#################################################################### # DELTA # # Database for Extended Ligand-Target Analyses # # 2025 # #################################################################### @MOLECULE 7cx2_min 4919 4973 308 0 0 SMALL USER_CHARGES File created by VEGA ZZ 3.2.4 @ATOM 1 N 71.4140 122.8660 128.3620 N.4 1 GLU1 -0.0641 2 CA 71.7190 122.2140 127.0950 C.3 1 GLU1 0.1935 3 CB 73.2380 121.9860 126.8810 C.3 1 GLU1 -0.0068 4 CG 73.9450 123.1440 126.1700 C.3 1 GLU1 0.0360 5 CD 73.6300 124.4840 126.8390 C.2 1 GLU1 0.1760 6 OE1 73.4750 124.5350 128.0500 O.co2 1 GLU1 -0.6478 7 OE2 73.5380 125.4820 126.1460 O.co2 1 GLU1 -0.6478 8 C 71.0850 120.8270 127.0330 C.2 1 GLU1 0.2316 9 O 71.0330 120.1120 128.0320 O.2 1 GLU1 -0.2773 10 H1 70.3970 123.0370 128.4590 H 1 GLU1 0.2750 11 H2 71.9360 123.7730 128.3940 H 1 GLU1 0.2750 12 H3 71.7640 122.2770 129.1440 H 1 GLU1 0.2750 13 HA 71.3090 122.8230 126.2870 H 1 GLU1 0.0690 14 HB1 73.4300 121.1050 126.2640 H 1 GLU1 0.0295 15 HB2 73.7250 121.7780 127.8350 H 1 GLU1 0.0295 16 HG1 73.6320 123.1910 125.1270 H 1 GLU1 0.0374 17 HG2 75.0240 122.9920 126.1740 H 1 GLU1 0.0374 18 N 70.6010 120.4560 125.8510 N.am 2 SER2 -0.2432 19 CA 69.9460 119.1870 125.5740 C.3 2 SER2 0.1111 20 CB 68.7260 119.4710 124.6820 C.3 2 SER2 0.0681 21 OG 67.9840 118.2830 124.4390 O.3 2 SER2 -0.3930 22 C 70.8910 118.2410 124.8450 C.2 2 SER2 0.2236 23 O 71.7160 118.6860 124.0410 O.2 2 SER2 -0.2775 24 H 70.6970 121.1140 125.0770 H 2 SER2 0.1313 25 HA 69.6210 118.7650 126.5240 H 2 SER2 0.0580 26 HB1 69.0580 119.9100 123.7330 H 2 SER2 0.0577 27 HB2 68.0870 120.2070 125.1810 H 2 SER2 0.0577 28 HG 67.2300 118.4460 123.8750 H 2 SER2 0.2095 29 N 70.8010 116.9330 125.0990 N.am 3 PRO3 -0.2315 30 CA 71.6140 115.9520 124.3740 C.3 3 PRO3 0.0907 31 CD 69.9310 116.3390 126.1150 C.3 3 PRO3 0.0071 32 CB 71.5330 114.7270 125.2940 C.3 3 PRO3 -0.0276 33 CG 70.1590 114.8360 125.9490 C.3 3 PRO3 -0.0379 34 C 71.0900 115.6570 122.9710 C.2 3 PRO3 0.2189 35 O 70.9660 114.5040 122.5600 O.2 3 PRO3 -0.2778 36 HA 72.6390 116.3210 124.3030 H 3 PRO3 0.0559 37 HD1 68.8940 116.6270 125.9440 H 3 PRO3 0.0431 38 HD2 70.2760 116.6910 127.0890 H 3 PRO3 0.0431 39 HB1 72.2990 114.8140 126.0650 H 3 PRO3 0.0285 40 HB2 71.6940 113.7720 124.7920 H 3 PRO3 0.0285 41 HG1 69.4040 114.4240 125.2770 H 3 PRO3 0.0278 42 HG2 70.0970 114.2940 126.8930 H 3 PRO3 0.0278 43 N 70.7820 116.7190 122.2250 N.am 4 ALA4 -0.2459 44 CA 70.2220 116.5480 120.8910 C.3 4 ALA4 0.0850 45 CB 69.2330 117.6920 120.6430 C.3 4 ALA4 -0.0411 46 C 71.3050 116.5590 119.8210 C.2 4 ALA4 0.2184 47 O 71.1850 115.8620 118.8070 O.2 4 ALA4 -0.2778 48 H 70.9400 117.6580 122.5910 H 4 ALA4 0.1312 49 HA 69.6900 115.5970 120.8380 H 4 ALA4 0.0554 50 HB1 68.7630 117.6050 119.6620 H 4 ALA4 0.0249 51 HB2 69.7240 118.6640 120.6960 H 4 ALA4 0.0249 52 HB3 68.4390 117.6820 121.3900 H 4 ALA4 0.0249 53 N 72.3650 117.3370 120.0250 N.am 5 ILE5 -0.2454 54 CA 73.4230 117.4290 119.0270 C.3 5 ILE5 0.0903 55 CB 73.9770 118.8780 119.0530 C.3 5 ILE5 -0.0201 56 CG1 72.8730 119.9030 118.7140 C.3 5 ILE5 -0.0514 57 CG2 75.1930 119.0630 118.1220 C.3 5 ILE5 -0.0605 58 CD1 73.2940 121.3610 118.9410 C.3 5 ILE5 -0.0650 59 C 74.5460 116.4280 119.2910 C.2 5 ILE5 0.2190 60 O 75.1790 115.9480 118.3450 O.2 5 ILE5 -0.2778 61 H 72.4380 117.8740 120.8890 H 5 ILE5 0.1312 62 HA 73.0080 117.2190 118.0390 H 5 ILE5 0.0560 63 HB 74.3120 119.0850 120.0710 H 5 ILE5 0.0318 64 HG11 71.9900 119.7240 119.3270 H 5 ILE5 0.0266 65 HG12 72.5510 119.7710 117.6800 H 5 ILE5 0.0266 66 HG21 75.5780 120.0810 118.1560 H 5 ILE5 0.0233 67 HG22 74.9350 118.8360 117.0870 H 5 ILE5 0.0233 68 HG23 76.0220 118.4170 118.4090 H 5 ILE5 0.0233 69 HD11 72.4490 122.0330 118.7890 H 5 ILE5 0.0230 70 HD12 74.0780 121.6700 118.2510 H 5 ILE5 0.0230 71 HD13 73.6580 121.5110 119.9580 H 5 ILE5 0.0230 72 N 74.7980 116.1560 120.5710 N.am 6 SER6 -0.2436 73 CA 75.7780 115.1590 120.9970 C.3 6 SER6 0.1109 74 CB 76.0270 115.2930 122.5010 C.3 6 SER6 0.0681 75 OG 76.6540 116.5490 122.6810 O.3 6 SER6 -0.3930 76 C 75.3620 113.7210 120.6440 C.2 6 SER6 0.2210 77 O 76.1850 112.9190 120.2010 O.2 6 SER6 -0.2777 78 H 74.2820 116.6680 121.2870 H 6 SER6 0.1312 79 HA 76.7080 115.3800 120.4750 H 6 SER6 0.0580 80 HB1 76.6960 114.5030 122.8600 H 6 SER6 0.0577 81 HB2 75.0830 115.2330 123.0550 H 6 SER6 0.0577 82 HG 76.7050 116.8010 123.6080 H 6 SER6 0.2095 83 N 74.0800 113.4070 120.8440 N.am 7 SER7 -0.2435 84 CA 73.5410 112.0810 120.5620 C.3 7 SER7 0.1109 85 CB 72.0730 112.0260 121.0000 C.3 7 SER7 0.0681 86 OG 71.3120 112.9790 120.2680 O.3 7 SER7 -0.3930 87 C 73.6650 111.7410 119.0850 C.2 7 SER7 0.2209 88 O 73.9690 110.5970 118.7280 O.2 7 SER7 -0.2777 89 H 73.4520 114.1230 121.2090 H 7 SER7 0.1312 90 HA 74.1340 111.3650 121.1320 H 7 SER7 0.0580 91 HB1 72.0200 112.2310 122.0750 H 7 SER7 0.0577 92 HB2 71.6710 111.0210 120.8310 H 7 SER7 0.0577 93 HG 70.4200 113.0390 120.6000 H 7 SER7 0.2095 94 N 73.4380 112.7230 118.2090 N.am 8 VAL8 -0.2453 95 CA 73.5150 112.4510 116.7790 C.3 8 VAL8 0.0901 96 CB 72.8660 113.6210 116.0110 C.3 8 VAL8 -0.0227 97 CG1 73.0310 113.4940 114.4860 C.3 8 VAL8 -0.0608 98 CG2 71.3740 113.7390 116.3590 C.3 8 VAL8 -0.0608 99 C 74.9530 112.2090 116.3480 C.2 8 VAL8 0.2189 100 O 75.2290 111.2630 115.6050 O.2 8 VAL8 -0.2778 101 H 73.2110 113.6610 118.5400 H 8 VAL8 0.1312 102 HA 72.9520 111.5370 116.5850 H 8 VAL8 0.0560 103 HB 73.3540 114.5460 116.3240 H 8 VAL8 0.0315 104 HG11 72.5210 114.3070 113.9690 H 8 VAL8 0.0233 105 HG12 72.6120 112.5550 114.1240 H 8 VAL8 0.0233 106 HG13 74.0780 113.5300 114.1870 H 8 VAL8 0.0233 107 HG21 70.9290 114.6150 115.8860 H 8 VAL8 0.0233 108 HG22 71.2100 113.8290 117.4320 H 8 VAL8 0.0233 109 HG23 70.8230 112.8610 116.0190 H 8 VAL8 0.0233 110 N 75.8940 113.0350 116.8010 N.am 9 MET9 -0.2456 111 CA 77.2860 112.8250 116.4260 C.3 9 MET9 0.0885 112 CB 78.0870 114.1160 116.6570 C.3 9 MET9 -0.0199 113 CG 78.1090 114.5790 118.1160 C.3 9 MET9 -0.0047 114 SD 79.0190 116.1270 118.3520 S.3 9 MET9 -0.1641 115 CE 78.2670 117.1390 117.0640 C.3 9 MET9 -0.0181 116 C 77.9180 111.6340 117.1360 C.2 9 MET9 0.2187 117 O 79.0430 111.2560 116.7910 O.2 9 MET9 -0.2778 118 H 75.6400 113.8130 117.4100 H 9 MET9 0.1312 119 HA 77.3030 112.6020 115.3570 H 9 MET9 0.0557 120 HB1 77.6520 114.8850 116.0220 H 9 MET9 0.0293 121 HB2 79.1160 113.9970 116.3240 H 9 MET9 0.0293 122 HG1 78.5500 113.8000 118.7350 H 9 MET9 0.0377 123 HG2 77.0930 114.7110 118.4630 H 9 MET9 0.0377 124 HE1 78.3730 118.1950 117.3030 H 9 MET9 0.0340 125 HE2 77.2010 116.9260 116.9870 H 9 MET9 0.0340 126 HE3 78.7370 116.9430 116.1000 H 9 MET9 0.0340 127 N 77.2330 111.0440 118.1180 N.am 10 PHE10 -0.2453 128 CA 77.6200 109.7220 118.6020 C.3 10 PHE10 0.0917 129 CB 77.1230 109.5840 120.0540 C.3 10 PHE10 -0.0036 130 CG 77.3580 108.2240 120.6720 C.ar 10 PHE10 -0.0454 131 CD1 78.5620 107.5470 120.5010 C.ar 10 PHE10 -0.0585 132 CD2 76.3670 107.6320 121.4510 C.ar 10 PHE10 -0.0585 133 CE1 78.7860 106.3230 121.1170 C.ar 10 PHE10 -0.0615 134 CE2 76.5850 106.4060 122.0670 C.ar 10 PHE10 -0.0615 135 CZ 77.7980 105.7530 121.9050 C.ar 10 PHE10 -0.0617 136 C 77.0400 108.6150 117.7280 C.2 10 PHE10 0.2191 137 O 77.7800 107.7590 117.2240 O.2 10 PHE10 -0.2778 138 H 76.4330 111.5210 118.5340 H 10 PHE10 0.1312 139 HA 78.7070 109.6500 118.5620 H 10 PHE10 0.0560 140 HB1 76.0570 109.8110 120.0930 H 10 PHE10 0.0333 141 HB2 77.6060 110.3360 120.6790 H 10 PHE10 0.0333 142 HD1 79.3370 107.9630 119.8800 H 10 PHE10 0.0620 143 HD2 75.4230 108.1350 121.5980 H 10 PHE10 0.0620 144 HE1 79.7300 105.8150 120.9790 H 10 PHE10 0.0618 145 HE2 75.8110 105.9630 122.6760 H 10 PHE10 0.0618 146 HZ 77.9700 104.8000 122.3840 H 10 PHE10 0.0618 147 N 75.7190 108.6250 117.5360 N.am 11 SER11 -0.2436 148 CA 75.0410 107.5280 116.8520 C.3 11 SER11 0.1109 149 CB 73.5190 107.6800 116.9980 C.3 11 SER11 0.0681 150 OG 73.0500 108.8850 116.4030 O.3 11 SER11 -0.3930 151 C 75.4510 107.4500 115.3870 C.2 11 SER11 0.2209 152 O 75.8560 106.3870 114.8990 O.2 11 SER11 -0.2777 153 H 75.1710 109.4160 117.8740 H 11 SER11 0.1312 154 HA 75.3570 106.6070 117.3420 H 11 SER11 0.0580 155 HB1 73.2730 107.6750 118.0660 H 11 SER11 0.0577 156 HB2 73.0250 106.8150 116.5400 H 11 SER11 0.0577 157 HG 72.1040 108.9730 116.4960 H 11 SER11 0.2095 158 N 75.3200 108.5640 114.6600 N.am 12 ALA12 -0.2459 159 CA 75.7100 108.5800 113.2560 C.3 12 ALA12 0.0850 160 CB 75.4590 109.9850 112.6970 C.3 12 ALA12 -0.0411 161 C 77.1770 108.2120 113.0920 C.2 12 ALA12 0.2182 162 O 77.5370 107.4640 112.1770 O.2 12 ALA12 -0.2778 163 H 74.9440 109.4090 115.0910 H 12 ALA12 0.1312 164 HA 75.0830 107.8640 112.7320 H 12 ALA12 0.0554 165 HB1 75.6840 110.0330 111.6310 H 12 ALA12 0.0249 166 HB2 76.0720 110.7330 113.2020 H 12 ALA12 0.0249 167 HB3 74.4150 110.2720 112.8290 H 12 ALA12 0.0249 168 N 78.0320 108.7160 113.9760 N.am 13 GLY13 -0.2485 169 CA 79.4420 108.3930 113.9330 C.3 13 GLY13 0.0765 170 C 79.7110 106.9070 114.0300 C.2 13 GLY13 0.2155 171 O 80.3520 106.3280 113.1440 O.2 13 GLY13 -0.2781 172 H 77.6870 109.3450 114.7010 H 13 GLY13 0.1309 173 HA1 79.9210 108.9080 114.7650 H 13 GLY13 0.0521 174 HA2 79.8510 108.7700 112.9960 H 13 GLY13 0.0521 175 N 79.2090 106.2750 115.0950 N.am 14 VAL14 -0.2456 176 CA 79.4870 104.8560 115.2980 C.3 14 VAL14 0.0901 177 CB 79.1030 104.3680 116.7100 C.3 14 VAL14 -0.0227 178 CG1 79.8940 105.1200 117.7910 C.3 14 VAL14 -0.0608 179 CG2 77.5940 104.4270 116.9900 C.3 14 VAL14 -0.0608 180 C 78.8540 104.0190 114.1910 C.2 14 VAL14 0.2189 181 O 79.4490 103.0330 113.7270 O.2 14 VAL14 -0.2778 182 H 78.6320 106.7830 115.7650 H 14 VAL14 0.1312 183 HA 80.5680 104.7440 115.1870 H 14 VAL14 0.0560 184 HB 79.4010 103.3210 116.7820 H 14 VAL14 0.0315 185 HG11 79.7130 104.6880 118.7750 H 14 VAL14 0.0233 186 HG12 79.6110 106.1710 117.8350 H 14 VAL14 0.0233 187 HG13 80.9670 105.0710 117.6040 H 14 VAL14 0.0233 188 HG21 77.3730 104.1060 118.0080 H 14 VAL14 0.0233 189 HG22 77.0340 103.7800 116.3160 H 14 VAL14 0.0233 190 HG23 77.2120 105.4370 116.8720 H 14 VAL14 0.0233 191 N 77.6540 104.3980 113.7310 N.am 15 LEU15 -0.2456 192 CA 77.0090 103.5900 112.7030 C.3 15 LEU15 0.0880 193 CB 75.4840 103.7970 112.6240 C.3 15 LEU15 -0.0266 194 CG 74.9870 105.1470 112.0810 C.3 15 LEU15 -0.0449 195 CD1 74.8510 105.1700 110.5500 C.3 15 LEU15 -0.0626 196 CD2 73.6350 105.5160 112.7120 C.3 15 LEU15 -0.0626 197 C 77.7560 103.6940 111.3810 C.2 15 LEU15 0.2185 198 O 77.9920 102.6760 110.7240 O.2 15 LEU15 -0.2778 199 H 77.2000 105.2370 114.0930 H 15 LEU15 0.1312 200 HA 77.1390 102.5540 113.0240 H 15 LEU15 0.0557 201 HB1 75.1030 103.6640 113.6370 H 15 LEU15 0.0287 202 HB2 75.0350 102.9910 112.0410 H 15 LEU15 0.0287 203 HG 75.7140 105.8960 112.3720 H 15 LEU15 0.0296 204 HD11 74.4720 106.1340 110.2110 H 15 LEU15 0.0232 205 HD12 74.1580 104.4020 110.2060 H 15 LEU15 0.0232 206 HD13 75.7980 105.0110 110.0420 H 15 LEU15 0.0232 207 HD21 73.2820 106.4840 112.3560 H 15 LEU15 0.0232 208 HD22 73.7040 105.5700 113.7980 H 15 LEU15 0.0232 209 HD23 72.8740 104.7750 112.4650 H 15 LEU15 0.0232 210 N 78.1610 104.9040 110.9860 N.am 16 GLY16 -0.2485 211 CA 78.9830 105.0400 109.7970 C.3 16 GLY16 0.0765 212 C 80.2830 104.2690 109.9020 C.2 16 GLY16 0.2155 213 O 80.7160 103.6270 108.9410 O.2 16 GLY16 -0.2781 214 H 77.8930 105.7320 111.5190 H 16 GLY16 0.1309 215 HA1 79.2100 106.0990 109.6950 H 16 GLY16 0.0521 216 HA2 78.4080 104.7060 108.9330 H 16 GLY16 0.0521 217 N 80.9120 104.2950 111.0810 N.am 17 ASN17 -0.2454 218 CA 82.1760 103.5850 111.2460 C.3 17 ASN17 0.0957 219 CB 82.7850 103.9000 112.6210 C.3 17 ASN17 0.0446 220 CG 83.1640 105.3820 112.7410 C.2 17 ASN17 0.2000 221 OD1 82.7160 106.2280 111.9850 O.2 17 ASN17 -0.2797 222 ND2 84.0160 105.6460 113.7360 N.am 17 ASN17 -0.2723 223 C 82.0050 102.0810 111.0660 C.2 17 ASN17 0.2191 224 O 82.7310 101.4620 110.2780 O.2 17 ASN17 -0.2778 225 H 80.5090 104.8100 111.8640 H 17 ASN17 0.1312 226 HA 82.8450 103.9380 110.4570 H 17 ASN17 0.0562 227 HB1 83.6860 103.3070 112.7880 H 17 ASN17 0.0375 228 HB2 82.0790 103.6660 113.4160 H 17 ASN17 0.0375 229 HD21 84.3130 106.5940 113.8650 H 17 ASN17 0.1266 230 HD22 84.3750 104.9390 114.3420 H 17 ASN17 0.1266 231 N 81.0470 101.4650 111.7690 N.am 18 LEU18 -0.2456 232 CA 80.9700 100.0090 111.6590 C.3 18 LEU18 0.0880 233 CB 80.0870 99.5170 112.8180 C.3 18 LEU18 -0.0266 234 CG 80.8110 99.5410 114.1770 C.3 18 LEU18 -0.0449 235 CD1 79.8200 99.7340 115.3310 C.3 18 LEU18 -0.0626 236 CD2 81.6240 98.2540 114.3740 C.3 18 LEU18 -0.0626 237 C 80.3440 99.5950 110.3310 C.2 18 LEU18 0.2187 238 O 80.5800 98.4800 109.8520 O.2 18 LEU18 -0.2778 239 H 80.3980 101.9890 112.3560 H 18 LEU18 0.1312 240 HA 81.9700 99.5860 111.7250 H 18 LEU18 0.0557 241 HB1 79.7210 98.5060 112.6300 H 18 LEU18 0.0287 242 HB2 79.1960 100.1470 112.8600 H 18 LEU18 0.0287 243 HG 81.4940 100.3910 114.2000 H 18 LEU18 0.0296 244 HD11 80.3380 99.7640 116.2900 H 18 LEU18 0.0232 245 HD12 79.0920 98.9230 115.3680 H 18 LEU18 0.0232 246 HD13 79.2720 100.6710 115.2240 H 18 LEU18 0.0232 247 HD21 82.1480 98.2540 115.3280 H 18 LEU18 0.0232 248 HD22 82.3640 98.1240 113.5860 H 18 LEU18 0.0232 249 HD23 80.9760 97.3770 114.3610 H 18 LEU18 0.0232 250 N 79.5590 100.4780 109.7090 N.am 19 ILE19 -0.2454 251 CA 79.0570 100.2030 108.3670 C.3 19 ILE19 0.0903 252 CB 77.9750 101.2340 107.9650 C.3 19 ILE19 -0.0201 253 CG1 76.6670 100.9650 108.7370 C.3 19 ILE19 -0.0514 254 CG2 77.6930 101.2530 106.4480 C.3 19 ILE19 -0.0605 255 CD1 75.6660 102.1240 108.6620 C.3 19 ILE19 -0.0650 256 C 80.2120 100.1550 107.3770 C.2 19 ILE19 0.2189 257 O 80.3210 99.2260 106.5690 O.2 19 ILE19 -0.2778 258 H 79.3090 101.3500 110.1750 H 19 ILE19 0.1312 259 HA 78.6140 99.2060 108.3860 H 19 ILE19 0.0560 260 HB 78.3450 102.2230 108.2390 H 19 ILE19 0.0318 261 HG11 76.8870 100.7680 109.7860 H 19 ILE19 0.0266 262 HG12 76.1990 100.0530 108.3660 H 19 ILE19 0.0266 263 HG21 76.9180 101.9740 106.1950 H 19 ILE19 0.0233 264 HG22 77.3680 100.2730 106.0970 H 19 ILE19 0.0233 265 HG23 78.5750 101.5380 105.8740 H 19 ILE19 0.0233 266 HD11 74.8260 101.9560 109.3360 H 19 ILE19 0.0230 267 HD12 75.2620 102.2440 107.6580 H 19 ILE19 0.0230 268 HD13 76.1370 103.0640 108.9460 H 19 ILE19 0.0230 269 N 81.1010 101.1510 107.4310 N.am 20 ALA20 -0.2459 270 CA 82.2830 101.1180 106.5810 C.3 20 ALA20 0.0850 271 CB 83.0430 102.4360 106.7870 C.3 20 ALA20 -0.0411 272 C 83.1880 99.9420 106.9160 C.2 20 ALA20 0.2184 273 O 83.9020 99.4540 106.0340 O.2 20 ALA20 -0.2778 274 H 80.9520 101.9340 108.0670 H 20 ALA20 0.1312 275 HA 81.9480 101.0240 105.5470 H 20 ALA20 0.0554 276 HB1 83.9650 102.4650 106.2080 H 20 ALA20 0.0249 277 HB2 83.3060 102.5780 107.8360 H 20 ALA20 0.0249 278 HB3 82.4330 103.2880 106.4860 H 20 ALA20 0.0249 279 N 83.1770 99.4780 108.1670 N.am 21 LEU21 -0.2457 280 CA 83.8840 98.2420 108.4900 C.3 21 LEU21 0.0880 281 CB 84.0460 98.0580 110.0110 C.3 21 LEU21 -0.0266 282 CG 85.0060 99.0820 110.6560 C.3 21 LEU21 -0.0449 283 CD1 84.9380 99.0420 112.1880 C.3 21 LEU21 -0.0626 284 CD2 86.4620 98.8980 110.1990 C.3 21 LEU21 -0.0626 285 C 83.2300 97.0410 107.8210 C.2 21 LEU21 0.2187 286 O 83.9190 96.0920 107.4260 O.2 21 LEU21 -0.2778 287 H 82.6760 99.9860 108.8960 H 21 LEU21 0.1312 288 HA 84.8730 98.3220 108.0480 H 21 LEU21 0.0557 289 HB1 84.4180 97.0550 110.2250 H 21 LEU21 0.0287 290 HB2 83.0650 98.1170 110.4800 H 21 LEU21 0.0287 291 HG 84.6880 100.0730 110.3490 H 21 LEU21 0.0296 292 HD11 85.6390 99.7520 112.6290 H 21 LEU21 0.0232 293 HD12 85.1830 98.0500 112.5700 H 21 LEU21 0.0232 294 HD13 83.9480 99.3080 112.5490 H 21 LEU21 0.0232 295 HD21 87.1210 99.6040 110.7060 H 21 LEU21 0.0232 296 HD22 86.5820 99.0690 109.1310 H 21 LEU21 0.0232 297 HD23 86.8210 97.8930 110.4210 H 21 LEU21 0.0232 298 N 81.9000 97.0580 107.6960 N.am 22 ALA22 -0.2459 299 CA 81.1970 95.9310 107.0920 C.3 22 ALA22 0.0850 300 CB 79.6830 96.1580 107.1790 C.3 22 ALA22 -0.0411 301 C 81.6440 95.7010 105.6550 C.2 22 ALA22 0.2184 302 O 81.8880 94.5590 105.2500 O.2 22 ALA22 -0.2778 303 H 81.3710 97.8660 108.0260 H 22 ALA22 0.1312 304 HA 81.4670 95.0490 107.6740 H 22 ALA22 0.0554 305 HB1 79.1350 95.2770 106.8450 H 22 ALA22 0.0249 306 HB2 79.3600 96.9990 106.5670 H 22 ALA22 0.0249 307 HB3 79.3840 96.3650 108.2070 H 22 ALA22 0.0249 308 N 81.7600 96.7710 104.8650 N.am 23 LEU23 -0.2457 309 CA 82.2580 96.6200 103.5030 C.3 23 LEU23 0.0880 310 CB 81.9510 97.8990 102.6940 C.3 23 LEU23 -0.0266 311 CG 80.4610 98.1410 102.3680 C.3 23 LEU23 -0.0449 312 CD1 79.6640 98.6740 103.5680 C.3 23 LEU23 -0.0626 313 CD2 80.3250 99.1160 101.1880 C.3 23 LEU23 -0.0626 314 C 83.7580 96.3680 103.4640 C.2 23 LEU23 0.2187 315 O 84.2560 95.8250 102.4720 O.2 23 LEU23 -0.2778 316 H 81.5000 97.6940 105.2140 H 23 LEU23 0.1312 317 HA 81.7600 95.7610 103.0500 H 23 LEU23 0.0557 318 HB1 82.4870 97.8320 101.7450 H 23 LEU23 0.0287 319 HB2 82.3640 98.7710 103.2040 H 23 LEU23 0.0287 320 HG 80.0200 97.1920 102.0590 H 23 LEU23 0.0296 321 HD11 78.6480 98.9400 103.2780 H 23 LEU23 0.0232 322 HD12 80.1310 99.5670 103.9870 H 23 LEU23 0.0232 323 HD13 79.5760 97.9350 104.3620 H 23 LEU23 0.0232 324 HD21 79.2790 99.2720 100.9250 H 23 LEU23 0.0232 325 HD22 80.8340 98.7350 100.3020 H 23 LEU23 0.0232 326 HD23 80.7580 100.0870 101.4310 H 23 LEU23 0.0232 327 N 84.4910 96.7450 104.5120 N.am 24 LEU24 -0.2456 328 CA 85.9160 96.4520 104.5690 C.3 24 LEU24 0.0880 329 CB 86.6160 97.4030 105.5580 C.3 24 LEU24 -0.0266 330 CG 86.7230 98.8550 105.0420 C.3 24 LEU24 -0.0449 331 CD1 86.9570 99.8490 106.1890 C.3 24 LEU24 -0.0626 332 CD2 87.8270 99.0070 103.9840 C.3 24 LEU24 -0.0626 333 C 86.2040 94.9920 104.8820 C.2 24 LEU24 0.2187 334 O 87.3720 94.5880 104.8540 O.2 24 LEU24 -0.2778 335 H 84.0480 97.2450 105.2830 H 24 LEU24 0.1312 336 HA 86.3210 96.6250 103.5720 H 24 LEU24 0.0557 337 HB1 87.6180 97.0410 105.7870 H 24 LEU24 0.0287 338 HB2 86.0710 97.3770 106.5000 H 24 LEU24 0.0287 339 HG 85.7780 99.1220 104.5700 H 24 LEU24 0.0296 340 HD11 86.8820 100.8760 105.8340 H 24 LEU24 0.0232 341 HD12 87.9390 99.7150 106.6410 H 24 LEU24 0.0232 342 HD13 86.2140 99.7360 106.9760 H 24 LEU24 0.0232 343 HD21 87.8740 100.0320 103.6170 H 24 LEU24 0.0232 344 HD22 87.6560 98.3560 103.1280 H 24 LEU24 0.0232 345 HD23 88.8040 98.7600 104.4010 H 24 LEU24 0.0232 346 N 85.1780 94.1980 105.1840 N.am 25 ALA25 -0.2459 347 CA 85.3380 92.7600 105.3510 C.3 25 ALA25 0.0850 348 CB 84.4970 92.3340 106.5600 C.3 25 ALA25 -0.0411 349 C 84.8930 91.9950 104.1110 C.2 25 ALA25 0.2184 350 O 85.4940 90.9730 103.7640 O.2 25 ALA25 -0.2778 351 H 84.2520 94.6090 105.3020 H 25 ALA25 0.1312 352 HA 86.3880 92.5280 105.5390 H 25 ALA25 0.0554 353 HB1 84.5910 91.2650 106.7540 H 25 ALA25 0.0249 354 HB2 83.4410 92.5600 106.4100 H 25 ALA25 0.0249 355 HB3 84.8200 92.8630 107.4570 H 25 ALA25 0.0249 356 N 83.8440 92.4840 103.4100 N.am 26 ARG26 -0.2457 357 CA 83.4040 91.8540 102.1920 C.3 26 ARG26 0.0879 358 CB 81.8880 92.0290 102.0370 C.3 26 ARG26 -0.0258 359 CG 81.3280 91.2730 100.8230 C.3 26 ARG26 -0.0154 360 CD 79.7930 91.2820 100.7580 C.3 26 ARG26 0.1045 361 NE 79.3760 91.4270 99.3700 N.pl3 26 ARG26 -0.4450 362 CZ 78.7350 90.5500 98.6070 C.cat 26 ARG26 0.5062 363 NH1 78.3620 89.3660 98.9910 N.pl3 26 ARG26 -0.4573 364 NH2 78.4610 90.8920 97.3950 N.pl3 26 ARG26 -0.4573 365 C 84.2180 92.4970 101.0980 C.2 26 ARG26 0.2187 366 O 84.3570 93.7160 101.0780 O.2 26 ARG26 -0.2778 367 H 83.3570 93.3130 103.7500 H 26 ARG26 0.1312 368 HA 83.6440 90.7900 102.2420 H 26 ARG26 0.0557 369 HB1 81.6380 93.0890 101.9710 H 26 ARG26 0.0286 370 HB2 81.4030 91.6580 102.9410 H 26 ARG26 0.0286 371 HG1 81.6790 90.2410 100.8230 H 26 ARG26 0.0299 372 HG2 81.7440 91.7250 99.9240 H 26 ARG26 0.0299 373 HD1 79.3820 92.1450 101.2860 H 26 ARG26 0.0711 374 HD2 79.3560 90.3840 101.2020 H 26 ARG26 0.0711 375 HE 79.5780 92.2610 98.8610 H 26 ARG26 0.3153 376 HH11 77.9300 88.8020 98.2650 H 26 ARG26 0.3114 377 HH12 78.4840 89.0120 99.9060 H 26 ARG26 0.3114 378 HH21 77.9640 90.1980 96.8610 H 26 ARG26 0.3114 379 HH22 78.7040 91.7680 97.0010 H 26 ARG26 0.3114 380 N 84.8200 91.7030 100.1840 N.am 27 ARG27 -0.2457 381 CA 85.7250 92.2580 99.2020 C.3 27 ARG27 0.0879 382 CB 86.4640 91.0730 98.5430 C.3 27 ARG27 -0.0258 383 CG 87.9480 91.3580 98.2800 C.3 27 ARG27 -0.0154 384 CD 88.1910 92.2430 97.0550 C.3 27 ARG27 0.1045 385 NE 89.2340 93.2190 97.3670 N.pl3 27 ARG27 -0.4450 386 CZ 89.9130 93.8950 96.4530 C.cat 27 ARG27 0.5062 387 NH1 89.7220 93.6830 95.1810 N.pl3 27 ARG27 -0.4573 388 NH2 90.7860 94.7880 96.8290 N.pl3 27 ARG27 -0.4573 389 C 85.0330 93.1560 98.2060 C.2 27 ARG27 0.2187 390 O 85.5340 94.2390 97.9080 O.2 27 ARG27 -0.2778 391 H 84.6330 90.7000 100.1870 H 27 ARG27 0.1312 392 HA 86.4300 92.8690 99.7700 H 27 ARG27 0.0557 393 HB1 85.9600 90.7310 97.6370 H 27 ARG27 0.0286 394 HB2 86.4300 90.2230 99.2260 H 27 ARG27 0.0286 395 HG1 88.4810 90.4160 98.1430 H 27 ARG27 0.0299 396 HG2 88.3820 91.8070 99.1750 H 27 ARG27 0.0299 397 HD1 87.3000 92.8060 96.7750 H 27 ARG27 0.0711 398 HD2 88.4880 91.6260 96.2020 H 27 ARG27 0.0711 399 HE 89.4370 93.3900 98.3300 H 27 ARG27 0.3153 400 HH11 90.2420 94.2080 94.5080 H 27 ARG27 0.3114 401 HH12 89.0570 92.9960 94.8970 H 27 ARG27 0.3114 402 HH21 91.2940 95.2990 96.1360 H 27 ARG27 0.3114 403 HH22 90.9450 94.9580 97.7980 H 27 ARG27 0.3114 404 N 83.8770 92.7460 97.6550 N.am 28 TRP28 -0.2453 405 CA 83.2220 93.5840 96.6930 C.3 28 TRP28 0.0918 406 CB 83.2440 92.9210 95.3030 C.3 28 TRP28 -0.0021 407 CG 84.6500 92.9050 94.7260 C.ar 28 TRP28 -0.0260 408 CD2 85.2850 91.8300 94.0020 C.ar 28 TRP28 -0.0028 409 CD1 85.5700 93.9610 94.7400 C.ar 28 TRP28 -0.0136 410 NE1 86.7100 93.5790 94.1130 N.ar 28 TRP28 -0.2641 411 CE2 86.5750 92.2820 93.6340 C.ar 28 TRP28 0.0269 412 CE3 84.8710 90.5750 93.6450 C.ar 28 TRP28 -0.0528 413 CZ2 87.4090 91.4640 92.9200 C.ar 28 TRP28 -0.0430 414 CZ3 85.7160 89.7420 92.9120 C.ar 28 TRP28 -0.0611 415 CH2 86.9880 90.1860 92.5490 C.ar 28 TRP28 -0.0602 416 C 81.8230 93.7790 97.1700 C.2 28 TRP28 0.2190 417 O 81.2900 92.9350 97.8880 O.2 28 TRP28 -0.2778 418 H 83.4700 91.8490 97.9180 H 28 TRP28 0.1312 419 HA 83.6680 94.5780 96.6600 H 28 TRP28 0.0560 420 HB1 82.6000 93.4590 94.6060 H 28 TRP28 0.0334 421 HB2 82.8530 91.9040 95.3660 H 28 TRP28 0.0334 422 HD1 85.4000 94.9270 95.1930 H 28 TRP28 0.0748 423 HE1 87.4950 94.1510 93.9890 H 28 TRP28 0.1331 424 HE3 83.8870 90.2260 93.9250 H 28 TRP28 0.0624 425 HZ2 88.3920 91.8060 92.6330 H 28 TRP28 0.0633 426 HZ3 85.3850 88.7510 92.6310 H 28 TRP28 0.0618 427 HH2 87.6430 89.5360 91.9860 H 28 TRP28 0.0618 428 N 81.1990 94.9210 96.7950 N.am 29 ARG29 -0.2456 429 CA 79.8440 95.2340 97.1730 C.3 29 ARG29 0.0879 430 CB 79.5120 96.7030 96.8490 C.3 29 ARG29 -0.0258 431 CG 78.2860 97.2190 97.6250 C.3 29 ARG29 -0.0154 432 CD 78.0610 98.7310 97.4690 C.3 29 ARG29 0.1045 433 NE 76.9590 99.1570 98.3370 N.pl3 29 ARG29 -0.4450 434 CZ 76.5910 100.4250 98.5260 C.cat 29 ARG29 0.5062 435 NH1 77.1960 101.4110 97.9160 N.pl3 29 ARG29 -0.4573 436 NH2 75.6050 100.6910 99.3400 N.pl3 29 ARG29 -0.4573 437 C 78.8590 94.2560 96.5940 C.2 29 ARG29 0.2185 438 O 78.1140 93.6320 97.3500 O.2 29 ARG29 -0.2778 439 H 81.7110 95.5890 96.2190 H 29 ARG29 0.1312 440 HA 79.8170 95.1060 98.2570 H 29 ARG29 0.0557 441 HB1 79.3720 96.8380 95.7750 H 29 ARG29 0.0286 442 HB2 80.3720 97.3150 97.1210 H 29 ARG29 0.0286 443 HG1 78.4190 96.9950 98.6840 H 29 ARG29 0.0299 444 HG2 77.3930 96.6780 97.3080 H 29 ARG29 0.0299 445 HD1 77.8050 98.9850 96.4370 H 29 ARG29 0.0711 446 HD2 78.9590 99.2830 97.7590 H 29 ARG29 0.0711 447 HE 76.4380 98.4600 98.8280 H 29 ARG29 0.3153 448 HH11 76.9070 102.3540 98.0730 H 29 ARG29 0.3114 449 HH12 77.9470 101.2220 97.2910 H 29 ARG29 0.3114 450 HH21 75.3180 101.6350 99.4910 H 29 ARG29 0.3114 451 HH22 75.1300 99.9540 99.8160 H 29 ARG29 0.3114 452 N 78.8680 94.0610 95.2530 N.am 30 GLY30 -0.2485 453 CA 