 292 LEU292 0.0287 4778 HB2 119.8690 101.4120 125.3620 H 292 LEU292 0.0287 4779 HG 122.2400 100.5230 125.7690 H 292 LEU292 0.0296 4780 HD11 121.6080 99.2580 127.8170 H 292 LEU292 0.0232 4781 HD12 119.9430 99.1640 127.2420 H 292 LEU292 0.0232 4782 HD13 120.6670 100.7250 127.6310 H 292 LEU292 0.0232 4783 HD21 122.4980 98.0350 125.8780 H 292 LEU292 0.0232 4784 HD22 122.2770 98.6000 124.2350 H 292 LEU292 0.0232 4785 HD23 120.9330 97.8470 125.0930 H 292 LEU292 0.0232 4786 N 119.1760 102.5730 122.6330 N.am 293 ALA293 -0.2459 4787 CA 118.1360 103.0220 121.7140 C.3 293 ALA293 0.0850 4788 CB 117.7010 104.4260 122.1460 C.3 293 ALA293 -0.0411 4789 C 118.6500 103.0610 120.2810 C.2 293 ALA293 0.2185 4790 O 117.9270 102.7020 119.3430 O.2 293 ALA293 -0.2778 4791 H 119.5150 103.2010 123.3610 H 293 ALA293 0.1312 4792 HA 117.2990 102.3240 121.7710 H 293 ALA293 0.0554 4793 HB1 117.0500 104.8860 121.4060 H 293 ALA293 0.0249 4794 HB2 118.5590 105.0850 122.2820 H 293 ALA293 0.0249 4795 HB3 117.1520 104.3860 123.0850 H 293 ALA293 0.0249 4796 N 119.8930 103.5080 120.0900 N.am 294 THR294 -0.2434 4797 CA 120.4700 103.5450 118.7510 C.3 294 THR294 0.1135 4798 CB 121.8420 104.2540 118.8130 C.3 294 THR294 0.0763 4799 OG1 121.7060 105.6030 119.2160 O.3 294 THR294 -0.3900 4800 CG2 122.5670 104.2960 117.4600 C.3 294 THR294 -0.0370 4801 C 120.6430 102.1440 118.1740 C.2 294 THR294 0.2212 4802 O 120.3470 101.9200 116.9950 O.2 294 THR294 -0.2777 4803 H 120.4440 103.8260 120.8870 H 294 THR294 0.1313 4804 HA 119.7850 104.1040 118.1100 H 294 THR294 0.0583 4805 HB 122.4950 103.7350 119.5240 H 294 THR294 0.0611 4806 HG1 121.2400 105.6610 120.0460 H 294 THR294 0.2098 4807 HG21 123.5150 104.8270 117.5450 H 294 THR294 0.0255 4808 HG22 121.9610 104.8110 116.7170 H 294 THR294 0.0255 4809 HG23 122.7880 103.2990 117.0800 H 294 THR294 0.0255 4810 N 121.1050 101.1880 118.9860 N.am 295 MET295 -0.2456 4811 CA 121.2930 99.8310 118.4790 C.3 295 MET295 0.0886 4812 CB 122.0290 99.0630 119.5990 C.3 295 MET295 -0.0199 4813 CG 121.9560 97.5300 119.5360 C.3 295 MET295 -0.0047 4814 SD 120.4280 96.9010 120.2670 S.3 295 MET295 -0.1641 4815 CE 120.7290 97.2860 122.0030 C.3 295 MET295 -0.0181 4816 C 119.9580 99.1830 118.1300 C.2 295 MET295 0.2187 4817 O 119.8930 98.3270 117.2400 O.2 295 MET295 -0.2778 4818 H 121.3260 101.4060 119.9580 H 295 MET295 0.1312 4819 HA 121.8940 99.8760 117.5710 H 295 MET295 0.0557 4820 HB1 121.6500 99.3870 120.5690 H 295 MET295 0.0293 4821 HB2 123.0750 99.3650 119.5900 H 295 MET295 0.0293 4822 HG1 122.7890 97.1100 120.1010 H 295 MET295 0.0377 4823 HG2 122.0620 97.1590 118.5160 H 295 MET295 0.0377 4824 HE1 120.3960 96.4550 122.6240 H 295 MET295 0.0340 4825 HE2 120.1680 98.1720 122.3000 H 295 MET295 0.0340 4826 HE3 121.7900 97.4400 122.1960 H 295 MET295 0.0340 4827 N 118.8780 99.5890 118.8040 N.am 296 ASN296 -0.2452 4828 CA 117.5480 99.1780 118.3630 C.3 296 ASN296 0.0957 4829 CB 116.5160 99.7010 119.3720 C.3 296 ASN296 0.0446 4830 CG 115.2180 98.8920 119.3170 C.2 296 ASN296 0.2000 4831 OD1 114.1680 99.3800 118.9290 O.2 296 ASN296 -0.2797 4832 ND2 115.3510 97.6250 119.7360 N.am 296 ASN296 -0.2723 4833 C 117.2540 99.7070 116.9660 C.2 296 ASN296 0.2192 4834 O 116.6890 98.9960 116.1270 O.2 296 ASN296 -0.2778 4835 H 118.9830 100.1850 119.6250 H 296 ASN296 0.1312 4836 HA 117.5610 98.0870 118.3260 H 296 ASN296 0.0562 4837 HB1 116.2840 100.7540 119.2130 H 296 ASN296 0.0375 4838 HB2 116.9160 99.6240 120.3800 H 296 ASN296 0.0375 4839 HD21 114.5400 97.0410 119.7410 H 296 ASN296 0.1266 4840 HD22 116.2240 97.2530 120.0450 H 296 ASN296 0.1266 4841 N 117.6340 100.9590 116.7010 N.am 297 SER297 -0.2436 4842 CA 117.4850 101.5170 115.3610 C.3 297 SER297 0.1109 4843 CB 117.6460 103.0440 115.2860 C.3 297 SER297 0.0681 4844 OG 118.9750 103.4960 115.5270 O.3 297 SER297 -0.3930 4845 C 118.3530 100.7740 114.3530 C.2 297 SER297 0.2209 4846 O 117.9430 100.5630 113.2060 O.2 297 SER297 -0.2777 4847 H 118.0330 101.5320 117.4440 H 297 SER297 0.1312 4848 HA 116.4510 101.3120 115.0710 H 297 SER297 0.0580 4849 HB1 116.9510 103.5050 115.9960 H 297 SER297 0.0577 4850 HB2 117.3280 103.3590 114.2860 H 297 SER297 0.0577 4851 HG 119.0270 104.4420 115.4290 H 297 SER297 0.2095 4852 N 119.5630 100.3790 114.7590 N.am 298 CYS298 -0.2448 4853 CA 120.4690 99.6760 113.8580 C.3 298 CYS298 0.0965 4854 CB 121.8560 99.6450 114.5100 C.3 298 CYS298 0.0147 4855 SG 123.1500 98.9250 113.4660 S.3 298 CYS298 -0.1762 4856 C 120.0060 98.2570 113.5490 C.2 298 CYS298 0.2195 4857 O 120.2300 97.7760 112.4330 O.2 298 CYS298 -0.2778 4858 H 119.8580 100.5730 115.7160 H 298 CYS298 0.1312 4859 HA 120.5050 100.2400 112.9240 H 298 CYS298 0.0565 4860 HB1 121.8110 99.0820 115.4420 H 298 CYS298 0.0394 4861 HB2 122.1520 100.6600 114.7770 H 298 CYS298 0.0394 4862 HG 124.2930 98.8670 114.1520 H 298 CYS298 0.1017 4863 N 119.3740 97.5760 114.5060 N.am 299 ILE299 -0.2454 4864 CA 118.8990 96.2150 114.2770 C.3 299 ILE299 0.0903 4865 CB 118.7710 95.5000 115.6450 C.3 299 ILE299 -0.0201 4866 CG1 120.1660 95.2850 116.2670 C.3 299 ILE299 -0.0514 4867 CG2 118.0070 94.1610 115.5650 C.3 299 ILE299 -0.0605 4868 CD1 120.1160 94.7610 117.7060 C.3 299 ILE299 -0.0650 4869 C 117.5830 96.1770 113.5020 C.2 299 ILE299 0.2189 4870 O 117.3040 95.1810 112.8190 O.2 299 ILE299 -0.2778 4871 H 119.2200 98.0140 115.4140 H 299 ILE299 0.1312 4872 HA 119.6500 95.6970 113.6830 H 299 ILE299 0.0560 4873 HB 118.2040 96.1580 116.3070 H 299 ILE299 0.0318 4874 HG11 120.7230 96.2210 116.2670 H 299 ILE299 0.0266 4875 HG12 120.7450 94.5970 115.6490 H 299 ILE299 0.0266 4876 HG21 117.9390 93.6770 116.5380 H 299 ILE299 0.0233 4877 HG22 118.4940 93.4690 114.8790 H 299 ILE299 0.0233 4878 HG23 116.9790 94.2990 115.2290 H 299 ILE299 0.0233 4879 HD11 121.1030 94.7980 118.1670 H 299 ILE299 0.0230 4880 HD12 119.7770 93.7270 117.7470 H 299 ILE299 0.0230 4881 HD13 119.4370 95.3610 118.3110 H 299 ILE299 0.0230 4882 N 116.7910 97.2480 113.5510 N.am 300 ASN300 -0.2452 4883 CA 115.4930 97.2770 112.8760 C.3 300 ASN300 0.0959 4884 CB 114.8950 98.6780 113.1130 C.3 300 ASN300 0.0446 4885 CG 113.4160 98.7770 112.7140 C.2 300 ASN300 0.2000 4886 OD1 112.6970 97.7900 112.5990 O.2 300 ASN300 -0.2797 4887 ND2 113.0140 100.0380 112.5130 N.am 300 ASN300 -0.2723 4888 C 115.5570 96.9410 111.3870 C.2 300 ASN300 0.2218 4889 O 114.7550 96.1060 110.9380 O.2 300 ASN300 -0.2776 4890 H 117.0980 98.0690 114.0730 H 300 ASN300 0.1312 4891 HA 114.8830 96.5190 113.3700 H 300 ASN300 0.0562 4892 HB1 115.4600 99.4450 112.5810 H 300 ASN300 0.0375 4893 HB2 114.9580 98.9340 114.1710 H 300 ASN300 0.0375 4894 HD21 112.0740 100.2520 112.2590 H 300 ASN300 0.1266 4895 HD22 113.6480 100.8120 112.6140 H 300 ASN300 0.1266 4896 N 116.4570 97.5270 110.5670 N.am 301 PRO301 -0.2316 4897 CA 116.4300 97.2030 109.1330 C.3 301 PRO301 0.0907 4898 HA 115.4022 97.2544 108.7704 H 301 PRO301 0.0559 4899 CD 117.4471 98.5481 110.9078 C.3 301 PRO301 0.0071 4900 HD1 118.0562 98.2410 111.7439 H 301 PRO301 0.0431 4901 HD2 116.9176 99.4725 111.1319 H 301 PRO301 0.0431 4902 CB 117.2920 98.3146 108.5164 C.3 301 PRO301 -0.0276 4903 HB1 116.6573 99.1708 108.2847 H 301 PRO301 0.0285 4904 HB2 117.7972 98.0289 107.5923 H 301 PRO301 0.0285 4905 CG 118.2615 98.7122 109.6259 C.3 301 PRO301 -0.0379 4906 HG1 119.1110 98.0292 109.6399 H 301 PRO301 0.0278 4907 HG2 118.6518 99.7227 109.5046 H 301 PRO301 0.0278 4908 C 117.0100 95.8340 108.8150 C.2 301 PRO301 0.2189 4909 O 116.4940 95.1310 107.9400 O.2 301 PRO301 -0.2778 4910 N 118.0810 95.4400 109.5100 N.am 302 ILE302 -0.2454 4911 CA 118.7000 94.1500 109.2270 C.3 302 ILE302 0.0903 4912 CB 120.1460 94.1050 109.7710 C.3 302 ILE302 -0.0201 4913 CG1 120.2790 94.3880 111.2830 C.3 302 ILE302 -0.0514 4914 CG2 121.0200 95.0970 108.9850 C.3 302 ILE302 -0.0605 4915 CD1 119.9290 93.2050 112.1960 C.3 302 ILE302 -0.0650 4916 C 117.8250 92.9920 109.6890 C.2 302 ILE302 0.2189 4917 O 117.9850 91.8680 109.2010 O.2 302 ILE302 -0.2778 4918 H 118.4660 96.0410 110.2390 H 302 ILE302 0.1312 4919 HA 118.7530 94.0610 108.1400 H 302 ILE302 0.0560 4920 HB 120.5530 93.1120 109.5760 H 302 ILE302 0.0318 4921 HG11 119.6970 95.2660 111.5550 H 302 ILE302 0.0266 4922 HG12 121.3160 94.6530 111.4950 H 302 ILE302 0.0266 4923 HG21 122.0660 95.0200 109.2820 H 302 ILE302 0.0233 4924 HG22 120.7050 96.1270 109.1550 H 302 ILE302 0.0233 4925 HG23 120.9690 94.9050 107.9130 H 302 ILE302 0.0233 4926 HD11 120.2420 93.4100 113.2200 H 302 ILE302 0.0230 4927 HD12 120.4340 92.2940 111.8740 H 302 ILE302 0.0230 4928 HD13 118.8610 93.0080 112.2280 H 302 ILE302 0.0230 4929 N 116.9050 93.2360 110.6260 N.am 303 ALA303 -0.2459 4930 CA 115.9690 92.1910 111.0310 C.3 303 ALA303 0.0850 4931 CB 115.1580 92.7010 112.2270 C.3 303 ALA303 -0.0411 4932 C 115.0510 91.8030 109.8800 C.2 303 ALA303 0.2184 4933 O 114.7480 90.6190 109.6890 O.2 303 ALA303 -0.2778 4934 H 116.8560 94.1570 111.0610 H 303 ALA303 0.1312 4935 HA 116.5580 91.3190 111.3190 H 303 ALA303 0.0554 4936 HB1 114.4550 91.9450 112.5790 H 303 ALA303 0.0249 4937 HB2 114.5920 93.5980 111.9720 H 303 ALA303 0.0249 4938 HB3 115.8150 92.9550 113.0590 H 303 ALA303 0.0249 4939 N 114.5930 92.7900 109.1060 N.am 304 LEU304 -0.2457 4940 CA 113.7500 92.5010 107.9500 C.3 304 LEU304 0.0880 4941 CB 113.2810 93.8550 107.3880 C.3 304 LEU304 -0.0266 4942 CG 112.3370 93.7810 106.1750 C.3 304 LEU304 -0.0449 4943 CD1 111.0930 92.9270 106.4550 C.3 304 LEU304 -0.0626 4944 CD2 111.9350 95.1980 105.7420 C.3 304 LEU304 -0.0626 4945 C 114.5070 91.6930 106.9030 C.2 304 LEU304 0.2187 4946 O 113.9310 90.8210 106.2430 O.2 304 LEU304 -0.2778 4947 H 114.8350 93.7560 109.3250 H 304 LEU304 0.1312 4948 HA 112.8970 91.9320 108.3140 H 304 LEU304 0.0557 4949 HB1 114.1530 94.4520 107.1210 H 304 LEU304 0.0287 4950 HB2 112.7860 94.4050 108.1890 H 304 LEU304 0.0287 4951 HG 112.8770 93.3220 105.3460 H 304 LEU304 0.0296 4952 HD11 110.4190 92.9290 105.5990 H 304 LEU304 0.0232 4953 HD12 110.5420 93.3030 107.3170 H 304 LEU304 0.0232 4954 HD13 111.3590 91.8880 106.6510 H 304 LEU304 0.0232 4955 HD21 111.2530 95.1750 104.8930 H 304 LEU304 0.0232 4956 HD22 112.8090 95.7820 105.4500 H 304 LEU304 0.0232 4957 HD23 111.4350 95.7320 106.5500 H 304 LEU304 0.0232 4958 N 115.8000 91.9790 106.7300 N.am 305 TYR305 -0.2453 4959 CA 116.6100 91.2210 105.7820 C.3 305 TYR305 0.0917 4960 CB 117.9850 91.9070 105.7750 C.3 305 TYR305 -0.0036 4961 CG 118.8620 91.4150 104.6630 C.ar 305 TYR305 -0.0453 4962 CD1 118.7280 91.9680 103.3990 C.ar 305 TYR305 -0.0561 4963 CD2 119.8060 90.4130 104.8730 C.ar 305 TYR305 -0.0561 4964 CE1 119.5160 91.5190 102.3560 C.ar 305 TYR305 -0.0317 4965 CE2 120.6000 89.9650 103.8240 C.ar 305 TYR305 -0.0317 4966 CZ 120.4490 90.5150 102.5590 C.ar 305 TYR305 0.0726 4967 OH 121.2180 90.0690 101.5020 O.3 305 TYR305 -0.3598 4968 C 116.7520 89.7660 106.2120 C.2 305 TYR305 0.2190 4969 O 116.7660 88.8600 105.3700 O.2 305 TYR305 -0.2778 4970 H 116.2260 92.7350 107.2660 H 305 TYR305 0.1312 4971 HA 116.1240 91.2740 104.8070 H 305 TYR305 0.0560 4972 HB1 118.4960 91.7770 106.7300 H 305 TYR305 0.0333 4973 HB2 117.8540 92.9830 105.6560 H 305 TYR305 0.0333 4974 HD1 118.0050 92.7500 103.2200 H 305 TYR305 0.0621 4975 HD2 119.9210 89.9760 105.8540 H 305 TYR305 0.0621 4976 HE1 119.3820 91.9600 101.3860 H 305 TYR305 0.0643 4977 HE2 121.3280 89.1860 103.9900 H 305 TYR305 0.0643 4978 HH 121.9170 89.5190 101.8330 H 305 TYR305 0.2173 4979 N 116.8720 89.5220 107.5180 N.am 306 PHE306 -0.2453 4980 CA 117.1010 88.1640 107.9990 C.3 306 PHE306 0.0917 4981 CB 117.6490 88.2310 109.4390 C.3 306 PHE306 -0.0036 4982 CG 119.1560 88.3200 109.4890 C.ar 306 PHE306 -0.0454 4983 CD1 119.8430 89.3340 108.8240 C.ar 306 PHE306 -0.0585 4984 CD2 119.8900 87.3850 110.2150 C.ar 306 PHE306 -0.0585 4985 CE1 