77.9090 93.1990 94.6190 C.3 30 GLY30 0.0765 454 C 78.5200 91.8590 94.3600 C.2 30 GLY30 0.2155 455 O 79.7390 91.7060 94.2860 O.2 30 GLY30 -0.2781 456 H 79.5690 94.5350 94.6830 H 30 GLY30 0.1309 457 HA1 77.6350 93.6570 93.6700 H 30 GLY30 0.0521 458 HA2 77.0110 93.0990 95.2320 H 30 GLY30 0.0521 459 N 77.6760 90.8180 94.2170 N.am 31 ASP31 -0.2454 460 CA 78.2430 89.5300 93.9390 C.3 31 ASP31 0.0974 461 CB 77.3210 88.4250 94.4770 C.3 31 ASP31 0.0576 462 CG 77.3720 88.5250 96.0080 C.2 31 ASP31 0.1780 463 OD1 76.4990 89.1310 96.6160 O.co2 31 ASP31 -0.6478 464 OD2 78.3140 88.0330 96.6130 O.co2 31 ASP31 -0.6478 465 C 78.4640 89.4720 92.4690 C.2 31 ASP31 0.2192 466 O 77.5300 89.4720 91.6720 O.2 31 ASP31 -0.2778 467 H 76.6670 90.9420 94.3040 H 31 ASP31 0.1312 468 HA 79.2110 89.4330 94.4400 H 31 ASP31 0.0563 469 HB1 77.6660 87.4340 94.1820 H 31 ASP31 0.0394 470 HB2 76.2950 88.5440 94.1310 H 31 ASP31 0.0394 471 N 79.7460 89.4630 92.0840 N.am 32 VAL32 -0.2454 472 CA 80.0790 89.5140 90.7010 C.3 32 VAL32 0.0901 473 CB 80.9020 90.7970 90.4460 C.3 32 VAL32 -0.0227 474 CG1 82.2470 90.8100 91.1940 C.3 32 VAL32 -0.0608 475 CG2 81.0870 91.0870 88.9490 C.3 32 VAL32 -0.0608 476 C 80.8140 88.2560 90.3920 C.2 32 VAL32 0.2187 477 O 81.2220 87.5290 91.2960 O.2 32 VAL32 -0.2778 478 H 80.4870 89.4190 92.7840 H 32 VAL32 0.1312 479 HA 79.1780 89.5260 90.0850 H 32 VAL32 0.0560 480 HB 80.3070 91.6200 90.8460 H 32 VAL32 0.0315 481 HG11 82.7540 91.7660 91.0760 H 32 VAL32 0.0233 482 HG12 82.9160 90.0320 90.8270 H 32 VAL32 0.0233 483 HG13 82.1080 90.6510 92.2630 H 32 VAL32 0.0233 484 HG21 81.4730 92.0910 88.7880 H 32 VAL32 0.0233 485 HG22 80.1380 91.0170 88.4160 H 32 VAL32 0.0233 486 HG23 81.7810 90.3900 88.4850 H 32 VAL32 0.0233 487 N 80.9440 87.9380 89.0880 N.am 33 GLY33 -0.2485 488 CA 81.7140 86.8040 88.6620 C.3 33 GLY33 0.0765 489 C 83.0860 87.3290 88.3480 C.2 33 GLY33 0.2156 490 O 83.3940 88.4830 88.6480 O.2 33 GLY33 -0.2781 491 H 80.4830 88.5180 88.3870 H 33 GLY33 0.1309 492 HA1 81.2450 86.3990 87.7660 H 33 GLY33 0.0521 493 HA2 81.7500 86.0400 89.4410 H 33 GLY33 0.0521 494 N 83.9630 86.5140 87.7240 N.am 34 CYS34 -0.2451 495 CA 85.2720 87.0310 87.4090 C.3 34 CYS34 0.0965 496 CB 86.1540 85.8950 86.8740 C.3 34 CYS34 0.0147 497 SG 86.4160 84.5890 88.1010 S.3 34 CYS34 -0.1762 498 C 85.0950 88.1050 86.3810 C.2 34 CYS34 0.2195 499 O 84.7400 87.8310 85.2350 O.2 34 CYS34 -0.2778 500 H 83.7060 85.5570 87.4820 H 34 CYS34 0.1312 501 HA 85.7060 87.4440 88.3220 H 34 CYS34 0.0565 502 HB1 87.1270 86.2820 86.5710 H 34 CYS34 0.0394 503 HB2 85.7030 85.4490 85.9860 H 34 CYS34 0.0394 504 HG 87.1730 83.6210 87.5760 H 34 CYS34 0.1017 505 N 85.3200 89.3700 86.7970 N.am 35 SER35 -0.2436 506 CA 85.0980 90.4730 85.9110 C.3 35 SER35 0.1109 507 CB 83.7280 91.1230 86.1760 C.3 35 SER35 0.0681 508 OG 83.7700 92.1350 87.1710 O.3 35 SER35 -0.3930 509 C 86.2250 91.4240 86.0660 C.2 35 SER35 0.2209 510 O 86.8590 91.5060 87.1170 O.2 35 SER35 -0.2777 511 H 85.6500 89.5410 87.7470 H 35 SER35 0.1312 512 HA 85.1310 90.1080 84.8820 H 35 SER35 0.0580 513 HB1 83.0180 90.3590 86.4990 H 35 SER35 0.0577 514 HB2 83.3080 91.5250 85.2450 H 35 SER35 0.0577 515 HG 84.3150 92.8520 86.8470 H 35 SER35 0.2095 516 N 86.4550 92.2070 85.0030 N.am 36 ALA36 -0.2459 517 CA 87.4360 93.2410 85.0530 C.3 36 ALA36 0.0850 518 CB 88.2300 93.2480 83.7420 C.3 36 ALA36 -0.0411 519 C 86.6490 94.4960 85.2080 C.2 36 ALA36 0.2182 520 O 85.4930 94.5630 84.7880 O.2 36 ALA36 -0.2778 521 H 85.9210 92.0610 84.1460 H 36 ALA36 0.1312 522 HA 88.1060 93.1090 85.9050 H 36 ALA36 0.0554 523 HB1 88.9650 94.0540 83.7270 H 36 ALA36 0.0249 524 HB2 87.5770 93.3740 82.8770 H 36 ALA36 0.0249 525 HB3 88.7700 92.3100 83.6130 H 36 ALA36 0.0249 526 N 87.2550 95.5100 85.8540 N.am 37 GLY37 -0.2485 527 CA 86.5870 96.7600 86.0740 C.3 37 GLY37 0.0765 528 C 87.3860 97.5290 87.0800 C.2 37 GLY37 0.2155 529 O 88.3570 97.0220 87.6450 O.2 37 GLY37 -0.2781 530 H 88.2090 95.3870 86.1940 H 37 GLY37 0.1309 531 HA1 85.5810 96.5740 86.4510 H 37 GLY37 0.0521 532 HA2 86.5460 97.2970 85.1250 H 37 GLY37 0.0521 533 N 86.9760 98.7920 87.3460 N.am 38 ARG38 -0.2459 534 CA 87.6810 99.6630 88.2500 C.3 38 ARG38 0.0879 535 CB 87.1500 101.1080 88.1800 C.3 38 ARG38 -0.0258 536 CG 85.6240 101.2560 87.9960 C.3 38 ARG38 -0.0154 537 CD 85.0750 102.6330 88.4110 C.3 38 ARG38 0.1045 538 NE 86.0420 103.6740 88.1420 N.pl3 38 ARG38 -0.4450 539 CZ 85.9830 104.9610 88.4440 C.cat 38 ARG38 0.5062 540 NH1 84.8860 105.5390 88.8140 N.pl3 38 ARG38 -0.4573 541 NH2 87.0610 105.6730 88.3550 N.pl3 38 ARG38 -0.4573 542 C 87.5770 99.0900 89.6350 C.2 38 ARG38 0.2187 543 O 86.4780 98.9870 90.1790 O.2 38 ARG38 -0.2778 544 H 86.1340 99.1400 86.8870 H 38 ARG38 0.1312 545 HA 88.7310 99.6540 87.9490 H 38 ARG38 0.0557 546 HB1 87.6350 101.5970 87.3350 H 38 ARG38 0.0286 547 HB2 87.4840 101.6550 89.0640 H 38 ARG38 0.0286 548 HG1 85.0960 100.4890 88.5630 H 38 ARG38 0.0299 549 HG2 85.3840 101.0780 86.9470 H 38 ARG38 0.0299 550 HD1 84.9250 102.6500 89.4830 H 38 ARG38 0.0711 551 HD2 84.1380 102.8750 87.9050 H 38 ARG38 0.0711 552 HE 86.8920 103.4590 87.6470 H 38 ARG38 0.3153 553 HH11 84.8560 106.5450 88.8540 H 38 ARG38 0.3114 554 HH12 84.0750 105.0180 89.0440 H 38 ARG38 0.3114 555 HH21 87.0880 106.6370 88.6060 H 38 ARG38 0.3114 556 HH22 87.8750 105.2030 87.9930 H 38 ARG38 0.3114 557 N 88.7340 98.6950 90.2240 N.am 39 ARG39 -0.2457 558 CA 88.7950 98.1050 91.5370 C.3 39 ARG39 0.0879 559 CB 88.4850 96.5840 91.4250 C.3 39 ARG39 -0.0258 560 CG 87.0870 96.2500 90.8690 C.3 39 ARG39 -0.0154 561 CD 86.7830 94.7600 90.7040 C.3 39 ARG39 0.1045 562 NE 85.3810 94.6450 90.3020 N.pl3 39 ARG39 -0.4450 563 CZ 84.8330 93.6150 89.6690 C.cat 39 ARG39 0.5062 564 NH1 85.5150 92.5520 89.3460 N.pl3 39 ARG39 -0.4573 565 NH2 83.5700 93.6700 89.3520 N.pl3 39 ARG39 -0.4573 566 C 90.1920 98.2770 92.0470 C.2 39 ARG39 0.2187 567 O 91.1040 98.6270 91.3000 O.2 39 ARG39 -0.2778 568 H 89.6060 98.8230 89.7100 H 39 ARG39 0.1312 569 HA 88.0980 98.6330 92.1890 H 39 ARG39 0.0557 570 HB1 88.5880 96.1160 92.4050 H 39 ARG39 0.0286 571 HB2 89.2310 96.1130 90.7830 H 39 ARG39 0.0286 572 HG1 86.9680 96.6650 89.8720 H 39 ARG39 0.0299 573 HG2 86.3300 96.7150 91.5020 H 39 ARG39 0.0299 574 HD1 86.9150 94.2120 91.6350 H 39 ARG39 0.0711 575 HD2 87.4240 94.3220 89.9330 H 39 ARG39 0.0711 576 HE 84.7640 95.4040 90.4970 H 39 ARG39 0.3153 577 HH11 85.0610 91.8160 88.8440 H 39 ARG39 0.3114 578 HH12 86.4780 92.4650 89.5790 H 39 ARG39 0.3114 579 HH21 83.1800 92.9080 88.8300 H 39 ARG39 0.3114 580 HH22 82.9970 94.4420 89.6060 H 39 ARG39 0.3114 581 N 90.3820 98.0400 93.3600 N.am 40 SER40 -0.2436 582 CA 91.6850 98.0710 93.9550 C.3 40 SER40 0.1109 583 CB 91.6380 98.8860 95.2550 C.3 40 SER40 0.0681 584 OG 92.8850 98.8140 95.9310 O.3 40 SER40 -0.3930 585 C 92.0650 96.6470 94.1570 C.2 40 SER40 0.2210 586 O 91.2020 95.7710 94.2080 O.2 40 SER40 -0.2777 587 H 89.5750 97.8320 93.9480 H 40 SER40 0.1312 588 HA 92.4040 98.5280 93.2700 H 40 SER40 0.0580 589 HB1 90.8560 98.5040 95.9170 H 40 SER40 0.0577 590 HB2 91.3800 99.9210 94.9960 H 40 SER40 0.0577 591 HG 93.0210 99.5470 96.5290 H 40 SER40 0.2095 592 N 93.3860 96.3970 94.2430 N.am 41 SER41 -0.2435 593 CA 93.9110 95.1160 94.6170 C.3 41 SER41 0.1109 594 CB 95.2810 94.8980 93.9520 C.3 41 SER41 0.0681 595 OG 96.2120 95.8760 94.4000 O.3 41 SER41 -0.3930 596 C 94.0370 95.2360 96.1000 C.2 41 SER41 0.2209 597 O 94.1610 96.3500 96.6180 O.2 41 SER41 -0.2777 598 H 94.0400 97.1510 94.0330 H 41 SER41 0.1312 599 HA 93.2060 94.3290 94.3460 H 41 SER41 0.0580 600 HB1 95.1580 94.9540 92.8640 H 41 SER41 0.0577 601 HB2 95.6550 93.8980 94.1930 H 41 SER41 0.0577 602 HG 97.0380 95.8220 93.9230 H 41 SER41 0.2095 603 N 94.0440 94.1100 96.8410 N.am 42 LEU42 -0.2456 604 CA 94.1610 94.2720 98.2660 C.3 42 LEU42 0.0880 605 CB 93.9160 92.9280 98.9740 C.3 42 LEU42 -0.0266 606 CG 92.4430 92.4790 98.9550 C.3 42 LEU42 -0.0449 607 CD1 92.3180 91.0090 99.3730 C.3 42 LEU42 -0.0626 608 CD2 91.5720 93.3590 99.8670 C.3 42 LEU42 -0.0626 609 C 95.5370 94.7780 98.5350 C.2 42 LEU42 0.2187 610 O 96.5420 94.1300 98.2350 O.2 42 LEU42 -0.2778 611 H 93.9700 93.1870 96.4120 H 42 LEU42 0.1312 612 HA 93.4360 95.0160 98.5970 H 42 LEU42 0.0557 613 HB1 94.2460 92.9840 100.0130 H 42 LEU42 0.0287 614 HB2 94.5380 92.1630 98.5050 H 42 LEU42 0.0287 615 HG 92.0700 92.5520 97.9340 H 42 LEU42 0.0296 616 HD11 91.2800 90.6750 99.3310 H 42 LEU42 0.0232 617 HD12 92.6750 90.8560 100.3920 H 42 LEU42 0.0232 618 HD13 92.8980 90.3600 98.7160 H 42 LEU42 0.0232 619 HD21 90.5440 92.9980 99.8980 H 42 LEU42 0.0232 620 HD22 91.5480 94.3970 99.5400 H 42 LEU42 0.0232 621 HD23 91.9460 93.3470 100.8910 H 42 LEU42 0.0232 622 N 95.6020 96.0000 99.0880 N.am 43 SER43 -0.2436 623 CA 96.8980 96.5740 99.2060 C.3 43 SER43 0.1109 624 CB 97.2280 97.3690 97.9280 C.3 43 SER43 0.0681 625 OG 98.6260 97.6350 97.8920 O.3 43 SER43 -0.3930 626 C 96.9180 97.4400 100.4250 C.2 43 SER43 0.2209 627 O 95.9300 97.5380 101.1640 O.2 43 SER43 -0.2777 628 H 94.7660 96.4900 99.4060 H 43 SER43 0.1312 629 HA 97.6540 95.8100 99.3480 H 43 SER43 0.0580 630 HB1 96.6440 98.2970 97.8900 H 43 SER43 0.0577 631 HB2 96.9530 96.7760 97.0480 H 43 SER43 0.0577 632 HG 98.8560 98.1870 97.1450 H 43 SER43 0.2095 633 N 98.0330 98.2000 100.5930 N.am 44 LEU44 -0.2456 634 CA 98.3460 99.0820 101.7120 C.3 44 LEU44 0.0880 635 CB 99.6160 99.8690 101.3300 C.3 44 LEU44 -0.0266 636 CG 100.0780 100.9270 102.3500 C.3 44 LEU44 -0.0449 637 CD1 100.4010 100.3040 103.7120 C.3 44 LEU44 -0.0626 638 CD2 101.2850 101.7060 101.8130 C.3 44 LEU44 -0.0626 639 C 97.1980 100.0370 102.0140 C.2 44 LEU44 0.2187 640 O 96.9960 100.4170 103.1750 O.2 44 LEU44 -0.2778 641 H 98.7310 98.1470 99.8510 H 44 LEU44 0.1312 642 HA 98.5130 98.4530 102.5860 H 44 LEU44 0.0557 643 HB1 99.4440 100.3670 100.3730 H 44 LEU44 0.0287 644 HB2 100.4300 99.1660 101.1520 H 44 LEU44 0.0287 645 HG 99.2740 101.6500 102.4950 H 44 LEU44 0.0296 646 HD11 100.7360 101.0640 104.4180 H 44 LEU44 0.0232 647 HD12 101.1890 99.5560 103.6240 H 44 LEU44 0.0232 648 HD13 99.5250 99.8260 104.1510 H 44 LEU44 0.0232 649 HD21 101.5900 102.4860 102.5110 H 44 LEU44 0.0232 650 HD22 101.0500 102.1900 100.8640 H 44 LEU44 0.0232 651 HD23 102.1400 101.0500 101.6500 H 44 LEU44 0.0232 652 N 96.4280 100.4200 100.9930 N.am 45 PHE45 -0.2453 653 CA 95.3360 101.3600 101.2190 C.3 45 PHE45 0.0917 654 CB 94.7740 101.7360 99.8400 C.3 45 PHE45 -0.0036 655 CG 93.6750 102.7610 99.9030 C.ar 45 PHE45 -0.0454 656 CD1 93.9740 104.1210 99.9070 C.ar 45 PHE45 -0.0585 657 CD2 92.3450 102.3600 99.9570 C.ar 45 PHE45 -0.0585 658 CE1 92.9560 105.0640 99.9490 C.ar 45 PHE45 -0.0615 659 CE2 91.3290 103.3030 100.0130 C.ar 45 PHE45 -0.0615 660 CZ 91.6310 104.6570 100.0070 C.ar 45 PHE45 -0.0617 661 C 94.2750 100.7660 102.1330 C.2 45 PHE45 0.2190 662 O 93.6900 101.4800 102.9510 O.2 45 PHE45 -0.2778 663 H 96.6030 100.0560 100.0560 H 45 PHE45 0.1312 664 HA 95.7600 102.2420 101.7060 H 45 PHE45 0.0560 665 HB1 94.4100 100.8460 99.3250 H 45 PHE45 0.0333 666 HB2 95.5800 102.1340 99.2210 H 45 PHE45 0.0333 667 HD1 95.0060 104.4490 99.8840 H 45 PHE45 0.0620 668 HD2 92.1060 101.3070 99.9800 H 45 PHE45 0.0620 669 HE1 93.2000 106.1140 99.9590 H 45 PHE45 0.0618 670 HE2 90.3100 102.9770 100.1080 H 45 PHE45 0.0618 671 HZ 90.8450 105.3960 100.0710 H 45 PHE45 0.0618 672 N 94.0070 99.4640 102.0140 N.am 46 HIS46 -0.2453 673 CA 93.0690 98.8360 102.9370 C.3 46 HIS46 0.0932 674 ND1 92.8110 97.3770 99.9410 N.ar 46 HIS46 -0.2469 675 CG 92.1230 97.4130 101.1020 C.ar 46 HIS46 0.0551 676 CB 92.7680 97.4020 102.4700 C.3 46 HIS46 0.0146 677 NE2 90.6390 97.4340 99.4460 N.ar 46 HIS46 -0.2539 678 CD2 90.7520 97.4290 100.7970 C.ar 46 HIS46 0.0047 679 CE1 91.8950 97.4270 98.9620 C.ar 46 HIS46 0.0737 680 C 93.6340 98.7820 104.3480 C.2 46 HIS46 0.2190 681 O 92.9070 99.0270 105.3180 O.2 46 HIS46 -0.2778 682 H 94.4550 98.9120 101.2830 H 46 HIS46 0.1312 683 HA 92.1580 99.4370 102.9550 H 46 HIS46 0.0561 684 HB1 92.0950 96.9030 103.1700 H 46 HIS46 0.0348 685 HB2 93.6830 96.8100 102.4270 H 46 HIS46 0.0348 686 HE2 89.8060 97.4620 98.9320 H 46 HIS46 0.1339 687 HD2 89.9470 97.4410 101.5180 H 46 HIS46 0.0764 688 HE1 92.1580 97.4380 97.9140 H 46 HIS46 0.0963 689 N 94.9250 98.4690 104.4830 N.am 47 VAL47 -0.2454 690 CA 95.5650 98.4430 105.7910 C.3 47 VAL47 0.0901 691 CB 97.0060 97.8930 105.6260 C.3 47 VAL47 -0.0227 692 CG1 97.7340 97.7250 106.9730 C.3 47 VAL47 -0.0608 693 CG2 97.0370 96.5640 104.8520 C.3 47 VAL47 -0.0608 694 C 95.6100 99.8200 106.4340 C.2 47 VAL47 0.2189 695 O 95.7560 99.9230 107.6570 O.2 47 VAL47 -0.2778 696 H 95.4740 98.2440 103.6540 H 47 VAL47 0.1312 697 HA 94.9790 97.7860 106.4350 H 47 VAL47 0.0560 698 HB 97.5780 98.6140 105.0400 H 47 VAL47 0.0315 699 HG11 98.7200 97.2830 106.8360 H 47 VAL47 0.0233 700 HG12 97.1730 97.0830 107.6520 H 47 VAL47 0.0233 701 HG13 97.8890 98.6790 107.4790 H 47 VAL47 0.0233 702 HG21 98.0550 96.1800 104.7860 H 47 VAL47 0.0233 703 HG22 96.6710 96.6760 103.8310 H 47 VAL47 0.0233 704 HG23 96.4290 95.8090 105.3510 H 47 VAL47 0.0233 705 N 95.4560 100.8850 105.6510 N.am 48 LEU48 -0.2456 706 CA 95.3400 102.2240 106.2180 C.3 48 LEU48 0.0880 707 CB 95.9700 103.2000 105.2140 C.3 48 LEU48 -0.0266 708 CG 97.5040 103.1370 105.1340 C.3 48 LEU48 -0.0449 709 CD1 98.0090 103.8450 103.8720 C.3 48 LEU48 -0.0626 710 CD2 98.1500 103.7620 106.3760 C.3 48 LEU48 -0.0626 711 C 93.8960 102.6280 106.4940 C.2 48 LEU48 0.2187 712 O 93.6160 103.2400 107.5300 O.2 48 LEU48 -0.2778 713 H 95.4190 100.7630 104.6390 H 48 LEU48 0.1312 714 HA 95.8790 102.2590 107.1680 H 48 LEU48 0.0557 715 HB1 95.6790 104.2160 105.4690 H 48 LEU48 0.0287 716 HB2 95.5580 102.9950 104.2260 H 48 LEU48 0.0287 717 HG 97.8140 102.0930 105.0720 H 48 LEU48 0.0296 718 HD11 99.0920 103.7590 103.7780 H 48 LEU48 0.0232 719 HD12 97.7630 104.9070 103.8940 H 48 LEU48 0.0232 720 HD13 97.5650 103.4180 102.9730 H 48 LEU48 0.0232 721 HD21 99.2350 103.7690 106.2840 H 48 LEU48 0.0232 722 HD22 97.8950 103.2080 107.2790 H 48 LEU48 0.0232 723 HD23 97.8260 104.7940 106.5150 H 48 LEU48 0.0232 724 N 92.9700 102.2800 105.5990 N.am 49 VAL49 -0.2454 725 CA 91.5650 102.6410 105.7810 C.3 49 VAL49 0.0901 726 CB 90.7290 102.3950 104.5030 C.3 49 VAL49 -0.0227 727 CG1 89.2130 102.4890 104.7580 C.3 49 VAL49 -0.0608 728 CG2 91.0920 103.4000 103.4050 C.3 49 VAL49 -0.0608 729 C 90.9830 101.9260 106.9920 C.2 49 VAL49 0.2190 730 O 90.2660 102.5250 107.8050 O.2 49 VAL49 -0.2778 731 H 93.2480 101.7520 104.7720 H 49 VAL49 0.1312 732 HA 91.5480 103.7070 106.0180 H 49 VAL49 0.0560 733 HB 90.9450 101.3890 104.1400 H 49 VAL49 0.0315 734 HG11 88.6470 102.3640 103.8350 H 49 VAL49 0.0233 735 HG12 88.9450 103.4560 105.1850 H 49 VAL49 0.0233 736 HG13 88.8790 101.7170 105.4470 H 49 VAL49 0.0233 737 HG21 90.4040 103.3210 102.5660 H 49 VAL49 0.0233 738 HG22 92.0970 103.2410 103.0240 H 49 VAL49 0.0233 739 HG23 91.0350 104.4220 103.7800 H 49 VAL49 0.0233 740 N 91.2560 100.6250 107.1140 N.am 50 THR50 -0.2434 741 CA 90.7400 99.8700 108.2480 C.3 50 THR50 0.1135 742 CB 91.0940 98.3760 108.1310 C.3 50 THR50 0.0763 743 OG1 92.4960 98.2480 107.9630 O.3 50 THR50 -0.3900 744 CG2 90.3550 97.7110 106.9620 C.3 50 THR50 -0.0370 745 C 91.2610 100.4300 109.5610 C.2 50 THR50 0.2212 746 O 90.5090 100.5460 110.5330 O.2 50 THR50 -0.2777 747 H 91.8280 100.1580 106.4100 H 50 THR50 0.1313 748 HA 89.6570 99.9950 108.2510 H 50 THR50 0.0583 749 HB 90.7850 97.8840 109.0620 H 50 THR50 0.0611 750 HG1 92.7750 97.3400 108.0170 H 50 THR50 0.2098 751 HG21 90.5700 96.6440 106.9030 H 50 THR50 0.0255 752 HG22 90.6300 98.1600 106.0080 H 50 THR50 0.0255 753 HG23 89.2790 97.8200 107.0840 H 50 THR50 0.0255 754 N 92.5420 100.8010 109.6050 N.am 51 GLU51 -0.2456 755 CA 93.1000 101.3520 110.8340 C.3 51 GLU51 0.0883 756 CB 94.6290 101.3370 110.6560 C.3 51 GLU51 -0.0193 757 CG 95.1800 99.8930 110.6530 C.3 51 GLU51 0.0356 758 CD 96.7140 99.7920 110.5720 C.2 51 GLU51 0.1760 759 OE1 97.3550 100.7110 110.0640 O.co2 51 GLU51 -0.6478 760 OE2 97.2520 98.7830 111.0270 O.co2 51 GLU51 -0.6478 761 C 92.5200 102.7260 111.1400 C.2 51 GLU51 0.2187 762 O 92.2800 103.0560 112.3070 O.2 51 GLU51 -0.2778 763 H 93.1310 100.6990 108.7790 H 51 GLU51 0.1312 764 HA 92.8270 100.6870 111.6550 H 51 GLU51 0.0557 765 HB1 95.1100 101.9220 111.4380 H 51 GLU51 0.0290 766 HB2 94.8920 101.8130 109.7110 H 51 GLU51 0.0290 767 HG1 94.7720 99.3250 109.8190 H 51 GLU51 0.0374 768 HG2 94.8660 99.3740 111.5570 H 51 GLU51 0.0374 769 N 92.2660 103.5340 110.1090 N.am 52 LEU52 -0.2456 770 CA 91.6210 104.8260 110.3270 C.3 52 LEU52 0.0880 771 CB 91.5940 105.5810 108.9840 C.3 52 LEU52 -0.0266 772 CG 90.9950 107.0010 109.0390 C.3 52 LEU52 -0.0449 773 CD1 91.8190 107.9510 109.9200 C.3 52 LEU52 -0.0626 774 CD2 90.8540 107.5780 107.6240 C.3 52 LEU52 -0.0626 775 C 90.2250 104.6500 110.9130 C.2 52 LEU52 0.2187 776 O 89.8520 105.3290 111.8790 O.2 52 LEU52 -0.2778 777 H 92.5240 103.2480 109.1640 H 52 LEU52 0.1312 778 HA 92.2250 105.3670 111.0550 H 52 LEU52 0.0557 779 HB1 91.0350 104.9880 108.2600 H 52 LEU52 0.0287 780 HB2 92.6100 105.6410 108.5930 H 52 LEU52 0.0287 781 HG 89.9920 106.9420 109.4640 H 52 LEU52 0.0296 782 HD11 91.3640 108.9420 109.9460 H 52 LEU52 0.0232 783 HD12 92.8350 108.0640 109.5430 H 52 LEU52 0.0232 784 HD13 91.8720 107.5970 110.9500 H 52 LEU52 0.0232 785 HD21 90.3960 108.5660 107.6520 H 52 LEU52 0.0232 786 HD22 90.2250 106.9440 106.9980 H 52 LEU52 0.0232 787 HD23 91.8240 107.6770 107.1370 H 52 LEU52 0.0232 788 N 89.4390 103.7340 110.3440 N.am 53 VAL53 -0.2454 789 CA 88.0750 103.5290 110.8250 C.3 53 VAL53 0.0901 790 CB 87.2280 102.7430 109.8030 C.3 53 VAL53 -0.0227 791 CG1 85.7850 102.5510 110.2980 C.3 53 VAL53 -0.0608 792 CG2 87.1860 103.4590 108.4420 C.3 53 VAL53 -0.0608 793 C 88.0860 102.9280 112.2260 C.2 53 VAL53 0.2189 794 O 87.2530 103.2720 113.0740 O.2 53 VAL53 -0.2778 795 H 89.7930 103.1740 109.5690 H 53 VAL53 0.1312 796 HA 87.6410 104.5280 110.9230 H 53 VAL53 0.0560 797 HB 87.6830 101.7620 109.6570 H 53 VAL53 0.0315 798 HG11 85.1760 102.0660 109.5350 H 53 VAL53 0.0233 799 HG12 85.3200 103.5120 110.5240 H 53 VAL53 0.0233 800 HG13 85.7430 101.9420 111.2000 H 53 VAL53 0.0233 801 HG21 86.6150 102.8840 107.7120 H 53 VAL53 0.0233 802 HG22 88.1770 103.6220 108.0260 H 53 VAL53 0.0233 803 HG23 86.7160 104.4380 108.5330 H 53 VAL53 0.0233 804 N 89.0350 102.0290 112.4940 N.am 54 PHE54 -0.2453 805 CA 89.1590 101.4460 113.8240 C.3 54 PHE54 0.0917 806 CB 90.2690 100.3820 113.7580 C.3 54 PHE54 -0.0036 807 CG 90.6260 99.8180 115.1090 C.ar 54 PHE54 -0.0454 808 CD1 89.8170 98.8620 115.7150 C.ar 54 PHE54 -0.0585 809 CD2 91.7530 100.2790 115.7850 C.ar 54 PHE54 -0.0585 810 CE1 90.1310 98.3710 116.9760 C.ar 54 PHE54 -0.0615 811 CE2 92.0660 99.7940 117.0470 C.ar 54 PHE54 -0.0615 812 CZ 91.2560 98.8370 117.6430 C.ar 54 PHE54 -0.0617 813 C 89.5030 102.5080 114.8590 C.2 54 PHE54 0.2191 814 O 88.9370 102.5210 115.9580 O.2 54 PHE54 -0.2778 815 H 89.6820 101.7460 111.7580 H 54 PHE54 0.1312 816 HA 88.2000 100.9980 114.0850 H 54 PHE54 0.0560 817 HB1 91.1650 100.8110 113.3080 H 54 PHE54 0.0333 818 HB2 89.9640 99.5690 113.0990 H 54 PHE54 0.0333 819 HD1 88.9350 98.5030 115.2050 H 54 PHE54 0.0620 820 HD2 92.3820 101.0350 115.3350 H 54 PHE54 0.0620 821 HE1 89.4970 97.6310 117.4410 H 54 PHE54 0.0618 822 HE2 92.9370 100.1700 117.5640 H 54 PHE54 0.0618 823 HZ 91.4980 98.4610 118.6260 H 54 PHE54 0.0618 824 N 90.4290 103.4090 114.5250 N.am 55 THR55 -0.2434 825 CA 90.7720 104.4870 115.4440 C.3 55 THR55 0.1135 826 CB 91.9340 105.2990 114.8330 C.3 55 THR55 0.0763 827 OG1 93.0470 104.4310 114.6820 O.3 55 THR55 -0.3900 828 CG2 92.3700 106.5000 115.6950 C.3 55 THR55 -0.0370 829 C 89.5880 105.4230 115.6560 C.2 55 THR55 0.2212 830 O 89.3390 105.8680 116.7800 O.2 55 THR55 -0.2777 831 H 90.8990 103.3430 113.6220 H 55 THR55 0.1313 832 HA 91.0650 104.0440 116.3970 H 55 THR55 0.0583 833 HB 91.5930 105.6650 113.8530 H 55 THR55 0.0611 834 HG1 93.6840 104.8180 114.0870 H 55 THR55 0.2098 835 HG21 93.1940 107.0460 115.2350 H 55 THR55 0.0255 836 HG22 92.6950 106.1730 116.6830 H 55 THR55 0.0255 837 HG23 91.5590 107.2160 115.8280 H 55 THR55 0.0255 838 N 88.8290 105.7100 114.5960 N.am 56 ASP56 -0.2450 839 CA 87.6410 106.5480 114.7410 C.3 56 ASP56 0.0974 840 CB 87.0550 106.9540 113.3820 C.3 56 ASP56 0.0576 841 CG 87.9790 107.9780 112.7120 C.2 56 ASP56 0.1780 842 OD1 88.3290 108.9670 113.3610 O.co2 56 ASP56 -0.6478 843 OD2 88.3370 107.7760 111.5570 O.co2 56 ASP56 -0.6478 844 C 86.6320 105.9140 115.6930 C.2 56 ASP56 0.2192 845 O 86.0910 106.5810 116.5860 O.2 56 ASP56 -0.2778 846 H 89.0800 105.3420 113.6790 H 56 ASP56 0.1312 847 HA 87.9760 107.4500 115.2580 H 56 ASP56 0.0563 848 HB1 86.0860 107.4360 113.4960 H 56 ASP56 0.0394 849 HB2 86.9250 106.0900 112.7320 H 56 ASP56 0.0394 850 N 86.3660 104.6200 115.5120 N.am 57 LEU57 -0.2456 851 CA 85.3980 103.9300 116.3600 C.3 57 LEU57 0.0880 852 CB 85.1680 102.5240 115.7860 C.3 57 LEU57 -0.0266 853 CG 84.0680 101.7180 116.5020 C.3 57 LEU57 -0.0449 854 CD1 82.6780 102.3530 116.3330 C.3 57 LEU57 -0.0626 855 CD2 84.0580 100.2700 116.0040 C.3 57 LEU57 -0.0626 856 C 85.8660 103.8900 117.8090 C.2 57 LEU57 0.2187 857 O 85.0990 104.2020 118.7300 O.2 57 LEU57 -0.2778 858 H 86.8440 104.1060 114.7720 H 57 LEU57 0.1312 859 HA 84.4800 104.5160 116.3200 H 57 LEU57 0.0557 860 HB1 86.1090 101.9720 115.8200 H 57 LEU57 0.0287 861 HB2 84.9180 102.6080 114.7280 H 57 LEU57 0.0287 862 HG 84.2970 101.6890 117.5680 H 57 LEU57 0.0296 863 HD11 81.9140 101.7590 116.8340 H 57 LEU57 0.0232 864 HD12 82.4030 102.4230 115.2820 H 57 LEU57 0.0232 865 HD13 82.6370 103.3550 116.7590 H 57 LEU57 0.0232 866 HD21 83.3290 99.6790 116.5560 H 57 LEU57 0.0232 867 HD22 85.0330 99.8010 116.1390 H 57 LEU57 0.0232 868 HD23 83.8080 100.2190 114.9440 H 57 LEU57 0.0232 869 N 87.1250 103.5000 118.0320 N.am 58 LEU58 -0.2456 870 CA 87.6600 103.4150 119.3850 C.3 58 LEU58 0.0880 871 CB 88.9790 102.6230 119.2910 C.3 58 LEU58 -0.0266 872 CG 89.5940 102.2050 120.6450 C.3 58 LEU58 -0.0449 873 CD1 90.1960 100.7960 120.5640 C.3 58 LEU58 -0.0626 874 CD2 90.6730 103.1910 121.1150 C.3 58 LEU58 -0.0626 875 C 87.8550 104.7870 120.0160 C.2 58 LEU58 0.2185 876 O 87.9990 104.8770 121.2380 O.2 58 LEU58 -0.2778 877 H 87.7220 103.2580 117.2410 H 58 LEU58 0.1312 878 HA 86.9360 102.8630 119.9860 H 58 LEU58 0.0557 879 HB1 89.7090 103.1700 118.6900 H 58 LEU58 0.0287 880 HB2 88.7640 101.7220 118.7140 H 58 LEU58 0.0287 881 HG 88.8030 102.1780 121.3950 H 58 LEU58 0.0296 882 HD11 90.5920 100.4820 121.5300 H 58 LEU58 0.0232 883 HD12 91.0130 100.7630 119.8430 H 58 LEU58 0.0232 884 HD13 89.4490 100.0630 120.2580 H 58 LEU58 0.0232 885 HD21 91.0790 102.8960 122.0820 H 58 LEU58 0.0232 886 HD22 90.2800 104.1970 121.2220 H 58 LEU58 0.0232 887 HD23 91.5010 103.2370 120.4050 H 58 LEU58 0.0232 888 N 87.8460 105.8520 119.2230 N.am 59 GLY59 -0.2485 889 CA 87.9230 107.1870 119.7730 C.3 59 GLY59 0.0765 890 C 86.5630 107.7110 120.1720 C.2 59 GLY59 0.2156 891 O 86.4270 108.3850 121.1970 O.2 59 GLY59 -0.2781 892 H 87.7840 105.7270 118.2130 H 59 GLY59 0.1309 893 HA1 88.3450 107.8260 118.9970 H 59 GLY59 0.0521 894 HA2 88.5890 107.1910 120.6310 H 59 GLY59 0.0521 895 N 85.5440 107.4150 119.3630 N.am 60 THR60 -0.2436 896 CA 84.1960 107.8400 119.7230 C.3 60 THR60 0.1135 897 CB 83.3340 107.6570 118.4590 C.3 60 THR60 0.0763 898 OG1 83.8640 108.5460 117.4900 O.3 60 THR60 -0.3900 899 CG2 81.8530 107.9880 118.6680 C.3 60 THR60 -0.0370 900 C 83.6670 107.0530 120.9180 C.2 60 THR60 0.2212 901 O 83.0730 107.6340 121.8370 O.2 60 THR60 -0.2777 902 H 85.7060 106.8960 118.5000 H 60 THR60 0.1312 903 HA 84.2370 108.8980 119.9890 H 60 THR60 0.0583 904 HB 83.4420 106.6190 118.1200 H 60 THR60 0.0611 905 HG1 83.5060 108.3840 116.6220 H 60 THR60 0.2098 906 HG21 81.2740 107.8320 117.7570 H 60 THR60 0.0255 