121.2280 89.4120 108.8810 C.ar 306 PHE306 -0.0615 4986 CE2 121.2760 87.4590 110.2740 C.ar 306 PHE306 -0.0615 4987 CZ 121.9470 88.4730 109.6060 C.ar 306 PHE306 -0.0617 4988 C 115.8320 87.3200 107.9360 C.2 306 PHE306 0.2190 4989 O 115.8880 86.1350 107.5850 O.2 306 PHE306 -0.2778 4990 H 116.8030 90.2910 108.1850 H 306 PHE306 0.1312 4991 HA 117.8390 87.6950 107.3450 H 306 PHE306 0.0560 4992 HB1 117.3480 87.3480 110.0050 H 306 PHE306 0.0333 4993 HB2 117.2230 89.0840 109.9700 H 306 PHE306 0.0333 4994 HD1 119.3100 90.0760 108.2530 H 306 PHE306 0.0620 4995 HD2 119.3850 86.5910 110.7460 H 306 PHE306 0.0620 4996 HE1 121.7450 90.2070 108.3630 H 306 PHE306 0.0618 4997 HE2 121.8330 86.7290 110.8430 H 306 PHE306 0.0618 4998 HZ 123.0240 88.5340 109.6550 H 306 PHE306 0.0618 4999 N 114.6820 87.9060 108.2770 N.am 307 VAL307 -0.2454 5000 CA 113.4570 87.1180 108.4100 C.3 307 VAL307 0.0901 5001 CB 112.3430 87.9370 109.1040 C.3 307 VAL307 -0.0227 5002 CG1 112.0050 89.2440 108.3770 C.3 307 VAL307 -0.0608 5003 CG2 111.0610 87.1140 109.3030 C.3 307 VAL307 -0.0608 5004 C 112.9820 86.6230 107.0460 C.2 307 VAL307 0.2190 5005 O 112.5200 85.4840 106.9070 O.2 307 VAL307 -0.2778 5006 H 114.6570 88.9110 108.4460 H 307 VAL307 0.1312 5007 HA 113.6960 86.2490 109.0260 H 307 VAL307 0.0560 5008 HB 112.7180 88.2110 110.0910 H 307 VAL307 0.0315 5009 HG11 111.3410 89.8660 108.9790 H 307 VAL307 0.0233 5010 HG12 111.5120 89.0700 107.4210 H 307 VAL307 0.0233 5011 HG13 112.9060 89.8150 108.1890 H 307 VAL307 0.0233 5012 HG21 110.2890 87.7160 109.7800 H 307 VAL307 0.0233 5013 HG22 111.2450 86.2340 109.9190 H 307 VAL307 0.0233 5014 HG23 110.6440 86.7750 108.3540 H 307 VAL307 0.0233 5015 N 113.0950 87.4630 106.0200 N.am 308 SER308 -0.2436 5016 CA 112.6250 87.1240 104.6850 C.3 308 SER308 0.1109 5017 CB 111.3010 87.8580 104.4120 C.3 308 SER308 0.0681 5018 OG 111.5110 89.2580 104.2730 O.3 308 SER308 -0.3930 5019 C 113.6820 87.4960 103.6570 C.2 308 SER308 0.2209 5020 O 114.4730 88.4200 103.8620 O.2 308 SER308 -0.2777 5021 H 113.5250 88.3750 106.1740 H 308 SER308 0.1312 5022 HA 112.4610 86.0480 104.6220 H 308 SER308 0.0580 5023 HB1 110.6090 87.6440 105.2360 H 308 SER308 0.0577 5024 HB2 110.8470 87.4710 103.4940 H 308 SER308 0.0577 5025 HG 110.6880 89.7410 104.2810 H 308 SER308 0.2095 5026 N 113.6790 86.7750 102.5390 N.am 309 LYS309 -0.2456 5027 CA 114.6110 87.0230 101.4440 C.3 309 LYS309 0.0878 5028 CB 115.3170 85.6850 101.1550 C.3 309 LYS309 -0.0289 5029 CG 116.1390 85.1800 102.3700 C.3 309 LYS309 -0.0496 5030 CD 115.3440 84.4340 103.4760 C.3 309 LYS309 -0.0278 5031 CE 115.6870 84.9170 104.9010 C.3 309 LYS309 0.1103 5032 NZ 114.8820 84.3120 105.9720 N.4 309 LYS309 -0.0749 5033 C 113.8280 87.6340 100.2840 C.2 309 LYS309 0.2187 5034 O 113.4210 86.9490 99.3460 O.2 309 LYS309 -0.2778 5035 H 112.9990 86.0200 102.4440 H 309 LYS309 0.1312 5036 HA 115.3570 87.7560 101.7620 H 309 LYS309 0.0557 5037 HB1 115.9950 85.8270 100.3130 H 309 LYS309 0.0285 5038 HB2 114.5990 84.9240 100.8440 H 309 LYS309 0.0285 5039 HG1 116.6790 86.0250 102.8000 H 309 LYS309 0.0266 5040 HG2 116.9180 84.5080 102.0070 H 309 LYS309 0.0266 5041 HD1 115.5530 83.3660 103.4000 H 309 LYS309 0.0282 5042 HD2 114.2710 84.5120 103.3120 H 309 LYS309 0.0282 5043 HE1 115.5690 86.0010 104.9750 H 309 LYS309 0.0559 5044 HE2 116.7370 84.7120 105.1180 H 309 LYS309 0.0559 5045 HZ1 115.2210 84.6580 106.8950 H 309 LYS309 0.2742 5046 HZ2 114.9630 83.2760 105.9530 H 309 LYS309 0.2742 5047 HZ3 113.8820 84.5900 105.8870 H 309 LYS309 0.2742 5048 N 113.6240 88.9480 100.3600 N.am 310 LYS310 -0.2457 5049 CA 113.0590 89.7130 99.2560 C.3 310 LYS310 0.0878 5050 CB 111.6550 90.2300 99.6560 C.3 310 LYS310 -0.0289 5051 CG 110.9000 90.9720 98.5250 C.3 310 LYS310 -0.0496 5052 CD 109.9500 92.0780 99.0260 C.3 310 LYS310 -0.0278 5053 CE 109.2070 92.7800 97.8720 C.3 310 LYS310 0.1103 5054 NZ 108.5030 94.0120 98.2540 N.4 310 LYS310 -0.0749 5055 C 113.9420 90.9240 98.9970 C.2 310 LYS310 0.2187 5056 O 114.0540 91.3970 97.8610 O.2 310 LYS310 -0.2778 5057 H 113.8720 89.4360 101.2210 H 310 LYS310 0.1312 5058 HA 113.0160 89.1040 98.3520 H 310 LYS310 0.0557 5059 HB1 111.7560 90.8880 100.5220 H 310 LYS310 0.0285 5060 HB2 111.0440 89.3960 100.0010 H 310 LYS310 0.0285 5061 HG1 110.3480 90.2440 97.9290 H 310 LYS310 0.0266 5062 HG2 111.6050 91.4360 97.8360 H 310 LYS310 0.0266 5063 HD1 110.5350 92.8130 99.5820 H 310 LYS310 0.0282 5064 HD2 109.2310 91.6590 99.7320 H 310 LYS310 0.0282 5065 HE1 108.4790 92.0960 97.4290 H 310 LYS310 0.0559 5066 HE2 109.9120 93.0380 97.0790 H 310 LYS310 0.0559 5067 HZ1 108.0120 94.4090 97.4260 H 310 LYS310 0.2742 5068 HZ2 109.1830 94.7220 98.5960 H 310 LYS310 0.2742 5069 HZ3 107.8060 93.8160 99.0010 H 310 LYS310 0.2742 5070 N 114.5720 91.4280 100.0550 N.am 311 PHE311 -0.2453 5071 CA 115.5580 92.4890 99.9190 C.3 311 PHE311 0.0917 5072 CB 115.5920 93.3220 101.2100 C.3 311 PHE311 -0.0036 5073 CG 114.2730 94.0030 101.4650 C.ar 311 PHE311 -0.0454 5074 CD1 113.2880 93.3710 102.2190 C.ar 311 PHE311 -0.0585 5075 CD2 114.0280 95.2780 100.9630 C.ar 311 PHE311 -0.0585 5076 CE1 112.0740 93.9990 102.4590 C.ar 311 PHE311 -0.0615 5077 CE2 112.8200 95.9160 101.2180 C.ar 311 PHE311 -0.0615 5078 CZ 111.8430 95.2760 101.9680 C.ar 311 PHE311 -0.0617 5079 C 116.9300 91.8790 99.6660 C.2 311 PHE311 0.2190 5080 O 117.3570 90.9710 100.3850 O.2 311 PHE311 -0.2778 5081 H 114.3590 91.0620 100.9830 H 311 PHE311 0.1312 5082 HA 115.2820 93.1280 99.0770 H 311 PHE311 0.0560 5083 HB1 116.3740 94.0800 101.1550 H 311 PHE311 0.0333 5084 HB2 115.8380 92.6900 102.0660 H 311 PHE311 0.0333 5085 HD1 113.4690 92.3910 102.6350 H 311 PHE311 0.0620 5086 HD2 114.7890 95.7900 100.3910 H 311 PHE311 0.0620 5087 HE1 111.3280 93.5060 103.0650 H 311 PHE311 0.0618 5088 HE2 112.6550 96.9190 100.8510 H 311 PHE311 0.0618 5089 HZ 110.9170 95.7790 102.2010 H 311 PHE311 0.0618 