907 HG22 81.7400 109.0320 118.9540 H 60 THR60 0.0255 908 HG23 81.4180 107.3620 119.4450 H 60 THR60 0.0255 909 N 83.8900 105.7340 120.9390 N.am 61 CYS61 -0.2448 910 CA 83.3060 104.8990 121.9850 C.3 61 CYS61 0.0965 911 CB 83.4880 103.4300 121.5830 C.3 61 CYS61 0.0147 912 SG 82.5870 103.0100 120.0660 S.3 61 CYS61 -0.1762 913 C 83.9100 105.1550 123.3600 C.2 61 CYS61 0.2195 914 O 83.3490 104.6970 124.3600 O.2 61 CYS61 -0.2778 915 H 84.4730 105.3080 120.2180 H 61 CYS61 0.1312 916 HA 82.2420 105.1350 122.0370 H 61 CYS61 0.0565 917 HB1 83.1460 102.7680 122.3800 H 61 CYS61 0.0394 918 HB2 84.5470 103.2180 121.4300 H 61 CYS61 0.0394 919 HG 83.0510 101.8580 119.5750 H 61 CYS61 0.1017 920 N 85.0400 105.8520 123.4380 N.am 62 LEU62 -0.2456 921 CA 85.6810 106.1390 124.7130 C.3 62 LEU62 0.0880 922 CB 87.1660 105.7260 124.5730 C.3 62 LEU62 -0.0266 923 CG 87.4640 104.2270 124.7910 C.3 62 LEU62 -0.0449 924 CD1 86.6320 103.2820 123.9100 C.3 62 LEU62 -0.0626 925 CD2 88.9580 103.9520 124.5810 C.3 62 LEU62 -0.0626 926 C 85.6020 107.6090 125.0990 C.2 62 LEU62 0.2187 927 O 86.1930 108.0040 126.1090 O.2 62 LEU62 -0.2778 928 H 85.4700 106.1950 122.5790 H 62 LEU62 0.1312 929 HA 85.2120 105.5670 125.5150 H 62 LEU62 0.0557 930 HB1 87.7800 106.2700 125.2930 H 62 LEU62 0.0287 931 HB2 87.5330 106.0360 123.5930 H 62 LEU62 0.0287 932 HG 87.2320 103.9910 125.8300 H 62 LEU62 0.0296 933 HD11 86.9940 102.2570 123.9890 H 62 LEU62 0.0232 934 HD12 86.6760 103.5660 122.8590 H 62 LEU62 0.0232 935 HD13 85.5890 103.2680 124.2190 H 62 LEU62 0.0232 936 HD21 89.2070 102.9190 124.8260 H 62 LEU62 0.0232 937 HD22 89.5720 104.5980 125.2090 H 62 LEU62 0.0232 938 HD23 89.2430 104.1220 123.5430 H 62 LEU62 0.0232 939 N 84.8940 108.4280 124.3250 N.am 63 ILE63 -0.2454 940 CA 84.7510 109.8420 124.6480 C.3 63 ILE63 0.0903 941 CB 85.4330 110.6510 123.5200 C.3 63 ILE63 -0.0201 942 CG1 86.9520 110.4120 123.4510 C.3 63 ILE63 -0.0514 943 CG2 85.1350 112.1550 123.5800 C.3 63 ILE63 -0.0605 944 CD1 87.7380 110.9910 124.6320 C.3 63 ILE63 -0.0650 945 C 83.2760 110.2090 124.7450 C.2 63 ILE63 0.2190 946 O 82.8570 110.8980 125.6800 O.2 63 ILE63 -0.2778 947 H 84.4420 108.0590 123.4880 H 63 ILE63 0.1312 948 HA 85.2040 110.0670 125.6140 H 63 ILE63 0.0560 949 HB 85.0240 110.2930 122.5730 H 63 ILE63 0.0318 950 HG11 87.3330 110.8570 122.5330 H 63 ILE63 0.0266 951 HG12 87.1660 109.3470 123.3710 H 63 ILE63 0.0266 952 HG21 85.6620 112.6700 122.7810 H 63 ILE63 0.0233 953 HG22 85.4530 112.5850 124.5280 H 63 ILE63 0.0233 954 HG23 84.0730 112.3620 123.4600 H 63 ILE63 0.0233 955 HD11 88.7980 110.8050 124.4810 H 63 ILE63 0.0230 956 HD12 87.4490 110.5310 125.5760 H 63 ILE63 0.0230 957 HD13 87.6150 112.0690 124.7210 H 63 ILE63 0.0230 958 N 82.4810 109.7690 123.7750 N.am 64 SER64 -0.2436 959 CA 81.0590 110.0950 123.8020 C.3 64 SER64 0.1111 960 CB 80.3620 109.6100 122.5240 C.3 64 SER64 0.0681 961 OG 80.7820 110.4100 121.4290 O.3 64 SER64 -0.3930 962 C 80.3080 109.5380 125.0130 C.2 64 SER64 0.2236 963 O 79.4240 110.2460 125.5290 O.2 64 SER64 -0.2775 964 H 82.8630 109.2060 123.0150 H 64 SER64 0.1312 965 HA 80.9880 111.1810 123.8170 H 64 SER64 0.0580 966 HB1 79.2740 109.6930 122.6440 H 64 SER64 0.0577 967 HB2 80.6020 108.5600 122.3370 H 64 SER64 0.0577 968 HG 80.3110 110.1840 120.6330 H 64 SER64 0.2095 969 N 80.5740 108.3210 125.5100 N.am 65 PRO65 -0.2315 970 CA 79.8020 107.8500 126.6730 C.3 65 PRO65 0.0907 971 CD 81.5060 107.3220 124.9980 C.3 65 PRO65 0.0071 972 CB 80.2590 106.4030 126.8640 C.3 65 PRO65 -0.0276 973 CG 80.8900 106.0240 125.5330 C.3 65 PRO65 -0.0379 974 C 80.0230 108.6640 127.9350 C.2 65 PRO65 0.2189 975 O 79.0690 108.8880 128.6870 O.2 65 PRO65 -0.2778 976 HA 78.7470 107.8870 126.3960 H 65 PRO65 0.0559 977 HD1 82.4840 107.5240 125.4340 H 65 PRO65 0.0431 978 HD2 81.5500 107.3390 123.9100 H 65 PRO65 0.0431 979 HB1 79.4390 105.7400 127.1410 H 65 PRO65 0.0285 980 HB2 81.0210 106.3230 127.6410 H 65 PRO65 0.0285 981 HG1 81.5980 105.2140 125.6710 H 65 PRO65 0.0278 982 HG2 80.1170 105.6790 124.8450 H 65 PRO65 0.0278 983 N 81.2530 109.1090 128.2010 N.am 66 VAL66 -0.2454 984 CA 81.5000 109.8260 129.4480 C.3 66 VAL66 0.0901 985 CB 83.0190 109.8700 129.7310 C.3 66 VAL66 -0.0227 986 CG1 83.8370 110.4210 128.5540 C.3 66 VAL66 -0.0608 987 CG2 83.3520 110.6270 131.0280 C.3 66 VAL66 -0.0608 988 C 80.8610 111.2110 129.4140 C.2 66 VAL66 0.2189 989 O 80.4650 111.7440 130.4580 O.2 66 VAL66 -0.2778 990 H 82.0130 108.9500 127.5390 H 66 VAL66 0.1312 991 HA 81.0150 109.2650 130.2490 H 66 VAL66 0.0560 992 HB 83.3420 108.8390 129.8790 H 66 VAL66 0.0315 993 HG11 84.8890 110.5250 128.8190 H 66 VAL66 0.0233 994 HG12 83.4710 111.3980 128.2430 H 66 VAL66 0.0233 995 HG13 83.7930 109.7540 127.6930 H 66 VAL66 0.0233 996 HG21 84.4090 110.5330 131.2750 H 66 VAL66 0.0233 997 HG22 82.7790 110.2350 131.8690 H 66 VAL66 0.0233 998 HG23 83.1310 111.6900 130.9390 H 66 VAL66 0.0233 999 N 80.7170 111.8040 128.2320 N.am 67 VAL67 -0.2454 1000 CA 80.0520 113.0990 128.1400 C.3 67 VAL67 0.0901 1001 CB 80.6100 113.8760 126.9230 C.3 67 VAL67 -0.0227 1002 CG1 80.4390 113.1370 125.5980 C.3 67 VAL67 -0.0608 1003 CG2 80.0380 115.2890 126.7950 C.3 67 VAL67 -0.0608 1004 C 78.5340 112.9410 128.0850 C.2 67 VAL67 0.2189 1005 O 77.8040 113.8410 128.5130 O.2 67 VAL67 -0.2778 1006 H 81.0720 111.3530 127.3890 H 67 VAL67 0.1312 1007 HA 80.2880 113.6720 129.0390 H 67 VAL67 0.0560 1008 HB 81.6830 113.9820 127.0890 H 67 VAL67 0.0315 1009 HG11 80.9620 113.6560 124.7970 H 67 VAL67 0.0233 1010 HG12 79.3920 113.0350 125.3130 H 67 VAL67 0.0233 1011 HG13 80.8730 112.1510 125.6740 H 67 VAL67 0.0233 1012 HG21 80.5160 115.8380 125.9830 H 67 VAL67 0.0233 1013 HG22 80.2200 115.8350 127.7110 H 67 VAL67 0.0233 1014 HG23 78.9650 115.2850 126.6050 H 67 VAL67 0.0233 1015 N 78.0630 111.8570 127.4800 N.am 68 LEU68 -0.2456 1016 CA 76.6350 111.5730 127.4510 C.3 68 LEU68 0.0880 1017 CB 76.3320 110.4430 126.4570 C.3 68 LEU68 -0.0266 1018 CG 76.4880 110.8890 124.9870 C.3 68 LEU68 -0.0449 1019 CD1 76.5760 109.6780 124.0530 C.3 68 LEU68 -0.0626 1020 CD2 75.3550 111.8250 124.5350 C.3 68 LEU68 -0.0626 1021 C 76.1870 111.2820 128.8770 C.2 68 LEU68 0.2187 1022 O 75.1210 111.7070 129.3190 O.2 68 LEU68 -0.2778 1023 H 78.7120 111.2130 127.0280 H 68 LEU68 0.1312 1024 HA 76.1290 112.4890 127.1450 H 68 LEU68 0.0557 1025 HB1 75.3200 110.0670 126.6080 H 68 LEU68 0.0287 1026 HB2 77.0020 109.6070 126.6660 H 68 LEU68 0.0287 1027 HG 77.4220 111.4420 124.8840 H 68 LEU68 0.0296 1028 HD11 76.7380 110.0010 123.0250 H 68 LEU68 0.0232 1029 HD12 75.6580 109.0900 124.0830 H 68 LEU68 0.0232 1030 HD13 77.4020 109.0220 124.3280 H 68 LEU68 0.0232 1031 HD21 75.4770 112.1080 123.4890 H 68 LEU68 0.0232 1032 HD22 75.3340 112.7460 125.1160 H 68 LEU68 0.0232 1033 HD23 74.3820 111.3430 124.6360 H 68 LEU68 0.0232 1034 N 77.0470 110.5640 129.5900 N.am 69 ALA69 -0.2459 1035 CA 76.8120 110.1450 130.9670 C.3 69 ALA69 0.0850 1036 CB 77.9510 109.2310 131.4330 C.3 69 ALA69 -0.0411 1037 C 76.6620 111.3180 131.9240 C.2 69 ALA69 0.2185 1038 O 75.8490 111.2770 132.8450 O.2 69 ALA69 -0.2778 1039 H 77.9240 110.2890 129.1480 H 69 ALA69 0.1312 1040 HA 75.8710 109.5930 130.9670 H 69 ALA69 0.0554 1041 HB1 77.8110 108.9160 132.4670 H 69 ALA69 0.0249 1042 HB2 78.9160 109.7320 131.3610 H 69 ALA69 0.0249 1043 HB3 77.9950 108.3280 130.8260 H 69 ALA69 0.0249 1044 N 77.4280 112.3770 131.6890 N.am 70 SER70 -0.2436 1045 CA 77.4050 113.5540 132.5550 C.3 70 SER70 0.1109 1046 CB 78.4840 114.5490 132.1040 C.3 70 SER70 0.0681 1047 OG 78.7190 115.4780 133.1540 O.3 70 SER70 -0.3930 1048 C 76.0340 114.2160 132.6320 C.2 70 SER70 0.2209 1049 O 75.6410 114.7090 133.6880 O.2 70 SER70 -0.2777 1050 H 78.0500 112.3690 130.8810 H 70 SER70 0.1312 1051 HA 77.6540 113.1980 133.5550 H 70 SER70 0.0580 1052 HB1 78.1760 115.0660 131.1880 H 70 SER70 0.0577 1053 HB2 79.4050 113.9970 131.8810 H 70 SER70 0.0577 1054 HG 79.4280 116.0830 132.9460 H 70 SER70 0.2095 1055 N 75.3050 114.2330 131.5240 N.am 71 TYR71 -0.2453 1056 CA 73.9920 114.8500 131.5110 C.3 71 TYR71 0.0917 1057 CB 73.4140 114.8240 130.0830 C.3 71 TYR71 -0.0036 1058 CG 73.8800 116.0050 129.2670 C.ar 71 TYR71 -0.0453 1059 CD1 73.3100 117.2550 129.4860 C.ar 71 TYR71 -0.0561 1060 CD2 74.8690 115.8780 128.2930 C.ar 71 TYR71 -0.0561 1061 CE1 73.7150 118.3570 128.7480 C.ar 71 TYR71 -0.0317 1062 CE2 75.2650 116.9810 127.5400 C.ar 71 TYR71 -0.0317 1063 CZ 74.6820 118.2220 127.7660 C.ar 71 TYR71 0.0726 1064 OH 75.0510 119.3290 127.0290 O.3 71 TYR71 -0.3598 1065 C 73.0600 114.1820 132.5170 C.2 71 TYR71 0.2190 1066 O 72.2750 114.8630 133.1750 O.2 71 TYR71 -0.2778 1067 H 75.6710 113.8080 130.6720 H 71 TYR71 0.1312 1068 HA 74.1260 115.8810 131.8460 H 71 TYR71 0.0560 1069 HB1 72.3240 114.8650 130.1120 H 71 TYR71 0.0333 1070 HB2 73.6680 113.8910 129.5800 H 71 TYR71 0.0333 1071 HD1 72.5490 117.3740 130.2450 H 71 TYR71 0.0621 1072 HD2 75.3350 114.9190 128.1140 H 71 TYR71 0.0621 1073 HE1 73.2790 119.3260 128.9320 H 71 TYR71 0.0643 1074 HE2 76.0280 116.8840 126.7810 H 71 TYR71 0.0643 1075 HH 75.6510 119.0750 126.3300 H 71 TYR71 0.2173 1076 N 73.1330 112.8600 132.6480 N.am 72 ALA72 -0.2459 1077 CA 72.2420 112.1880 133.5930 C.3 72 ALA72 0.0850 1078 CB 71.7520 110.8990 132.9210 C.3 72 ALA72 -0.0411 1079 C 72.9410 111.8690 134.9110 C.2 72 ALA72 0.2184 1080 O 72.8760 110.7520 135.4210 O.2 72 ALA72 -0.2778 1081 H 73.8020 112.3230 132.0970 H 72 ALA72 0.1312 1082 HA 71.3760 112.8150 133.8110 H 72 ALA72 0.0554 1083 HB1 71.0480 110.3580 133.5540 H 72 ALA72 0.0249 1084 HB2 72.5830 110.2300 132.6910 H 72 ALA72 0.0249 1085 HB3 71.2430 111.1240 131.9830 H 72 ALA72 0.0249 1086 N 73.6250 112.8540 135.4660 N.am 73 ARG73 -0.2457 1087 CA 74.0550 112.8160 136.8590 C.3 73 ARG73 0.0879 1088 CB 75.4530 112.2670 137.1410 C.3 73 ARG73 -0.0258 1089 CG 75.3470 111.4050 138.4110 C.3 73 ARG73 -0.0154 1090 CD 76.6730 110.9450 138.9950 C.3 73 ARG73 0.1045 1091 NE 76.4310 110.0590 140.1380 N.pl3 73 ARG73 -0.4450 1092 CZ 76.0270 108.7940 140.0360 C.cat 73 ARG73 0.5062 1093 NH1 75.8200 108.2360 138.8710 N.pl3 73 ARG73 -0.4573 1094 NH2 75.8300 108.0950 141.1220 N.pl3 73 ARG73 -0.4573 1095 C 73.6890 114.0900 137.6030 C.2 73 ARG73 0.2187 1096 O 73.2700 114.0210 138.7610 O.2 73 ARG73 -0.2778 1097 H 73.8600 113.6690 134.9000 H 73 ARG73 0.1312 1098 HA 73.3470 112.1180 137.3140 H 73 ARG73 0.0557 1099 HB1 76.1750 113.0770 137.2550 H 73 ARG73 0.0286 1100 HB2 75.7910 111.6530 136.3050 H 73 ARG73 0.0286 1101 HG1 74.7170 110.5440 138.1890 H 73 ARG73 0.0299 1102 HG2 74.8230 111.9630 139.1890 H 73 ARG73 0.0299 1103 HD1 77.1900 111.8240 139.3770 H 73 ARG73 0.0711 1104 HD2 77.3140 110.4450 138.2640 H 73 ARG73 0.0711 1105 HE 76.5640 110.4290 141.0570 H 73 ARG73 0.3153 1106 HH11 75.5280 107.2850 138.8030 H 73 ARG73 0.3114 1107 HH12 75.9520 108.7740 138.0420 H 73 ARG73 0.3114 1108 HH21 75.5280 107.1460 141.0620 H 73 ARG73 0.3114 1109 HH22 75.9770 108.5080 142.0180 H 73 ARG73 0.3114 1110 N 73.8320 115.2480 136.9600 N.am 74 ASN74 -0.2452 1111 CA 73.3540 116.5160 137.5080 C.3 74 ASN74 0.0957 1112 CB 74.2120 117.0120 138.6810 C.3 74 ASN74 0.0446 1113 CG 73.3520 117.5080 139.8500 C.2 74 ASN74 0.2000 1114 OD1 73.5790 117.1570 140.9990 O.2 74 ASN74 -0.2797 1115 ND2 72.3530 118.3340 139.4980 N.am 74 ASN74 -0.2723 1116 C 73.3250 117.5130 136.3580 C.2 74 ASN74 0.2191 1117 O 74.3800 117.8490 135.8120 O.2 74 ASN74 -0.2778 1118 H 74.2930 115.2500 136.0500 H 74 ASN74 0.1312 1119 HA 72.3230 116.3170 137.8120 H 74 ASN74 0.0562 1120 HB1 74.8790 117.8160 138.3780 H 74 ASN74 0.0375 1121 HB2 74.8320 116.2020 139.0610 H 74 ASN74 0.0375 1122 HD21 71.7420 118.6740 140.2120 H 74 ASN74 0.1266 1123 HD22 72.2090 118.6220 138.5530 H 74 ASN74 0.1266 1124 N 72.1330 117.9820 135.9970 N.am 75 GLN75 -0.2456 1125 CA 71.9960 118.8440 134.8290 C.3 75 GLN75 0.0882 1126 CB 70.5200 118.9570 134.3890 C.3 75 GLN75 -0.0210 1127 CG 69.6740 120.0530 135.0680 C.3 75 GLN75 0.0225 1128 CD 69.8450 121.4270 134.3880 C.2 75 GLN75 0.1981 1129 OE1 69.8880 121.5450 133.1700 O.2 75 GLN75 -0.2798 1130 NE2 69.9360 122.4540 135.2460 N.am 75 GLN75 -0.2724 1131 C 72.6920 120.1830 135.0570 C.2 75 GLN75 0.2188 1132 O 72.3610 120.9180 135.9930 O.2 75 GLN75 -0.2778 1133 H 71.3070 117.7360 136.5430 H 75 GLN75 0.1312 1134 HA 72.5290 118.3220 134.0300 H 75 GLN75 0.0557 1135 HB1 70.0460 117.9910 134.5680 H 75 GLN75 0.0289 1136 HB2 70.4800 119.0860 133.3070 H 75 GLN75 0.0289 1137 HG1 69.9040 120.1240 136.1320 H 75 GLN75 0.0356 1138 HG2 68.6170 119.7960 134.9930 H 75 GLN75 0.0356 1139 HE21 70.0240 123.3860 134.8980 H 75 GLN75 0.1266 1140 HE22 69.9240 122.3040 136.2340 H 75 GLN75 0.1266 1141 N 73.6870 120.4710 134.2120 N.am 76 THR76 -0.2434 1142 CA 74.4040 121.7510 134.2060 C.3 76 THR76 0.1135 1143 CB 73.4940 122.8400 133.5870 C.3 76 THR76 0.0763 1144 OG1 72.8000 122.2900 132.4720 O.3 76 THR76 -0.3900 1145 CG2 74.2860 124.0670 133.1020 C.3 76 THR76 -0.0370 1146 C 74.8700 122.1380 135.6130 C.2 76 THR76 0.2212 1147 O 74.9440 123.3170 135.9690 O.2 76 THR76 -0.2777 1148 H 73.9630 119.7610 133.5330 H 76 THR76 0.1313 1149 HA 75.2830 121.5910 133.5820 H 76 THR76 0.0583 1150 HB 72.7750 123.1440 134.3610 H 76 THR76 0.0611 1151 HG1 72.0880 122.8640 132.2070 H 76 THR76 0.2098 1152 HG21 73.6260 124.8370 132.7000 H 76 THR76 0.0255 1153 HG22 74.9870 123.7880 132.3150 H 76 THR76 0.0255 1154 HG23 74.8600 124.5300 133.9030 H 76 THR76 0.0255 1155 N 75.1730 121.1350 136.4370 N.am 77 LEU77 -0.2456 1156 CA 75.6150 121.3610 137.8070 C.3 77 LEU77 0.0880 1157 CB 74.4280 121.1320 138.7600 C.3 77 LEU77 -0.0266 1158 CG 74.6830 121.5340 140.2290 C.3 77 LEU77 -0.0449 1159 CD1 73.4680 121.2110 141.1080 C.3 77 LEU77 -0.0626 1160 CD2 75.0480 123.0190 140.3670 C.3 77 LEU77 -0.0626 1161 C 76.8240 120.5380 138.2110 C.2 77 LEU77 0.2187 1162 O 77.5420 120.9500 139.1300 O.2 77 LEU77 -0.2778 1163 H 75.0930 120.1770 136.0970 H 77 LEU77 0.1312 1164 HA 75.9420 122.3980 137.8790 H 77 LEU77 0.0557 1165 HB1 74.1390 120.0850 138.7100 H 77 LEU77 0.0287 1166 HB2 73.5700 121.6950 138.3890 H 77 LEU77 0.0287 1167 HG 75.5160 120.9470 140.6160 H 77 LEU77 0.0296 1168 HD11 73.6310 121.5370 142.1360 H 77 LEU77 0.0232 1169 HD12 73.2790 120.1400 141.1400 H 77 LEU77 0.0232 1170 HD13 72.5700 121.7050 140.7400 H 77 LEU77 0.0232 1171 HD21 75.1510 123.3010 141.4150 H 77 LEU77 0.0232 1172 HD22 74.2810 123.6560 139.9250 H 77 LEU77 0.0232 1173 HD23 75.9970 123.2480 139.8830 H 77 LEU77 0.0232 1174 N 77.0800 119.4030 137.5680 N.am 78 VAL78 -0.2454 1175 CA 78.2330 118.5630 137.8640 C.3 78 VAL78 0.0901 1176 CB 77.6830 117.2420 138.4560 C.3 78 VAL78 -0.0227 1177 CG1 78.6930 116.0950 138.5440 C.3 78 VAL78 -0.0608 1178 CG2 77.1280 117.4950 139.8720 C.3 78 VAL78 -0.0608 1179 C 79.0500 118.4440 136.5870 C.2 78 VAL78 0.2189 1180 O 78.7900 117.5620 135.7590 O.2 78 VAL78 -0.2778 1181 H 76.4390 119.1060 136.8320 H 78 VAL78 0.1312 1182 HA 78.8680 119.0530 138.6050 H 78 VAL78 0.0560 1183 HB 76.8770 116.9000 137.8060 H 78 VAL78 0.0315 1184 HG11 78.2000 115.1680 138.8330 H 78 VAL78 0.0233 1185 HG12 79.4330 116.3130 139.3120 H 78 VAL78 0.0233 1186 HG13 79.1990 115.9100 137.5970 H 78 VAL78 0.0233 1187 HG21 76.6840 116.5920 140.2920 H 78 VAL78 0.0233 1188 HG22 76.3730 118.2790 139.8950 H 78 VAL78 0.0233 1189 HG23 77.9250 117.8070 140.5470 H 78 VAL78 0.0233 1190 N 80.0320 119.3300 136.4230 N.am 79 ALA79 -0.2459 1191 CA 80.9520 119.2240 135.2970 C.3 79 ALA79 0.0850 1192 CB 81.9160 120.4180 135.3250 C.3 79 ALA79 -0.0411 1193 C 81.7060 117.9010 135.3440 C.2 79 ALA79 0.2184 1194 O 81.6040 117.0780 134.4280 O.2 79 ALA79 -0.2778 1195 H 80.1410 120.0910 137.0930 H 79 ALA79 0.1312 1196 HA 80.3530 119.2440 134.3850 H 79 ALA79 0.0554 1197 HB1 82.6440 120.3650 134.5150 H 79 ALA79 0.0249 1198 HB2 82.4660 120.4670 136.2660 H 79 ALA79 0.0249 1199 HB3 81.3700 121.3540 135.2140 H 79 ALA79 0.0249 1200 N 82.4640 117.6820 136.4120 N.am 80 LEU80 -0.2457 1201 CA 83.1220 116.4100 136.6680 C.3 80 LEU80 0.0880 1202 CB 84.5160 116.6440 137.2920 C.3 80 LEU80 -0.0266 1203 CG 84.5570 117.0860 138.7760 C.3 80 LEU80 -0.0449 1204 CD1 85.9720 116.9170 139.3390 C.3 80 LEU80 -0.0626 1205 CD2 84.0570 118.5210 138.9920 C.3 80 LEU80 -0.0626 1206 C 82.2500 115.5670 137.5910 C.2 80 LEU80 0.2187 1207 O 81.5420 116.0990 138.4520 O.2 80 LEU80 -0.2778 1208 H 82.5910 118.4400 137.0830 H 80 LEU80 0.1312 1209 HA 83.2400 115.8860 135.7170 H 80 LEU80 0.0557 1210 HB1 85.0660 117.3610 136.6830 H 80 LEU80 0.0287 1211 HB2 85.0760 115.7140 137.2120 H 80 LEU80 0.0287 1212 HG 83.9290 116.4230 139.3730 H 80 LEU80 0.0296 1213 HD11 86.0250 117.2350 140.3810 H 80 LEU80 0.0232 1214 HD12 86.7040 117.4920 138.7720 H 80 LEU80 0.0232 1215 HD13 86.2620 115.8670 139.3120 H 80 LEU80 0.0232 1216 HD21 84.2470 118.8470 140.0150 H 80 LEU80 0.0232 1217 HD22 82.9820 118.5970 138.8380 H 80 LEU80 0.0232 1218 HD23 84.5540 119.2210 138.3210 H 80 LEU80 0.0232 1219 N 82.3020 114.2510 137.3990 N.am 81 ALA81 -0.2459 1220 CA 81.4550 113.2980 138.1090 C.3 81 ALA81 0.0852 1221 CB 81.7710 111.9140 137.5190 C.3 81 ALA81 -0.0411 1222 C 81.7280 113.3330 139.6090 C.2 81 ALA81 0.2211 1223 O 82.6560 114.0220 140.0500 O.2 81 ALA81 -0.2776 1224 H 82.9700 113.8890 136.7190 H 81 ALA81 0.1312 1225 HA 80.4220 113.5910 137.9190 H 81 ALA81 0.0554 1226 HB1 81.1250 111.1290 137.9050 H 81 ALA81 0.0249 1227 HB2 82.8000 111.6220 137.7340 H 81 ALA81 0.0249 1228 HB3 81.6540 111.9240 136.4360 H 81 ALA81 0.0249 1229 N 80.9230 112.6240 140.4340 N.am 82 PRO82 -0.2316 1230 CA 81.2300 112.5090 141.8700 C.3 82 PRO82 0.0907 1231 HA 80.9896 113.4819 142.3014 H 82 PRO82 0.0559 1232 CD 79.7063 111.9301 140.0564 C.3 82 PRO82 0.0071 1233 HD1 79.9745 111.0190 139.5299 H 82 PRO82 0.0431 1234 HD2 79.1064 112.5979 139.4396 H 82 PRO82 0.0431 1235 CB 80.2578 111.4468 142.3669 C.3 82 PRO82 -0.0276 1236 HB1 79.9784 111.5913 143.4110 H 82 PRO82 0.0285 1237 HB2 80.6972 110.4525 142.2704 H 82 PRO82 0.0285 1238 CG 79.0795 111.5747 141.4098 C.3 82 PRO82 -0.0379 1239 HG1 78.5073 110.6525 141.3852 H 82 PRO82 0.0278 1240 HG2 78.4245 112.3833 141.7373 H 82 PRO82 0.0278 1241 C 82.6860 112.2000 142.1990 C.2 82 PRO82 0.2189 1242 O 83.1350 112.4630 143.3190 O.2 82 PRO82 -0.2778 1243 N 83.4260 111.6360 141.2440 N.am 83 GLU83 -0.2456 1244 CA 84.8560 111.4240 141.4220 C.3 83 GLU83 0.0883 1245 CB 85.4260 110.6460 140.2220 C.3 83 GLU83 -0.0193 1246 CG 86.3950 109.5230 140.6390 C.3 83 GLU83 0.0356 1247 CD 87.7220 110.0870 141.1480 C.2 83 GLU83 0.1760 1248 OE1 88.4150 110.7190 140.3660 O.co2 83 GLU83 -0.6478 1249 OE2 88.0740 109.9080 142.3120 O.co2 83 GLU83 -0.6478 1250 C 85.5630 112.7430 141.7090 C.2 83 GLU83 0.2187 1251 O 85.0970 113.8150 141.3160 O.2 83 GLU83 -0.2778 1252 H 82.9820 111.3470 140.3720 H 83 GLU83 0.1312 1253 HA 84.9430 110.8090 142.3200 H 83 GLU83 0.0557 1254 HB1 85.9000 111.3180 139.5050 H 83 GLU83 0.0290 1255 HB2 84.6030 110.1790 139.6820 H 83 GLU83 0.0290 1256 HG1 86.6180 108.8860 139.7840 H 83 GLU83 0.0374 1257 HG2 85.9540 108.8860 141.4050 H 83 GLU83 0.0374 1258 N 86.7000 112.6570 142.4050 N.am 84 SER84 -0.2436 1259 CA 87.4720 113.8580 142.7080 C.3 84 SER84 0.1109 1260 CB 88.6120 113.4270 143.6410 C.3 84 SER84 0.0681 1261 OG 89.4610 114.5160 143.9890 O.3 84 SER84 -0.3930 1262 C 88.0350 114.4990 141.4460 C.2 84 SER84 0.2209 1263 O 88.2780 115.7110 141.4180 O.2 84 SER84 -0.2777 1264 H 87.0300 111.7470 142.7260 H 84 SER84 0.1312 1265 HA 86.8110 114.5700 143.2040 H 84 SER84 0.0580 1266 HB1 89.1940 112.6410 143.1480 H 84 SER84 0.0577 1267 HB2 88.1660 112.9850 144.5400 H 84 SER84 0.0577 1268 HG 90.1160 114.2540 144.6290 H 84 SER84 0.2095 1269 N 88.2530 113.7070 140.3990 N.am 85 ARG85 -0.2456 1270 CA 88.7550 114.2170 139.1260 C.3 85 ARG85 0.0879 1271 CB 90.2910 114.3940 139.1610 C.3 85 ARG85 -0.0258 1272 CG 91.0940 113.4630 140.0990 C.3 85 ARG85 -0.0154 1273 CD 91.3490 112.0460 139.5680 C.3 85 ARG85 0.1045 1274 NE 92.2770 111.3430 140.4660 N.pl3 85 ARG85 -0.4450 1275 CZ 91.8820 110.6340 141.5250 C.cat 85 ARG85 0.5062 1276 NH1 90.6330 110.4800 141.8160 N.pl3 85 ARG85 -0.4573 1277 NH2 92.7640 110.0700 142.3000 N.pl3 85 ARG85 -0.4573 1278 C 88.2620 113.2700 138.0410 C.2 85 ARG85 0.2187 1279 O 88.7560 112.1440 137.9340 O.2 85 ARG85 -0.2778 1280 H 88.0630 112.7090 140.4890 H 85 ARG85 0.1312 1281 HA 88.2870 115.1850 138.9470 H 85 ARG85 0.0557 1282 HB1 90.4710 115.4100 139.5170 H 85 ARG85 0.0286 1283 HB2 90.7070 114.3720 138.1520 H 85 ARG85 0.0286 1284 HG1 90.6460 113.4160 141.0910 H 85 ARG85 0.0299 1285 HG2 92.0680 113.9270 140.2570 H 85 ARG85 0.0299 1286 HD1 91.8200 112.0830 138.5850 H 85 ARG85 0.0711 1287 HD2 90.4380 111.4630 139.4480 H 85 ARG85 0.0711 1288 HE 93.2540 111.3900 140.2920 H 85 ARG85 0.3153 1289 HH11 90.2590 109.9820 142.5950 H 85 ARG85 0.3114 1290 HH12 89.9160 110.8600 141.2210 H 85 ARG85 0.3114 1291 HH21 92.4250 109.5400 143.0730 H 85 ARG85 0.3114 1292 HH22 93.7380 110.1640 142.1240 H 85 ARG85 0.3114 1293 N 87.2900 113.7180 137.2430 N.am 86 ALA86 -0.2459 1294 CA 86.6350 112.8480 136.2770 C.3 86 ALA86 0.0850 1295 CB 85.1650 112.7350 136.6730 C.3 86 ALA86 -0.0411 1296 C 86.7290 113.3190 134.8340 C.2 86 ALA86 0.2184 1297 O 86.2300 112.6170 133.9460 O.2 86 ALA86 -0.2778 1298 H 87.0000 114.6930 137.3120 H 86 ALA86 0.1312 1299 HA 87.0850 111.8540 136.3180 H 86 ALA86 0.0554 1300 HB1 84.6400 111.9910 136.0730 H 86 ALA86 0.0249 1301 HB2 84.6760 113.6930 136.5260 H 86 ALA86 0.0249 1302 HB3 85.0570 112.4610 137.7210 H 86 ALA86 0.0249 1303 N 87.3410 114.4730 134.5650 N.am 87 CYS87 -0.2449 1304 CA 87.4450 114.9640 133.2000 C.3 87 CYS87 0.0965 1305 CB 86.6260 116.2530 133.1690 C.3 87 CYS87 0.0147 1306 SG 87.0900 117.3780 134.5150 S.3 87 CYS87 -0.1762 1307 C 88.8750 115.1900 132.7340 C.2 87 CYS87 0.2195 1308 O 89.0730 115.5130 131.5580 O.2 87 CYS87 -0.2778 1309 H 87.7420 115.0190 135.3280 H 87 CYS87 0.1312 1310 HA 87.0070 114.2470 132.5040 H 87 CYS87 0.0565 1311 HB1 85.5710 116.0040 133.2910 H 87 CYS87 0.0394 1312 HB2 86.7090 116.7510 132.2050 H 87 CYS87 0.0394 1313 HG 86.1370 118.3030 134.6600 H 87 CYS87 0.1017 1314 N 89.8740 115.0420 133.6060 N.am 88 THR88 -0.2434 1315 CA 91.2500 115.0080 133.1270 C.3 88 THR88 0.1135 1316 CB 92.2150 114.9120 134.3230 C.3 88 THR88 0.0763 1317 OG1 91.8870 113.7620 135.0890 O.3 88 THR88 -0.3900 1318 CG2 92.1400 116.1690 135.2050 C.3 88 THR88 -0.0370 1319 C 91.4540 113.8400 132.1730 C.2 88 THR88 0.2212 1320 O 92.1450 113.9710 131.1570 O.2 88 THR88 -0.2777 1321 H 89.6760 114.9530 134.6030 H 88 THR88 0.1313 1322 HA 91.4290 115.9310 132.5720 H 88 THR88 0.0583 1323 HB 93.2330 114.8150 133.9260 H 88 THR88 0.0611 1324 HG1 92.4890 113.6570 135.8190 H 88 THR88 0.2098 1325 HG21 92.9060 116.1640 135.9810 H 88 THR88 0.0255 1326 HG22 91.1700 116.2520 135.6960 H 88 THR88 0.0255 1327 HG23 92.2890 117.0700 134.6110 H 88 THR88 0.0255 1328 N 90.8470 112.6920 132.4840 N.am 89 TYR89 -0.2453 1329 CA 90.8520 111.5670 131.5560 C.3 89 TYR89 0.0918 1330 CB 90.1450 110.3460 132.1810 C.3 89 TYR89 -0.0036 1331 CG 89.9090 109.2520 131.1640 C.ar 89 TYR89 -0.0453 1332 CD1 90.9720 108.4920 130.6840 C.ar 89 TYR89 -0.0561 1333 CD2 88.6500 109.0860 130.5890 C.ar 89 TYR89 -0.0561 1334 CE1 90.7850 107.6010 129.6340 C.ar 89 TYR89 -0.0317 1335 CE2 88.4630 108.2020 129.5340 C.ar 89 TYR89 -0.0317 1336 CZ 89.5330 107.4650 129.0500 C.ar 89 TYR89 0.0726 1337 OH 89.3610 106.6160 127.9760 O.3 89 TYR89 -0.3598 1338 C 90.1840 111.9320 130.2400 C.2 89 TYR89 0.2190 1339 O 90.6780 111.5690 129.1680 O.2 89 TYR89 -0.2778 1340 H 90.3730 112.6010 133.3830 H 89 TYR89 0.1312 1341 HA 91.8960 111.3260 131.3450 H 89 TYR89 0.0560 1342 HB1 89.1880 110.6470 132.6100 H 89 TYR89 0.0333 1343 HB2 90.7400 109.9500 133.0040 H 89 TYR89 0.0333 1344 HD1 91.9620 108.6260 131.0950 H 89 TYR89 0.0621 1345 HD2 87.8170 109.6870 130.9260 H 89 TYR89 0.0621 1346 HE1 91.6170 107.0320 129.2470 H 89 TYR89 0.0643 1347 HE2 87.4920 108.1050 129.0720 H 89 TYR89 0.0643 1348 HH 88.4890 106.7270 127.6190 H 89 TYR89 0.2173 1349 N 89.0470 112.6290 130.3000 N.am 90 PHE90 -0.2453 1350 CA 88.3710 113.0420 129.0760 C.3 90 PHE90 0.0917 1351 CB 87.0750 113.7900 129.4540 C.3 90 PHE90 -0.0036 1352 CG 86.3990 114.4600 128.2830 C.ar 90 PHE90 -0.0454 1353 CD1 85.4100 113.8050 127.5570 C.ar 90 PHE90 -0.0585 1354 CD2 86.7700 115.7470 127.9020 C.ar 90 PHE90 -0.0585 1355 CE1 84.7950 114.4270 126.4780 C.ar 90 PHE90 -0.0615 1356 CE2 86.1990 116.3500 126.7920 C.ar 90 PHE90 -0.0615 1357 CZ 85.2000 115.6960 126.0860 C.ar 90 PHE90 -0.0617 1358 C 89.2740 113.9210 128.2230 C.2 90 PHE90 0.2190 1359 O 89.3910 113.7170 127.0120 O.2 90 PHE90 -0.2778 1360 H 88.6490 112.8740 131.2070 H 90 PHE90 0.1312 1361 HA 88.1380 112.1400 128.5070 H 90 PHE90 0.0560 1362 HB1 87.2880 114.5570 130.1960 H 90 PHE90 0.0333 1363 HB2 86.3760 113.0990 129.9280 H 90 PHE90 0.0333 1364 HD1 85.1170 112.8040 127.8300 H 90 PHE90 0.0620 1365 HD2 87.5380 116.2750 128.4480 H 90 PHE90 0.0620 1366 HE1 84.0170 113.9140 125.9300 H 90 PHE90 0.0618 1367 HE2 86.5300 117.3320 126.4880 H 90 PHE90 0.0618 1368 HZ 84.7420 116.1740 125.2340 H 90 PHE90 0.0618 1369 N 89.9170 114.9120 128.8430 N.am 91 ALA91 -0.2459 1370 CA 90.7650 115.8350 128.0920 C.3 91 ALA91 0.0850 1371 CB 91.2380 116.9270 129.0550 C.3 91 ALA91 -0.0411 1372 C 91.9620 115.1140 127.4870 C.2 91 ALA91 0.2184 1373 O 92.2980 115.3150 126.3110 O.2 91 ALA91 -0.2778 1374 H 89.8160 115.0270 129.8520 H 91 ALA91 0.1312 1375 HA 90.1620 116.2630 127.2890 H 91 ALA91 0.0554 1376 HB1 91.8710 117.6510 128.5450 H 91 ALA91 0.0249 1377 HB2 91.8070 116.5050 129.8850 H 91 ALA91 0.0249 1378 HB3 90.3910 117.4620 129.4830 H 91 ALA91 0.0249 1379 N 92.6230 114.2720 128.2830 N.am 92 PHE92 -0.2453 1380 CA 93.7640 113.5170 127.7800 C.3 92 PHE92 0.0917 1381 CB 94.2520 112.6760 128.9840 C.3 92 PHE92 -0.0036 1382 CG 95.1240 111.4940 128.6350 C.ar 92 PHE92 -0.0454 1383 CD1 96.5040 111.6280 128.5490 C.ar 92 PHE92 -0.0585 1384 CD2 94.5560 110.2380 128.4240 C.ar 92 PHE92 -0.0585 1385 CE1 97.3020 110.5330 128.2360 C.ar 92 PHE92 -0.0615 1386 CE2 95.3480 109.1470 128.0920 C.ar 92 PHE92 -0.0615 1387 CZ 96.7240 109.2950 127.9960 C.ar 92 PHE92 -0.0617 1388 C 93.3600 112.6080 126.6280 C.2 92 PHE92 0.2190 1389 O 94.0510 112.5480 125.6040 O.2 92 PHE92 -0.2778 1390 H 92.3270 114.1560 129.2520 H 92 PHE92 0.1312 1391 HA 94.5280 114.2190 127.4400 H 92 PHE92 0.0560 1392 HB1 93.3880 112.2900 129.5280 H 92 PHE92 0.0333 1393 HB2 94.7790 113.3200 129.6890 H 92 PHE92 0.0333 1394 HD1 96.9580 112.5910 128.7240 H 92 PHE92 0.0620 1395 HD2 93.4850 110.1090 128.4990 H 92 PHE92 0.0620 1396 HE1 98.3750 110.6400 128.1740 H 92 PHE92 0.0618 1397 HE2 94.8940 108.1840 127.9110 H 92 PHE92 0.0618 1398 HZ 97.3460 108.4490 127.7410 H 92 PHE92 0.0618 1399 N 92.2310 111.9100 126.7610 N.am 93 ALA93 -0.2459 1400 CA 91.7980 111.0050 125.7050 C.3 93 ALA93 0.0850 1401 CB 90.6470 110.1620 126.2640 C.3 93 ALA93 -0.0411 1402 C 91.4000 111.7710 124.4510 C.2 93 ALA93 0.2184 1403 O 91.6670 111.3180 123.3330 O.2 93 ALA93 -0.2778 1404 H 91.6680 112.0100 127.6060 H 93 ALA93 0.1312 1405 HA 92.6400 110.3550 125.4640 H 93 ALA93 0.0554 1406 HB1 90.2930 109.4340 125.5360 H 93 ALA93 0.0249 1407 HB2 89.8070 110.7870 126.5670 H 93 ALA93 0.0249 1408 HB3 90.9720 109.6090 127.1450 H 93 ALA93 0.0249 1409 N 90.7800 112.9390 124.6370 N.am 94 MET94 -0.2456 1410 CA 90.3700 113.7890 123.5150 C.3 94 MET94 0.0886 1411 CB 89.5790 114.9750 124.1000 C.3 94 MET94 -0.0199 1412 CG 89.1330 116.0220 123.0690 C.3 94 MET94 -0.0047 1413 SD 88.1150 115.3070 121.7690 S.3 94 MET94 -0.1641 1414 CE 86.5540 115.2360 122.6590 C.3 94 MET94 -0.0181 1415 C 91.5760 114.2890 122.7180 C.2 94 MET94 0.2188 1416 O 91.5650 114.2650 121.4890 O.2 94 MET94 -0.2778 1417 H 90.5860 113.2490 125.5890 H 94 MET94 0.1312 1418 HA 89.7400 113.1850 122.8600 H 94 MET94 0.0557 1419 HB1 90.1800 115.4720 124.8630 H 94 MET94 0.0293 1420 HB2 88.7050 114.5880 124.6240 H 94 MET94 0.0293 1421 HG1 89.9860 116.5200 122.6090 H 94 MET94 0.0377 1422 HG2 88.5670 116.8100 123.5660 H 94 MET94 0.0377 1423 HE1 85.8000 114.7470 122.0460 H 94 MET94 0.0340 1424 HE2 86.2180 116.2390 122.9220 H 94 MET94 0.0340 1425 HE3 86.6710 114.6730 123.5850 H 94 MET94 0.0340 1426 N 92.6120 114.7390 123.4230 N.am 95 THR95 -0.2434 1427 CA 93.8570 115.1550 122.7810 C.3 95 THR95 0.1135 1428 CB 94.7880 115.7290 123.8730 C.3 95 THR95 0.0763 1429 OG1 94.1460 116.7680 124.5930 O.3 95 THR95 -0.3900 1430 CG2 96.0760 116.3330 123.3030 C.3 95 THR95 -0.0370 1431 C 94.5340 113.9790 122.0840 C.2 95 THR95 0.2212 1432 O 95.0150 114.1010 120.9470 O.2 95 THR95 -0.2777 1433 H 92.5340 114.7950 124.4380 H 95 THR95 0.1313 1434 HA 93.6090 115.9200 122.0430 H 95 THR95 0.0583 1435 HB 95.0760 114.9340 124.5730 H 95 THR95 0.0611 1436 HG1 93.3510 116.4380 125.0040 H 95 THR95 0.2098 1437 HG21 96.7130 116.7120 124.1030 H 95 THR95 0.0255 1438 HG22 95.8480 117.1670 122.6420 H 95 THR95 0.0255 1439 HG23 96.6550 115.6020 122.7400 H 95 THR95 0.0255 1440 N 94.5690 112.8250 122.7540 N.am 96 PHE96 -0.2453 1441 CA 95.2160 111.6430 122.1980 C.3 96 PHE96 0.0918 1442 CB 95.1210 110.5900 123.3220 C.3 96 PHE96 -0.0036 1443 CG 95.2920 109.1550 122.9020 C.ar 96 PHE96 -0.0454 1444 CD1 96.4820 108.7080 122.3410 C.ar 96 PHE96 -0.0585 1445 CD2 94.2660 108.2400 123.1280 C.ar 96 PHE96 -0.0585 1446 CE1 96.6300 107.3740 121.9860 C.ar 96 PHE96 -0.0615 1447 CE2 94.4280 106.9000 122.8060 C.ar 96 PHE96 -0.0615 1448 CZ 95.6100 106.4660 122.2280 C.ar 96 PHE96 -0.0617 1449 C 94.5440 111.2030 120.9050 C.2 96 PHE96 0.2190 1450 O 95.2150 110.9440 119.9020 O.2 96 PHE96 -0.2778 1451 H 94.1340 112.7690 123.6750 H 96 PHE96 0.1312 1452 HA 96.2550 111.8900 121.9760 H 96 PHE96 0.0560 1453 HB1 94.1480 110.6770 123.8030 H 96 PHE96 0.0333 1454 HB2 95.8500 110.8170 124.1010 H 96 PHE96 0.0333 1455 HD1 97.2980 109.3970 122.1840 H 96 PHE96 0.0620 1456 HD2 93.3340 108.5650 123.5690 H 96 PHE96 0.0620 1457 HE1 97.5490 107.0300 121.5380 H 96 PHE96 0.0618 1458 HE2 93.6340 106.1960 123.0030 H 96 PHE96 0.0618 1459 HZ 95.7370 105.4250 121.9720 H 96 PHE96 0.0618 1460 N 93.2120 111.1290 120.9060 N.am 97 PHE97 -0.2453 1461 CA 92.5030 110.6870 119.7110 C.3 97 PHE97 0.0917 1462 CB 91.0310 110.3590 120.0280 C.3 97 PHE97 -0.0036 1463 CG 90.8760 109.1530 120.9200 C.ar 97 PHE97 -0.0454 1464 CD1 91.4680 107.9380 120.5850 C.ar 97 PHE97 -0.0585 1465 CD2 90.0920 109.2190 122.0680 C.ar 97 PHE97 -0.0585 1466 CE1 91.3280 106.8320 121.4100 C.ar 97 PHE97 -0.0615 1467 CE2 89.9520 108.1150 122.8990 C.ar 97 PHE97 -0.0615 1468 CZ 90.5810 106.9220 122.5760 C.ar 97 PHE97 -0.0617 1469 C 92.5790 111.7220 118.6000 C.2 97 PHE97 0.2191 1470 O 92.6470 111.3570 117.4210 O.2 97 PHE97 -0.2778 1471 H 92.6890 111.3820 121.7440 H 97 PHE97 0.1312 1472 HA 93.0160 109.8000 119.3390 H 97 PHE97 0.0560 1473 HB1 90.4820 110.1550 119.1070 H 97 PHE97 0.0333 1474 HB2 90.5520 111.2240 120.4890 H 97 PHE97 0.0333 1475 HD1 92.0420 107.8410 119.6750 H 97 PHE97 0.0620 1476 HD2 89.5980 110.1430 122.3270 H 97 PHE97 0.0620 1477 HE1 91.8050 105.9020 121.1410 H 97 PHE97 0.0618 1478 HE2 89.3420 108.1810 123.7880 H 97 PHE97 0.0618 1479 HZ 90.4690 106.0600 123.2160 H 97 PHE97 0.0618 1480 N 92.5890 113.0100 118.9510 N.am 98 SER98 -0.2436 1481 CA 92.7780 114.0500 117.9490 C.3 98 SER98 0.1109 1482 CB 92.7030 115.4080 118.6620 C.3 98 SER98 0.0681 1483 OG 92.8430 116.4870 117.7450 O.3 98 SER98 -0.3930 1484 C 94.1070 113.8750 117.2290 C.2 98 SER98 0.2209 1485 O 94.1570 113.8310 115.9930 O.2 98 SER98 -0.2777 1486 H 92.4630 113.2680 119.9300 H 98 SER98 0.1312 1487 HA 91.9720 113.9600 117.2220 H 98 SER98 0.0580 1488 HB1 93.4780 115.4590 119.4350 H 98 SER98 0.0577 1489 HB2 91.7340 115.4790 119.1670 H 98 SER98 0.0577 1490 HG 92.8380 117.3230 118.2070 H 98 SER98 0.2095 1491 N 95.1990 113.7690 117.9890 N.am 99 LEU99 -0.2456 1492 CA 96.5060 113.5960 117.3630 C.3 99 LEU99 0.0880 1493 CB 97.5760 113.6400 118.4660 C.3 99 LEU99 -0.0266 1494 CG 97.6620 115.0040 119.1750 C.3 99 LEU99 -0.0449 1495 CD1 98.4970 114.8980 120.4560 C.3 99 LEU99 -0.0626 1496 CD2 98.2310 116.0850 118.2460 C.3 99 LEU99 -0.0626 1497 C 96.5860 112.2850 116.5950 C.2 99 LEU99 0.2187 1498 O 97.1780 112.2290 115.5110 O.2 99 LEU99 -0.2778 1499 H 95.1200 113.8090 119.0050 H 99 LEU99 0.1312 1500 HA 96.6400 114.4080 116.6480 H 99 LEU99 0.0557 1501 HB1 98.5550 113.3900 118.0540 H 99 LEU99 0.0287 1502 HB2 97.3500 112.8670 119.2020 H 99 LEU99 0.0287 1503 HG 96.6620 115.3170 119.4760 H 99 LEU99 0.0296 1504 HD11 98.5100 115.8510 120.9860 H 99 LEU99 0.0232 1505 HD12 99.5270 114.6180 120.2370 H 99 LEU99 0.0232 1506 HD13 98.0820 114.1510 121.1340 H 99 LEU99 0.0232 1507 HD21 98.3370 117.0370 118.7650 H 99 LEU99 0.0232 1508 HD22 97.5860 116.2510 117.3850 H 99 LEU99 0.0232 1509 HD23 99.2100 115.7930 117.8700 H 99 LEU99 0.0232 1510 N 95.9840 111.2220 117.1310 N.am 100 ALA100 -0.2459 1511 CA 96.0290 109.9300 116.4580 C.3 100 ALA100 0.0850 1512 CB 95.3010 108.8910 117.3240 C.3 100 ALA100 -0.0411 1513 C 95.3510 109.9990 115.0980 C.2 100 ALA100 0.2185 1514 O 95.9210 109.5740 114.0870 O.2 100 ALA100 -0.2778 1515 H 95.4890 111.3140 118.0180 H 100 ALA100 0.1312 1516 HA 97.0790 109.6710 116.3300 H 100 ALA100 0.0554 1517 HB1 95.4070 107.8870 116.9120 H 100 ALA100 0.0249 1518 HB2 94.2340 109.1080 117.3990 H 100 ALA100 0.0249 1519 HB3 95.6880 108.8780 118.3390 H 100 ALA100 0.0249 1520 N 94.1390 110.5570 115.0430 N.am 101 THR101 -0.2434 1521 CA 93.4310 110.5960 113.7700 C.3 101 THR101 0.1135 1522 CB 91.9230 110.8260 113.9910 C.3 101 THR101 0.0763 1523 OG1 91.5020 109.9050 114.9860 O.3 101 THR101 -0.3900 1524 CG2 91.1060 110.6660 112.6870 C.3 101 THR101 -0.0370 1525 C 94.0370 111.6150 112.8130 C.2 101 THR101 0.2212 1526 O 94.0060 111.4020 111.5970 O.2 101 THR101 -0.2777 1527 H 93.7140 110.9510 115.8820 H 101 THR101 0.1313 1528 HA 93.5410 109.6100 113.3140 H 101 THR101 0.0583 1529 HB 91.7860 111.8370 114.3810 H 101 THR101 0.0611 1530 HG1 90.5510 109.8080 114.9630 H 101 THR101 0.2098 1531 HG21 90.0550 110.9230 112.8270 H 101 THR101 0.0255 1532 HG22 91.1450 109.6400 112.3190 H 101 THR101 0.0255 1533 HG23 91.4740 111.3160 111.8950 H 101 THR101 0.0255 1534 N 94.6450 112.6900 113.3230 N.am 102 MET102 -0.2456 1535 CA 95.2870 113.6420 112.4230 C.3 102 MET102 0.0886 1536 CB 95.6030 114.8980 113.2540 C.3 102 MET102 -0.0199 1537 CG 96.0650 116.0950 112.4190 C.3 102 MET102 -0.0047 1538 SD 94.7300 116.8140 111.4440 S.3 102 MET102 -0.1641 1539 CE 94.1970 118.0930 112.5970 C.3 102 MET102 -0.0181 1540 C 96.5440 113.0460 111.7980 C.2 102 MET102 0.2187 1541 O 96.7760 113.1950 110.5910 O.2 102 MET102 -0.2778 1542 H 94.6600 112.8430 114.3320 H 102 MET102 0.1312 1543 HA 94.5740 113.8810 111.6300 H 102 MET102 0.0557 1544 HB1 96.3610 114.6590 114.0020 H 102 MET102 0.0293 1545 HB2 94.7160 115.1920 113.8170 H 102 MET102 0.0293 1546 HG1 96.8540 115.7840 111.7410 H 102 MET102 0.0377 1547 HG2 96.4960 116.8680 113.0550 H 102 MET102 0.0377 1548 HE1 93.2790 118.5620 112.2450 H 102 MET102 0.0340 1549 HE2 94.9740 118.8490 112.7120 H 102 MET102 0.0340 1550 HE3 94.0070 117.6560 113.5780 H 102 MET102 0.0340 1551 N 97.3580 112.3460 112.5930 N.am 103 LEU103 -0.2456 1552 CA 98.5100 111.6510 112.0280 C.3 103 LEU103 0.0880 1553 CB 99.3260 111.0710 113.1930 C.3 103 LEU103 -0.0266 1554 CG 99.9890 112.1280 114.0970 C.3 103 LEU103 -0.0449 1555 CD1 100.3900 111.5230 115.4510 C.3 103 LEU103 -0.0626 1556 CD2 101.2060 112.7570 113.4100 C.3 103 LEU103 -0.0626 1557 C 98.0830 110.5210 111.1000 C.2 103 LEU103 0.2187 1558 O 98.7560 110.2570 110.0980 O.2 103 LEU103 -0.2778 1559 H 97.1740 112.2970 113.5950 H 103 LEU103 0.1312 1560 HA 99.0930 112.3720 111.4550 H 103 LEU103 0.0557 1561 HB1 100.0960 110.4080 112.8030 H 103 LEU103 0.0287 1562 HB2 98.6590 110.4500 113.7940 H 103 LEU103 0.0287 1563 HG 99.2710 112.9240 114.2990 H 103 LEU103 0.0296 1564 HD11 100.8440 112.2740 116.0970 H 103 LEU103 0.0232 1565 HD12 101.1070 110.7110 115.3270 H 103 LEU103 0.0232 1566 HD13 99.5220 111.1220 115.9760 H 103 LEU103 0.0232 1567 HD21 101.6300 113.5580 114.0170 H 103 LEU103 0.0232 1568 HD22 100.9380 113.1800 112.4440 H 103 LEU103 0.0232 1569 HD23 101.9880 112.0160 113.2400 H 103 LEU103 0.0232 1570 N 96.9640 109.8570 111.3970 N.am 104 MET104 -0.2456 1571 CA 96.4990 108.7840 110.5270 C.3 104 MET104 0.0885 1572 CB 95.4470 107.9470 111.2740 C.3 104 MET104 -0.0199 1573 CG 95.1790 106.5890 110.6110 C.3 104 MET104 -0.0047 1574 SD 96.6880 105.6050 110.5250 S.3 104 MET104 -0.1641 1575 CE 96.0880 104.2760 109.4680 C.3 104 MET104 -0.0181 1576 C 95.9470 109.3220 109.2150 C.2 104 MET104 0.2187 1577 O 95.9740 108.6170 108.2020 O.2 104 MET104 -0.2778 1578 H 96.4340 110.1010 112.2340 H 104 MET104 0.1312 1579 HA 97.3670 108.1630 110.2990 H 104 MET104 0.0557 1580 HB1 94.5160 108.5080 111.3740 H 104 MET104 0.0293 1581 HB2 95.7960 107.7600 112.2890 H 104 MET104 0.0293 1582 HG1 94.7840 106.7220 109.6030 H 104 MET104 0.0377 1583 HG2 94.4230 106.0290 111.1610 H 104 MET104 0.0377 1584 HE1 96.6840 103.3740 109.6180 H 104 MET104 0.0340 1585 HE2 96.1230 104.5680 108.4190 H 104 MET104 0.0340 1586 HE3 95.0560 104.0370 109.7240 H 104 MET104 0.0340 1587 N 95.4390 110.5540 109.2080 N.am 105 LEU105 -0.2456 1588 CA 95.0580 111.1740 107.9440 C.3 105 LEU105 0.0880 1589 CB 94.0640 112.3150 108.2280 C.3 105 LEU105 -0.0266 1590 CG 92.6880 111.8190 108.7190 C.3 105 LEU105 -0.0449 1591 CD1 91.8870 112.9630 109.3550 C.3 105 LEU105 -0.0626 1592 CD2 91.8680 111.1690 107.5940 C.3 105 LEU105 -0.0626 1593 C 96.2750 111.6660 107.1730 C.2 105 LEU105 0.2187 1594 O 96.3010 111.5790 105.9390 O.2 105 LEU105 -0.2778 1595 H 95.3170 111.0620 110.0840 H 105 LEU105 0.1312 1596 HA 94.5690 110.4170 107.3290 H 105 LEU105 0.0557 1597 HB1 93.9160 112.9250 107.3350 H 105 LEU105 0.0287 1598 HB2 94.5000 112.9780 108.9770 H 105 LEU105 0.0287 1599 HG 92.8330 111.0640 109.4910 H 105 LEU105 0.0296 1600 HD11 90.9320 112.6030 109.7380 H 105 LEU105 0.0232 1601 HD12 91.6720 113.7450 108.6260 H 105 LEU105 0.0232 1602 HD13 92.4290 113.4120 110.1870 H 105 LEU105 0.0232 1603 HD21 90.8910 110.8540 107.9630 H 105 LEU105 0.0232 1604 HD22 92.3590 110.2850 107.1890 H 105 LEU105 0.0232 1605 HD23 91.6920 111.8660 106.7750 H 105 LEU105 0.0232 1606 N 97.2910 112.1650 107.8790 N.am 106 PHE106 -0.2453 1607 CA 98.5240 112.5620 107.2070 C.3 106 PHE106 0.0917 1608 CB 99.4230 113.2780 108.2330 C.3 106 PHE106 -0.0036 1609 CG 100.8140 113.5800 107.7290 C.ar 106 PHE106 -0.0454 1610 CD1 101.0230 114.1060 106.4550 C.ar 106 PHE106 -0.0585 1611 CD2 101.9190 113.2940 108.5260 C.ar 106 PHE106 -0.0585 1612 CE1 102.3120 114.2820 105.9680 C.ar 106 PHE106 -0.0615 1613 CE2 103.2070 113.5030 108.0530 C.ar 106 PHE106 -0.0615 1614 CZ 103.4050 113.9880 106.7680 C.ar 106 PHE106 -0.0617 1615 C 99.2120 111.3660 106.5630 C.2 106 PHE106 0.2190 1616 O 99.7970 111.4860 105.4800 O.2 106 PHE106 -0.2778 1617 H 97.2060 112.2690 108.8900 H 106 PHE106 0.1312 1618 HA 98.2590 113.2390 106.4020 H 106 PHE106 0.0560 1619 HB1 99.4990 112.6600 109.1280 H 106 PHE106 0.0333 1620 HB2 98.9540 114.2110 108.5480 H 106 PHE106 0.0333 1621 HD1 100.1850 114.3390 105.8160 H 106 PHE106 0.0620 1622 HD2 101.7800 112.8910 109.5190 H 106 PHE106 0.0620 1623 HE1 102.4620 114.6520 104.9640 H 106 PHE106 0.0618 1624 HE2 104.0570 113.2720 108.6790 H 106 PHE106 0.0618 1625 HZ 104.4070 114.1340 106.3910 H 106 PHE106 0.0618 1626 N 99.1590 110.2040 107.2150 N.am 107 ALA107 -0.2459 1627 CA 99.7670 109.0060 106.6450 C.3 107 ALA107 0.0850 1628 CB 99.6050 107.8550 107.6470 C.3 107 ALA107 -0.0411 1629 C 99.1210 108.6450 105.3140 C.2 107 ALA107 0.2184 1630 O 99.8140 108.3470 104.3350 O.2 107 ALA107 -0.2778 1631 H 98.6900 110.1520 108.1190 H 107 ALA107 0.1312 1632 HA 100.8230 109.2220 106.4750 H 107 ALA107 0.0554 1633 HB1 100.0540 106.9340 107.2720 H 107 ALA107 0.0249 1634 HB2 98.5530 107.6510 107.8560 H 107 ALA107 0.0249 1635 HB3 100.0850 108.0950 108.5950 H 107 ALA107 0.0249 1636 N 97.7890 108.6740 105.2570 N.am 108 MET108 -0.2456 1637 CA 97.0980 108.3580 104.0110 C.3 108 MET108 0.0885 1638 CB 95.5950 108.2080 104.2740 C.3 108 MET108 -0.0199 1639 CG 95.2890 107.0290 105.1980 C.3 108 MET108 -0.0047 1640 SD 93.6120 106.4200 104.9460 S.3 108 MET108 -0.1641 1641 CE 93.9200 105.3210 103.5500 C.3 108 MET108 -0.0181 1642 C 97.3630 109.4160 102.9480 C.2 108 MET108 0.2187 1643 O 97.5390 109.0860 101.7680 O.2 108 MET108 -0.2778 1644 H 97.2500 108.9180 106.0880 H 108 MET108 0.1312 1645 HA 97.5050 107.4120 103.6470 H 108 MET108 0.0557 1646 HB1 95.0880 108.0330 103.3280 H 108 MET108 0.0293 1647 HB2 95.1750 109.1250 104.6900 H 108 MET108 0.0293 1648 HG1 95.4270 107.2880 106.2470 H 108 MET108 0.0377 1649 HG2 95.9930 106.2210 105.0030 H 108 MET108 0.0377 1650 HE1 93.1750 105.4900 102.7760 H 108 MET108 0.0340 1651 HE2 93.8290 104.2860 103.8680 H 108 MET108 0.0340 1652 HE3 94.9050 105.4830 103.1130 H 108 MET108 0.0340 1653 N 97.3940 110.6900 103.3440 N.am 109 ALA109 -0.2459 1654 CA 97.7220 111.7470 102.3940 C.3 109 ALA109 0.0850 1655 CB 97.6630 113.0990 103.1180 C.3 109 ALA109 -0.0411 1656 C 99.0920 111.5150 101.7700 C.2 109 ALA109 0.2184 1657 O 99.2530 111.5910 100.5470 O.2 109 ALA109 -0.2778 1658 H 97.1880 110.9260 104.3150 H 109 ALA109 0.1312 1659 HA 96.9720 111.7110 101.6030 H 109 ALA109 0.0554 1660 HB1 97.8310 113.9260 102.4290 H 109 ALA109 0.0249 1661 HB2 98.4070 113.1630 103.9130 H 109 ALA109 0.0249 1662 HB3 96.6840 113.2490 103.5750 H 109 ALA109 0.0249 1663 N 100.0890 111.2040 102.5990 N.am 110 LEU110 -0.2457 1664 CA 101.4450 111.0120 102.0930 C.3 110 LEU110 0.0880 1665 CB 102.4050 110.9770 103.2920 C.3 110 LEU110 -0.0266 1666 CG 103.8900 110.7830 102.9240 C.3 110 LEU110 -0.0449 1667 CD1 104.3920 111.8490 101.9390 C.3 110 LEU110 -0.0626 1668 CD2 104.7540 110.7690 104.1910 C.3 110 LEU110 -0.0626 1669 C 101.5550 109.7480 101.2490 C.2 110 LEU110 0.2187 1670 O 102.2790 109.7270 100.2470 O.2 110 LEU110 -0.2778 1671 H 99.9030 111.0990 103.5960 H 110 LEU110 0.1312 1672 HA 101.6700 111.8690 101.4570 H 110 LEU110 0.0557 1673 HB1 102.0960 110.1820 103.9730 H 110 LEU110 0.0287 1674 HB2 102.2940 111.9050 103.8540 H 110 LEU110 0.0287 1675 HG 104.0020 109.8090 102.4460 H 110 LEU110 0.0296 1676 HD11 105.4530 111.7160 101.7300 H 110 LEU110 0.0232 1677 HD12 104.2520 112.8540 102.3390 H 110 LEU110 0.0232 1678 HD13 103.8690 111.7910 100.9840 H 110 LEU110 0.0232 1679 HD21 105.8020 110.5870 103.9490 H 110 LEU110 0.0232 1680 HD22 104.4310 109.9850 104.8770 H 110 LEU110 0.0232 1681 HD23 104.6930 111.7210 104.7190 H 110 LEU110 0.0232 1682 N 100.8480 108.6820 101.6320 N.am 111 GLU111 -0.2456 1683 CA 100.8850 107.4650 100.8300 C.3 111 GLU111 0.0883 1684 CB 100.0590 106.3860 101.5980 C.3 111 GLU111 -0.0193 1685 CG 99.1730 105.3920 100.7870 C.3 111 GLU111 0.0356 1686 CD 97.6930 105.8410 100.6360 C.2 111 GLU111 0.1760 1687 OE1 96.9900 105.9390 101.6390 O.co2 111 GLU111 -0.6478 1688 OE2 97.2270 106.0920 99.5220 O.co2 111 GLU111 -0.6478 1689 C 100.2790 107.6970 99.4540 C.2 111 GLU111 0.2187 1690 O 100.8420 107.2660 98.4430 O.2 111 GLU111 -0.2778 1691 H 100.2850 108.7190 102.4820 H 111 GLU111 0.1312 1692 HA 101.9250 107.1580 100.7100 H 111 GLU111 0.0557 1693 HB1 99.4200 106.8710 102.3370 H 111 GLU111 0.0290 1694 HB2 100.7620 105.8060 102.1950 H 111 GLU111 0.0290 1695 HG1 99.1420 104.4390 101.3140 H 111 GLU111 0.0374 1696 HG2 99.5950 105.1710 99.8080 H 111 GLU111 0.0374 1697 N 99.1400 108.3880 99.3910 N.am 112 ARG112 -0.2457 1698 CA 98.5400 108.6870 98.0960 C.3 112 ARG112 0.0879 1699 CB 97.2150 109.4180 98.3680 C.3 112 ARG112 -0.0258 1700 CG 96.1090 109.1190 97.3420 C.3 112 ARG112 -0.0154 1701 CD 95.0070 108.2030 97.8990 C.3 112 ARG112 0.1045 1702 NE 94.2970 108.8850 98.9920 N.pl3 112 ARG112 -0.4450 1703 CZ 94.5060 108.6370 100.2850 C.cat 112 ARG112 0.5062 1704 NH1 95.3100 107.6980 100.6750 N.pl3 112 ARG112 -0.4573 1705 NH2 93.8940 109.3580 101.1830 N.pl3 112 ARG112 -0.4573 1706 C 99.4290 109.6130 97.2770 C.2 112 ARG112 0.2187 1707 O 99.5420 109.4600 96.0530 O.2 112 ARG112 -0.2778 1708 H 98.6890 108.7070 100.2480 H 112 ARG112 0.1312 1709 HA 98.3890 107.7350 97.5830 H 112 ARG112 0.0557 1710 HB1 97.3670 110.4970 98.4390 H 112 ARG112 0.0286 1711 HB2 96.8870 109.1510 99.3650 H 112 ARG112 0.0286 1712 HG1 96.5400 108.6780 96.4420 H 112 ARG112 0.0299 1713 HG2 95.6560 110.0570 97.0220 H 112 ARG112 0.0299 1714 HD1 95.4100 107.2410 98.2230 H 112 ARG112 0.0711 1715 HD2 94.2670 107.9880 97.1270 H 112 ARG112 0.0711 1716 HE 93.6280 109.5940 98.7910 H 112 ARG112 0.3153 1717 HH11 95.5050 107.4550 101.6240 H 112 ARG112 0.3114 1718 HH12 95.8420 107.1330 100.0330 H 112 ARG112 0.3114 1719 HH21 94.0740 109.1670 102.1450 H 112 ARG112 0.3114 1720 HH22 93.2610 110.0840 100.9290 H 112 ARG112 0.3114 1721 N 100.0830 110.5720 97.9370 N.am 113 TYR113 -0.2453 1722 CA 100.9770 111.4780 97.2250 C.3 113 TYR113 0.0917 1723 CB 101.4290 112.6240 98.1460 C.3 113 TYR113 -0.0036 1724 CG 102.4670 113.5260 97.5180 C.ar 113 TYR113 -0.0453 1725 CD1 102.3970 113.8800 96.1710 C.ar 113 TYR113 -0.0561 1726 CD2 103.5550 113.9650 98.2680 C.ar 113 TYR113 -0.0561 1727 CE1 103.4340 114.5740 95.5670 C.ar 113 TYR113 -0.0317 1728 CE2 104.5660 114.7140 97.6770 C.ar 113 TYR113 -0.0317 1729 CZ 104.5120 115.0070 96.3220 C.ar 113 TYR113 0.0726 1730 OH 105.5280 115.7200 95.7210 O.3 113 TYR113 -0.3598 1731 C 102.1500 110.7310 96.6110 C.2 113 TYR113 0.2190 1732 O 102.5250 110.9890 95.4640 O.2 113 TYR113 -0.2778 1733 H 99.9570 110.6720 98.9440 H 113 TYR113 0.1312 1734 HA 100.4060 111.8810 96.3960 H 113 TYR113 0.0560 1735 HB1 101.8250 112.2080 99.0730 H 113 TYR113 0.0333 1736 HB2 100.5640 113.2270 98.4160 H 113 TYR113 0.0333 1737 HD1 101.5700 113.5570 95.5570 H 113 TYR113 0.0621 1738 HD2 103.6290 113.7070 99.3150 H 113 TYR113 0.0621 1739 HE1 103.4080 114.7580 94.5030 H 113 TYR113 0.0643 1740 HE2 105.4080 115.0440 98.2660 H 113 TYR113 0.0643 1741 HH 106.1870 115.9390 96.3670 H 113 TYR113 0.2173 1742 N 102.7490 109.8040 97.3600 N.am 114 LEU114 -0.2456 1743 CA 103.8590 109.0310 96.8140 C.3 114 LEU114 0.0880 1744 CB 104.5650 108.2960 97.9620 C.3 114 LEU114 -0.0266 1745 CG 105.2210 109.2380 98.9900 C.3 114 LEU114 -0.0449 1746 CD1 105.5640 108.4780 100.2770 C.3 114 LEU114 -0.0626 1747 CD2 106.4700 109.9230 98.4170 C.3 114 LEU114 -0.0626 1748 C 103.3810 108.0680 95.7390 C.2 114 LEU114 0.2187 1749 O 104.1120 107.7780 94.7870 O.2 114 LEU114 -0.2778 1750 H 102.4310 109.6360 98.3140 H 114 LEU114 0.1312 1751 HA 104.5480 109.7300 96.3380 H 114 LEU114 0.0557 1752 HB1 105.3320 107.6340 97.5610 H 114 LEU114 0.0287 1753 HB2 103.8350 107.6590 98.4660 H 114 LEU114 0.0287 1754 HG 104.5140 110.0210 99.2630 H 114 LEU114 0.0296 1755 HD11 106.0040 109.1440 101.0200 H 114 LEU114 0.0232 1756 HD12 106.2720 107.6720 100.0840 H 114 LEU114 0.0232 1757 HD13 104.6690 108.0400 100.7190 H 114 LEU114 0.0232 1758 HD21 106.9340 110.5710 99.1610 H 114 LEU114 0.0232 1759 HD22 106.2260 110.5440 97.5550 H 114 LEU114 0.0232 1760 HD23 107.2130 109.1900 98.1020 H 114 LEU114 0.0232 1761 N 102.1480 107.6220 95.8540 N.am 115 SER115 -0.2436 1762 CA 101.6190 106.6720 94.8860 C.3 115 SER115 0.1109 1763 CB 100.3360 106.0610 95.4670 C.3 115 SER115 0.0681 1764 OG 99.8030 105.0740 94.5920 O.3 115 SER115 -0.3930 1765 C 101.3410 107.3250 93.5410 C.2 115 SER115 0.2209 1766 O 101.5090 106.6900 92.4980 O.2 115 SER115 -0.2777 1767 H 101.5610 107.9430 96.6240 H 115 SER115 0.1312 1768 HA 102.3610 105.8870 94.7380 H 115 SER115 0.0580 1769 HB1 99.5960 106.8510 95.6380 H 115 SER115 0.0577 1770 HB2 100.5710 105.6170 96.4410 H 115 SER115 0.0577 1771 HG 99.0430 104.6460 94.9780 H 115 SER115 0.2095 1772 N 100.8950 108.5790 93.5350 N.am 116 ILE116 -0.2453 1773 CA 100.5370 109.2210 92.2750 C.3 116 ILE116 0.0903 1774 CB 