5090 N 117.5970 92.3340 98.6000 N.am 312 LYS312 -0.2456 5091 CA 118.9280 91.7770 98.2350 C.3 312 LYS312 0.0878 5092 CB 118.9530 91.4850 96.7220 C.3 312 LYS312 -0.0289 5093 CG 117.7010 90.7610 96.1950 C.3 312 LYS312 -0.0496 5094 CD 117.4300 89.4070 96.8640 C.3 312 LYS312 -0.0278 5095 CE 116.1720 88.7410 96.2950 C.3 312 LYS312 0.1103 5096 NZ 115.9010 87.4320 96.8900 N.4 312 LYS312 -0.0749 5097 C 120.0340 92.7730 98.6030 C.2 312 LYS312 0.2187 5098 O 120.0710 93.8480 97.9840 O.2 312 LYS312 -0.2778 5099 H 117.1880 93.0740 98.0290 H 312 LYS312 0.1312 5100 HA 119.1000 90.8520 98.7890 H 312 LYS312 0.0557 5101 HB1 119.8460 90.9070 96.4800 H 312 LYS312 0.0285 5102 HB2 119.0450 92.4210 96.1670 H 312 LYS312 0.0285 5103 HG1 117.8200 90.6120 95.1200 H 312 LYS312 0.0266 5104 HG2 116.8280 91.4060 96.3040 H 312 LYS312 0.0266 5105 HD1 117.3130 89.5420 97.9400 H 312 LYS312 0.0282 5106 HD2 118.2960 88.7580 96.7240 H 312 LYS312 0.0282 5107 HE1 116.2730 88.6080 95.2150 H 312 LYS312 0.0559 5108 HE2 115.3000 89.3780 96.4600 H 312 LYS312 0.0559 5109 HZ1 115.0540 87.0120 96.4550 H 312 LYS312 0.2742 5110 HZ2 115.7430 87.5360 97.9120 H 312 LYS312 0.2742 5111 HZ3 116.7140 86.8020 96.7300 H 312 LYS312 0.2742 5112 N 120.8919 92.3698 99.5578 N.am 313 ASN313 -0.2436 5113 CA 121.9710 93.2068 100.0880 C.3 313 ASN313 0.1085 5114 CB 122.8845 93.7662 98.9841 C.3 313 ASN313 0.0463 5115 CG 123.4460 92.6323 98.1153 C.2 313 ASN313 0.2000 5116 OD1 123.0246 92.3986 96.9890 O.2 313 ASN313 -0.2797 5117 ND2 124.4298 91.9421 98.7124 N.am 313 ASN313 -0.2723 5118 C 121.4635 94.3314 101.0201 C.2 313 ASN313 0.1948 5119 O 120.2585 94.4542 101.2400 O.co2 313 ASN313 -0.6467 5120 OXT 122.3018 95.0763 101.5231 O.co2 313 ASN313 -0.6467 5121 H 120.7938 91.4636 99.9639 H 313 ASN313 0.1312 5122 HA 122.5425 92.5401 100.7320 H 313 ASN313 0.0581 5123 HB1 123.7205 94.3093 99.4248 H 313 ASN313 0.0376 5124 HB2 122.3567 94.4736 98.3480 H 313 ASN313 0.0376 5125 HD21 124.8717 91.1870 98.2318 H 313 ASN313 0.1266 5126 HD22 124.7171 92.1850 99.6386 H 313 ASN313 0.1266 @BOND 1 1 2 1 2 1 11 1 3 1 12 1 4 1 13 1 5 2 5 1 6 2 9 1 7 2 14 1 8 3 4 ar 9 3 8 ar 10 4 5 1 11 4 7 ar 12 5 15 1 13 5 16 1 14 6 8 ar 15 6 7 ar 16 6 17 1 17 7 18 1 18 8 19 1 19 9 10 2 20 9 20 am 21 20 21 1 22 20 28 1 23 21 22 1 24 21 26 1 25 21 29 1 26 22 23 1 27 22 30 1 28 22 31 1 29 23 24 2 30 23 25 am 31 25 32 1 32 25 33 1 33 26 27 2 34 26 34 am 35 34 35 1 36 34 46 1 37 35 36 1 38 35 44 1 39 35 47 1 40 36 37 1 41 36 48 1 42 36 49 1 43 37 38 ar 44 37 39 ar 45 38 40 ar 46 38 50 1 47 39 41 ar 48 39 51 1 49 40 42 ar 50 40 52 1 51 41 42 ar 52 41 53 1 53 42 43 1 54 43 54 1 55 44 45 2 56 44 55 am 57 55 56 1 58 55 61 1 59 56 57 1 60 56 59 1 61 56 62 1 62 57 58 1 63 57 63 1 64 57 64 1 65 58 65 1 66 59 60 2 67 59 66 am 68 66 68 1 69 66 67 1 70 67 69 1 71 67 71 1 72 67 73 1 73 68 70 1 74 68 74 1 75 68 75 1 76 69 70 1 77 69 76 1 78 69 77 1 79 70 78 1 80 70 79 1 81 71 72 2 82 71 80 am 83 80 81 1 84 80 89 1 85 81 82 1 86 81 87 1 87 81 90 1 88 82 83 1 89 82 91 1 90 82 92 1 91 83 84 1 92 83 93 1 93 83 94 1 94 84 85 2 95 84 86 am 96 86 95 1 97 86 96 1 98 87 88 2 99 87 97 am 100 97 98 1 101 97 106 1 102 98 99 1 103 98 104 1 104 98 107 1 105 99 100 1 106 99 108 1 107 99 109 1 108 100 101 1 109 100 110 1 110 100 111 1 111 101 102 2 112 101 103 am 113 103 112 1 114 103 113 1 115 104 105 2 116 104 114 am 117 114 115 1 118 114 121 1 119 115 116 1 120 115 119 1 121 115 122 1 122 116 118 1 123 116 117 1 124 116 123 1 125 117 124 1 126 118 125 1 127 118 126 1 128 118 127 1 129 119 120 2 130 119 128 am 131 128 129 1 132 128 137 1 133 129 130 1 134 129 135 1 135 129 138 1 136 130 131 1 137 130 139 1 138 130 140 1 139 131 132 1 140 131 141 1 141 131 142 1 142 132 133 1 143 132 143 1 144 132 144 1 145 133 134 1 146 133 145 1 147 133 146 1 148 134 147 1 149 134 148 1 150 134 149 1 151 135 136 2 152 135 150 am 153 150 151 1 154 150 158 1 155 151 152 1 156 151 156 1 157 151 159 1 158 152 154 1 159 152 153 1 160 152 160 1 161 153 155 1 162 153 161 1 163 153 162 1 164 154 163 1 165 154 164 1 166 154 165 1 167 155 166 1 168 155 167 1 169 155 168 1 170 156 157 2 171 156 169 am 172 169 170 1 173 169 176 1 174 170 171 1 175 170 174 1 176 170 177 1 177 171 173 1 178 171 172 1 179 171 178 1 180 172 179 1 181 173 180 1 182 173 181 1 183 173 182 1 184 174 175 2 185 174 183 am 186 183 184 1 187 183 189 1 188 184 185 1 189 184 187 1 190 184 190 1 191 185 186 1 192 185 191 1 193 185 192 1 194 186 193 1 195 187 188 2 196 187 194 am 197 194 195 1 198 194 199 1 199 195 196 1 200 195 197 1 201 195 200 1 202 196 201 1 203 196 202 1 204 196 203 1 205 197 198 2 206 197 204 am 207 204 205 1 208 204 215 1 209 205 206 1 210 205 213 1 211 205 216 1 212 206 207 1 213 206 217 1 214 206 218 1 215 207 208 ar 216 207 209 ar 217 208 210 ar 218 208 219 1 219 209 211 ar 220 209 220 1 221 210 212 ar 222 210 221 1 223 211 212 ar 224 211 222 1 225 212 223 1 226 213 214 2 227 213 224 am 228 224 225 1 229 224 233 1 230 225 226 1 231 225 231 1 232 225 234 1 233 226 227 1 234 226 235 1 235 226 236 1 236 227 228 1 237 227 237 1 238 227 238 1 239 228 229 1 240 228 239 1 241 228 240 1 242 229 230 1 243 229 241 1 244 229 242 1 245 230 243 1 246 230 244 1 247 230 245 1 248 231 232 2 249 231 246 am 250 246 247 1 251 246 258 1 252 247 248 1 253 247 256 1 254 247 259 1 255 248 249 1 256 248 260 1 257 248 261 1 258 249 250 ar 259 249 251 ar 260 250 252 ar 261 250 262 1 262 251 253 ar 263 251 263 1 264 252 254 ar 265 252 264 1 266 253 254 ar 267 253 265 1 268 254 255 1 269 255 266 1 270 256 257 2 271 256 267 am 272 267 268 1 273 267 275 1 274 268 269 1 275 268 273 1 276 268 276 1 277 269 271 1 278 269 270 1 279 269 277 1 280 270 272 1 281 270 278 1 282 270 279 1 283 271 280 1 284 271 281 1 285 271 282 1 286 272 283 1 287 272 284 1 288 272 285 1 289 273 274 2 290 273 286 am 291 286 287 1 