99.2060 109.9860 92.4910 C.3 116 ILE116 -0.0201 1775 CG1 98.0780 109.0770 93.0230 C.3 116 ILE116 -0.0514 1776 CG2 98.7390 110.7480 91.2360 C.3 116 ILE116 -0.0605 1777 CD1 97.7330 107.8980 92.1050 C.3 116 ILE116 -0.0650 1778 C 101.6400 110.1680 91.8270 C.2 116 ILE116 0.2187 1779 O 101.8050 110.4240 90.6320 O.2 116 ILE116 -0.2778 1780 H 100.8030 109.0910 94.4120 H 116 ILE116 0.1312 1781 HA 100.4060 108.4740 91.4910 H 116 ILE116 0.0560 1782 HB 99.3830 110.7340 93.2660 H 116 ILE116 0.0318 1783 HG11 97.1810 109.6750 93.1830 H 116 ILE116 0.0266 1784 HG12 98.3410 108.6860 94.0060 H 116 ILE116 0.0266 1785 HG21 97.7810 111.2400 91.4070 H 116 ILE116 0.0233 1786 HG22 98.6230 110.0790 90.3840 H 116 ILE116 0.0233 1787 HG23 99.4500 111.5230 90.9530 H 116 ILE116 0.0233 1788 HD11 96.9090 107.3170 92.5200 H 116 ILE116 0.0230 1789 HD12 98.5790 107.2210 91.9900 H 116 ILE116 0.0230 1790 HD13 97.4310 108.2360 91.1140 H 116 ILE116 0.0230 1791 N 102.4090 110.6890 92.7690 N.am 117 GLY117 -0.2485 1792 CA 103.3920 111.6920 92.4250 C.3 117 GLY117 0.0765 1793 C 104.7340 111.1280 92.0210 C.2 117 GLY117 0.2155 1794 O 105.3710 111.6400 91.0990 O.2 117 GLY117 -0.2781 1795 H 102.3090 110.3830 93.7370 H 117 GLY117 0.1309 1796 HA1 103.5270 112.3090 93.3130 H 117 GLY117 0.0521 1797 HA2 103.0080 112.3300 91.6280 H 117 GLY117 0.0521 1798 N 105.1780 110.0770 92.7060 N.am 118 HIS118 -0.2455 1799 CA 106.4700 109.4400 92.4550 C.3 118 HIS118 0.0934 1800 ND1 108.4760 111.9620 93.3470 N.ar 118 HIS118 -0.2469 1801 CG 107.5170 111.1960 93.9100 C.ar 118 HIS118 0.0551 1802 CB 107.3760 109.7100 93.6720 C.3 118 HIS118 0.0146 1803 NE2 107.1790 113.2810 94.5950 N.ar 118 HIS118 -0.2539 1804 CD2 106.7070 112.0200 94.7110 C.ar 118 HIS118 0.0047 1805 CE1 108.2440 113.2150 93.7750 C.ar 118 HIS118 0.0737 1806 C 106.2430 107.9450 92.3160 C.2 118 HIS118 0.2217 1807 O 106.4700 107.1840 93.2620 O.2 118 HIS118 -0.2776 1808 H 104.5860 109.6960 93.4440 H 118 HIS118 0.1312 1809 HA 106.9230 109.8410 91.5470 H 118 HIS118 0.0561 1810 HB1 108.3660 109.2790 93.5210 H 118 HIS118 0.0348 1811 HB2 106.9610 109.2620 94.5770 H 118 HIS118 0.0348 1812 HE2 106.8110 114.0870 95.0160 H 118 HIS118 0.1339 1813 HD2 105.8460 111.7040 95.2830 H 118 HIS118 0.0764 1814 HE1 108.8420 114.0670 93.4860 H 118 HIS118 0.0963 1815 N 105.7920 107.4880 91.1490 N.am 119 PRO119 -0.2316 1816 CA 105.4020 106.0790 91.0270 C.3 119 PRO119 0.0907 1817 CD 105.5650 108.2730 89.9420 C.3 119 PRO119 0.0071 1818 CB 104.7240 106.0150 89.6450 C.3 119 PRO119 -0.0276 1819 CG 104.4770 107.4670 89.2360 C.3 119 PRO119 -0.0379 1820 C 106.5730 105.1250 91.1080 C.2 119 PRO119 0.2189 1821 O 106.5280 104.1600 91.8810 O.2 119 PRO119 -0.2778 1822 HA 104.6870 105.8650 91.8250 H 119 PRO119 0.0559 1823 HD1 106.5030 108.2970 89.3860 H 119 PRO119 0.0431 1824 HD2 105.2280 109.2810 90.1680 H 119 PRO119 0.0431 1825 HB1 103.7990 105.4380 89.6730 H 119 PRO119 0.0285 1826 HB2 105.3670 105.5500 88.8950 H 119 PRO119 0.0285 1827 HG1 104.4790 107.6110 88.1560 H 119 PRO119 0.0278 1828 HG2 103.5030 107.7830 89.6120 H 119 PRO119 0.0278 1829 N 107.6310 105.3720 90.3360 N.am 120 TYR120 -0.2453 1830 CA 108.7750 104.4690 90.3370 C.3 120 TYR120 0.0917 1831 CB 109.8530 105.0070 89.3810 C.3 120 TYR120 -0.0036 1832 CG 109.2830 105.3820 88.0370 C.ar 120 TYR120 -0.0453 1833 CD1 108.6670 104.4260 87.2320 C.ar 120 TYR120 -0.0561 1834 CD2 109.3360 106.7020 87.5950 C.ar 120 TYR120 -0.0561 1835 CE1 108.1060 104.7860 86.0130 C.ar 120 TYR120 -0.0317 1836 CE2 108.7840 107.0600 86.3710 C.ar 120 TYR120 -0.0317 1837 CZ 108.1670 106.1030 85.5820 C.ar 120 TYR120 0.0726 1838 OH 107.6110 106.4570 84.3700 O.3 120 TYR120 -0.3598 1839 C 109.3280 104.2800 91.7420 C.2 120 TYR120 0.2190 1840 O 109.4600 103.1440 92.2090 O.2 120 TYR120 -0.2778 1841 H 107.6400 106.1990 89.7400 H 120 TYR120 0.1312 1842 HA 108.4000 103.5050 89.9890 H 120 TYR120 0.0560 1843 HB1 110.6330 104.2610 89.2340 H 120 TYR120 0.0333 1844 HB2 110.3360 105.8850 89.8130 H 120 TYR120 0.0333 1845 HD1 108.6000 103.3990 87.5580 H 120 TYR120 0.0621 1846 HD2 109.7980 107.4650 88.2040 H 120 TYR120 0.0621 1847 HE1 107.6210 104.0450 85.3950 H 120 TYR120 0.0643 1848 HE2 108.8280 108.0860 86.0370 H 120 TYR120 0.0643 1849 HH 107.9200 107.3180 84.1210 H 120 TYR120 0.2173 1850 N 109.6310 105.3770 92.4400 N.am 121 PHE121 -0.2453 1851 CA 110.1060 105.2770 93.8160 C.3 121 PHE121 0.0917 1852 CB 110.2760 106.7140 94.3400 C.3 121 PHE121 -0.0036 1853 CG 110.8010 106.7860 95.7510 C.ar 121 PHE121 -0.0454 1854 CD1 109.9200 106.8600 96.8260 C.ar 121 PHE121 -0.0585 1855 CD2 112.1700 106.8290 95.9960 C.ar 121 PHE121 -0.0585 1856 CE1 110.3970 106.9850 98.1230 C.ar 121 PHE121 -0.0615 1857 CE2 112.6510 106.9610 97.2930 C.ar 121 PHE121 -0.0615 1858 CZ 111.7630 107.0480 98.3570 C.ar 121 PHE121 -0.0617 1859 C 109.1210 104.5140 94.6870 C.2 121 PHE121 0.2190 1860 O 109.5240 103.7480 95.5630 O.2 121 PHE121 -0.2778 1861 H 109.5290 106.2950 92.0070 H 121 PHE121 0.1312 1862 HA 111.0570 104.7450 93.8030 H 121 PHE121 0.0560 1863 HB1 109.3220 107.2420 94.2920 H 121 PHE121 0.0333 1864 HB2 110.9520 107.2660 93.6870 H 121 PHE121 0.0333 1865 HD1 108.8530 106.8360 96.6530 H 121 PHE121 0.0620 1866 HD2 112.8670 106.7940 95.1720 H 121 PHE121 0.0620 1867 HE1 109.6980 107.0580 98.9450 H 121 PHE121 0.0618 1868 HE2 113.7150 107.0270 97.4650 H 121 PHE121 0.0618 1869 HZ 112.1250 107.1840 99.3640 H 121 PHE121 0.0618 1870 N 107.8250 104.7190 94.4770 N.am 122 TYR122 -0.2453 1871 CA 106.8500 104.0180 95.2980 C.3 122 TYR122 0.0917 1872 CB 105.4990 104.7330 95.0990 C.3 122 TYR122 -0.0036 1873 CG 104.3740 104.1910 95.9450 C.ar 122 TYR122 -0.0453 1874 CD1 103.5470 103.1800 95.4640 C.ar 122 TYR122 -0.0561 1875 CD2 104.0950 104.7460 97.1900 C.ar 122 TYR122 -0.0561 1876 CE1 102.4700 102.7270 96.2170 C.ar 122 TYR122 -0.0317 1877 CE2 103.0030 104.3170 97.9330 C.ar 122 TYR122 -0.0317 1878 CZ 102.1940 103.2990 97.4500 C.ar 122 TYR122 0.0726 1879 OH 101.1110 102.8630 98.1860 O.3 122 TYR122 -0.3598 1880 C 106.7610 102.5590 94.8970 C.2 122 TYR122 0.2190 1881 O 106.4050 101.7040 95.7120 O.2 122 TYR122 -0.2778 1882 H 107.5170 105.3620 93.7470 H 122 TYR122 0.1312 1883 HA 107.1580 104.0830 96.3430 H 122 TYR122 0.0560 1884 HB1 105.2000 104.6980 94.0510 H 122 TYR122 0.0333 1885 HB2 105.6210 105.7910 95.3330 H 122 TYR122 0.0333 1886 HD1 103.7370 102.7430 94.4940 H 122 TYR122 0.0621 1887 HD2 104.7220 105.5310 97.5800 H 122 TYR122 0.0621 1888 HE1 101.8320 101.9440 95.8380 H 122 TYR122 0.0643 1889 HE2 102.7850 104.7690 98.8880 H 122 TYR122 0.0643 1890 HH 100.8930 103.5100 98.8440 H 122 TYR122 0.2173 1891 N 107.0780 102.2520 93.6400 N.am 123 GLN123 -0.2456 1892 CA 106.9030 100.8910 93.1500 C.3 123 GLN123 0.0882 1893 CB 107.1620 100.8600 91.6340 C.3 123 GLN123 -0.0210 1894 CG 106.8830 99.4990 90.9710 C.3 123 GLN123 0.0225 1895 CD 105.3900 99.1560 90.9870 C.2 123 GLN123 0.1981 1896 OE1 104.6460 99.5240 90.0900 O.2 123 GLN123 -0.2798 1897 NE2 105.0030 98.4320 92.0470 N.am 123 GLN123 -0.2724 1898 C 107.8200 99.9270 93.8850 C.2 123 GLN123 0.2187 1899 O 107.4640 98.7660 94.1180 O.2 123 GLN123 -0.2778 1900 H 107.4450 102.9730 93.0180 H 123 GLN123 0.1312 1901 HA 105.8690 100.6160 93.3670 H 123 GLN123 0.0557 1902 HB1 108.1970 101.1380 91.4400 H 123 GLN123 0.0289 1903 HB2 106.5550 101.6270 91.1510 H 123 GLN123 0.0289 1904 HG1 107.4440 98.6950 91.4480 H 123 GLN123 0.0356 1905 HG2 107.1970 99.5250 89.9280 H 123 GLN123 0.0356 1906 HE21 104.0450 98.1570 92.1230 H 123 GLN123 0.1266 1907 HE22 105.6440 98.1640 92.7670 H 123 GLN123 0.1266 1908 N 109.0040 100.3920 94.2720 N.am 124 ARG124 -0.2457 1909 CA 109.9360 99.5590 95.0120 C.3 124 ARG124 0.0879 1910 CB 111.3590 99.6860 94.4290 C.3 124 ARG124 -0.0258 1911 CG 111.6710 101.0120 93.7120 C.3 124 ARG124 -0.0154 1912 CD 113.0900 101.0100 93.1240 C.3 124 ARG124 0.1045 1913 NE 113.2530 102.0400 92.0920 N.pl3 124 ARG124 -0.4450 1914 CZ 112.8040 101.9160 90.8430 C.cat 124 ARG124 0.5062 1915 NH1 112.1140 100.8700 90.4680 N.pl3 124 ARG124 -0.4573 1916 NH2 113.0610 102.8540 89.9710 N.pl3 124 ARG124 -0.4573 1917 C 109.8860 99.8050 96.5150 C.2 124 ARG124 0.2187 1918 O 109.5780 98.8880 97.2790 O.2 124 ARG124 -0.2778 1919 H 109.2630 101.3520 94.0450 H 124 ARG124 0.1312 1920 HA 109.6390 98.5140 94.8960 H 124 ARG124 0.0557 1921 HB1 111.4840 98.8840 93.6990 H 124 ARG124 0.0286 1922 HB2 112.1090 99.4880 95.1970 H 124 ARG124 0.0286 1923 HG1 111.5420 101.8570 94.3910 H 124 ARG124 0.0299 1924 HG2 110.9580 101.1590 92.9020 H 124 ARG124 0.0299 1925 HD1 113.3500 100.0410 92.6870 H 124 ARG124 0.0711 1926 HD2 113.8290 101.2050 93.9040 H 124 ARG124 0.0711 1927 HE 113.7360 102.8830 92.3240 H 124 ARG124 0.3153 1928 HH11 111.8010 100.7710 89.5260 H 124 ARG124 0.3114 1929 HH12 111.8990 100.1650 91.1390 H 124 ARG124 0.3114 1930 HH21 112.7340 102.7690 89.0320 H 124 ARG124 0.3114 1931 HH22 113.5890 103.6570 90.2380 H 124 ARG124 0.3114 1932 N 110.1320 101.0370 96.9570 N.am 125 ARG125 -0.2457 1933 CA 110.4980 101.2980 98.3480 C.3 125 ARG125 0.0879 1934 CB 111.3510 102.5790 98.4210 C.3 125 ARG125 -0.0258 1935 CG 112.2240 102.6390 99.6890 C.3 125 ARG125 -0.0154 1936 CD 112.8580 104.0120 99.9240 C.3 125 ARG125 0.1045 1937 NE 113.6550 103.9690 101.1520 N.pl3 125 ARG125 -0.4450 1938 CZ 114.3790 104.9840 101.6140 C.cat 125 ARG125 0.5062 1939 NH1 114.4270 106.1260 100.9800 N.pl3 125 ARG125 -0.4573 1940 NH2 115.0540 104.8390 102.7230 N.pl3 125 ARG125 -0.4573 1941 C 109.2770 101.4080 99.2620 C.2 125 ARG125 0.2187 1942 O 109.3250 102.0000 100.3360 O.2 125 ARG125 -0.2778 1943 H 110.0630 101.8200 96.3070 H 125 ARG125 0.1312 1944 HA 111.0890 100.4450 98.6870 H 125 ARG125 0.0557 1945 HB1 110.7060 103.4570 98.3550 H 125 ARG125 0.0286 1946 HB2 112.0050 102.6280 97.5500 H 125 ARG125 0.0286 1947 HG1 113.0030 101.8790 99.6220 H 125 ARG125 0.0299 1948 HG2 111.6380 102.3830 100.5700 H 125 ARG125 0.0299 1949 HD1 112.0810 104.7700 100.0490 H 125 ARG125 0.0711 1950 HD2 113.5060 104.2920 99.0890 H 125 ARG125 0.0711 1951 HE 113.6540 103.1230 101.6850 H 125 ARG125 0.3153 1952 HH11 114.9770 106.8800 101.3330 H 125 ARG125 0.3114 1953 HH12 113.9080 106.2390 100.1380 H 125 ARG125 0.3114 1954 HH21 115.6030 105.5900 103.0820 H 125 ARG125 0.3114 1955 HH22 115.0240 103.9730 103.2170 H 125 ARG125 0.3114 1956 N 108.1680 100.8150 98.8230 N.am 126 VAL126 -0.2454 1957 CA 106.9610 100.7580 99.6440 C.3 126 VAL126 0.0901 1958 CB 106.0130 101.9430 99.3210 C.3 126 VAL126 -0.0227 1959 CG1 104.7570 101.9200 100.2130 C.3 126 VAL126 -0.0608 1960 CG2 106.7060 103.3100 99.4440 C.3 126 VAL126 -0.0608 1961 C 106.2370 99.4410 99.4000 C.2 126 VAL126 0.2190 1962 O 105.9060 99.1060 98.2580 O.2 126 VAL126 -0.2778 1963 H 108.1610 100.3920 97.8950 H 126 VAL126 0.1312 1964 HA 107.2560 100.7890 100.6950 H 126 VAL126 0.0560 1965 HB 105.6830 101.8500 98.2850 H 126 VAL126 0.0315 1966 HG11 104.1190 102.7810 100.0200 H 126 VAL126 0.0233 1967 HG12 105.0240 101.9410 101.2700 H 126 VAL126 0.0233 1968 HG13 104.1520 101.0300 100.0380 H 126 VAL126 0.0233 1969 HG21 105.9990 104.1220 99.2780 H 126 VAL126 0.0233 1970 HG22 107.5010 103.4280 98.7090 H 126 VAL126 0.0233 1971 HG23 107.1340 103.4470 100.4370 H 126 VAL126 0.0233 1972 N 105.9710 98.6950 100.4690 N.am 127 SER127 -0.2436 1973 CA 105.2780 97.4200 100.3820 C.3 127 SER127 0.1109 1974 CB 106.2930 96.2790 100.5430 C.3 127 SER127 0.0681 1975 OG 105.6440 95.0090 100.5240 O.3 127 SER127 -0.3930 1976 C 104.1930 97.3210 101.4460 C.2 127 SER127 0.2209 1977 O 104.2470 97.9760 102.4890 O.2 127 SER127 -0.2777 1978 H 106.2650 99.0310 101.3860 H 127 SER127 0.1312 1979 HA 104.7900 97.3450 99.4080 H 127 SER127 0.0580 1980 HB1 106.8370 96.4060 101.4850 H 127 SER127 0.0577 1981 HB2 107.0230 96.3500 99.7270 H 127 SER127 0.0577 1982 HG 106.2840 94.3000 100.5490 H 127 SER127 0.2095 1983 N 103.2070 96.4660 101.1650 N.am 128 ARG128 -0.2456 1984 CA 102.0370 96.3510 102.0300 C.3 128 ARG128 0.0879 1985 CB 101.0190 95.3980 101.3760 C.3 128 ARG128 -0.0258 1986 CG 99.7430 95.1630 102.2140 C.3 128 ARG128 -0.0154 1987 CD 98.7950 94.1300 101.5920 C.3 128 ARG128 0.1045 1988 NE 99.4510 92.8200 101.5220 N.pl3 128 ARG128 -0.4450 1989 CZ 99.4160 91.9860 100.4820 C.cat 128 ARG128 0.5062 1990 NH1 98.7460 92.2560 99.3900 N.pl3 128 ARG128 -0.4573 1991 NH2 100.0750 90.8610 100.5540 N.pl3 128 ARG128 -0.4573 1992 C 102.4090 95.8370 103.4130 C.2 128 ARG128 0.2187 1993 O 101.7930 96.2230 104.4130 O.2 128 ARG128 -0.2778 1994 H 103.2720 95.8830 100.3310 H 128 ARG128 0.1312 1995 HA 101.6130 97.3510 102.1400 H 128 ARG128 0.0557 1996 HB1 101.5130 94.4460 101.1790 H 128 ARG128 0.0286 1997 HB2 100.7380 95.7980 100.4010 H 128 ARG128 0.0286 1998 HG1 99.2170 96.1100 102.3430 H 128 ARG128 0.0299 1999 HG2 99.9970 94.8230 103.2180 H 128 ARG128 0.0299 2000 HD1 98.4970 94.4480 100.5980 H 128 ARG128 0.0711 2001 HD2 97.8930 94.0160 102.1990 H 128 ARG128 0.0711 2002 HE 99.9730 92.5250 102.3220 H 128 ARG128 0.3153 2003 HH11 98.7580 91.6180 98.6250 H 128 ARG128 0.3114 2004 HH12 98.2190 93.1010 99.3120 H 128 ARG128 0.3114 2005 HH21 100.0650 90.2210 99.7890 H 128 ARG128 0.3114 2006 HH22 100.5940 90.6340 101.3750 H 128 ARG128 0.3114 2007 N 103.4150 94.9660 103.4900 N.am 129 SER129 -0.2436 2008 CA 103.7510 94.3190 104.7540 C.3 129 SER129 0.1109 2009 CB 104.9020 93.3310 104.5310 C.3 129 SER129 0.0681 2010 OG 104.5050 92.3720 103.5550 O.3 129 SER129 -0.3930 2011 C 104.1000 95.3380 105.8320 C.2 129 SER129 0.2207 2012 O 103.7020 95.1890 106.9920 O.2 129 SER129 -0.2777 2013 H 103.9580 94.7490 102.6540 H 129 SER129 0.1312 2014 HA 102.8620 93.7790 105.0810 H 129 SER129 0.0580 2015 HB1 105.1460 92.8320 105.4760 H 129 SER129 0.0577 2016 HB2 105.7920 93.8720 104.1900 H 129 SER129 0.0577 2017 HG 105.2010 91.7360 103.4000 H 129 SER129 0.2095 2018 N 104.8360 96.3880 105.4650 N.am 130 GLY130 -0.2484 2019 CA 105.1680 97.4340 106.4160 C.3 130 GLY130 0.0765 2020 C 104.0180 98.3650 106.7310 C.2 130 GLY130 0.2153 2021 O 104.2220 99.3890 107.3900 O.2 130 GLY130 -0.2781 2022 H 105.1700 96.4570 104.5040 H 130 GLY130 0.1309 2023 HA1 105.9800 98.0140 105.9800 H 130 GLY130 0.0521 2024 HA2 105.5300 96.9750 107.3370 H 130 GLY130 0.0521 2025 N 102.8120 98.0390 106.2650 N.am 131 GLY131 -0.2487 2026 CA 101.6810 98.9240 106.4810 C.3 131 GLY131 0.0765 2027 C 101.0740 98.7940 107.8630 C.2 131 GLY131 0.2155 2028 O 100.4820 99.7430 108.3810 O.2 131 GLY131 -0.2781 2029 H 102.6830 97.1650 105.7550 H 131 GLY131 0.1309 2030 HA1 100.9210 98.6430 105.7550 H 131 GLY131 0.0521 2031 HA2 101.9790 99.9570 106.2970 H 131 GLY131 0.0521 2032 N 101.1900 97.6150 108.4730 N.am 132 LEU132 -0.2459 2033 CA 100.6060 97.4270 109.7960 C.3 132 LEU132 0.0880 2034 CB 100.5700 95.9270 110.1390 C.3 132 LEU132 -0.0266 2035 CG 99.6410 95.0810 109.2380 C.3 132 LEU132 -0.0449 2036 CD1 100.2540 94.7480 107.8660 C.3 132 LEU132 -0.0626 2037 CD2 99.2510 93.7820 109.9550 C.3 132 LEU132 -0.0626 2038 C 101.3580 98.2110 110.8610 C.2 132 LEU132 0.2187 2039 O 100.8220 98.4460 111.9470 O.2 132 LEU132 -0.2778 2040 H 101.6850 96.8480 108.0170 H 132 LEU132 0.1312 2041 HA 99.5840 97.8190 109.7690 H 132 LEU132 0.0557 2042 HB1 100.2150 95.8360 111.1680 H 132 LEU132 0.0287 2043 HB2 101.5780 95.5110 110.1330 H 132 LEU132 0.0287 2044 HG 98.7210 95.6460 109.0760 H 132 LEU132 0.0296 2045 HD11 99.6240 94.0440 107.3240 H 132 LEU132 0.0232 2046 HD12 101.2400 94.2960 107.9740 H 132 LEU132 0.0232 2047 HD13 100.3540 95.6240 107.2290 H 132 LEU132 0.0232 2048 HD21 98.5610 93.1910 109.3520 H 132 LEU132 0.0232 2049 HD22 98.7570 93.9920 110.9040 H 132 LEU132 0.0232 2050 HD23 100.1280 93.1680 110.1620 H 132 LEU132 0.0232 2051 N 102.6040 98.5440 110.5500 N.am 133 ALA133 -0.2459 2052 CA 103.5000 99.2880 111.4250 C.3 133 ALA133 0.0850 2053 CB 104.8970 99.3010 110.7950 C.3 133 ALA133 -0.0411 2054 C 103.0510 100.7100 111.7260 C.2 133 ALA133 0.2184 2055 O 103.2660 101.2150 112.8240 O.2 133 ALA133 -0.2778 2056 H 102.9580 98.2600 109.6370 H 133 ALA133 0.1312 2057 HA 103.5240 98.7440 112.3700 H 133 ALA133 0.0554 2058 HB1 105.6250 99.7750 111.4540 H 133 ALA133 0.0249 2059 HB2 104.8980 99.8420 109.8480 H 133 ALA133 0.0249 2060 HB3 105.2400 98.2860 110.5950 H 133 ALA133 0.0249 2061 N 102.4550 101.3620 110.7360 N.am 134 VAL134 -0.2454 2062 CA 102.0430 102.7560 110.8700 C.3 134 VAL134 0.0901 2063 CB 101.5350 103.2530 109.4990 C.3 134 VAL134 -0.0227 2064 CG1 100.1360 102.7200 109.1470 C.3 134 VAL134 -0.0608 2065 CG2 101.5670 104.7850 109.3870 C.3 134 VAL134 -0.0608 2066 C 101.0250 103.0690 111.9630 C.2 134 VAL134 0.2189 2067 O 101.1460 104.0960 112.6240 O.2 134 VAL134 -0.2778 2068 H 102.2800 100.8760 109.8570 H 134 VAL134 0.1312 2069 HA 102.9540 103.2980 111.1240 H 134 VAL134 0.0560 2070 HB 102.2250 102.8630 108.7490 H 134 VAL134 0.0315 2071 HG11 99.9880 102.7040 108.0710 H 134 VAL134 0.0233 2072 HG12 99.3460 103.3290 109.5890 H 134 VAL134 0.0233 2073 HG13 99.9820 101.7060 109.5100 H 134 VAL134 0.0233 2074 HG21 101.2730 105.1070 108.3880 H 134 VAL134 0.0233 2075 HG22 102.5660 105.1740 109.5830 H 134 VAL134 0.0233 2076 HG23 100.8830 105.2480 110.0980 H 134 VAL134 0.0233 2077 N 100.0220 102.2210 112.1590 N.am 135 LEU135 -0.2456 2078 CA 99.0310 102.5200 113.1900 C.3 135 LEU135 0.0883 2079 CB 97.7840 101.6210 113.0680 C.3 135 LEU135 -0.0266 2080 CG 96.7690 101.7480 114.2200 C.3 135 LEU135 -0.0449 2081 CD1 96.1340 103.1430 114.2290 C.3 135 LEU135 -0.0626 2082 CD2 95.6860 100.6630 114.1460 C.3 135 LEU135 -0.0626 2083 C 99.6230 102.5720 114.5980 C.2 135 LEU135 0.2214 2084 O 99.3100 103.4780 115.3670 O.2 135 LEU135 -0.2776 2085 H 99.9450 101.3730 111.5980 H 135 LEU135 0.1312 2086 HA 98.6940 103.5360 112.9780 H 135 LEU135 0.0557 2087 HB1 98.0590 100.5780 112.9390 H 135 LEU135 0.0287 2088 HB2 97.2790 101.9020 112.1480 H 135 LEU135 0.0287 2089 HG 97.2910 101.5900 115.1630 H 135 LEU135 0.0296 2090 HD11 95.3560 103.2030 114.9860 H 135 LEU135 0.0232 2091 HD12 95.6810 103.3660 113.2630 H 135 LEU135 0.0232 2092 HD13 96.8680 103.9200 114.4420 H 135 LEU135 0.0232 2093 HD21 95.0630 100.6640 115.0390 H 135 LEU135 0.0232 2094 HD22 96.1280 99.6710 114.0480 H 135 LEU135 0.0232 2095 HD23 95.0240 100.8170 113.2980 H 135 LEU135 0.0232 2096 N 100.4840 101.6020 114.9360 N.am 136 PRO136 -0.2316 2097 CA 101.1490 101.5340 116.2400 C.3 136 PRO136 0.0907 2098 HA 100.3645 101.4870 116.9958 H 136 PRO136 0.0559 2099 CD 100.6368 100.3469 114.1902 C.3 136 PRO136 0.0071 2100 HD1 101.2283 100.4966 113.3141 H 136 PRO136 0.0431 2101 HD2 99.6695 99.9556 113.8980 H 136 PRO136 0.0431 2102 CB 101.9725 100.2383 116.1920 C.3 136 PRO136 -0.0276 2103 HB1 102.0524 99.7586 117.1674 H 136 PRO136 0.0285 2104 HB2 102.9868 100.4236 115.8330 H 136 PRO136 0.0285 2105 CG 101.2718 99.3654 115.1685 C.3 136 PRO136 -0.0379 2106 HG1 101.9435 98.6634 114.6738 H 136 PRO136 0.0278 2107 HG2 100.4885 98.7870 115.6594 H 136 PRO136 0.0278 2108 C 102.0750 102.7110 116.5170 C.2 136 PRO136 0.2189 2109 O 102.0900 103.2070 117.6390 O.2 136 PRO136 -0.2778 2110 N 102.8290 103.1590 115.5200 N.am 137 VAL137 -0.2454 2111 CA 103.7350 104.2840 115.7210 C.3 137 VAL137 0.0901 2112 CB 104.5670 104.5010 114.4380 C.3 137 VAL137 -0.0227 2113 CG1 105.3880 105.8020 114.4700 C.3 137 VAL137 -0.0608 2114 CG2 105.5010 103.3100 114.1810 C.3 137 VAL137 -0.0608 2115 C 102.9340 105.5230 116.0920 C.2 137 VAL137 0.2189 2116 O 103.3570 106.3230 116.9220 O.2 137 VAL137 -0.2778 2117 H 102.7740 102.7120 114.6050 H 137 VAL137 0.1312 2118 HA 104.3860 104.0370 116.5610 H 137 VAL137 0.0560 2119 HB 103.8740 104.5680 113.5960 H 137 VAL137 0.0315 2120 HG11 106.0030 105.8980 113.5750 H 137 VAL137 0.0233 2121 HG12 106.0520 105.8260 115.3350 H 137 VAL137 0.0233 2122 HG13 104.7490 106.6850 114.5140 H 137 VAL137 0.0233 2123 HG21 106.0250 103.4210 113.2320 H 137 VAL137 0.0233 2124 HG22 104.9570 102.3670 114.1440 H 137 VAL137 0.0233 2125 HG23 106.2500 103.2230 114.9680 H 137 VAL137 0.0233 2126 N 101.7860 105.6870 115.4480 N.am 138 ILE138 -0.2454 2127 CA 100.8870 106.8050 115.7250 C.3 138 ILE138 0.0903 2128 CB 99.7070 106.8700 114.7240 C.3 138 ILE138 -0.0201 2129 CG1 100.1450 107.1560 113.2670 C.3 138 ILE138 -0.0514 2130 CG2 98.6480 107.8960 115.1570 C.3 138 ILE138 -0.0605 2131 CD1 101.4000 108.0270 113.1140 C.3 138 ILE138 -0.0650 2132 C 100.4430 106.7740 117.1820 C.2 138 ILE138 0.2189 2133 O 100.4840 107.7920 117.8860 O.2 138 ILE138 -0.2778 2134 H 101.5210 105.0080 114.7340 H 138 ILE138 0.1312 2135 HA 101.4900 107.7080 115.6370 H 138 ILE138 0.0560 2136 HB 99.2070 105.9010 114.7240 H 138 ILE138 0.0318 2137 HG11 99.3230 107.6180 112.7190 H 138 ILE138 0.0266 2138 HG12 100.3200 106.2200 112.7470 H 138 ILE138 0.0266 2139 HG21 97.8590 107.9880 114.4110 H 138 ILE138 0.0233 2140 HG22 99.0950 108.8790 115.3020 H 138 ILE138 0.0233 2141 HG23 98.1660 107.6060 116.0910 H 138 ILE138 0.0233 2142 HD11 101.5350 108.3290 112.0760 H 138 ILE138 0.0230 2143 HD12 102.2960 107.4840 113.4140 H 138 ILE138 0.0230 2144 HD13 101.3400 108.9270 113.7230 H 138 ILE138 0.0230 2145 N 100.0010 105.6040 117.6490 N.am 139 TYR139 -0.2453 2146 CA 99.5820 105.4680 119.0390 C.3 139 TYR139 0.0917 2147 CB 98.9860 104.0750 119.3060 C.3 139 TYR139 -0.0036 2148 CG 97.5860 103.9100 118.7610 C.ar 139 TYR139 -0.0453 2149 CD1 96.5810 104.8200 119.0870 C.ar 139 TYR139 -0.0561 2150 CD2 97.2510 102.8010 117.9880 C.ar 139 TYR139 -0.0561 2151 CE1 95.2790 104.6420 118.6390 C.ar 139 TYR139 -0.0317 2152 CE2 95.9430 102.6080 117.5590 C.ar 139 TYR139 -0.0317 2153 CZ 94.9580 103.5350 117.8720 C.ar 139 TYR139 0.0726 2154 OH 93.6630 103.3600 117.4310 O.3 139 TYR139 -0.3598 2155 C 100.7250 105.7860 119.9910 C.2 139 TYR139 0.2190 2156 O 100.5170 106.4360 121.0180 O.2 139 TYR139 -0.2778 2157 H 99.9560 104.7970 117.0270 H 139 TYR139 0.1312 2158 HA 98.8380 106.2400 119.2100 H 139 TYR139 0.0560 2159 HB1 98.9300 103.8900 120.3800 H 139 TYR139 0.0333 2160 HB2 99.6420 103.3070 118.8940 H 139 TYR139 0.0333 2161 HD1 96.8030 105.6790 119.6990 H 139 TYR139 0.0621 2162 HD2 98.0060 102.0760 117.7210 H 139 TYR139 0.0621 2163 HE1 94.5110 105.3590 118.8880 H 139 TYR139 0.0643 2164 HE2 95.6890 101.7420 116.9680 H 139 TYR139 0.0643 2165 HH 93.6550 103.2740 116.4830 H 139 TYR139 0.2173 2166 N 101.9420 105.3580 119.6570 N.am 140 ALA140 -0.2459 2167 CA 103.0870 105.6110 120.5250 C.3 140 ALA140 0.0850 2168 CB 104.2940 104.8440 119.9730 C.3 140 ALA140 -0.0411 2169 C 103.3910 107.1010 120.6220 C.2 140 ALA140 0.2184 2170 O 103.5690 107.6380 121.7220 O.2 140 ALA140 -0.2778 2171 H 102.0740 104.8470 118.7840 H 140 ALA140 0.1312 2172 HA 102.8290 105.2450 121.5200 H 140 ALA140 0.0554 2173 HB1 105.1710 104.9720 120.6090 H 140 ALA140 0.0249 2174 HB2 104.5550 105.1780 118.9680 H 140 ALA140 0.0249 2175 HB3 104.0780 103.7770 119.9160 H 140 ALA140 0.0249 2176 N 103.4550 107.7840 119.4770 N.am 141 VAL141 -0.2454 2177 CA 103.7540 109.2150 119.4800 C.3 141 VAL141 0.0901 2178 CB 103.9050 109.6870 118.0160 C.3 141 VAL141 -0.0227 2179 CG1 103.9890 111.2180 117.8800 C.3 141 VAL141 -0.0608 2180 CG2 105.1340 109.0440 117.3530 C.3 141 VAL141 -0.0608 2181 C 102.6640 109.9860 120.2130 C.2 141 VAL141 0.2190 2182 O 102.9510 110.8840 121.0170 O.2 141 VAL141 -0.2778 2183 H 103.2940 107.3030 118.5920 H 141 VAL141 0.1312 2184 HA 104.6900 109.3540 120.0240 H 141 VAL141 0.0560 2185 HB 103.0220 109.3570 117.4640 H 141 VAL141 0.0315 2186 HG11 104.1430 111.5090 116.8400 H 141 VAL141 0.0233 2187 HG12 104.8180 111.6190 118.4650 H 141 VAL141 0.0233 2188 HG13 103.0740 111.7060 118.2160 H 141 VAL141 0.0233 2189 HG21 105.1940 109.3130 116.2980 H 141 VAL141 0.0233 2190 HG22 105.1100 107.9570 117.4090 H 141 VAL141 0.0233 2191 HG23 106.0550 109.3760 117.8330 H 141 VAL141 0.0233 2192 N 101.3980 109.6420 119.9620 N.am 142 SER142 -0.2436 2193 CA 100.3090 110.3540 120.6190 C.3 142 SER142 0.1109 2194 CB 98.9700 110.0800 119.9260 C.3 142 SER142 0.0681 2195 OG 98.6430 108.7010 119.9650 O.3 142 SER142 -0.3930 2196 C 100.3000 110.0940 122.1210 C.2 142 SER142 0.2209 2197 O 100.0830 111.0200 122.9120 O.2 142 SER142 -0.2777 2198 H 101.1940 108.8830 119.3120 H 142 SER142 0.1312 2199 HA 100.5220 111.4170 120.4970 H 142 SER142 0.0580 2200 HB1 99.0490 110.4180 118.8860 H 142 SER142 0.0577 2201 HB2 98.1810 110.6720 120.4040 H 142 SER142 0.0577 2202 HG 97.8410 108.5320 119.4790 H 142 SER142 0.2095 2203 N 100.5550 108.8510 122.5390 N.am 143 LEU143 -0.2456 2204 CA 100.5830 108.5440 123.9640 C.3 143 LEU143 0.0880 2205 CB 100.7260 107.0260 124.1830 C.3 143 LEU143 -0.0266 2206 CG 99.4480 106.2270 123.8850 C.3 143 LEU143 -0.0449 2207 CD1 99.7520 104.7280 123.7770 C.3 143 LEU143 -0.0626 2208 CD2 98.3490 106.4840 124.9270 C.3 143 LEU143 -0.0626 2209 C 101.7390 109.2480 124.6560 C.2 143 LEU143 0.2187 2210 O 101.5960 109.7130 125.7910 O.2 143 LEU143 -0.2778 2211 H 100.7310 108.1130 121.8580 H 143 LEU143 0.1312 2212 HA 99.6580 108.9190 124.4020 H 143 LEU143 0.0557 2213 HB1 101.0240 106.8140 125.2110 H 143 LEU143 0.0287 2214 HB2 101.5410 106.6610 123.5540 H 143 LEU143 0.0287 2215 HG 99.0750 106.5460 122.9190 H 143 LEU143 0.0296 2216 HD11 98.8540 104.1650 123.5190 H 143 LEU143 0.0232 2217 HD12 100.1360 104.3350 124.7180 H 143 LEU143 0.0232 2218 HD13 100.4950 104.5340 123.0030 H 143 LEU143 0.0232 2219 HD21 97.4600 105.8930 124.7090 H 143 LEU143 0.0232 2220 HD22 98.0420 107.5300 124.9420 H 143 LEU143 0.0232 2221 HD23 98.6870 106.2200 125.9300 H 143 LEU143 0.0232 2222 N 102.8870 109.3540 123.9860 N.am 144 LEU144 -0.2456 2223 CA 104.0040 110.0850 124.5710 C.3 144 LEU144 0.0880 2224 CB 105.2240 109.8580 123.6590 C.3 144 LEU144 -0.0266 2225 CG 106.5710 110.3850 124.2000 C.3 144 LEU144 -0.0449 2226 CD1 107.7340 109.6080 123.5670 C.3 144 LEU144 -0.0626 2227 CD2 106.7680 111.8900 123.9540 C.3 144 LEU144 -0.0626 2228 C 103.6670 111.5650 124.7150 C.2 144 LEU144 0.2187 2229 O 103.8900 112.1660 125.7730 O.2 144 LEU144 -0.2778 2230 H 102.9830 108.9240 123.0660 H 144 LEU144 0.1312 2231 HA 104.1870 109.6670 125.5630 H 144 LEU144 0.0557 2232 HB1 105.0370 110.2580 122.6620 H 144 LEU144 0.0287 2233 HB2 105.3120 108.7790 123.5200 H 144 LEU144 0.0287 2234 HG 106.6080 110.2030 125.2750 H 144 LEU144 0.0296 2235 HD11 108.6930 109.9460 123.9600 H 144 LEU144 0.0232 2236 HD12 107.7520 109.7400 122.4840 H 144 LEU144 0.0232 2237 HD13 107.6530 108.5410 123.7720 H 144 LEU144 0.0232 2238 HD21 107.7730 112.2010 124.2400 H 144 LEU144 0.0232 2239 HD22 106.0800 112.5020 124.5340 H 144 LEU144 0.0232 2240 HD23 106.6330 112.1380 122.9010 H 144 LEU144 0.0232 2241 N 103.1140 112.1700 123.6610 N.am 145 PHE145 -0.2453 2242 CA 102.8090 113.5960 123.7240 C.3 145 PHE145 0.0917 2243 CB 102.3560 114.0110 122.3090 C.3 145 PHE145 -0.0036 2244 CG 102.1650 115.4980 122.1310 C.ar 145 PHE145 -0.0454 2245 CD1 103.1720 116.2750 121.5650 C.ar 145 PHE145 -0.0585 2246 CD2 100.9650 116.1110 122.4820 C.ar 145 PHE145 -0.0585 2247 CE1 102.9800 117.6340 121.3500 C.ar 145 PHE145 -0.0615 2248 CE2 100.7750 117.4730 122.2830 C.ar 145 PHE145 -0.0615 2249 CZ 101.7830 118.2360 121.7110 C.ar 145 PHE145 -0.0617 2250 C 101.7030 113.8930 124.7290 C.2 145 PHE145 0.2190 2251 O 101.6530 114.9970 125.2820 O.2 145 PHE145 -0.2778 2252 H 102.9060 111.6380 122.8160 H 145 PHE145 0.1312 2253 HA 103.7180 114.1240 124.0170 H 145 PHE145 0.0560 2254 HB1 101.4280 113.5000 122.0470 H 145 PHE145 0.0333 2255 HB2 103.0930 113.6680 121.5820 H 145 PHE145 0.0333 2256 HD1 104.1060 115.8190 121.2730 H 145 PHE145 0.0620 2257 HD2 100.1690 115.5250 122.9190 H 145 PHE145 0.0620 2258 HE1 103.7640 118.2200 120.8930 H 145 PHE145 0.0618 2259 HE2 99.8420 117.9340 122.5700 H 145 PHE145 0.0618 2260 HZ 101.6350 119.2940 121.5470 H 145 PHE145 0.0618 2261 N 100.8120 112.9360 124.9780 N.am 146 CYS146 -0.2449 2262 CA 99.7180 113.1630 125.9100 C.3 146 CYS146 0.0965 2263 CB 98.4640 112.4530 125.3930 C.3 146 CYS146 0.0147 2264 SG 97.8820 113.1650 123.8350 S.3 146 CYS146 -0.1762 2265 C 100.0410 112.7270 127.3330 C.2 146 CYS146 0.2195 2266 O 99.3130 113.1000 128.2590 O.2 146 CYS146 -0.2778 2267 H 100.8970 112.0340 124.5100 H 146 CYS146 0.1312 2268 HA 99.5030 114.2330 125.9470 H 146 CYS146 0.0565 2269 HB1 97.6550 112.5460 126.1170 H 146 CYS146 0.0394 2270 HB2 98.6500 111.3870 125.2550 H 146 CYS146 0.0394 2271 HG 96.6040 112.8320 123.6650 H 146 CYS146 0.1017 2272 N 101.0990 111.9450 127.5290 N.am 147 SER147 -0.2436 2273 CA 101.6720 111.7350 128.8490 C.3 147 SER147 0.1109 2274 CB 102.2660 110.3220 128.9070 C.3 147 SER147 0.0681 2275 OG 101.2170 109.3660 128.8070 O.3 147 SER147 -0.3930 2276 C 102.7420 112.7630 129.1730 C.2 147 SER147 0.2209 2277 O 103.2540 112.7760 130.2950 O.2 147 SER147 -0.2777 2278 H 101.5220 111.4770 126.7270 H 147 SER147 0.1312 2279 HA 100.8820 111.8210 129.5960 H 147 SER147 0.0580 2280 HB1 102.7970 110.1760 129.8540 H 147 SER147 0.0577 2281 HB2 102.9860 110.1990 128.0880 H 147 SER147 0.0577 2282 HG 101.5600 108.4800 128.7240 H 147 SER147 0.2095 2283 N 103.1150 113.5940 128.2040 N.am 148 LEU148 -0.2456 2284 CA 103.9790 114.7370 128.4860 C.3 148 LEU148 0.0883 2285 CB 104.1630 115.5010 127.1600 C.3 148 LEU148 -0.0266 2286 CG 105.1880 116.6510 127.1790 C.3 148 LEU148 -0.0449 2287 CD1 105.8680 116.7890 125.8100 C.3 148 LEU148 -0.0626 2288 CD2 104.5400 117.9910 127.5640 C.3 148 LEU148 -0.0626 2289 C 103.4660 115.6300 129.6120 C.2 148 LEU148 0.2214 2290 O 104.2890 116.0480 130.4440 O.2 148 LEU148 -0.2776 2291 H 102.7930 113.4300 127.2500 H 148 LEU148 0.1312 2292 HA 104.9370 114.3210 128.8040 H 148 LEU148 0.0557 2293 HB1 103.2080 115.8860 126.8100 H 148 LEU148 0.0287 2294 HB2 104.4690 114.7680 126.4120 H 148 LEU148 0.0287 2295 HG 105.9660 116.4070 127.9030 H 148 LEU148 0.0296 2296 HD11 106.6080 117.5890 125.8170 H 148 LEU148 0.0232 2297 HD12 105.1390 117.0140 125.0300 H 148 LEU148 0.0232 2298 HD13 106.3800 115.8680 125.5300 H 148 LEU148 0.0232 2299 HD21 105.2860 118.7850 127.6130 H 148 LEU148 0.0232 2300 HD22 104.0480 117.9490 128.5330 H 148 LEU148 0.0232 2301 HD23 103.7890 118.2860 126.8310 H 148 LEU148 0.0232 2302 N 102.1730 115.9700 129.7090 N.am 149 PRO149 -0.2316 2303 CA 101.7210 116.7470 130.8760 C.3 149 PRO149 0.0907 2304 CD 101.1130 115.7450 128.7310 C.3 149 PRO149 0.0071 2305 CB 100.2940 117.1660 130.5040 C.3 149 PRO149 -0.0276 2306 CG 99.8380 116.1380 129.4750 C.3 149 PRO149 -0.0379 2307 C 101.7810 115.9750 132.1820 C.2 149 PRO149 0.2189 2308 O 101.7560 116.6000 133.2490 O.2 149 PRO149 -0.2778 2309 HA 102.3630 117.6220 130.9740 H 149 PRO149 0.0559 2310 HD1 101.0720 114.7210 128.4130 H 149 PRO149 0.0431 2311 HD2 101.3100 116.3970 127.8790 H 149 PRO149 0.0431 2312 HB1 100.3270 118.1440 130.0240 H 149 PRO149 0.0285 2313 HB2 99.6170 117.2450 131.3560 H 149 PRO149 0.0285 2314 HG1 99.4380 115.2640 129.9900 H 149 PRO149 0.0278 2315 HG2 99.0610 116.5150 128.8090 H 149 PRO149 0.0278 2316 N 101.8550 114.6420 132.1370 N.am 150 LEU150 -0.2456 2317 CA 102.0610 113.8630 133.3530 C.3 150 LEU150 0.0880 2318 CB 101.8470 112.3690 133.0400 C.3 150 LEU150 -0.0266 2319 CG 101.7600 111.4510 134.2780 C.3 150 LEU150 -0.0449 2320 CD1 100.6380 110.4150 134.1180 C.3 150 LEU150 -0.0626 2321 CD2 103.0920 110.7340 134.5480 C.3 150 LEU150 -0.0626 2322 C 103.4220 114.1400 133.9800 C.2 150 LEU150 0.2187 2323 O 103.6360 113.8060 135.1500 O.2 150 LEU150 -0.2778 2324 H 101.7660 114.1630 131.2410 H 150 LEU150 0.1312 2325 HA 101.3010 114.1920 134.0630 H 150 LEU150 0.0557 2326 HB1 102.6270 111.9980 132.3790 H 150 LEU150 0.0287 2327 HB2 100.9210 112.2890 132.4680 H 150 LEU150 0.0287 2328 HG 101.5160 112.0600 135.1500 H 150 LEU150 0.0296 2329 HD11 100.5640 109.7770 134.9990 H 150 LEU150 0.0232 2330 HD12 100.8160 109.7730 133.2540 H 150 LEU150 0.0232 2331 HD13 99.6720 110.9010 133.9790 H 150 LEU150 0.0232 2332 HD21 103.0340 110.1310 135.4540 H 150 LEU150 0.0232 2333 HD22 103.9160 111.4350 134.6750 H 150 LEU150 0.0232 2334 HD23 103.3540 110.0710 133.7230 H 150 LEU150 0.0232 2335 N 104.3360 114.7600 133.2380 N.am 151 LEU151 -0.2456 2336 CA 105.6680 115.0970 133.7310 C.3 151 LEU151 0.0880 2337 CB 106.6620 114.8510 132.5790 C.3 151 LEU151 -0.0266 2338 CG 106.5410 113.4700 131.9040 C.3 151 LEU151 -0.0449 2339 CD1 107.4990 113.3730 130.7100 C.3 151 LEU151 -0.0626 2340 CD2 106.7820 112.3230 132.8940 C.3 151 LEU151 -0.0626 2341 C 105.7460 116.5470 134.1880 C.2 151 LEU151 0.2187 2342 O 106.7570 117.2220 133.9700 O.2 151 LEU151 -0.2778 2343 H 104.0940 115.0120 132.2790 H 151 LEU151 0.1312 2344 HA 105.9080 114.4590 134.5820 H 151 LEU151 0.0557 2345 HB1 107.6830 114.9930 132.9380 H 151 LEU151 0.0287 2346 HB2 106.5020 115.6080 131.8130 H 151 LEU151 0.0287 2347 HG 105.5340 113.3590 131.5010 H 151 LEU151 0.0296 2348 HD11 107.3930 112.4170 130.1980 H 151 LEU151 0.0232 2349 HD12 108.5370 113.4710 131.0290 H 151 LEU151 0.0232 2350 HD13 107.2970 114.1610 129.9840 H 151 LEU151 0.0232 2351 HD21 106.7140 111.3560 132.3950 H 151 LEU151 0.0232 2352 HD22 106.0410 112.3270 133.6940 H 151 LEU151 0.0232 2353 HD23 107.7690 112.3970 133.3500 H 151 LEU151 0.0232 2354 N 104.6660 117.0520 134.7930 N.am 152 ASP152 -0.2451 2355 CA 104.6210 118.3780 135.4110 C.3 152 ASP152 0.0974 2356 CB 105.4350 118.6420 136.6940 C.3 152 ASP152 0.0576 2357 CG 104.9240 119.9200 137.4330 C.2 152 ASP152 0.1780 2358 OD1 103.7840 120.3480 137.2120 O.co2 152 ASP152 -0.6478 2359 OD2 105.6730 120.4860 138.2250 O.co2 152 ASP152 -0.6478 2360 C 104.7290 119.5020 134.3840 C.2 152 ASP152 0.2192 2361 O 105.4350 120.4880 134.6100 O.2 152 ASP152 -0.2778 2362 H 103.8230 116.4790 134.8260 H 152 ASP152 0.1312 2363 HA 103.5760 118.4090 135.7200 H 152 ASP152 0.0563 2364 HB1 106.4940 118.7600 136.4660 H 152 ASP152 0.0394 2365 HB2 105.3400 117.8040 137.3810 H 152 ASP152 0.0394 2366 N 104.0310 119.3790 133.2550 N.am 153 TYR153 -0.2453 2367 CA 104.1520 120.3390 132.1620 C.3 153 TYR153 0.0917 2368 CB 104.7940 119.6910 130.9190 C.3 153 TYR153 -0.0036 2369 CG 106.2370 119.2620 131.1010 C.ar 153 TYR153 -0.0453 2370 CD1 107.1500 120.0030 131.8530 C.ar 153 TYR153 -0.0561 2371 CD2 106.6990 118.1200 130.4540 C.ar 153 TYR153 -0.0561 2372 CE1 108.4710 119.5900 131.9800 C.ar 153 TYR153 -0.0317 2373 CE2 108.0170 117.7040 130.5760 C.ar 153 TYR153 -0.0317 2374 CZ 108.9060 118.4400 131.3430 C.ar 153 TYR153 0.0726 2375 OH 110.2210 118.0370 131.4580 O.3 153 TYR153 -0.3598 2376 C 102.8440 121.0560 131.8400 C.2 153 TYR153 0.2188 2377 O 102.8440 122.2750 131.6510 O.2 153 TYR153 -0.2778 2378 H 103.3930 118.5900 133.1510 H 153 TYR153 0.1312 2379 HA 104.7870 121.1580 132.4960 H 153 TYR153 0.0560 2380 HB1 104.7680 120.3850 130.0790 H 153 TYR153 0.0333 2381 HB2 104.2040 118.8250 130.6250 H 153 TYR153 0.0333 2382 HD1 106.8570 120.9050 132.3660 H 153 TYR153 0.0621 2383 HD2 106.0270 117.5390 129.8460 H 153 TYR153 0.0621 2384 HE1 109.1620 120.1610 132.5830 H 153 TYR153 0.0643 2385 HE2 108.3500 116.8080 130.0760 H 153 TYR153 0.0643 2386 HH 110.2960 117.1320 131.1880 H 153 TYR153 0.2173 2387 N 101.7240 120.3280 131.7690 N.am 154 GLY154 -0.2485 2388 CA 100.4560 120.9200 131.4030 C.3 154 GLY154 0.0765 2389 C 99.4300 120.7940 132.5170 C.2 154 GLY154 0.2155 2390 O 99.6240 120.0640 133.4920 O.2 154 GLY154 -0.2781 2391 H 101.7650 119.3310 131.9780 H 154 GLY154 0.1309 2392 HA1 100.0990 120.3840 130.5250 H 154 GLY154 0.0521 2393 HA2 100.5750 121.9710 131.1350 H 154 GLY154 0.0521 2394 N 98.3260 121.5220 132.3480 N.am 155 GLN155 -0.2459 2395 CA 97.2200 121.5070 133.2990 C.3 155 GLN155 0.0882 2396 CB 97.3270 122.6970 134.2760 C.3 155 GLN155 -0.0210 2397 CG 98.5480 122.6470 135.2190 C.3 155 GLN155 0.0225 2398 CD 99.8520 123.1210 134.5540 C.2 155 GLN155 0.1981 2399 OE1 99.8920 124.1210 133.8440 O.2 155 GLN155 -0.2798 2400 NE2 100.9110 122.3390 134.8230 N.am 155 GLN155 -0.2724 2401 C 95.9000 121.5520 132.5430 C.2 155 GLN155 0.2187 2402 O 95.7770 122.2710 131.5480 O.2 155 GLN155 -0.2778 2403 H 98.2520 122.1130 131.5200 H 155 GLN155 0.1312 2404 HA 97.2550 120.5640 133.8490 H 155 GLN155 0.0557 2405 HB1 96.4340 122.7010 134.9020 H 155 GLN155 0.0289 2406 HB2 97.3050 123.6410 133.7280 H 155 GLN155 0.0289 2407 HG1 98.6830 121.6400 135.6160 H 155 GLN155 0.0356 2408 HG2 98.3760 123.2980 136.0760 H 155 GLN155 0.0356 2409 HE21 101.8060 122.4830 134.4040 H 155 GLN155 0.1266 2410 HE22 100.8390 121.5590 135.4480 H 155 GLN155 0.1266 2411 N 94.9230 120.7840 133.0160 N.am 156 TYR156 -0.2453 2412 CA 93.6030 120.7270 132.4080 C.3 156 TYR156 0.0917 2413 CB 93.0680 119.2850 132.4360 C.3 156 TYR156 -0.0036 2414 CG 93.9220 118.3410 131.6260 C.ar 156 TYR156 -0.0453 2415 CD1 94.0320 118.4980 130.2460 C.ar 156 TYR156 -0.0561 2416 CD2 94.5950 117.2840 132.2360 C.ar 156 TYR156 -0.0561 2417 CE1 94.7950 117.6160 129.4900 C.ar 156 TYR156 -0.0317 2418 CE2 95.3600 116.4020 131.4800 C.ar 156 TYR156 -0.0317 2419 CZ 95.4590 116.5680 130.1070 C.ar 156 TYR156 0.0726 2420 OH 96.2160 115.6990 129.3480 O.3 156 TYR156 -0.3598 2421 C 92.6400 121.6900 133.1010 C.2 156 TYR156 0.2190 2422 O 92.8440 122.0930 134.2480 O.2 156 TYR156 -0.2778 2423 H 95.1070 120.2110 133.8400 H 156 TYR156 0.1312 2424 HA 93.6910 121.0570 131.3700 H 156 TYR156 0.0560 2425 HB1 92.0570 119.2490 132.0290 H 156 TYR156 0.0333 2426 HB2 93.0020 118.9340 133.4660 H 156 TYR156 0.0333 2427 HD1 93.5120 119.3030 129.7490 H 156 TYR156 0.0621 2428 HD2 94.5260 117.1410 133.3040 H 156 TYR156 0.0621 2429 HE1 94.8700 117.7350 128.4200 H 156 TYR156 0.0643 2430 HE2 95.8790 115.5850 131.9590 H 156 TYR156 0.0643 2431 HH 96.6320 115.0530 129.9060 H 156 TYR156 0.2173 2432 N 91.5740 122.0460 132.3880 N.am 157 VAL157 -0.2454 2433 CA 90.5990 123.0240 132.8630 C.3 157 VAL157 0.0901 2434 CB 91.0260 124.4540 132.4380 C.3 157 VAL157 -0.0227 2435 CG1 89.8930 125.3730 131.9310 C.3 157 VAL157 -0.0608 2436 CG2 91.7380 125.1520 133.5960 C.3 157 VAL157 -0.0608 2437 C 89.2270 122.6550 132.3100 C.2 157 VAL157 0.2189 2438 O 89.1070 122.1710 131.1790 O.2 157 VAL157 -0.2778 2439 H 91.4320 121.6180 131.4730 H 157 VAL157 0.1312 2440 HA 90.5360 122.9360 133.9500 H 157 VAL157 0.0560 2441 HB 91.7310 124.3600 131.6110 H 157 VAL157 0.0315 2442 HG11 90.2830 126.3500 131.6440 H 157 VAL157 0.0233 2443 HG12 89.1380 125.5340 132.7010 H 157 VAL157 0.0233 2444 HG13 89.4000 124.9640 131.0500 H 157 VAL157 0.0233 2445 HG21 91.9490 126.1780 133.3190 H 157 VAL157 0.0233 2446 HG22 92.6710 124.6570 133.8610 H 157 VAL157 0.0233 2447 HG23 91.1080 125.1800 134.4860 H 157 VAL157 0.0233 2448 N 88.1940 122.8700 133.1270 N.am 158 GLN158 -0.2456 2449 CA 86.8090 122.6690 132.7210 C.3 158 GLN158 0.0882 2450 CB 85.9370 122.2390 133.9220 C.3 158 GLN158 -0.0210 2451 CG 85.9830 123.1400 135.1750 C.3 158 GLN158 0.0225 2452 CD 85.2170 124.4640 135.0250 C.2 158 GLN158 0.1981 2453 OE1 84.3350 124.6180 134.1940 O.2 158 GLN158 -0.2798 2454 NE2 85.6130 125.4110 135.8880 N.am 158 GLN158 -0.2724 2455 C 86.2730 123.9150 132.0280 C.2 158 GLN158 0.2187 2456 O 86.5830 125.0430 132.4210 O.2 158 GLN158 -0.2778 2457 H 88.3820 123.1890 134.0770 H 158 GLN158 0.1312 2458 HA 86.7970 121.8700 131.9790 H 158 GLN158 0.0557 2459 HB1 86.2760 121.2500 134.2310 H 158 GLN158 0.0289 2460 HB2 84.9040 122.0960 133.6000 H 158 GLN158 0.0289 2461 HG1 87.0100 123.3510 135.4690 H 158 GLN158 0.0356 2462 HG2 85.5260 122.6090 136.0100 H 158 GLN158 0.0356 2463 HE21 85.1600 126.3010 135.8710 H 158 GLN158 0.1266 2464 HE22 86.3400 125.2450 136.5530 H 158 GLN158 0.1266 2465 N 85.4580 123.7040 131.0000 N.am 159 TYR159 -0.2453 2466 CA 84.9580 124.7860 130.1670 C.3 159 TYR159 0.0917 2467 CB 85.1420 124.3940 128.6880 C.3 159 TYR159 -0.0036 2468 CG 86.5620 124.6580 128.2620 C.ar 159 TYR159 -0.0453 2469 CD1 87.5880 123.7920 128.6300 C.ar 159 TYR159 -0.0561 2470 CD2 86.8770 125.8190 127.5610 C.ar 159 TYR159 -0.0561 2471 CE1 88.9110 124.1080 128.3500 C.ar 159 TYR159 -0.0317 2472 CE2 88.1970 126.1280 127.2650 C.ar 159 TYR159 -0.0317 2473 CZ 89.2160 125.2820 127.6790 C.ar 159 TYR159 0.0726 2474 OH 90.5330 125.6110 127.4430 O.3 159 TYR159 -0.3598 2475 C 83.5120 125.1240 130.5170 C.2 159 TYR159 0.2190 2476 O 82.8830 124.4920 131.3670 O.2 159 TYR159 -0.2778 2477 H 85.1730 122.7480 130.7870 H 159 TYR159 0.1312 2478 HA 85.5470 125.6790 130.3500 H 159 TYR159 0.0560 2479 HB1 84.4830 124.9620 128.0290 H 159 TYR159 0.0333 2480 HB2 84.8930 123.3440 128.5300 H 159 TYR159 0.0333 2481 HD1 87.3620 122.8840 129.1670 H 159 TYR159 0.0621 2482 HD2 86.0950 126.4950 127.2430 H 159 TYR159 0.0621 2483 HE1 89.7080 123.4530 128.6670 H 159 TYR159 0.0643 2484 HE2 88.4280 127.0350 126.7260 H 159 TYR159 0.0643 2485 HH 90.5740 126.3680 126.8730 H 159 TYR159 0.2173 2486 N 82.9900 126.1470 129.8410 N.am 160 CYS160 -0.2448 2487 CA 81.7080 126.7260 130.2410 C.3 160 CYS160 0.0967 2488 CB 81.4890 128.0700 129.5230 C.3 160 CYS160 0.0147 2489 SG 79.9780 128.9360 130.0210 S.3 160 CYS160 -0.1762 2490 C 80.5330 125.7680 130.0810 C.2 160 CYS160 0.2221 2491 O 79.7180 125.6780 131.0150 O.2 160 CYS160 -0.2775 2492 H 83.4890 126.5300 129.0380 H 160 CYS160 0.1312 2493 HA 81.7900 126.9290 131.3100 H 160 CYS160 0.0565 2494 HB1 81.4740 127.9530 128.4420 H 160 CYS160 0.0394 2495 HB2 82.3360 128.7240 129.7290 H 160 CYS160 0.0394 2496 HG 79.8920 130.0950 129.3600 H 160 CYS160 0.1017 2497 N 80.3640 125.0470 128.9650 N.am 161 PRO161 -0.2315 2498 CA 79.2810 124.0480 128.9090 C.3 161 PRO161 0.0907 2499 CD 81.1640 125.1150 127.7450 C.3 161 PRO161 0.0071 2500 CB 79.4330 123.4400 127.5050 C.3 161 PRO161 -0.0276 2501 CG 80.2420 124.4680 126.7140 C.3 161 PRO161 -0.0379 2502 C 79.3690 122.9900 129.9950 C.2 161 PRO161 0.2187 2503 O 78.3710 122.3030 130.2440 O.2 161 PRO161 -0.2778 2504 HA 78.3390 124.5890 129.0060 H 161 PRO161 0.0559 2505 HD1 82.0640 124.5220 127.9110 H 161 PRO161 0.0431 2506 HD2 81.4240 126.1360 127.4800 H 161 PRO161 0.0431 2507 HB1 78.4730 123.2150 127.0380 H 161 PRO161 0.0285 2508 HB2 79.9970 122.5080 127.5420 H 161 PRO161 0.0285 2509 HG1 80.7730 124.0330 125.8710 H 161 PRO161 0.0278 2510 HG2 79.5800 125.2270 126.3060 H 161 PRO161 0.0278 2511 N 80.5200 122.8360 130.6410 N.am 162 GLY162 -0.2485 2512 CA 80.6870 121.9460 131.7760 C.3 162 GLY162 0.0765 2513 C 81.0540 120.5190 131.4420 C.2 162 GLY162 0.2156 2514 O 81.8300 119.8920 132.1650 O.2 162 GLY162 -0.2781 2515 H 81.3280 123.3710 130.3230 H 162 GLY162 0.1309 2516 HA1 79.7700 121.9550 132.3670 H 162 GLY162 0.0521 2517 HA2 81.4800 122.3760 132.3880 H 162 GLY162 0.0521 2518 N 80.5170 119.9920 130.3440 N.am 163 THR163 -0.2436 2519 CA 80.6340 118.5790 130.0180 C.3 163 THR163 0.1135 2520 CB 79.3130 118.2240 129.3060 C.3 163 THR163 0.0763 2521 OG1 79.1410 119.1260 128.2240 O.3 163 THR163 -0.3900 2522 CG2 78.1200 118.2990 130.2820 C.3 163 THR163 -0.0370 2523 C 81.8920 118.2440 129.2260 C.2 163 THR163 0.2212 2524 O 81.9800 117.1450 128.6680 O.2 163 THR163 -0.2777 2525 H 80.0040 120.6020 129.7070 H 163 THR163 0.1312 2526 HA 80.6930 118.0180 130.9520 H 163 THR163 0.0583 2527 HB 79.3640 117.2060 128.9260 H 163 THR163 0.0611 2528 HG1 78.2420 119.1000 127.9080 H 163 THR163 0.2098 2529 HG21 77.2020 117.9200 129.8320 H 163 THR163 0.0255 2530 HG22 77.9330 119.3220 130.6110 H 163 THR163 0.0255 2531 HG23 78.3050 117.6970 131.1710 H 163 THR163 0.0255 2532 N 82.8660 119.1490 129.1650 N.am 164 TRP164 -0.2453 2533 CA 84.0910 118.8690 128.4260 C.3 164 TRP164 0.0918 2534 CB 83.8870 119.0790 126.9100 C.3 164 TRP164 -0.0021 2535 CG 83.7890 120.5410 126.5330 C.ar 164 TRP164 -0.0260 2536 CD2 84.8170 121.3580 125.9340 C.ar 164 TRP164 -0.0028 2537 CD1 82.6680 121.3580 126.6900 C.ar 164 TRP164 -0.0136 2538 NE1 82.9610 122.5990 126.2300 N.ar 164 TRP164 -0.2641 2539 CE2 84.2560 122.6400 125.7370 C.ar 164 TRP164 0.0269 2540 CE3 86.1130 121.1140 125.5620 C.ar 164 TRP164 -0.0528 2541 CZ2 84.9980 123.6350 125.1630 C.ar 164 TRP164 -0.0430 2542 CZ3 86.8760 122.1280 124.9790 C.ar 164 TRP164 -0.0611 2543 CH2 86.3160 123.3890 124.7780 C.ar 164 TRP164 -0.0602 2544 C 85.2350 119.6910 129.0000 C.2 164 TRP164 0.2190 2545 O 85.0910 120.8970 129.2140 O.2 164 TRP164 -0.2778 2546 H 82.7550 120.0450 129.6390 H 164 TRP164 0.1312 2547 HA 84.3310 117.8190 128.6060 H 164 TRP164 0.0560 2548 HB1 82.9830 118.5680 126.5800 H 164 TRP164 0.0334 2549 HB2 84.7060 118.6350 126.3490 H 164 TRP164 0.0334 2550 HD1 81.7240 121.0390 127.1090 H 164 TRP164 0.0748 2551 HE1 82.3550 123.3650 126.2250 H 164 TRP164 0.1331 2552 HE3 86.5450 120.1370 125.7180 H 164 TRP164 0.0624 2553 HZ2 84.5650 124.6150 125.0190 H 164 TRP164 0.0633 2554 HZ3 87.8950 121.9380 124.6790 H 164 TRP164 0.0618 2555 HH2 86.9040 124.1810 124.3370 H 164 TRP164 0.0618 2556 N 86.3630 119.0330 129.2530 N.am 165 CYS165 -0.2449 2557 CA 87.5650 119.6700 129.7690 C.3 165 CYS165 0.0965 2558 CB 87.9940 119.0390 131.0920 C.3 165 CYS165 0.0147 2559 SG 86.7720 119.3590 132.3850 S.3 165 CYS165 -0.1762 2560 C 88.6740 119.5740 128.7300 C.2 165 CYS165 0.2195 2561 O 88.6570 118.6940 127.8650 O.2 165 CYS165 -0.2778 2562 H 86.3870 118.0290 129.0760 H 165 CYS165 0.1312 2563 HA 87.3600 120.7290 129.9280 H 165 CYS165 0.0565 2564 HB1 88.9470 119.4600 131.4170 H 165 CYS165 0.0394 2565 HB2 88.1440 117.9650 130.9800 H 165 CYS165 0.0394 2566 HG 87.3810 119.3700 133.5720 H 165 CYS165 0.1017 2567 N 89.6410 120.4850 128.8170 N.am 166 PHE166 -0.2453 2568 CA 90.7140 120.5300 127.8270 C.3 166 PHE166 0.0917 2569 CB 90.1800 121.1340 126.5060 C.3 166 PHE166 -0.0036 2570 CG 90.9700 120.7010 125.2970 C.ar 166 PHE166 -0.0454 2571 CD1 90.9450 119.3720 124.8800 C.ar 166 PHE166 -0.0585 2572 CD2 91.7440 121.6160 124.5880 C.ar 166 PHE166 -0.0585 2573 CE1 91.6950 118.9610 123.7860 C.ar 166 PHE166 -0.0615 2574 CE2 92.5010 121.2050 123.4980 C.ar 166 PHE166 -0.0615 2575 CZ 92.4770 119.8770 123.0970 C.ar 166 PHE166 -0.0617 2576 C 91.9040 121.2920 128.4000 C.2 166 PHE166 0.2190 2577 O 91.8800 121.7570 129.5410 O.2 166 PHE166 -0.2778 2578 H 89.6320 121.1580 129.5830 H 166 PHE166 0.1312 2579 HA 91.0380 119.5010 127.6710 H 166 PHE166 0.0560 2580 HB1 90.1350 122.2220 126.5600 H 166 PHE166 0.0333 2581 HB2 89.1540 120.8050 126.3430 H 166 PHE166 0.0333 2582 HD1 90.3460 118.6490 125.4160 H 166 PHE166 0.0620 2583 HD2 91.7750 122.6520 124.8970 H 166 PHE166 0.0620 2584 HE1 91.6790 117.9270 123.4750 H 166 PHE166 0.0618 2585 HE2 93.1070 121.9210 122.9610 H 166 PHE166 0.0618 2586 HZ 93.0680 119.5520 122.2530 H 166 PHE166 0.0618 2587 N 92.9530 121.4220 127.5820 N.am 167 ILE167 -0.2454 2588 CA 94.1820 122.0750 128.0190 C.3 167 ILE167 0.0903 2589 CB 95.2380 121.9910 126.8840 C.3 167 ILE167 -0.0201 2590 CG1 95.8170 120.5660 126.7340 C.3 167 ILE167 -0.0514 2591 CG2 96.4050 122.9810 127.0760 C.3 167 ILE167 -0.0605 2592 CD1 94.8650 119.5190 126.1440 C.3 167 ILE167 -0.0650 2593 C 93.8950 123.5050 128.4560 C.2 167 ILE167 0.2189 2594 O 93.1140 124.2280 127.8240 O.2 167 ILE167 -0.2778 2595 H 92.8930 121.0570 126.6320 H 167 ILE167 0.1312 2596 HA 94.5360 121.5240 128.8920 H 167 ILE167 0.0560 2597 HB 94.7520 122.2610 125.9450 H 167 ILE167 0.0318 2598 HG11 96.1910 120.2170 127.6970 H 167 ILE167 0.0266 2599 HG12 96.6850 120.6110 126.0750 H 167 ILE167 0.0266 2600 HG21 97.1570 122.8610 126.2950 H 167 ILE167 0.0233 2601 HG22 96.8950 122.8330 128.0380 H 167 ILE167 0.0233 2602 HG23 96.0680 124.0160 127.0240 H 167 ILE167 0.0233 2603 HD11 95.3980 118.5870 125.9570 H 167 ILE167 0.0230 2604 HD12 94.4540 119.8540 125.1930 H 167 ILE167 0.0230 2605 HD13 94.0380 119.2810 126.8100 H 167 ILE167 0.0230 2606 N 94.5260 123.9160 129.5550 N.am 168 ARG168 -0.2456 2607 CA 94.2960 125.2410 130.1140 C.3 168 ARG168 0.0879 2608 CB 94.7150 125.5430 131.5890 C.3 168 ARG168 -0.0258 2609 CG 94.2480 126.9990 131.8850 C.3 168 ARG168 -0.0154 2610 CD 94.2210 127.7190 133.2360 C.3 168 ARG168 0.1045 2611 NE 93.9670 129.1590 132.9770 N.pl3 168 ARG168 -0.4450 2612 CZ 93.0220 129.7380 132.2010 C.cat 168 ARG168 0.5062 2613 NH1 