292 286 294 1 293 287 288 1 294 287 292 1 295 287 295 1 296 288 289 1 297 288 296 1 298 288 297 1 299 289 290 2 300 289 291 am 301 291 298 1 302 291 299 1 303 292 293 2 304 292 300 am 305 300 301 1 306 300 307 1 307 301 302 1 308 301 305 1 309 301 308 1 310 302 304 1 311 302 303 1 312 302 309 1 313 303 310 1 314 304 311 1 315 304 312 1 316 304 313 1 317 305 306 2 318 305 314 am 319 314 315 1 320 314 321 1 321 315 316 1 322 315 319 1 323 315 322 1 324 316 317 1 325 316 318 1 326 316 323 1 327 317 324 1 328 317 325 1 329 317 326 1 330 318 327 1 331 318 328 1 332 318 329 1 333 319 320 2 334 319 330 am 335 330 331 1 336 330 338 1 337 331 332 1 338 331 336 1 339 331 339 1 340 332 334 1 341 332 333 1 342 332 340 1 343 333 335 1 344 333 341 1 345 333 342 1 346 334 343 1 347 334 344 1 348 334 345 1 349 335 346 1 350 335 347 1 351 335 348 1 352 336 337 2 353 336 349 am 354 349 350 1 355 349 355 1 356 350 351 1 357 350 353 1 358 350 356 1 359 351 352 1 360 351 357 1 361 351 358 1 362 352 359 1 363 353 354 2 364 353 360 am 365 360 361 1 366 360 366 1 367 361 362 1 368 361 364 1 369 361 367 1 370 362 363 1 371 362 368 1 372 362 369 1 373 363 370 1 374 364 365 2 375 364 371 am 376 371 372 1 377 371 378 1 378 372 373 1 379 372 376 1 380 372 379 1 381 373 375 1 382 373 374 1 383 373 380 1 384 374 381 1 385 375 382 1 386 375 383 1 387 375 384 1 388 376 377 2 389 376 385 am 390 385 386 1 391 385 393 1 392 386 387 1 393 386 391 1 394 386 394 1 395 387 389 1 396 387 388 1 397 387 395 1 398 388 390 1 399 388 396 1 400 388 397 1 401 389 398 1 402 389 399 1 403 389 400 1 404 390 401 1 405 390 402 1 406 390 403 1 407 391 392 2 408 391 404 am 409 404 405 1 410 404 415 1 411 405 406 1 412 405 413 1 413 405 416 1 414 406 407 1 415 406 417 1 416 406 418 1 417 407 408 ar 418 407 409 ar 419 408 410 ar 420 408 419 1 421 409 411 ar 422 409 420 1 423 410 412 ar 424 410 421 1 425 411 412 ar 426 411 422 1 427 412 423 1 428 413 414 2 429 413 424 am 430 424 425 1 431 424 432 1 432 425 426 1 433 425 430 1 434 425 433 1 435 426 428 1 436 426 427 1 437 426 434 1 438 427 429 1 439 427 435 1 440 427 436 1 441 428 437 1 442 428 438 1 443 428 439 1 444 429 440 1 445 429 441 1 446 429 442 1 447 430 431 2 448 430 443 am 449 443 444 1 450 443 450 1 451 444 445 1 452 444 448 1 453 444 451 1 454 445 446 1 455 445 447 1 456 445 452 1 457 446 453 1 458 446 454 1 459 446 455 1 460 447 456 1 461 447 457 1 462 447 458 1 463 448 449 2 464 448 459 am 465 459 460 1 466 459 463 1 467 460 461 1 468 460 464 1 469 460 465 1 470 461 462 2 471 461 466 am 472 466 467 1 473 466 474 1 474 467 468 1 475 467 472 1 476 467 475 1 477 468 469 1 478 468 476 1 479 468 477 1 480 469 470 1 481 469 478 1 482 469 479 1 483 470 471 1 484 471 480 1 485 471 481 1 486 471 482 1 487 472 473 2 488 472 483 am 489 483 484 1 490 483 490 1 491 484 485 1 492 484 488 1 493 484 491 1 494 485 486 1 495 485 487 1 496 485 492 1 497 486 493 1 498 486 494 1 499 486 495 1 500 487 496 1 501 487 497 1 502 487 498 1 503 488 489 2 504 488 499 am 505 499 500 1 506 499 503 1 507 500 501 1 508 500 504 1 509 500 505 1 510 501 502 2 511 501 506 am 512 506 507 1 513 506 514 1 514 507 508 1 515 507 512 1 516 507 515 1 517 508 509 1 518 508 516 1 519 508 517 1 520 509 510 2 521 509 511 am 522 511 518 1 523 511 519 1 524 512 513 2 525 512 520 am 526 520 521 1 527 520 525 1 528 521 522 1 529 521 523 1 530 521 526 1 531 522 527 1 532 522 528 1 533 522 529 1 534 523 524 2 535 523 530 am 536 530 531 1 537 530 537 1 538 531 532 1 539 531 535 1 540 531 538 1 541 532 534 1 542 532 533 1 543 532 539 1 544 533 540 1 545 534 541 1 546 534 542 1 547 534 543 1 548 535 536 2 549 535 544 am 550 544 545 1 551 544 552 1 552 545 546 1 553 545 550 1 554 545 553 1 555 546 547 1 556 546 554 1 557 546 555 1 558 547 548 1 559 547 549 1 560 547 556 1 561 548 557 1 562 548 558 1 563 548 559 1 564 549 560 1 565 549 561 1 566 549 562 1 567 550 551 2 568 550 563 am 569 563 564 1 570 563 571 1 571 564 565 1 572 564 569 1 573 564 572 1 574 565 566 1 575 565 573 1 576 565 574 1 577 566 567 1 578 566 568 1 579 566 575 1 580 567 576 1 581 567 577 1 582 567 578 1 583 568 579 1 584 568 580 1 585 568 581 1 586 569 570 2 587 569 582 am 588 582 583 1 589 582 593 1 590 583 584 1 591 583 591 1 592 583 594 1 593 584 585 1 594 584 595 1 595 584 596 1 596 585 586 1 597 585 597 1 598 585 598 1 599 586 587 1 600 586 599 1 601 586 600 1 602 587 588 ar 603 587 601 1 604 588 589 ar 605 588 590 ar 606 589 602 1 607 589 603 1 608 590 604 1 609 590 605 1 610 591 592 2 611 591 606 am 612 606 607 1 613 606 614 1 614 607 608 1 615 607 612 1 616 607 615 1 617 608 610 1 618 608 609 1 619 608 616 1 620 609 611 1 621 609 617 1 622 609 618 1 623 610 619 1 624 610 620 1 625 610 621 1 626 611 622 1 627 611 623 1 628 611 624 1 629 612 613 2 630 612 625 am 631 625 626 1 632 625 633 1 633 626 627 1 634 626 631 1 635 626 634 1 636 627 629 1 637 627 628 1 638 627 635 1 639 628 630 1 640 628 636 1 641 628 637 1 642 629 638 1 643 629 639 1 644 629 640 1 645 630 641 1 646 630 642 1 647 630 643 1 648 631 632 2 649 631 644 am 650 644 645 1 651 644 656 1 652 645 646 1 653 645 654 1 654 645 657 1 655 646 647 1 656 646 658 1 657 646 659 1 658 647 648 ar 659 647 649 ar 660 648 650 ar 661 648 660 1 662 649 651 ar 663 649 661 1 664 650 652 ar 665 650 662 1 666 651 652 ar 667 651 663 1 668 652 653 1 669 653 664 1 670 654 655 2 671 654 665 am 672 665 666 1 673 665 674 1 674 666 667 1 675 666 672 1 676 666 675 1 677 667 668 1 678 667 676 1 679 667 677 1 680 668 669 1 681 668 678 1 682 668 679 1 683 669 670 2 684 669 671 am 685 671 680 1 686 671 681 1 687 672 673 2 688 672 682 am 689 682 683 1 690 682 690 1 691 683 684 1 692 683 688 1 693 683 691 1 694 684 685 1 695 684 692 1 696 684 693 1 697 685 686 2 698 685 687 am 699 687 694 1 700 687 695 1 701 688 689 2 702 688 696 am 703 696 697 1 