92.0260 129.1020 131.6470 N.pl3 168 ARG168 -0.4573 2614 NH2 93.0770 131.0150 131.9580 N.pl3 168 ARG168 -0.4573 2615 C 94.7860 126.3290 129.1660 C.2 168 ARG168 0.2187 2616 O 95.8130 126.1780 128.4980 O.2 168 ARG168 -0.2778 2617 H 95.1850 123.2880 130.0150 H 168 ARG168 0.1312 2618 HA 93.2060 125.3220 130.1010 H 168 ARG168 0.0557 2619 HB1 95.7930 125.4430 131.7180 H 168 ARG168 0.0286 2620 HB2 94.2400 124.8290 132.2600 H 168 ARG168 0.0286 2621 HG1 93.2430 127.0590 131.4840 H 168 ARG168 0.0299 2622 HG2 94.9030 127.6480 131.3130 H 168 ARG168 0.0299 2623 HD1 95.1980 127.6530 133.7190 H 168 ARG168 0.0711 2624 HD2 93.4790 127.3570 133.9450 H 168 ARG168 0.0711 2625 HE 94.5730 129.8400 133.3790 H 168 ARG168 0.3153 2626 HH11 91.4080 129.6190 131.0250 H 168 ARG168 0.3114 2627 HH12 91.8620 128.1390 131.8050 H 168 ARG168 0.3114 2628 HH21 92.3620 131.3770 131.3430 H 168 ARG168 0.3114 2629 HH22 93.7730 131.6160 132.3290 H 168 ARG168 0.3114 2630 N 94.0330 127.4250 129.1030 N.am 169 HIS169 -0.2453 2631 CA 94.4750 128.6050 128.3720 C.3 169 HIS169 0.0932 2632 ND1 94.4100 131.8800 127.5910 N.ar 169 HIS169 -0.2469 2633 CG 93.7520 130.7340 127.3110 C.ar 169 HIS169 0.0551 2634 CB 93.3890 129.6870 128.3420 C.3 169 HIS169 0.0146 2635 NE2 93.9980 131.8380 125.3990 N.ar 169 HIS169 -0.2539 2636 CD2 93.5090 130.6930 125.9280 C.ar 169 HIS169 0.0047 2637 CE1 94.5370 132.5280 126.4210 C.ar 169 HIS169 0.0737 2638 C 95.7820 129.1290 128.9520 C.2 169 HIS169 0.2188 2639 O 95.8570 129.4750 130.1340 O.2 169 HIS169 -0.2778 2640 H 93.1290 127.4390 129.5760 H 169 HIS169 0.1312 2641 HA 94.6580 128.2600 127.3520 H 169 HIS169 0.0561 2642 HB1 93.2690 130.1580 129.3150 H 169 HIS169 0.0348 2643 HB2 92.4250 129.2540 128.0740 H 169 HIS169 0.0348 2644 HE2 93.9690 132.1030 124.4550 H 169 HIS169 0.1339 2645 HD2 93.0070 129.9020 125.3910 H 169 HIS169 0.0764 2646 HE1 95.0190 133.4900 126.3150 H 169 HIS169 0.0963 2647 N 96.8110 129.1860 128.1100 N.am 170 GLY170 -0.2485 2648 CA 98.0860 129.7920 128.4330 C.3 170 GLY170 0.0765 2649 C 98.7710 129.2040 129.6600 C.2 170 GLY170 0.2155 2650 O 98.5920 128.0380 130.0240 O.2 170 GLY170 -0.2781 2651 H 96.6950 128.7790 127.1820 H 170 GLY170 0.1309 2652 HA1 97.9100 130.8600 128.5710 H 170 GLY170 0.0521 2653 HA2 98.7300 129.6550 127.5640 H 170 GLY170 0.0521 2654 N 99.5960 130.0540 130.2780 N.am 171 ARG171 -0.2459 2655 CA 100.4020 129.7460 131.4590 C.3 171 ARG171 0.0879 2656 CB 99.5740 129.1940 132.6630 C.3 171 ARG171 -0.0258 2657 CG 100.3740 128.8640 133.9650 C.3 171 ARG171 -0.0154 2658 CD 100.7420 127.3670 134.1700 C.3 171 ARG171 0.1045 2659 NE 101.5830 127.1540 135.3620 N.pl3 171 ARG171 -0.4450 2660 CZ 102.3010 126.0440 135.6090 C.cat 171 ARG171 0.5062 2661 NH1 102.3370 125.0340 134.7860 N.pl3 171 ARG171 -0.4573 2662 NH2 102.9990 125.9400 136.7090 N.pl3 171 ARG171 -0.4573 2663 C 101.5160 128.7580 131.1290 C.2 171 ARG171 0.2187 2664 O 102.3850 128.4920 131.9660 O.2 171 ARG171 -0.2778 2665 H 99.6700 130.9960 129.8940 H 171 ARG171 0.1312 2666 HA 100.8770 130.6860 131.7390 H 171 ARG171 0.0557 2667 HB1 99.0060 128.3110 132.3720 H 171 ARG171 0.0286 2668 HB2 98.8240 129.9470 132.9040 H 171 ARG171 0.0286 2669 HG1 99.7750 129.1710 134.8220 H 171 ARG171 0.0299 2670 HG2 101.2730 129.4800 134.0100 H 171 ARG171 0.0299 2671 HD1 101.2950 126.9850 133.3210 H 171 ARG171 0.0711 2672 HD2 99.8440 126.7550 134.2810 H 171 ARG171 0.0711 2673 HE 101.6460 127.8670 136.0560 H 171 ARG171 0.3153 2674 HH11 102.9200 124.2460 134.9910 H 171 ARG171 0.3114 2675 HH12 101.7800 125.0270 133.9590 H 171 ARG171 0.3114 2676 HH21 103.5070 125.0930 136.8850 H 171 ARG171 0.3114 2677 HH22 103.0350 126.6770 137.3760 H 171 ARG171 0.3114 2678 N 101.5100 128.2390 129.9020 N.am 172 THR172 -0.2434 2679 CA 102.5410 127.3520 129.3820 C.3 172 THR172 0.1135 2680 CB 102.1970 125.8690 129.6740 C.3 172 THR172 0.0763 2681 OG1 101.0170 125.5200 128.9680 O.3 172 THR172 -0.3900 2682 CG2 102.0310 125.5850 131.1740 C.3 172 THR172 -0.0370 2683 C 102.6250 127.5550 127.8770 C.2 172 THR172 0.2212 2684 O 101.7690 128.2030 127.2690 O.2 172 THR172 -0.2777 2685 H 100.7320 128.4790 129.2870 H 172 THR172 0.1313 2686 HA 103.4950 127.6380 129.8270 H 172 THR172 0.0583 2687 HB 103.0170 125.2470 129.2990 H 172 THR172 0.0611 2688 HG1 100.6430 124.7160 129.3150 H 172 THR172 0.2098 2689 HG21 102.0010 124.5180 131.3860 H 172 THR172 0.0255 2690 HG22 101.0920 126.0050 131.5290 H 172 THR172 0.0255 2691 HG23 102.8550 126.0040 131.7520 H 172 THR172 0.0255 2692 N 103.6720 126.9900 127.2780 N.am 173 ALA173 -0.2458 2693 CA 103.7820 126.9070 125.8290 C.3 173 ALA173 0.0850 2694 CB 105.2620 127.0420 125.4500 C.3 173 ALA173 -0.0411 2695 C 103.2070 125.6070 125.2830 C.2 173 ALA173 0.2184 2696 O 103.5740 125.1890 124.1790 O.2 173 ALA173 -0.2778 2697 H 104.4200 126.6030 127.8530 H 173 ALA173 0.1312 2698 HA 103.2240 127.7340 125.3850 H 173 ALA173 0.0554 2699 HB1 105.3980 127.0480 124.3680 H 173 ALA173 0.0249 2700 HB2 105.8550 126.2230 125.8590 H 173 ALA173 0.0249 2701 HB3 105.6750 127.9750 125.8350 H 173 ALA173 0.0249 2702 N 102.3130 124.9610 126.0340 N.am 174 TYR174 -0.2453 2703 CA 101.7890 123.6580 125.6430 C.3 174 TYR174 0.0917 2704 CB 101.2200 122.9420 126.8830 C.3 174 TYR174 -0.0036 2705 CG 100.7890 121.5070 126.6720 C.ar 174 TYR174 -0.0453 2706 CD1 101.5240 120.6200 125.8830 C.ar 174 TYR174 -0.0561 2707 CD2 99.6610 121.0270 127.3350 C.ar 174 TYR174 -0.0561 2708 CE1 101.1230 119.2960 125.7430 C.ar 174 TYR174 -0.0317 2709 CE2 99.2670 119.7010 127.2050 C.ar 174 TYR174 -0.0317 2710 CZ 99.9930 118.8370 126.4020 C.ar 174 TYR174 0.0726 2711 OH 99.5990 117.5220 126.2630 O.3 174 TYR174 -0.3598 2712 C 100.7330 123.7840 124.5530 C.2 174 TYR174 0.2190 2713 O 100.8120 123.1060 123.5200 O.2 174 TYR174 -0.2778 2714 H 101.9890 125.3880 126.9010 H 174 TYR174 0.1312 2715 HA 102.6300 123.0960 125.2350 H 174 TYR174 0.0560 2716 HB1 100.3570 123.5030 127.2380 H 174 TYR174 0.0333 2717 HB2 101.9600 122.9540 127.6830 H 174 TYR174 0.0333 2718 HD1 102.4180 120.9410 125.3710 H 174 TYR174 0.0621 2719 HD2 99.0820 121.6860 127.9660 H 174 TYR174 0.0621 2720 HE1 101.6930 118.6140 125.1290 H 174 TYR174 0.0643 2721 HE2 98.3940 119.3380 127.7260 H 174 TYR174 0.0643 2722 HH 98.7870 117.3740 126.7290 H 174 TYR174 0.2173 2723 N 99.7290 124.6350 124.7730 N.am 175 LEU175 -0.2456 2724 CA 98.7020 124.8380 123.7580 C.3 175 LEU175 0.0880 2725 CB 97.6280 125.7940 124.3070 C.3 175 LEU175 -0.0266 2726 CG 96.4250 126.0200 123.3670 C.3 175 LEU175 -0.0449 2727 CD1 95.6770 124.7140 123.0630 C.3 175 LEU175 -0.0626 2728 CD2 95.4660 127.0610 123.9610 C.3 175 LEU175 -0.0626 2729 C 99.3120 125.3630 122.4650 C.2 175 LEU175 0.2187 2730 O 98.8480 125.0240 121.3700 O.2 175 LEU175 -0.2778 2731 H 99.6800 125.1460 125.6550 H 175 LEU175 0.1312 2732 HA 98.2690 123.8570 123.5580 H 175 LEU175 0.0557 2733 HB1 98.0890 126.7550 124.5380 H 175 LEU175 0.0287 2734 HB2 97.2620 125.4050 125.2580 H 175 LEU175 0.0287 2735 HG 96.7890 126.4260 122.4220 H 175 LEU175 0.0296 2736 HD11 94.7950 124.9030 122.4510 H 175 LEU175 0.0232 2737 HD12 95.3450 124.2260 123.9810 H 175 LEU175 0.0232 2738 HD13 96.3030 124.0110 122.5140 H 175 LEU175 0.0232 2739 HD21 94.6360 127.2600 123.2830 H 175 LEU175 0.0232 2740 HD22 95.9760 128.0080 124.1420 H 175 LEU175 0.0232 2741 HD23 95.0500 126.7190 124.9100 H 175 LEU175 0.0232 2742 N 100.3560 126.1880 122.5750 N.am 176 GLN176 -0.2456 2743 CA 101.1050 126.6150 121.3980 C.3 176 GLN176 0.0882 2744 CB 102.2480 127.5530 121.8170 C.3 176 GLN176 -0.0210 2745 CG 101.7690 128.7920 122.5960 C.3 176 GLN176 0.0225 2746 CD 100.8050 129.6490 121.7610 C.2 176 GLN176 0.1981 2747 OE1 101.2160 130.4560 120.9410 O.2 176 GLN176 -0.2798 2748 NE2 99.5060 129.4270 122.0160 N.am 176 GLN176 -0.2724 2749 C 101.6010 125.4120 120.6050 C.2 176 GLN176 0.2187 2750 O 101.4300 125.3380 119.3820 O.2 176 GLN176 -0.2778 2751 H 100.6340 126.5250 123.4970 H 176 GLN176 0.1312 2752 HA 100.3990 127.1430 120.7550 H 176 GLN176 0.0557 2753 HB1 102.7980 127.8760 120.9310 H 176 GLN176 0.0289 2754 HB2 102.9640 127.0070 122.4330 H 176 GLN176 0.0289 2755 HG1 102.6220 129.4150 122.8630 H 176 GLN176 0.0356 2756 HG2 101.2840 128.5100 123.5320 H 176 GLN176 0.0356 2757 HE21 98.8170 129.9490 121.5130 H 176 GLN176 0.1266 2758 HE22 99.2050 128.7540 122.6900 H 176 GLN176 0.1266 2759 N 102.2140 124.4520 121.3020 N.am 177 LEU177 -0.2456 2760 CA 102.7760 123.2820 120.6400 C.3 177 LEU177 0.0880 2761 CB 103.5770 122.4900 121.6880 C.3 177 LEU177 -0.0266 2762 CG 104.2930 121.2390 121.1450 C.3 177 LEU177 -0.0449 2763 CD1 105.3060 121.5850 120.0460 C.3 177 LEU177 -0.0626 2764 CD2 104.9720 120.4770 122.2900 C.3 177 LEU177 -0.0626 2765 C 101.6860 122.4170 120.0200 C.2 177 LEU177 0.2187 2766 O 101.8410 121.9260 118.8970 O.2 177 LEU177 -0.2778 2767 H 102.2900 124.5390 122.3150 H 177 LEU177 0.1312 2768 HA 103.4480 123.6500 119.8680 H 177 LEU177 0.0557 2769 HB1 102.9120 122.1920 122.4990 H 177 LEU177 0.0287 2770 HB2 104.3140 123.1530 122.1420 H 177 LEU177 0.0287 2771 HG 103.5470 120.5750 120.7080 H 177 LEU177 0.0296 2772 HD11 105.8320 120.6920 119.7070 H 177 LEU177 0.0232 2773 HD12 106.0510 122.2960 120.4050 H 177 LEU177 0.0232 2774 HD13 104.8180 122.0200 119.1740 H 177 LEU177 0.0232 2775 HD21 105.4700 119.5780 121.9250 H 177 LEU177 0.0232 2776 HD22 104.2450 120.1690 123.0420 H 177 LEU177 0.0232 2777 HD23 105.7230 121.0940 122.7840 H 177 LEU177 0.0232 2778 N 100.5730 122.2300 120.7280 N.am 178 TYR178 -0.2453 2779 CA 99.4830 121.4300 120.1780 C.3 178 TYR178 0.0917 2780 CB 98.4150 121.2770 121.2760 C.3 178 TYR178 -0.0036 2781 CG 97.1550 120.6040 120.7920 C.ar 178 TYR178 -0.0453 2782 CD1 97.0610 119.2160 120.7300 C.ar 178 TYR178 -0.0561 2783 CD2 96.0710 121.3730 120.3780 C.ar 178 TYR178 -0.0561 2784 CE1 95.8980 118.6090 120.2700 C.ar 178 TYR178 -0.0317 2785 CE2 94.9160 120.7690 119.9060 C.ar 178 TYR178 -0.0317 2786 CZ 94.8230 119.3850 119.8620 C.ar 178 TYR178 0.0726 2787 OH 93.6660 118.7850 119.4090 O.3 178 TYR178 -0.3598 2788 C 98.9050 122.0760 118.9230 C.2 178 TYR178 0.2190 2789 O 98.6800 121.4010 117.9060 O.2 178 TYR178 -0.2778 2790 H 100.4830 122.6460 121.6550 H 178 TYR178 0.1312 2791 HA 99.8910 120.4550 119.9060 H 178 TYR178 0.0560 2792 HB1 98.1580 122.2580 121.6800 H 178 TYR178 0.0333 2793 HB2 98.8260 120.7080 122.1100 H 178 TYR178 0.0333 2794 HD1 97.8960 118.6020 121.0360 H 178 TYR178 0.0621 2795 HD2 96.1330 122.4520 120.4040 H 178 TYR178 0.0621 2796 HE1 95.8270 117.5330 120.2200 H 178 TYR178 0.0643 2797 HE2 94.0940 121.3790 119.5670 H 178 TYR178 0.0643 2798 HH 93.0370 119.4520 119.1680 H 178 TYR178 0.2173 2799 N 98.6680 123.3880 118.9750 N.am 179 ALA179 -0.2459 2800 CA 98.1150 124.0910 117.8260 C.3 179 ALA179 0.0850 2801 CB 97.8120 125.5340 118.2390 C.3 179 ALA179 -0.0411 2802 C 99.0630 124.0350 116.6370 C.2 179 ALA179 0.2185 2803 O 98.6330 123.7950 115.5050 O.2 179 ALA179 -0.2778 2804 H 98.8770 123.9050 119.8290 H 179 ALA179 0.1312 2805 HA 97.1900 123.5800 117.5530 H 179 ALA179 0.0554 2806 HB1 97.2950 126.0690 117.4430 H 179 ALA179 0.0249 2807 HB2 98.7240 126.0790 118.4870 H 179 ALA179 0.0249 2808 HB3 97.1700 125.5580 119.1190 H 179 ALA179 0.0249 2809 N 100.3640 124.2490 116.8680 N.am 180 THR180 -0.2434 2810 CA 101.2910 124.2240 115.7400 C.3 180 THR180 0.1135 2811 CB 102.6240 124.9190 116.0710 C.3 180 THR180 0.0763 2812 OG1 103.3000 125.1860 114.8520 O.3 180 THR180 -0.3900 2813 CG2 103.5160 124.0960 117.0070 C.3 180 THR180 -0.0370 2814 C 101.4750 122.8130 115.1920 C.2 180 THR180 0.2212 2815 O 101.7060 122.6480 113.9890 O.2 180 THR180 -0.2777 2816 H 100.7010 124.4260 117.8140 H 180 THR180 0.1313 2817 HA 100.8250 124.8140 114.9500 H 180 THR180 0.0583 2818 HB 102.3700 125.8690 116.5550 H 180 THR180 0.0611 2819 HG1 104.1270 125.6290 115.0140 H 180 THR180 0.2098 2820 HG21 104.3650 124.6710 117.3740 H 180 THR180 0.0255 2821 HG22 103.8990 123.2010 116.5160 H 180 THR180 0.0255 2822 HG23 102.9360 123.7810 117.8650 H 180 THR180 0.0255 2823 N 101.3480 121.7850 116.0350 N.am 181 LEU181 -0.2456 2824 CA 101.3900 120.4180 115.5300 C.3 181 LEU181 0.0880 2825 CB 101.4240 119.4750 116.7450 C.3 181 LEU181 -0.0266 2826 CG 101.3940 117.9690 116.4260 C.3 181 LEU181 -0.0449 2827 CD1 102.4550 117.5650 115.3920 C.3 181 LEU181 -0.0626 2828 CD2 101.5710 117.1590 117.7180 C.3 181 LEU181 -0.0626 2829 C 100.2060 120.1440 114.6100 C.2 181 LEU181 0.2187 2830 O 100.3750 119.6390 113.4900 O.2 181 LEU181 -0.2778 2831 H 101.2220 121.9560 117.0330 H 181 LEU181 0.1312 2832 HA 102.3070 120.3180 114.9480 H 181 LEU181 0.0557 2833 HB1 100.5890 119.7100 117.4070 H 181 LEU181 0.0287 2834 HB2 102.3230 119.6990 117.3210 H 181 LEU181 0.0287 2835 HG 100.4140 117.7250 116.0110 H 181 LEU181 0.0296 2836 HD11 102.4360 116.4890 115.2160 H 181 LEU181 0.0232 2837 HD12 103.4560 117.8310 115.7310 H 181 LEU181 0.0232 2838 HD13 102.2860 118.0490 114.4310 H 181 LEU181 0.0232 2839 HD21 101.4950 116.0890 117.5260 H 181 LEU181 0.0232 2840 HD22 100.8130 117.4230 118.4560 H 181 LEU181 0.0232 2841 HD23 102.5460 117.3470 118.1680 H 181 LEU181 0.0232 2842 N 98.9930 120.4710 115.0680 N.am 182 LEU182 -0.2456 2843 CA 97.8280 120.2950 114.2040 C.3 182 LEU182 0.0880 2844 CB 96.5260 120.6220 114.9550 C.3 182 LEU182 -0.0266 2845 CG 95.9200 119.4320 115.7170 C.3 182 LEU182 -0.0449 2846 CD1 96.7730 118.9920 116.9100 C.3 182 LEU182 -0.0626 2847 CD2 94.4930 119.7690 116.1690 C.3 182 LEU182 -0.0626 2848 C 97.9290 121.1450 112.9440 C.2 182 LEU182 0.2187 2849 O 97.4830 120.7200 111.8720 O.2 182 LEU182 -0.2778 2850 H 98.8820 120.8400 116.0120 H 182 LEU182 0.1312 2851 HA 97.8200 119.2520 113.8830 H 182 LEU182 0.0557 2852 HB1 95.7710 120.9300 114.2310 H 182 LEU182 0.0287 2853 HB2 96.6750 121.4740 115.6200 H 182 LEU182 0.0287 2854 HG 95.8510 118.5890 115.0290 H 182 LEU182 0.0296 2855 HD11 96.3070 118.1490 117.4190 H 182 LEU182 0.0232 2856 HD12 96.8750 119.7970 117.6340 H 182 LEU182 0.0232 2857 HD13 97.7710 118.6800 116.6040 H 182 LEU182 0.0232 2858 HD21 94.0310 118.9140 116.6580 H 182 LEU182 0.0232 2859 HD22 93.8630 120.0400 115.3210 H 182 LEU182 0.0232 2860 HD23 94.4860 120.6030 116.8710 H 182 LEU182 0.0232 2861 N 98.5310 122.3310 113.0430 N.am 183 LEU183 -0.2456 2862 CA 98.6700 123.1900 111.8740 C.3 183 LEU183 0.0880 2863 CB 99.1380 124.5750 112.3440 C.3 183 LEU183 -0.0266 2864 CG 99.2320 125.6360 111.2330 C.3 183 LEU183 -0.0449 2865 CD1 97.8850 125.8600 110.5310 C.3 183 LEU183 -0.0626 2866 CD2 99.7670 126.9540 111.8080 C.3 183 LEU183 -0.0626 2867 C 99.6300 122.5870 110.8580 C.2 183 LEU183 0.2187 2868 O 99.3630 122.6170 109.6520 O.2 183 LEU183 -0.2778 2869 H 98.8970 122.6390 113.9440 H 183 LEU183 0.1312 2870 HA 97.6820 123.2580 111.4160 H 183 LEU183 0.0557 2871 HB1 100.1110 124.4760 112.8260 H 183 LEU183 0.0287 2872 HB2 98.4570 124.9320 113.1180 H 183 LEU183 0.0287 2873 HG 99.9480 125.2940 110.4850 H 183 LEU183 0.0296 2874 HD11 97.9600 126.6570 109.7910 H 183 LEU183 0.0232 2875 HD12 97.1090 126.1380 111.2450 H 183 LEU183 0.0232 2876 HD13 97.5540 124.9650 110.0040 H 183 LEU183 0.0232 2877 HD21 99.8810 127.7070 111.0270 H 183 LEU183 0.0232 2878 HD22 100.7430 126.8110 112.2740 H 183 LEU183 0.0232 2879 HD23 99.0930 127.3560 112.5650 H 183 LEU183 0.0232 2880 N 100.7540 122.0400 111.3250 N.am 184 LEU184 -0.2456 2881 CA 101.6790 121.3730 110.4160 C.3 184 LEU184 0.0880 2882 CB 102.9240 120.9500 111.2140 C.3 184 LEU184 -0.0266 2883 CG 103.7890 122.1410 111.6710 C.3 184 LEU184 -0.0449 2884 CD1 104.7140 121.7320 112.8250 C.3 184 LEU184 -0.0626 2885 CD2 104.6000 122.7280 110.5090 C.3 184 LEU184 -0.0626 2886 C 101.0240 120.1670 109.7580 C.2 184 LEU184 0.2187 2887 O 101.2010 119.9360 108.5560 O.2 184 LEU184 -0.2778 2888 H 100.9670 122.0890 112.3210 H 184 LEU184 0.1312 2889 HA 101.9400 122.0830 109.6300 H 184 LEU184 0.0557 2890 HB1 103.5420 120.2690 110.6270 H 184 LEU184 0.0287 2891 HB2 102.5960 120.3820 112.0870 H 184 LEU184 0.0287 2892 HG 103.1390 122.9300 112.0470 H 184 LEU184 0.0296 2893 HD11 105.3050 122.5810 113.1710 H 184 LEU184 0.0232 2894 HD12 105.4020 120.9440 112.5190 H 184 LEU184 0.0232 2895 HD13 104.1400 121.3650 113.6760 H 184 LEU184 0.0232 2896 HD21 105.2050 123.5710 110.8430 H 184 LEU184 0.0232 2897 HD22 103.9520 123.0900 109.7110 H 184 LEU184 0.0232 2898 HD23 105.2730 121.9840 110.0820 H 184 LEU184 0.0232 2899 N 100.2470 119.3970 110.5240 N.am 185 LEU185 -0.2456 2900 CA 99.5810 118.2330 109.9430 C.3 185 LEU185 0.0880 2901 CB 98.9810 117.3520 111.0450 C.3 185 LEU185 -0.0266 2902 CG 100.0420 116.7340 111.9810 C.3 185 LEU185 -0.0449 2903 CD1 99.4000 116.1200 113.2330 C.3 185 LEU185 -0.0626 2904 CD2 100.9020 115.6880 111.2580 C.3 185 LEU185 -0.0626 2905 C 98.5630 118.6470 108.8850 C.2 185 LEU185 0.2187 2906 O 98.4880 118.0350 107.8100 O.2 185 LEU185 -0.2778 2907 H 100.1190 119.6210 111.5110 H 185 LEU185 0.1312 2908 HA 100.3480 117.6710 109.4100 H 185 LEU185 0.0557 2909 HB1 98.4170 116.5470 110.5750 H 185 LEU185 0.0287 2910 HB2 98.2720 117.9440 111.6260 H 185 LEU185 0.0287 2911 HG 100.7090 117.5240 112.3240 H 185 LEU185 0.0296 2912 HD11 100.1620 115.7530 113.9210 H 185 LEU185 0.0232 2913 HD12 98.7570 115.2780 112.9780 H 185 LEU185 0.0232 2914 HD13 98.8030 116.8560 113.7710 H 185 LEU185 0.0232 2915 HD21 101.6510 115.2720 111.9330 H 185 LEU185 0.0232 2916 HD22 101.4430 116.1140 110.4140 H 185 LEU185 0.0232 2917 HD23 100.2910 114.8660 110.8820 H 185 LEU185 0.0232 2918 N 97.7860 119.6970 109.1600 N.am 186 ILE186 -0.2454 2919 CA 96.7990 120.1710 108.1940 C.3 186 ILE186 0.0903 2920 CB 95.8320 121.1820 108.8520 C.3 186 ILE186 -0.0201 2921 CG1 94.9680 120.4890 109.9290 C.3 186 ILE186 -0.0514 2922 CG2 94.9350 121.8830 107.8140 C.3 186 ILE186 -0.0605 2923 CD1 94.2000 121.4680 110.8260 C.3 186 ILE186 -0.0650 2924 C 97.4830 120.7010 106.9400 C.2 186 ILE186 0.2189 2925 O 97.0440 120.4290 105.8150 O.2 186 ILE186 -0.2778 2926 H 97.8830 120.1740 110.0560 H 186 ILE186 0.1312 2927 HA 96.2460 119.2840 107.9020 H 186 ILE186 0.0560 2928 HB 96.4380 121.9470 109.3430 H 186 ILE186 0.0318 2929 HG11 95.5960 119.8680 110.5660 H 186 ILE186 0.0266 2930 HG12 94.2630 119.8040 109.4580 H 186 ILE186 0.0266 2931 HG21 94.1910 122.5160 108.2890 H 186 ILE186 0.0233 2932 HG22 94.3930 121.1650 107.2010 H 186 ILE186 0.0233 2933 HG23 95.5160 122.5200 107.1480 H 186 ILE186 0.0233 2934 HD11 93.7420 120.9490 111.6670 H 186 ILE186 0.0230 2935 HD12 93.4000 121.9700 110.2830 H 186 ILE186 0.0230 2936 HD13 94.8670 122.2300 111.2270 H 186 ILE186 0.0230 2937 N 98.5600 121.4710 107.1090 N.am 187 VAL187 -0.2454 2938 CA 99.2810 122.0060 105.9590 C.3 187 VAL187 0.0901 2939 CB 100.3750 122.9750 106.4600 C.3 187 VAL187 -0.0227 2940 CG1 101.3990 123.3480 105.3750 C.3 187 VAL187 -0.0608 2941 CG2 99.7460 124.2570 107.0310 C.3 187 VAL187 -0.0608 2942 C 99.8320 120.8750 105.1030 C.2 187 VAL187 0.2190 2943 O 99.7300 120.9030 103.8710 O.2 187 VAL187 -0.2778 2944 H 98.8820 121.6880 108.0520 H 187 VAL187 0.1312 2945 HA 98.5570 122.5500 105.3500 H 187 VAL187 0.0560 2946 HB 100.9180 122.4770 107.2670 H 187 VAL187 0.0315 2947 HG11 102.1200 124.0740 105.7530 H 187 VAL187 0.0233 2948 HG12 100.9090 123.7870 104.5060 H 187 VAL187 0.0233 2949 HG13 101.9670 122.4800 105.0380 H 187 VAL187 0.0233 2950 HG21 100.4990 124.8810 107.5130 H 187 VAL187 0.0233 2951 HG22 98.9740 124.0470 107.7690 H 187 VAL187 0.0233 2952 HG23 99.2820 124.8470 106.2400 H 187 VAL187 0.0233 2953 N 100.4110 119.8540 105.7390 N.am 188 SER188 -0.2436 2954 CA 100.9550 118.7300 104.9850 C.3 188 SER188 0.1109 2955 CB 101.6750 117.7820 105.9490 C.3 188 SER188 0.0681 2956 OG 102.7940 118.4440 106.5260 O.3 188 SER188 -0.3930 2957 C 99.8610 117.9900 104.2270 C.2 188 SER188 0.2209 2958 O 100.0400 117.6360 103.0540 O.2 188 SER188 -0.2777 2959 H 100.4730 119.8600 106.7570 H 188 SER188 0.1312 2960 HA 101.6650 119.1350 104.2620 H 188 SER188 0.0580 2961 HB1 102.0270 116.9110 105.3930 H 188 SER188 0.0577 2962 HB2 100.9760 117.4440 106.7240 H 188 SER188 0.0577 2963 HG 103.1860 117.9240 107.2220 H 188 SER188 0.2095 2964 N 98.7170 117.7540 104.8740 N.am 189 VAL189 -0.2453 2965 CA 97.6390 117.0250 104.2130 C.3 189 VAL189 0.0901 2966 CB 96.5130 116.7170 105.2210 C.3 189 VAL189 -0.0227 2967 CG1 95.2110 116.2440 104.5430 C.3 189 VAL189 -0.0608 2968 CG2 96.9500 115.6570 106.2350 C.3 189 VAL189 -0.0608 2969 C 97.1090 117.8130 103.0220 C.2 189 VAL189 0.2189 2970 O 96.8930 117.2550 101.9380 O.2 189 VAL189 -0.2778 2971 H 98.5960 118.0840 105.8320 H 189 VAL189 0.1312 2972 HA 98.0590 116.0930 103.8300 H 189 VAL189 0.0560 2973 HB 96.3090 117.6360 105.7680 H 189 VAL189 0.0315 2974 HG11 94.4810 115.9060 105.2790 H 189 VAL189 0.0233 2975 HG12 95.4010 115.4100 103.8670 H 189 VAL189 0.0233 2976 HG13 94.7410 117.0410 103.9670 H 189 VAL189 0.0233 2977 HG21 96.2400 115.5810 107.0590 H 189 VAL189 0.0233 2978 HG22 97.9340 115.8600 106.6580 H 189 VAL189 0.0233 2979 HG23 96.9800 114.6880 105.7420 H 189 VAL189 0.0233 2980 N 96.9090 119.1210 103.1920 N.am 190 LEU190 -0.2456 2981 CA 96.4240 119.9380 102.0850 C.3 190 LEU190 0.0880 2982 CB 96.0450 121.3300 102.6120 C.3 190 LEU190 -0.0266 2983 CG 94.8660 121.3060 103.6090 C.3 190 LEU190 -0.0449 2984 CD1 94.6920 122.6750 104.2780 C.3 190 LEU190 -0.0626 2985 CD2 93.5520 120.8590 102.9520 C.3 190 LEU190 -0.0626 2986 C 97.4350 119.9850 100.9470 C.2 190 LEU190 0.2187 2987 O 97.0570 119.9440 99.7700 O.2 190 LEU190 -0.2778 2988 H 97.0960 119.5510 104.0980 H 190 LEU190 0.1312 2989 HA 95.5390 119.4400 101.6870 H 190 LEU190 0.0557 2990 HB1 95.7900 121.9870 101.7800 H 190 LEU190 0.0287 2991 HB2 96.9190 121.7710 103.0940 H 190 LEU190 0.0287 2992 HG 95.0860 120.5910 104.4020 H 190 LEU190 0.0296 2993 HD11 93.8910 122.6520 105.0170 H 190 LEU190 0.0232 2994 HD12 94.4490 123.4440 103.5440 H 190 LEU190 0.0232 2995 HD13 95.6060 122.9780 104.7900 H 190 LEU190 0.0232 2996 HD21 92.7330 120.8920 103.6700 H 190 LEU190 0.0232 2997 HD22 93.6080 119.8330 102.5910 H 190 LEU190 0.0232 2998 HD23 93.2870 121.5020 102.1120 H 190 LEU190 0.0232 2999 N 98.7280 120.0640 101.2740 N.am 191 ALA191 -0.2459 3000 CA 99.7480 120.1160 100.2320 C.3 191 ALA191 0.0850 3001 CB 101.1060 120.3630 100.8980 C.3 191 ALA191 -0.0411 3002 C 99.7710 118.8260 99.4260 C.2 191 ALA191 0.2184 3003 O 99.8250 118.8520 98.1900 O.2 191 ALA191 -0.2778 3004 H 99.0030 120.0880 102.2560 H 191 ALA191 0.1312 3005 HA 99.4950 120.9420 99.5650 H 191 ALA191 0.0554 3006 HB1 101.9060 120.4290 100.1600 H 191 ALA191 0.0249 3007 HB2 101.3570 119.5650 101.5990 H 191 ALA191 0.0249 3008 HB3 101.0950 121.2980 101.4600 H 191 ALA191 0.0249 3009 N 99.7240 117.6810 100.1090 N.am 192 CYS192 -0.2449 3010 CA 99.7280 116.4110 99.3910 C.3 192 CYS192 0.0965 3011 CB 99.8130 115.2860 100.4370 C.3 192 CYS192 0.0147 3012 SG 101.4370 115.1550 101.2320 S.3 192 CYS192 -0.1762 3013 C 98.4590 116.2330 98.5660 C.2 192 CYS192 0.2195 3014 O 98.5130 115.7190 97.4410 O.2 192 CYS192 -0.2778 3015 H 99.6850 117.6930 101.1280 H 192 CYS192 0.1312 3016 HA 100.5930 116.3910 98.7260 H 192 CYS192 0.0565 3017 HB1 99.5760 114.3200 99.9940 H 192 CYS192 0.0394 3018 HB2 99.0640 115.4540 101.2110 H 192 CYS192 0.0394 3019 HG 101.3870 114.2270 102.1910 H 192 CYS192 0.1017 3020 N 97.3110 116.6690 99.0900 N.am 193 ASN193 -0.2452 3021 CA 96.0760 116.5670 98.3190 C.3 193 ASN193 0.0957 3022 CB 94.8700 116.9450 99.1880 C.3 193 ASN193 0.0446 3023 CG 94.6520 115.9500 100.3370 C.2 193 ASN193 0.2000 3024 OD1 95.2590 114.8890 100.4060 O.2 193 ASN193 -0.2797 3025 ND2 93.7420 116.3630 101.2320 N.am 193 ASN193 -0.2723 3026 C 96.1310 117.4330 97.0660 C.2 193 ASN193 0.2191 3027 O 95.7050 117.0050 95.9860 O.2 193 ASN193 -0.2778 3028 H 97.2970 117.0720 100.0270 H 193 ASN193 0.1312 3029 HA 95.9850 115.5290 97.9900 H 193 ASN193 0.0562 3030 HB1 93.9740 116.9230 98.5780 H 193 ASN193 0.0375 3031 HB2 94.9780 117.9500 99.5980 H 193 ASN193 0.0375 3032 HD21 