704 696 705 1 705 697 698 1 706 697 703 1 707 697 706 1 708 698 699 1 709 698 707 1 710 698 708 1 711 699 700 1 712 699 709 1 713 699 710 1 714 700 701 1 715 700 711 1 716 700 712 1 717 701 702 1 718 701 713 1 719 701 714 1 720 702 715 1 721 702 716 1 722 702 717 1 723 703 704 2 724 703 718 am 725 718 719 1 726 718 724 1 727 719 720 1 728 719 722 1 729 719 725 1 730 720 721 1 731 720 726 1 732 720 727 1 733 721 728 1 734 722 723 2 735 722 729 am 736 729 730 1 737 729 737 1 738 730 731 1 739 730 735 1 740 730 738 1 741 731 732 1 742 731 739 1 743 731 740 1 744 732 733 1 745 732 741 1 746 732 742 1 747 733 734 1 748 734 743 1 749 734 744 1 750 734 745 1 751 735 736 2 752 735 746 am 753 746 747 1 754 746 757 1 755 747 748 1 756 747 755 1 757 747 758 1 758 748 749 1 759 748 759 1 760 748 760 1 761 749 750 1 762 749 761 1 763 749 762 1 764 750 751 1 765 750 763 1 766 750 764 1 767 751 752 ar 768 751 765 1 769 752 753 ar 770 752 754 ar 771 753 766 1 772 753 767 1 773 754 768 1 774 754 769 1 775 755 756 2 776 755 770 am 777 770 771 1 778 770 778 1 779 771 772 1 780 771 776 1 781 771 779 1 782 772 773 1 783 772 780 1 784 772 781 1 785 773 774 2 786 773 775 am 787 775 782 1 788 775 783 1 789 776 777 2 790 776 784 am 791 784 785 1 792 784 788 1 793 785 786 1 794 785 789 1 795 785 790 1 796 786 787 2 797 786 791 am 798 791 793 1 799 791 792 1 800 792 794 1 801 792 796 1 802 792 798 1 803 793 795 1 804 793 799 1 805 793 800 1 806 794 795 1 807 794 801 1 808 794 802 1 809 795 803 1 810 795 804 1 811 796 797 2 812 796 805 am 813 805 806 1 814 805 813 1 815 806 807 1 816 806 811 1 817 806 814 1 818 807 808 1 819 807 815 1 820 807 816 1 821 808 809 2 822 808 810 am 823 810 817 1 824 810 818 1 825 811 812 2 826 811 819 am 827 819 820 1 828 819 824 1 829 820 821 1 830 820 822 1 831 820 825 1 832 821 826 1 833 821 827 1 834 821 828 1 835 822 823 2 836 822 829 am 837 829 830 1 838 829 837 1 839 830 831 1 840 830 835 1 841 830 838 1 842 831 832 1 843 831 839 1 844 831 840 1 845 832 833 1 846 832 834 1 847 832 841 1 848 833 842 1 849 833 843 1 850 833 844 1 851 834 845 1 852 834 846 1 853 834 847 1 854 835 836 2 855 835 848 am 856 848 849 1 857 848 856 1 858 849 850 1 859 849 854 1 860 849 857 1 861 850 852 1 862 850 851 1 863 850 858 1 864 851 853 1 865 851 859 1 866 851 860 1 867 852 861 1 868 852 862 1 869 852 863 1 870 853 864 1 871 853 865 1 872 853 866 1 873 854 855 2 874 854 867 am 875 867 868 1 876 867 872 1 877 868 869 1 878 868 870 1 879 868 873 1 880 869 874 1 881 869 875 1 882 869 876 1 883 870 871 2 884 870 877 am 885 877 878 1 886 877 883 1 887 878 879 1 888 878 881 1 889 878 884 1 890 879 880 1 891 879 885 1 892 879 886 1 893 880 887 1 894 881 882 2 895 881 888 am 896 888 889 1 897 888 896 1 898 889 890 1 899 889 894 1 900 889 897 1 901 890 891 1 902 890 898 1 903 890 899 1 904 891 892 1 905 891 893 1 906 891 900 1 907 892 901 1 908 892 902 1 909 892 903 1 910 893 904 1 911 893 905 1 912 893 906 1 913 894 895 2 914 894 907 am 915 907 908 1 916 907 912 1 917 908 909 1 918 908 910 1 919 908 913 1 920 909 914 1 921 909 915 1 922 909 916 1 923 910 911 2 924 910 917 am 925 917 918 1 926 917 925 1 927 918 919 1 928 918 923 1 929 918 926 1 930 919 920 1 931 919 927 1 932 919 928 1 933 920 921 1 934 920 922 1 935 920 929 1 936 921 930 1 937 921 931 1 938 921 932 1 939 922 933 1 940 922 934 1 941 922 935 1 942 923 924 2 943 923 936 am 944 936 937 1 945 936 940 1 946 937 938 1 947 937 941 1 948 937 942 1 949 938 939 2 950 938 943 am 951 943 944 1 952 943 951 1 953 944 945 1 954 944 949 1 955 944 952 1 956 945 946 1 957 945 953 1 958 945 954 1 959 946 947 ar 960 946 948 ar 961 949 950 2 962 949 955 am 963 955 956 1 964 955 963 1 965 956 957 1 966 956 961 1 967 956 964 1 968 957 958 1 969 957 965 1 970 957 966 1 971 958 959 1 972 958 960 1 973 958 967 1 974 959 968 1 975 959 969 1 976 959 970 1 977 960 971 1 978 960 972 1 979 960 973 1 980 961 962 2 981 961 974 am 982 974 975 1 983 974 982 1 984 975 976 1 985 975 980 1 986 975 983 1 987 976 978 1 988 976 977 1 989 976 984 1 990 977 979 1 991 977 985 1 992 977 986 1 993 978 987 1 994 978 988 1 995 978 989 1 996 979 990 1 997 979 991 1 998 979 992 1 999 980 981 2 1000 980 993 am 1001 993 994 1 1002 993 1005 1 1003 994 995 1 1004 994 1003 1 1005 994 1006 1 1006 995 996 1 1007 995 1007 1 1008 995 1008 1 1009 996 997 ar 1010 996 998 ar 1011 997 999 ar 1012 997 1009 1 1013 998 1000 ar 1014 998 1010 1 1015 999 1001 ar 1016 999 1011 1 1017 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4968 4979 am 5040 4979 4980 1 5041 4979 4990 1 5042 4980 4981 1 5043 4980 4988 1 5044 4980 4991 1 5045 4981 4982 1 5046 4981 4992 1 5047 4981 4993 1 5048 4982 4983 ar 5049 4982 4984 ar 5050 4983 4985 ar 5051 4983 4994 1 5052 4984 4986 ar 5053 4984 4995 1 5054 4985 4987 ar 5055 4985 4996 1 5056 4986 4987 ar 5057 4986 4997 1 5058 4987 4998 1 5059 4988 4989 2 5060 4988 4999 am 5061 4999 5000 1 5062 4999 5006 1 5063 5000 5001 1 5064 5000 5004 1 5065 5000 5007 1 5066 5001 5002 1 5067 5001 5003 1 5068 5001 5008 1 5069 5002 5009 1 5070 5002 5010 1 5071 5002 5011 1 5072 5003 5012 1 5073 5003 5013 1 5074 5003 5014 1 5075 5004 5005 2 5076 5004 5015 am 5077 5015 5016 1 5078 5015 5021 1 5079 5016 5017 1 5080 5016 5019 1 5081 5016 5022 1 5082 5017 5018 1 5083 5017 5023 1 5084 5017 5024 1 5085 5018 5025 1 5086 5019 5020 2 5087 5019 5026 am 5088 5026 5027 1 5089 5026 5035 1 5090 5027 5028 1 5091 5027 5033 1 5092 5027 5036 1 5093 5028 5029 1 5094 5028 5037 1 5095 5028 5038 1 5096 5029 5030 1 5097 5029 5039 1 5098 5029 5040 1 5099 5030 5031 1 5100 5030 5041 1 5101 5030 5042 1 5102 5031 5032 1 5103 5031 5043 1 5104 5031 5044 1 5105 5032 5045 1 5106 5032 5046 1 5107 5032 5047 1 5108 5033 5034 2 5109 5033 5048 am 5110 5048 5049 1 5111 5048 5057 1 5112 5049 5050 1 5113 5049 5055 1 5114 5049 5058 1 5115 5050 5051 1 5116 5050 5059 1 5117 5050 5060 1 5118 5051 5052 1 5119 5051 5061 1 5120 5051 5062 1 5121 5052 5053 1 5122 5052 5063 1 5123 5052 5064 1 5124 5053 5054 1 5125 5053 5065 1 5126 5053 5066 1 5127 5054 5067 1 5128 5054 5068 1 5129 5054 5069 1 5130 5055 5056 2 5131 5055 5070 am 5132 5070 5071 1 5133 5070 5081 1 5134 5071 5072 1 5135 5071 5079 1 5136 5071 5082 1 5137 5072 5073 1 5138 5072 5083 1 5139 5072 5084 1 5140 5073 5074 ar 5141 5073 5075 ar 5142 5074 5076 ar 5143 5074 5085 1 5144 5075 5077 ar 5145 5075 5086 1 5146 5076 5078 ar 5147 5076 5087 1 5148 5077 5078 ar 5149 5077 5088 1 5150 5078 5089 1 5151 5079 5080 2 5152 5079 5090 am 5153 5090 5091 1 5154 5090 5099 1 5155 5091 5092 1 5156 5091 5097 1 5157 5091 5100 1 5158 5092 5093 1 5159 5092 5101 1 5160 5092 5102 1 5161 5093 5094 1 5162 5093 5103 1 5163 5093 5104 1 5164 5094 5095 1 5165 5094 5105 1 5166 5094 5106 1 5167 5095 5096 1 5168 5095 5107 1 5169 5095 5108 1 5170 5096 5109 1 5171 5096 5110 1 5172 5096 5111 1 5173 5097 5098 2 5174 5097 5112 am 5175 5112 5113 1 5176 5112 5121 1 5177 5113 5114 1 5178 5113 5118 1 5179 5113 5122 1 5180 5114 5115 1 5181 5114 5123 1 5182 5114 5124 1 5183 5115 5116 2 5184 5115 5117 am 5185 5117 5125 1 5186 5117 5126 1 5187 5118 5119 ar 5188 5118 5120 ar @SUBSTRUCTURE 1 HIS1 2 RESIDUE 1 R HIS 1 ROOT 2 ASN2 21 RESIDUE 1 R ASN 2 3 TYR3 35 RESIDUE 1 R TYR 2 4 CYS4 56 RESIDUE 1 R CYS 2 5 PRO5 67 RESIDUE 1 R PRO 2 6 GLN6 81 RESIDUE 1 R GLN 2 7 GLN7 98 RESIDUE 1 R GLN 2 8 THR8 115 RESIDUE 1 R THR 2 9 LYS9 129 RESIDUE 1 R LYS 2 10 ILE10 151 RESIDUE 1 R ILE 2 11 THR11 170 RESIDUE 1 R THR 2 12 SER12 184 RESIDUE 1 R SER 2 13 ALA13 195 RESIDUE 1 R ALA 2 14 PHE14 205 RESIDUE 1 R PHE 2 15 LYS15 225 RESIDUE 1 R LYS 2 16 TYR16 247 RESIDUE 1 R TYR 2 17 ILE17 268 RESIDUE 1 R ILE 2 18 ASN18 287 RESIDUE 1 R ASN 2 19 THR19 301 RESIDUE 1 R THR 2 20 VAL20 315 RESIDUE 1 R VAL 2 21 ILE21 331 RESIDUE 1 R ILE 2 22 SER22 350 RESIDUE 1 R SER 2 23 CYS23 361 RESIDUE 1 R CYS 2 24 THR24 372 RESIDUE 1 R THR 2 25 ILE25 386 RESIDUE 1 R ILE 2 26 PHE26 405 RESIDUE 1 R PHE 2 27 ILE27 425 RESIDUE 1 R ILE 2 28 VAL28 444 RESIDUE 1 R VAL 2 29 GLY29 460 RESIDUE 1 R GLY 2 30 MET30 467 RESIDUE 1 R MET 2 31 VAL31 484 RESIDUE 1 R VAL 2 32 GLY32 500 RESIDUE 1 R GLY 2 33 ASN33 507 RESIDUE 1 R ASN 2 34 ALA34 521 RESIDUE 1 R ALA 2 35 THR35 531 RESIDUE 1 R THR 2 36 LEU36 545 RESIDUE 1 R LEU 2 37 LEU37 564 RESIDUE 1 R LEU 2 38 ARG38 583 RESIDUE 1 R ARG 2 39 ILE39 607 RESIDUE 1 R ILE 2 40 ILE40 626 RESIDUE 1 R ILE 2 41 TYR41 645 RESIDUE 1 R TYR 2 42 GLN42 666 RESIDUE 1 R GLN 2 43 ASN43 683 RESIDUE 1 R ASN 2 44 LYS44 697 RESIDUE 1 R LYS 2 45 CYS45 719 RESIDUE 1 R CYS 2 46 MET46 730 RESIDUE 1 R MET 2 47 ARG47 747 RESIDUE 1 R ARG 2 48 ASN48 771 RESIDUE 1 R ASN 2 49 GLY49 785 RESIDUE 1 R GLY 2 50 PRO50 792 RESIDUE 1 R PRO 2 51 ASN51 806 RESIDUE 1 R ASN 2 52 ALA52 820 RESIDUE 1 R ALA 2 53 LEU53 830 RESIDUE 1 R LEU 2 54 ILE54 849 RESIDUE 1 R ILE 2 55 ALA55 868 RESIDUE 1 R ALA 2 56 SER56 878 RESIDUE 1 R SER 2 57 LEU57 889 RESIDUE 1 R LEU 2 58 ALA58 908 RESIDUE 1 R ALA 2 59 LEU59 918 RESIDUE 1 R LEU 2 60 GLY60 937 RESIDUE 1 R GLY 2 61 ASP61 944 RESIDUE 1 R ASP 2 62 LEU62 956 RESIDUE 1 R LEU 2 63 ILE63 975 RESIDUE 1 R ILE 2 64 TYR64 994 RESIDUE 1 R TYR 2 65 VAL65 1015 RESIDUE 1 R VAL 2 66 VAL66 1031 RESIDUE 1 R VAL 2 67 ILE67 1047 RESIDUE 1 R ILE 2 68 ASP68 1066 RESIDUE 1 R ASP 2 69 LEU69 1078 RESIDUE 1 R LEU 2 70 PRO70 1097 RESIDUE 1 R PRO 2 71 ILE71 1111 RESIDUE 1 R ILE 2 72 ASN72 1130 RESIDUE 1 R ASN 2 73 VAL73 1144 RESIDUE 1 R VAL 2 74 PHE74 1160 RESIDUE 1 R PHE 2 75 LYS75 1180 RESIDUE 1 R LYS 2 76 LEU76 1202 RESIDUE 1 R LEU 2 77 LEU77 1221 RESIDUE 1 R LEU 2 78 ALA78 1240 RESIDUE 1 R ALA 2 79 GLY79 1250 RESIDUE 1 R GLY 2 80 ARG80 1257 RESIDUE 1 R ARG 2 81 TRP81 1281 RESIDUE 1 R TRP 2 82 PRO82 1305 RESIDUE 1 R PRO 2 83 PHE83 1319 RESIDUE 1 R PHE 2 84 ASP84 1339 RESIDUE 1 R ASP 2 85 HIS85 1351 RESIDUE 1 R HIS 2 86 ASN86 1368 RESIDUE 1 R ASN 2 87 ASP87 1382 RESIDUE 1 R ASP 2 88 PHE88 1394 RESIDUE 1 R PHE 2 89 GLY89 1414 RESIDUE 1 R GLY 2 90 VAL90 1421 RESIDUE 1 R VAL 2 91 PHE91 1437 RESIDUE 1 R PHE 2 92 LEU92 1457 RESIDUE 1 R LEU 2 93 CYS93 1476 RESIDUE 1 R CYS 2 94 LYS94 1487 RESIDUE 1 R LYS 2 95 LEU95 1509 RESIDUE 1 R LEU 2 96 PHE96 1528 RESIDUE 1 R PHE 2 97 PRO97 1548 RESIDUE 1 R PRO 2 98 PHE98 1562 RESIDUE 1 R PHE 2 99 LEU99 1582 RESIDUE 1 R LEU 2 100 GLN100 1601 RESIDUE 1 R GLN 2 101 LYS101 1618 RESIDUE 1 R LYS 2 102 SER102 1640 RESIDUE 1 R SER 2 103 SER103 1651 RESIDUE 1 R SER 2 104 VAL104 1662 RESIDUE 1 R VAL 2 105 GLY105 1678 RESIDUE 1 R GLY 2 106 ILE106 1685 RESIDUE 1 R ILE 2 107 THR107 1704 RESIDUE 1 R THR 2 108 VAL108 1718 RESIDUE 1 R VAL 2 109 LEU109 1734 RESIDUE 1 R LEU 2 110 ASN110 1753 RESIDUE 1 R ASN 2 111 LEU111 1767 RESIDUE 1 R LEU 2 112 CYS112 1786 RESIDUE 1 R CYS 2 113 ALA113 1797 RESIDUE 1 R ALA 2 114 LEU114 1807 RESIDUE 1 R LEU 2 115 SER115 1826 RESIDUE 1 R SER 2 116 VAL116 1837 RESIDUE 1 R VAL 2 117 ASP117 1853 RESIDUE 1 R ASP 2 118 ARG118 1865 RESIDUE 1 R ARG 2 119 TYR119 1889 RESIDUE 1 R TYR 2 120 ARG120 1910 RESIDUE 1 R ARG 2 121 ALA121 1934 RESIDUE 1 R ALA 2 122 VAL122 1944 RESIDUE 1 R VAL 2 123 ALA123 1960 RESIDUE 1 R ALA 2 124 SER124 1970 RESIDUE 1 R SER 2 125 TRP125 1981 RESIDUE 1 R TRP 2 126 SER126 2005 RESIDUE 1 R SER 2 127 ARG127 2016 RESIDUE 1 R ARG 2 128 VAL128 2040 RESIDUE 1 R VAL 2 129 GLN129 2056 RESIDUE 1 R GLN 2 130 GLY130 2073 RESIDUE 1 R GLY 2 131 ILE131 2080 RESIDUE 1 R ILE 2 132 GLY132 2099 RESIDUE 1 R GLY 2 133 ILE133 2106 RESIDUE 1 R ILE 2 134 PRO134 2125 RESIDUE 1 R PRO 2 135 LEU135 2139 RESIDUE 1 R LEU 2 136 VAL136 2158 RESIDUE 1 R VAL 2 137 THR137 2174 RESIDUE 1 R THR 2 138 ALA138 2188 RESIDUE 1 R ALA 2 139 ILE139 2198 RESIDUE 1 R ILE 2 140 GLU140 2217 RESIDUE 1 R GLU 2 141 ILE141 2232 RESIDUE 1 R ILE 2 142 VAL142 2251 RESIDUE 1 R VAL 2 143 SER143 2267 RESIDUE 1 R SER 2 144 ILE144 2278 RESIDUE 1 R ILE 2 145 TRP145 2297 RESIDUE 1 R TRP 2 146 ILE146 2321 RESIDUE 1 R ILE 2 147 LEU147 2340 RESIDUE 1 R LEU 2 148 SER148 2359 RESIDUE 1 R SER 2 149 PHE149 2370 RESIDUE 1 R PHE 2 150 ILE150 2390 RESIDUE 1 R ILE 2 151 LEU151 2409 RESIDUE 1 R LEU 2 152 ALA152 2428 RESIDUE 1 R ALA 2 153 ILE153 2438 RESIDUE 1 R ILE 2 154 PRO154 2457 RESIDUE 1 R PRO 2 155 GLU155 2471 RESIDUE 1 R GLU 2 156 ALA156 2486 RESIDUE 1 R ALA 2 157 ILE157 2496 RESIDUE 1 R ILE 2 158 GLY158 2515 RESIDUE 1 R GLY 2 159 PHE159 2522 RESIDUE 1 R PHE 2 160 VAL160 2542 RESIDUE 1 R VAL 2 161 MET161 2558 RESIDUE 1 R MET 2 162 VAL162 2575 RESIDUE 1 R VAL 2 163 PRO163 2591 RESIDUE 1 R PRO 2 164 PHE164 2605 RESIDUE 1 R PHE 2 165 GLU165 2625 RESIDUE 1 R GLU 2 166 TYR166 2640 RESIDUE 1 R TYR 2 167 ARG167 2661 RESIDUE 1 R ARG 2 168 GLY168 2685 RESIDUE 1 R GLY 2 169 GLU169 2692 RESIDUE 1 R GLU 2 170 GLN170 2707 RESIDUE 1 R GLN 2 171 HIS171 2724 RESIDUE 1 R HIS 2 172 LYS172 2741 RESIDUE 1 R LYS 2 173 THR173 2763 RESIDUE 1 R THR 2 174 CYS174 2777 RESIDUE 1 R CYS 2 175 MET175 2788 RESIDUE 1 R MET 2 176 LEU176 2805 RESIDUE 1 R LEU 2 177 ASN177 2824 RESIDUE 1 R ASN 2 178 ALA178 2838 RESIDUE 1 R ALA 2 179 THR179 2848 RESIDUE 1 R THR 2 180 SER180 2862 RESIDUE 1 R SER 2 181 LYS181 2873 RESIDUE 1 R LYS 2 182 PHE182 2895 RESIDUE 1 R PHE 2 183 MET183 2915 RESIDUE 1 R MET 2 184 GLU184 2932 RESIDUE 1 R GLU 2 185 PHE185 2947 RESIDUE 1 R PHE 2 186 TYR186 2967 RESIDUE 1 R TYR 2 187 GLN187 2988 RESIDUE 1 R GLN 2 188 ASP188 3005 RESIDUE 1 R ASP 2 189 VAL189 3017 RESIDUE 1 R VAL 2 190 LYS190 3033 RESIDUE 1 R LYS 2 191 ASP191 3055 RESIDUE 1 R ASP 2 192 TRP192 3067 RESIDUE 1 R TRP 2 193 TRP193 3091 RESIDUE 1 R TRP 2 194 LEU194 3115 RESIDUE 1 R LEU 2 195 PHE195 3134 RESIDUE 1 R PHE 2 196 GLY196 3154 RESIDUE 1 R GLY 2 197 PHE197 3161 RESIDUE 1 R PHE 2 198 TYR198 3181 RESIDUE 1 R TYR 2 199 PHE199 3202 RESIDUE 1 R PHE 2 200 CYS200 3222 RESIDUE 1 R CYS 2 201 MET201 3233 RESIDUE 1 R MET 2 202 PRO202 3250 RESIDUE 1 R PRO 2 203 LEU203 3264 RESIDUE 1 R LEU 2 204 VAL204 3283 RESIDUE 1 R VAL 2 205 CYS205 3299 RESIDUE 1 R CYS 2 206 THR206 3310 RESIDUE 1 R THR 2 207 ALA207 3324 RESIDUE 1 R ALA 2 208 ILE208 3334 RESIDUE 1 R ILE 2 209 PHE209 3353 RESIDUE 1 R PHE 2 210 TYR210 3373 RESIDUE 1 R TYR 2 211 THR211 3394 RESIDUE 1 R THR 2 212 LEU212 3408 RESIDUE 1 R LEU 2 213 MET213 3427 RESIDUE 1 R MET 2 214 THR214 3444 RESIDUE 1 R THR 2 215 CYS215 3458 RESIDUE 1 R CYS 2 216 GLU216 3469 RESIDUE 1 R GLU 2 217 MET217 3484 RESIDUE 1 R MET 2 218 LEU218 3501 RESIDUE 1 R LEU 2 219 ASN219 3520 RESIDUE 1 R ASN 2 220 ARG220 3534 RESIDUE 1 R ARG 2 221 ARG221 3558 RESIDUE 1 R ARG 2 222 ASN222 3582 RESIDUE 1 R ASN 2 223 GLY223 3596 RESIDUE 1 R GLY 2 224 SER224 3603 RESIDUE 1 R SER 2 225 LEU225 3614 RESIDUE 1 R LEU 2 226 ARG226 3633 RESIDUE 1 R ARG 2 227 ILE227 3657 RESIDUE 1 R ILE 2 228 ALA228 3676 RESIDUE 1 R ALA 2 229 LEU229 3686 RESIDUE 1 R LEU 2 230 SER230 3705 RESIDUE 1 R SER 2 231 GLU231 3716 RESIDUE 1 R GLU 2 232 HIS232 3731 RESIDUE 1 R HIS 2 233 LEU233 3748 RESIDUE 1 R LEU 2 234 LYS234 3767 RESIDUE 1 R LYS 2 235 GLN235 3789 RESIDUE 1 R GLN 2 236 ARG236 3806 RESIDUE 1 R ARG 2 237 ARG237 3830 RESIDUE 1 R ARG 2 238 GLU238 3854 RESIDUE 1 R GLU 2 239 VAL239 3869 RESIDUE 1 R VAL 2 240 ALA240 3885 RESIDUE 1 R ALA 2 241 LYS241 3895 RESIDUE 1 R LYS 2 242 THR242 3917 RESIDUE 1 R THR 2 243 VAL243 3931 RESIDUE 1 R VAL 2 244 PHE244 3947 RESIDUE 1 R PHE 2 245 CYS245 3967 RESIDUE 1 R CYS 2 246 LEU246 3978 RESIDUE 1 R LEU 2 247 VAL247 3997 RESIDUE 1 R VAL 2 248 VAL248 4013 RESIDUE 1 R VAL 2 249 ILE249 4029 RESIDUE 1 R ILE 2 250 PHE250 4048 RESIDUE 1 R PHE 2 251 ALA251 4068 RESIDUE 1 R ALA 2 252 LEU252 4078 RESIDUE 1 R LEU 2 253 CYS253 4097 RESIDUE 1 R CYS 2 254 TRP254 4108 RESIDUE 1 R TRP 2 255 PHE255 4132 RESIDUE 1 R PHE 2 256 PRO256 4152 RESIDUE 1 R PRO 2 257 LEU257 4166 RESIDUE 1 R LEU 2 258 HIS258 4185 RESIDUE 1 R HIS 2 259 LEU259 4202 RESIDUE 1 R LEU 2 260 SER260 4221 RESIDUE 1 R SER 2 261 ARG261 4232 RESIDUE 1 R ARG 2 262 ILE262 4256 RESIDUE 1 R ILE 2 263 LEU263 4275 RESIDUE 1 R LEU 2 264 LYS264 4294 RESIDUE 1 R LYS 2 265 LYS265 4316 RESIDUE 1 R LYS 2 266 THR266 4338 RESIDUE 1 R THR 2 267 VAL267 4352 RESIDUE 1 R VAL 2 268 TYR268 4368 RESIDUE 1 R TYR 2 269 ASN269 4389 RESIDUE 1 R ASN 2 270 GLU270 4403 RESIDUE 1 R GLU 2 271 MET271 4418 RESIDUE 1 R MET 2 272 ASP272 4435 RESIDUE 1 R ASP 2 273 LYS273 4447 RESIDUE 1 R LYS 2 274 ASN274 4469 RESIDUE 1 R ASN 2 275 ARG275 4483 RESIDUE 1 R ARG 2 276 CYS276 4507 RESIDUE 1 R CYS 2 277 GLU277 4518 RESIDUE 1 R GLU 2 278 LEU278 4533 RESIDUE 1 R LEU 2 279 LEU279 4552 RESIDUE 1 R LEU 2 280 SER280 4571 RESIDUE 1 R SER 2 281 PHE281 4582 RESIDUE 1 R PHE 2 282 LEU282 4602 RESIDUE 1 R LEU 2 283 LEU283 4621 RESIDUE 1 R LEU 2 284 LEU284 4640 RESIDUE 1 R LEU 2 285 MET285 4659 RESIDUE 1 R MET 2 286 ASP286 4676 RESIDUE 1 R ASP 2 287 TYR287 4688 RESIDUE 1 R TYR 2 288 ILE288 4709 RESIDUE 1 R ILE 2 289 GLY289 4728 RESIDUE 1 R GLY 2 290 ILE290 4735 RESIDUE 1 R ILE 2 291 ASN291 4754 RESIDUE 1 R ASN 2 292 LEU292 4768 RESIDUE 1 R LEU 2 293 ALA293 4787 RESIDUE 1 R ALA 2 294 THR294 4797 RESIDUE 1 R THR 2 295 MET295 4811 RESIDUE 1 R MET 2 296 ASN296 4828 RESIDUE 1 R ASN 2 297 SER297 4842 RESIDUE 1 R SER 2 298 CYS298 4853 RESIDUE 1 R CYS 2 299 ILE299 4864 RESIDUE 1 R ILE 2 300 ASN300 4883 RESIDUE 1 R ASN 2 301 PRO301 4897 RESIDUE 1 R PRO 2 302 ILE302 4911 RESIDUE 1 R ILE 2 303 ALA303 4930 RESIDUE 1 R ALA 2 304 LEU304 4940 RESIDUE 1 R LEU 2 305 TYR305 4959 RESIDUE 1 R TYR 2 306 PHE306 4980 RESIDUE 1 R PHE 2 307 VAL307 5000 RESIDUE 1 R VAL 2 308 SER308 5016 RESIDUE 1 R SER 2 309 LYS309 5027 RESIDUE 1 R LYS 2 310 LYS310 5049 RESIDUE 1 R LYS 2 311 PHE311 5071 RESIDUE 1 R PHE 2 312 LYS312 5091 RESIDUE 1 R LYS 2 313 ASN313 5113 RESIDUE 1 R ASN 1