93.5440 115.7990 102.0340 H 193 ASN193 0.1266 3033 HD22 93.2500 117.2260 101.1140 H 193 ASN193 0.1266 3034 N 96.6660 118.6500 97.1830 N.am 194 PHE194 -0.2453 3035 CA 96.7610 119.5150 96.0120 C.3 194 PHE194 0.0917 3036 CB 97.1390 120.9520 96.4170 C.3 194 PHE194 -0.0036 3037 CG 96.0520 121.6770 97.1760 C.ar 194 PHE194 -0.0454 3038 CD1 94.7400 121.7110 96.7050 C.ar 194 PHE194 -0.0585 3039 CD2 96.3590 122.3830 98.3370 C.ar 194 PHE194 -0.0585 3040 CE1 93.7530 122.3950 97.4020 C.ar 194 PHE194 -0.0615 3041 CE2 95.3730 123.0610 99.0400 C.ar 194 PHE194 -0.0615 3042 CZ 94.0660 123.0620 98.5770 C.ar 194 PHE194 -0.0617 3043 C 97.7510 118.9630 94.9970 C.2 194 PHE194 0.2191 3044 O 97.5210 119.0530 93.7860 O.2 194 PHE194 -0.2778 3045 H 97.0070 118.9740 98.0880 H 194 PHE194 0.1312 3046 HA 95.7870 119.4990 95.5220 H 194 PHE194 0.0560 3047 HB1 97.3620 121.5470 95.5300 H 194 PHE194 0.0333 3048 HB2 98.0520 120.9330 97.0140 H 194 PHE194 0.0333 3049 HD1 94.4730 121.2110 95.7860 H 194 PHE194 0.0620 3050 HD2 97.3720 122.3880 98.7120 H 194 PHE194 0.0620 3051 HE1 92.7390 122.4050 97.0300 H 194 PHE194 0.0618 3052 HE2 95.6250 123.5880 99.9490 H 194 PHE194 0.0618 3053 HZ 93.2980 123.5890 99.1240 H 194 PHE194 0.0618 3054 N 98.8510 118.3730 95.4680 N.am 195 SER195 -0.2436 3055 CA 99.8090 117.7790 94.5420 C.3 195 SER195 0.1109 3056 CB 101.0820 117.4100 95.3120 C.3 195 SER195 0.0681 3057 OG 102.1580 117.2270 94.3980 O.3 195 SER195 -0.3930 3058 C 99.2000 116.5930 93.8020 C.2 195 SER195 0.2209 3059 O 99.4280 116.4200 92.5980 O.2 195 SER195 -0.2777 3060 H 99.0220 118.3370 96.4730 H 195 SER195 0.1312 3061 HA 100.0520 118.5480 93.8070 H 195 SER195 0.0580 3062 HB1 100.9240 116.5050 95.9080 H 195 SER195 0.0577 3063 HB2 101.3070 118.2250 96.0100 H 195 SER195 0.0577 3064 HG 102.9920 117.1670 94.8620 H 195 SER195 0.2095 3065 N 98.4100 115.7730 94.4970 N.am 196 VAL196 -0.2453 3066 CA 97.7660 114.6480 93.8280 C.3 196 VAL196 0.0901 3067 CB 97.1450 113.6880 94.8650 C.3 196 VAL196 -0.0227 3068 CG1 96.2590 112.6060 94.2200 C.3 196 VAL196 -0.0608 3069 CG2 98.2370 112.9950 95.6830 C.3 196 VAL196 -0.0608 3070 C 96.7390 115.1430 92.8180 C.2 196 VAL196 0.2189 3071 O 96.6180 114.5900 91.7210 O.2 196 VAL196 -0.2778 3072 H 98.2570 115.9320 95.4930 H 196 VAL196 0.1312 3073 HA 98.5390 114.1170 93.2690 H 196 VAL196 0.0560 3074 HB 96.5340 114.2770 95.5490 H 196 VAL196 0.0315 3075 HG11 95.8650 111.9230 94.9720 H 196 VAL196 0.0233 3076 HG12 96.8260 112.0160 93.5000 H 196 VAL196 0.0233 3077 HG13 95.4090 113.0360 93.6940 H 196 VAL196 0.0233 3078 HG21 97.8110 112.3870 96.4820 H 196 VAL196 0.0233 3079 HG22 98.9250 113.7050 96.1390 H 196 VAL196 0.0233 3080 HG23 98.8190 112.3350 95.0390 H 196 VAL196 0.0233 3081 N 95.9800 116.1850 93.1670 N.am 197 ILE197 -0.2454 3082 CA 95.0150 116.7380 92.2190 C.3 197 ILE197 0.0903 3083 CB 94.1410 117.8270 92.8950 C.3 197 ILE197 -0.0201 3084 CG1 93.1790 117.1840 93.9120 C.3 197 ILE197 -0.0514 3085 CG2 93.3520 118.6660 91.8690 C.3 197 ILE197 -0.0605 3086 CD1 92.3680 118.1820 94.7480 C.3 197 ILE197 -0.0650 3087 C 95.7270 117.2670 90.9800 C.2 197 ILE197 0.2189 3088 O 95.2690 117.0710 89.8470 O.2 197 ILE197 -0.2778 3089 H 96.0740 116.5950 94.0960 H 197 ILE197 0.1312 3090 HA 94.3770 115.9140 91.8930 H 197 ILE197 0.0560 3091 HB 94.8060 118.5040 93.4350 H 197 ILE197 0.0318 3092 HG11 93.7500 116.5670 94.6000 H 197 ILE197 0.0266 3093 HG12 92.4940 116.5110 93.3940 H 197 ILE197 0.0266 3094 HG21 92.7310 119.4200 92.3480 H 197 ILE197 0.0233 3095 HG22 92.7050 118.0360 91.2570 H 197 ILE197 0.0233 3096 HG23 94.0170 119.2120 91.2020 H 197 ILE197 0.0233 3097 HD11 91.7090 117.6490 95.4320 H 197 ILE197 0.0230 3098 HD12 91.7270 118.8120 94.1330 H 197 ILE197 0.0230 3099 HD13 93.0210 118.8270 95.3370 H 197 ILE197 0.0230 3100 N 96.8690 117.9300 91.1730 N.am 198 LEU198 -0.2456 3101 CA 97.6230 118.4530 90.0400 C.3 198 LEU198 0.0880 3102 CB 98.7680 119.3110 90.6140 C.3 198 LEU198 -0.0266 3103 CG 99.2220 120.4810 89.7230 C.3 198 LEU198 -0.0449 3104 CD1 100.3270 121.2800 90.4260 C.3 198 LEU198 -0.0626 3105 CD2 99.6880 120.0210 88.3400 C.3 198 LEU198 -0.0626 3106 C 98.1370 117.3290 89.1490 C.2 198 LEU198 0.2187 3107 O 98.0620 117.4180 87.9170 O.2 198 LEU198 -0.2778 3108 H 97.2170 118.0720 92.1210 H 198 LEU198 0.1312 3109 HA 96.9340 119.0750 89.4660 H 198 LEU198 0.0557 3110 HB1 99.6180 118.6820 90.8870 H 198 LEU198 0.0287 3111 HB2 98.4290 119.7490 91.5530 H 198 LEU198 0.0287 3112 HG 98.3720 121.1510 89.5830 H 198 LEU198 0.0296 3113 HD11 100.6250 122.1460 89.8340 H 198 LEU198 0.0232 3114 HD12 101.2120 120.6670 90.5950 H 198 LEU198 0.0232 3115 HD13 99.9870 121.6480 91.3950 H 198 LEU198 0.0232 3116 HD21 100.2000 120.8220 87.8050 H 198 LEU198 0.0232 3117 HD22 98.8460 119.7110 87.7240 H 198 LEU198 0.0232 3118 HD23 100.3710 119.1810 88.4390 H 198 LEU198 0.0232 3119 N 98.6590 116.2580 89.7530 N.am 199 ASN199 -0.2452 3120 CA 99.1480 115.1350 88.9570 C.3 199 ASN199 0.0957 3121 CB 99.9090 114.1660 89.8730 C.3 199 ASN199 0.0446 3122 CG 101.2150 114.8310 90.3310 C.2 199 ASN199 0.2000 3123 OD1 101.8800 115.5230 89.5660 O.2 199 ASN199 -0.2797 3124 ND2 101.5380 114.5890 91.6100 N.am 199 ASN199 -0.2723 3125 C 98.0100 114.4370 88.2220 C.2 199 ASN199 0.2191 3126 O 98.1820 113.9830 87.0830 O.2 199 ASN199 -0.2778 3127 H 98.7160 116.2240 90.7710 H 199 ASN199 0.1312 3128 HA 99.8060 115.5200 88.1860 H 199 ASN199 0.0562 3129 HB1 100.1680 113.2450 89.3510 H 199 ASN199 0.0375 3130 HB2 99.3040 113.8990 90.7410 H 199 ASN199 0.0375 3131 HD21 102.3660 114.9850 92.0050 H 199 ASN199 0.1266 3132 HD22 100.9600 114.0190 92.1920 H 199 ASN199 0.1266 3133 N 96.8380 114.3460 88.8500 N.am 200 LEU200 -0.2456 3134 CA 95.6870 113.7530 88.1790 C.3 200 LEU200 0.0880 3135 CB 94.5380 113.5690 89.1870 C.3 200 LEU200 -0.0266 3136 CG 94.7830 112.4910 90.2610 C.3 200 LEU200 -0.0449 3137 CD1 93.7400 112.6040 91.3820 C.3 200 LEU200 -0.0626 3138 CD2 94.7740 111.0750 89.6710 C.3 200 LEU200 -0.0626 3139 C 95.2400 114.6060 87.0000 C.2 200 LEU200 0.2187 3140 O 94.8740 114.0740 85.9470 O.2 200 LEU200 -0.2778 3141 H 96.7460 114.6930 89.8050 H 200 LEU200 0.1312 3142 HA 96.0000 112.7820 87.8050 H 200 LEU200 0.0557 3143 HB1 93.6220 113.3120 88.6540 H 200 LEU200 0.0287 3144 HB2 94.3570 114.5260 89.6780 H 200 LEU200 0.0287 3145 HG 95.7630 112.6460 90.7060 H 200 LEU200 0.0296 3146 HD11 93.9230 111.8680 92.1650 H 200 LEU200 0.0232 3147 HD12 92.7310 112.4380 91.0000 H 200 LEU200 0.0232 3148 HD13 93.7650 113.5910 91.8440 H 200 LEU200 0.0232 3149 HD21 94.9070 110.3260 90.4520 H 200 LEU200 0.0232 3150 HD22 95.5860 110.9410 88.9590 H 200 LEU200 0.0232 3151 HD23 93.8340 110.8630 89.1620 H 200 LEU200 0.0232 3152 N 95.2650 115.9300 87.1530 N.am 201 ILE201 -0.2454 3153 CA 94.9130 116.8050 86.0380 C.3 201 ILE201 0.0903 3154 CB 94.8500 118.2660 86.5460 C.3 201 ILE201 -0.0201 3155 CG1 93.6630 118.4610 87.5070 C.3 201 ILE201 -0.0514 3156 CG2 94.7650 119.2910 85.3980 C.3 201 ILE201 -0.0605 3157 CD1 93.7890 119.7080 88.3900 C.3 201 ILE201 -0.0650 3158 C 95.9170 116.6490 84.9040 C.2 201 ILE201 0.2189 3159 O 95.5460 116.6250 83.7250 O.2 201 ILE201 -0.2778 3160 H 95.5310 116.3330 88.0520 H 201 ILE201 0.1312 3161 HA 93.9330 116.4920 85.6720 H 201 ILE201 0.0560 3162 HB 95.7690 118.4600 87.1010 H 201 ILE201 0.0318 3163 HG11 93.5510 117.5960 88.1600 H 201 ILE201 0.0266 3164 HG12 92.7420 118.5190 86.9290 H 201 ILE201 0.0266 3165 HG21 94.6850 120.3090 85.7770 H 201 ILE201 0.0233 3166 HG22 93.8940 119.1020 84.7700 H 201 ILE201 0.0233 3167 HG23 95.6490 119.2640 84.7610 H 201 ILE201 0.0233 3168 HD11 92.9470 119.7750 89.0790 H 201 ILE201 0.0230 3169 HD12 93.8020 120.6230 87.7990 H 201 ILE201 0.0230 3170 HD13 94.7020 119.6760 88.9830 H 201 ILE201 0.0230 3171 N 97.2040 116.5410 85.2410 N.am 202 ARG202 -0.2456 3172 CA 98.2190 116.2990 84.2180 C.3 202 ARG202 0.0879 3173 CB 99.5980 116.2080 84.9140 C.3 202 ARG202 -0.0258 3174 CG 100.1710 117.5440 85.4310 C.3 202 ARG202 -0.0154 3175 CD 101.2960 117.3290 86.4660 C.3 202 ARG202 0.1045 3176 NE 102.1390 118.5190 86.6180 N.pl3 202 ARG202 -0.4450 3177 CZ 102.9800 118.6990 87.6410 C.cat 202 ARG202 0.5062 3178 NH1 103.0950 117.8270 88.6090 N.pl3 202 ARG202 -0.4573 3179 NH2 103.7130 119.7790 87.6850 N.pl3 202 ARG202 -0.4573 3180 C 97.9400 115.0070 83.4580 C.2 202 ARG202 0.2187 3181 O 97.9240 114.9890 82.2200 O.2 202 ARG202 -0.2778 3182 H 97.4810 116.6280 86.2190 H 202 ARG202 0.1312 3183 HA 98.1850 117.1310 83.5140 H 202 ARG202 0.0557 3184 HB1 100.3320 115.7720 84.2330 H 202 ARG202 0.0286 3185 HB2 99.5210 115.5110 85.7470 H 202 ARG202 0.0286 3186 HG1 99.3840 118.1490 85.8820 H 202 ARG202 0.0299 3187 HG2 100.5470 118.1170 84.5830 H 202 ARG202 0.0299 3188 HD1 101.9500 116.5040 86.1750 H 202 ARG202 0.0711 3189 HD2 100.8590 117.1020 87.4380 H 202 ARG202 0.0711 3190 HE 102.1030 119.2450 85.9350 H 202 ARG202 0.3153 3191 HH11 103.7390 117.9760 89.3550 H 202 ARG202 0.3114 3192 HH12 102.5370 116.9970 88.6220 H 202 ARG202 0.3114 3193 HH21 104.3400 119.9190 88.4480 H 202 ARG202 0.3114 3194 HH22 103.6530 120.4630 86.9630 H 202 ARG202 0.3114 3195 N 97.7130 113.9100 84.1850 N.am 203 MET203 -0.2456 3196 CA 97.5030 112.6310 83.5160 C.3 203 MET203 0.0885 3197 CB 97.7140 111.4540 84.4840 C.3 203 MET203 -0.0199 3198 CG 96.4980 111.1050 85.3500 C.3 203 MET203 -0.0047 3199 SD 96.8900 109.7850 86.5090 S.3 203 MET203 -0.1641 3200 CE 95.2060 109.2270 86.8380 C.3 203 MET203 -0.0181 3201 C 96.1490 112.5540 82.8240 C.2 203 MET203 0.2187 3202 O 95.9420 111.6600 81.9980 O.2 203 MET203 -0.2778 3203 H 97.6870 113.9660 85.2030 H 203 MET203 0.1312 3204 HA 98.2610 112.5710 82.7380 H 203 MET203 0.0557 3205 HB1 98.5700 111.6640 85.1250 H 203 MET203 0.0293 3206 HB2 97.9740 110.5660 83.9090 H 203 MET203 0.0293 3207 HG1 95.6730 110.7690 84.7210 H 203 MET203 0.0377 3208 HG2 96.1370 111.9740 85.8900 H 203 MET203 0.0377 3209 HE1 95.1650 108.6670 87.7720 H 203 MET203 0.0340 3210 HE2 94.8390 108.6070 86.0200 H 203 MET203 0.0340 3211 HE3 94.5410 110.0850 86.9360 H 203 MET203 0.0340 3212 N 95.2270 113.4620 83.1380 N.am 204 HIS204 -0.2453 3213 CA 94.0200 113.5890 82.3300 C.3 204 HIS204 0.0932 3214 ND1 90.5950 115.0000 83.1140 N.ar 204 HIS204 -0.2469 3215 CG 91.8030 115.0150 82.5060 C.ar 204 HIS204 0.0551 3216 CB 93.0590 114.4720 83.1830 C.3 204 HIS204 0.0146 3217 NE2 90.4300 116.3800 81.3780 N.ar 204 HIS204 -0.2539 3218 CD2 91.7100 115.9460 81.4500 C.ar 204 HIS204 0.0047 3219 CE1 89.7910 115.8120 82.4120 C.ar 204 HIS204 0.0737 3220 C 94.3020 114.3470 81.0400 C.2 204 HIS204 0.2190 3221 O 93.8060 113.9700 79.9730 O.2 204 HIS204 -0.2778 3222 H 95.3650 114.0700 83.9450 H 204 HIS204 0.1312 3223 HA 93.6170 112.6020 82.1100 H 204 HIS204 0.0561 3224 HB1 93.5920 115.3410 83.5550 H 204 HIS204 0.0348 3225 HB2 92.7610 113.9440 84.0790 H 204 HIS204 0.0348 3226 HE2 90.0700 117.0560 80.7680 H 204 HIS204 0.1339 3227 HD2 92.5190 116.3080 80.8360 H 204 HIS204 0.0764 3228 HE1 88.7640 116.0110 82.6810 H 204 HIS204 0.0963 3229 N 95.0980 115.4140 81.1210 N.am 205 ARG205 -0.2456 3230 CA 95.5170 116.1390 79.9280 C.3 205 ARG205 0.0879 3231 CB 96.1370 117.4550 80.4360 C.3 205 ARG205 -0.0258 3232 CG 96.4650 118.5010 79.3570 C.3 205 ARG205 -0.0154 3233 CD 96.7430 119.8800 79.9790 C.3 205 ARG205 0.1045 3234 NE 97.1810 120.8370 78.9570 N.pl3 205 ARG205 -0.4450 3235 CZ 97.2060 122.1600 79.1310 C.cat 205 ARG205 0.5062 3236 NH1 96.8050 122.7120 80.2470 N.pl3 205 ARG205 -0.4573 3237 NH2 97.6410 122.9290 78.1680 N.pl3 205 ARG205 -0.4573 3238 C 96.4660 115.3300 79.0560 C.2 205 ARG205 0.2187 3239 O 96.7640 115.7540 77.9350 O.2 205 ARG205 -0.2778 3240 H 95.4200 115.7290 82.0360 H 205 ARG205 0.1312 3241 HA 94.6160 116.3500 79.3500 H 205 ARG205 0.0557 3242 HB1 97.0300 117.2390 81.0250 H 205 ARG205 0.0286 3243 HB2 95.4280 117.8990 81.1370 H 205 ARG205 0.0286 3244 HG1 95.6310 118.5840 78.6600 H 205 ARG205 0.0299 3245 HG2 97.3270 118.1710 78.7780 H 205 ARG205 0.0299 3246 HD1 97.5340 119.8140 80.7300 H 205 ARG205 0.0711 3247 HD2 95.8370 120.2570 80.4620 H 205 ARG205 0.0711 3248 HE 97.4920 120.4990 78.0710 H 205 ARG205 0.3153 3249 HH11 96.8330 123.7030 80.3580 H 205 ARG205 0.3114 3250 HH12 96.4680 122.1400 80.9900 H 205 ARG205 0.3114 3251 HH21 97.6550 123.9200 78.2880 H 205 ARG205 0.3114 3252 HH22 97.9650 122.5390 77.3100 H 205 ARG205 0.3114 3253 N 96.9550 114.1910 79.5440 N.am 206 ARG206 -0.2457 3254 CA 97.7140 113.2740 78.7040 C.3 206 ARG206 0.0879 3255 CB 98.7310 112.4770 79.5560 C.3 206 ARG206 -0.0258 3256 CG 99.8990 113.2670 80.1600 C.3 206 ARG206 -0.0154 3257 CD 100.9990 112.3400 80.7150 C.3 206 ARG206 0.1045 3258 NE 100.4290 111.3200 81.6040 N.pl3 206 ARG206 -0.4450 3259 CZ 101.1260 110.3350 82.1670 C.cat 206 ARG206 0.5062 3260 NH1 102.4120 110.2110 81.9680 N.pl3 206 ARG206 -0.4573 3261 NH2 100.5150 109.4700 82.9340 N.pl3 206 ARG206 -0.4573 3262 C 96.8520 112.1860 78.0770 C.2 206 ARG206 0.2187 3263 O 97.2870 111.5540 77.1080 O.2 206 ARG206 -0.2778 3264 H 96.7950 113.9570 80.5240 H 206 ARG206 0.1312 3265 HA 98.2270 113.8270 77.9160 H 206 ARG206 0.0557 3266 HB1 99.1750 111.6920 78.9390 H 206 ARG206 0.0286 3267 HB2 98.1930 111.9620 80.3540 H 206 ARG206 0.0286 3268 HG1 99.5410 113.9180 80.9510 H 206 ARG206 0.0299 3269 HG2 100.3330 113.9200 79.4020 H 206 ARG206 0.0299 3270 HD1 101.7440 112.9130 81.2730 H 206 ARG206 0.0711 3271 HD2 101.5020 111.8250 79.8920 H 206 ARG206 0.0711 3272 HE 99.4520 111.3380 81.8090 H 206 ARG206 0.3153 3273 HH11 102.9210 109.4670 82.3970 H 206 ARG206 0.3114 3274 HH12 102.8880 110.8610 81.3820 H 206 ARG206 0.3114 3275 HH21 101.0280 108.7310 83.3650 H 206 ARG206 0.3114 3276 HH22 99.5330 109.5370 83.0950 H 206 ARG206 0.3114 3277 N 95.6480 111.9510 78.6010 N.am 207 SER207 -0.2436 3278 CA 94.8110 110.8690 78.0920 C.3 207 SER207 0.1109 3279 CB 94.0030 110.3210 79.2810 C.3 207 SER207 0.0681 3280 OG 93.0940 109.3180 78.8460 O.3 207 SER207 -0.3930 3281 C 93.9070 111.3410 76.9590 C.2 207 SER207 0.2209 3282 O 93.8320 110.6980 75.9070 O.2 207 SER207 -0.2777 3283 H 95.3090 112.5340 79.3660 H 207 SER207 0.1312 3284 HA 95.4470 110.0700 77.7060 H 207 SER207 0.0580 3285 HB1 93.4610 111.1320 79.7780 H 207 SER207 0.0577 3286 HB2 94.7020 109.9110 80.0200 H 207 SER207 0.0577 3287 HG 92.6670 108.8900 79.5890 H 207 SER207 0.2095 3288 N 93.2930 112.5440 77.1630 N.am 208 ARG208 -0.2456 3289 CA 92.4510 113.1740 76.1760 C.3 208 ARG208 0.0879 3290 CB 90.9990 112.7490 76.4900 C.3 208 ARG208 -0.0258 3291 CG 90.5710 112.9870 77.9600 C.3 208 ARG208 -0.0154 3292 CD 90.5470 111.6990 78.8110 C.3 208 ARG208 0.1045 3293 NE 90.3430 111.9730 80.2340 N.pl3 208 ARG208 -0.4450 3294 CZ 89.2510 112.4940 80.7700 C.cat 208 ARG208 0.5062 3295 NH1 88.1960 112.7690 80.0560 N.pl3 208 ARG208 -0.4573 3296 NH2 89.2250 112.7260 82.0380 N.pl3 208 ARG208 -0.4573 3297 C 92.6000 114.6770 76.2650 C.2 208 ARG208 0.2187 3298 O 93.3930 115.2020 77.0480 O.2 208 ARG208 -0.2778 3299 H 93.4370 113.0180 78.0540 H 208 ARG208 0.1312 3300 HA 92.7600 112.8480 75.1810 H 208 ARG208 0.0557 3301 HB1 90.8790 111.6920 76.2460 H 208 ARG208 0.0286 3302 HB2 90.3110 113.2710 75.8230 H 208 ARG208 0.0286 3303 HG1 89.5780 113.4300 77.9580 H 208 ARG208 0.0299 3304 HG2 91.2140 113.7260 78.4390 H 208 ARG208 0.0299 3305 HD1 91.4960 111.1750 78.7350 H 208 ARG208 0.0711 3306 HD2 89.7770 110.9970 78.4840 H 208 ARG208 0.0711 3307 HE 91.0140 111.7740 80.9650 H 208 ARG208 0.3153 3308 HH11 87.4000 113.1570 80.5060 H 208 ARG208 0.3114 3309 HH12 88.2130 112.5680 79.0840 H 208 ARG208 0.3114 3310 HH21 88.5060 113.1980 82.5280 H 208 ARG208 0.3114 3311 HH22 89.9990 112.3720 82.5830 H 208 ARG208 0.3114 3312 N 91.8700 115.4130 75.3950 N.am 209 ARG209 -0.2457 3313 CA 91.8450 116.8480 75.4590 C.3 209 ARG209 0.0879 3314 CB 92.2900 117.4070 74.0950 C.3 209 ARG209 -0.0258 3315 CG 93.5330 116.6790 73.5120 C.3 209 ARG209 -0.0154 3316 CD 94.8050 116.6980 74.3900 C.3 209 ARG209 0.1045 3317 NE 95.7860 115.7260 73.8800 N.pl3 209 ARG209 -0.4450 3318 CZ 96.1470 114.5700 74.4520 C.cat 209 ARG209 0.5062 3319 NH1 95.6890 114.1790 75.6120 N.pl3 209 ARG209 -0.4573 3320 NH2 96.9930 113.7880 73.8360 N.pl3 209 ARG209 -0.4573 3321 C 90.4710 117.1890 75.9350 C.2 209 ARG209 0.2187 3322 O 89.4830 116.7930 75.3130 O.2 209 ARG209 -0.2778 3323 H 91.3240 114.9370 74.6770 H 209 ARG209 0.1312 3324 HA 92.5460 117.1950 76.2200 H 209 ARG209 0.0557 3325 HB1 92.4900 118.4750 74.1850 H 209 ARG209 0.0286 3326 HB2 91.4720 117.3100 73.3800 H 209 ARG209 0.0286 3327 HG1 93.7740 117.1170 72.5440 H 209 ARG209 0.0299 3328 HG2 93.2730 115.6430 73.2930 H 209 ARG209 0.0299 3329 HD1 94.6020 116.4960 75.4400 H 209 ARG209 0.0711 3330 HD2 95.2800 117.6810 74.3510 H 209 ARG209 0.0711 3331 HE 96.2470 115.9200 73.0140 H 209 ARG209 0.3153 3332 HH11 95.9560 113.2870 75.9760 H 209 ARG209 0.3114 3333 HH12 95.0780 114.7610 76.1450 H 209 ARG209 0.3114 3334 HH21 97.2550 112.9170 74.2490 H 209 ARG209 0.3114 3335 HH22 97.3830 114.0460 72.9550 H 209 ARG209 0.3114 3336 N 90.3540 117.8930 77.0880 N.am 210 SER210 -0.2436 3337 CA 89.0570 118.2100 77.6250 C.3 210 SER210 0.1109 3338 CB 88.4040 116.9200 78.2090 C.3 210 SER210 0.0681 3339 OG 87.9250 116.0400 77.1990 O.3 210 SER210 -0.3930 3340 C 89.2610 119.1510 78.7650 C.2 210 SER210 0.2209 3341 O 90.3650 119.6220 79.0290 O.2 210 SER210 -0.2777 3342 H 91.1930 118.2010 77.5790 H 210 SER210 0.1312 3343 HA 88.4490 118.6900 76.8590 H 210 SER210 0.0580 3344 HB1 87.5570 117.1600 78.8620 H 210 SER210 0.0577 3345 HB2 89.1460 116.4090 78.8360 H 210 SER210 0.0577 3346 HG 87.6200 115.2150 77.5720 H 210 SER210 0.2095 3347 N 88.1610 119.4530 79.4710 N.am 211 ARG211 -0.2456 3348 CA 88.2540 120.2630 80.6450 C.3 211 ARG211 0.0879 3349 CB 87.2970 121.4770 80.6480 C.3 211 ARG211 -0.0258 3350 CG 85.7820 121.1940 80.8100 C.3 211 ARG211 -0.0154 3351 CD 85.0500 122.4010 81.4280 C.3 211 ARG211 0.1045 3352 NE 83.6000 122.2010 81.5380 N.pl3 211 ARG211 -0.4450 3353 CZ 82.9980 121.4580 82.4670 C.cat 211 ARG211 0.5062 3354 NH1 83.6710 120.7600 83.3360 N.pl3 211 ARG211 -0.4573 3355 NH2 81.6940 121.4200 82.5210 N.pl3 211 ARG211 -0.4573 3356 C 87.9220 119.3310 81.7570 C.2 211 ARG211 0.2187 3357 O 87.3200 118.2840 81.5240 O.2 211 ARG211 -0.2778 3358 H 87.2520 119.1020 79.1680 H 211 ARG211 0.1312 3359 HA 89.2780 120.6140 80.7930 H 211 ARG211 0.0557 3360 HB1 87.4640 122.0770 79.7530 H 211 ARG211 0.0286 3361 HB2 87.6080 122.1150 81.4770 H 211 ARG211 0.0286 3362 HG1 85.6060 120.3330 81.4520 H 211 ARG211 0.0299 3363 HG2 85.3490 120.9400 79.8420 H 211 ARG211 0.0299 3364 HD1 85.1970 123.2900 80.8100 H 211 ARG211 0.0711 3365 HD2 85.4420 122.6430 82.4210 H 211 ARG211 0.0711 3366 HE 83.0010 122.6660 80.8880 H 211 ARG211 0.3153 3367 HH11 83.1900 120.1760 83.9880 H 211 ARG211 0.3114 3368 HH12 84.6700 120.8010 83.3560 H 211 ARG211 0.3114 3369 HH21 81.2540 120.8730 83.2340 H 211 ARG211 0.3114 3370 HH22 81.1400 121.9340 81.8720 H 211 ARG211 0.3114 3371 N 88.3600 119.6690 82.9860 N.am 212 CYS212 -0.2449 3372 CA 88.0190 118.8850 84.1390 C.3 212 CYS212 0.0965 3373 CB 89.1780 118.9250 85.1460 C.3 212 CYS212 0.0147 3374 SG 90.7400 118.3410 84.4380 S.3 212 CYS212 -0.1762 3375 C 86.7760 119.5120 84.7030 C.2 212 CYS212 0.2192 3376 O 86.3160 120.5480 84.2170 O.2 212 CYS212 -0.2778 3377 H 88.9450 120.4970 83.0990 H 212 CYS212 0.1312 3378 HA 87.8120 117.8550 83.8440 H 212 CYS212 0.0565 3379 HB1 88.9420 118.3050 86.0110 H 212 CYS212 0.0394 3380 HB2 89.3310 119.9390 85.5200 H 212 CYS212 0.0394 3381 HG 91.5960 118.0440 85.4200 H 212 CYS212 0.1017 3382 N 86.1540 118.8520 85.7030 N.am 213 GLY213 -0.2484 3383 CA 84.9350 119.3510 86.2960 C.3 213 GLY213 0.0767 3384 C 83.7730 118.6050 85.7140 C.2 213 GLY213 0.2182 3385 O 83.8270 118.1290 84.5810 O.2 213 GLY213 -0.2779 3386 H 86.5550 117.9800 86.0480 H 213 GLY213 0.1309 3387 HA1 84.8330 120.4260 86.1380 H 213 GLY213 0.0521 3388 HA2 85.0330 119.1590 87.3640 H 213 GLY213 0.0521 3389 N 82.6890 118.5460 86.4490 N.am 214 PRO214 -0.2318 3390 CA 81.5430 117.8070 85.9930 C.3 214 PRO214 0.0907 3391 CD 82.5210 119.1850 87.7550 C.3 214 PRO214 0.0071 3392 CB 80.6430 117.7670 87.2370 C.3 214 PRO214 -0.0276 3393 CG 81.0310 119.0060 88.0390 C.3 214 PRO214 -0.0379 3394 C 80.8440 118.4480 84.8400 C.2 214 PRO214 0.2190 3395 O 80.9330 119.6640 84.6580 O.2 214 PRO214 -0.2778 3396 HA 81.8650 116.8010 85.7140 H 214 PRO214 0.0559 3397 HD1 82.8190 120.2330 87.7080 H 214 PRO214 0.0431 3398 HD2 83.1350 118.6390 88.4750 H 214 PRO214 0.0431 3399 HB1 80.8840 116.8800 87.8230 H 214 PRO214 0.0285 3400 HB2 79.5740 117.7250 87.0160 H 214 PRO214 0.0285 3401 HG1 80.4810 119.8700 87.6630 H 214 PRO214 0.0278 3402 HG2 80.8120 118.9090 89.1030 H 214 PRO214 0.0278 3403 N 80.1920 117.6100 84.0210 N.am 215 SER215 -0.2436 3404 CA 79.5020 118.0570 82.8560 C.3 215 SER215 0.1109 3405 CB 80.3770 117.9070 81.5990 C.3 215 SER215 0.0681 3406 OG 80.9720 116.6150 81.5290 O.3 215 SER215 -0.3930 3407 C 78.2830 117.2170 82.7480 C.2 215 SER215 0.2209 3408 O 78.3170 116.0170 83.0140 O.2 215 SER215 -0.2777 3409 H 80.1900 116.6140 84.2400 H 215 SER215 0.1312 3410 HA 79.1870 119.0920 82.9980 H 215 SER215 0.0580 3411 HB1 81.1700 118.6590 81.6350 H 215 SER215 0.0577 3412 HB2 79.7690 118.1110 80.7070 H 215 SER215 0.0577 3413 HG 81.3980 116.4750 80.6870 H 215 SER215 0.2095 3414 N 77.1720 117.8370 82.3270 N.am 216 LEU216 -0.2456 3415 CA 75.9590 117.1020 82.1250 C.3 216 LEU216 0.0880 3416 CB 74.7640 117.8710 82.7240 C.3 216 LEU216 -0.0266 3417 CG 74.6430 117.7630 84.2580 C.3 216 LEU216 -0.0449 3418 CD1 75.7480 118.5210 85.0100 C.3 216 LEU216 -0.0626 3419 CD2 73.2640 118.2560 84.7190 C.3 216 LEU216 -0.0626 3420 C 75.8150 116.9460 80.6450 C.2 216 LEU216 0.2185 3421 O 76.5560 117.5610 79.8730 O.2 216 LEU216 -0.2778 3422 H 77.1900 118.8410 82.1490 H 216 LEU216 0.1312 3423 HA 76.0220 116.1060 82.5680 H 216 LEU216 0.0557 3424 HB1 73.8410 117.4710 82.3000 H 216 LEU216 0.0287 3425 HB2 74.7970 118.9180 82.4210 H 216 LEU216 0.0287 3426 HG 74.7120 116.7100 84.5300 H 216 LEU216 0.0296 3427 HD11 75.5550 118.5230 86.0830 H 216 LEU216 0.0232 3428 HD12 75.8090 119.5590 84.6820 H 216 LEU216 0.0232 3429 HD13 76.7240 118.0600 84.8700 H 216 LEU216 0.0232 3430 HD21 73.1460 118.1440 85.7970 H 216 LEU216 0.0232 3431 HD22 72.4640 117.6880 84.2430 H 216 LEU216 0.0232 3432 HD23 73.1190 119.3080 84.4740 H 216 LEU216 0.0232 3433 N 74.8500 116.1010 80.2110 N.am 217 GLY217 -0.2485 3434 CA 74.6150 115.8450 78.8110 C.3 217 GLY217 0.0765 3435 C 74.3990 117.1540 78.1200 C.2 217 GLY217 0.2156 3436 O 73.3750 117.8170 78.2860 O.2 217 GLY217 -0.2781 3437 H 74.2670 115.6270 80.9010 H 217 GLY217 0.1309 3438 HA1 73.7220 115.2270 78.7290 H 217 GLY217 0.0521 3439 HA2 75.4750 115.3110 78.4060 H 217 GLY217 0.0521 3440 N 75.4140 117.5350 77.3250 N.am 218 SER218 -0.2439 3441 CA 75.4760 118.7830 76.6350 C.3 218 SER218 0.1109 3442 CB 76.1710 119.8400 77.5110 C.3 218 SER218 0.0681 3443 OG 77.5420 119.5280 77.7340 O.3 218 SER218 -0.3930 3444 C 76.1750 118.4810 75.3680 C.2 218 SER218 0.2207 3445 O 76.2690 117.3180 74.9780 O.2 218 SER218 -0.2777 3446 H 76.1940 116.8880 77.2070 H 218 SER218 0.1312 3447 HA 74.4570 119.0870 76.3930 H 218 SER218 0.0580 3448 HB1 75.6380 119.8920 78.4670 H 218 SER218 0.0577 3449 HB2 76.0810 120.8230 77.0370 H 218 SER218 0.0577 3450 HG 77.9570 120.1760 78.2950 H 218 SER218 0.2095 3451 N 76.6620 119.5490 74.7010 N.am 219 GLY219 -0.2484 3452 CA 77.4400 119.4470 73.5040 C.3 219 GLY219 0.0765 3453 C 78.8700 119.3360 73.9270 C.2 219 GLY219 0.2155 3454 O 79.1700 119.2690 75.1200 O.2 219 GLY219 -0.2781 3455 H 76.4650 120.4790 75.0700 H 219 GLY219 0.1309 3456 HA1 77.2800 120.3560 72.9250 H 219 GLY219 0.0521 3457 HA2 77.1270 118.5730 72.9310 H 219 GLY219 0.0521 3458 N 79.7810 119.3170 72.9370 N.am 220 ARG220 -0.2459 3459 CA 81.1860 119.1750 73.1830 C.3 220 ARG220 0.0879 3460 CB 81.7130 118.2110 72.0830 C.3 220 ARG220 -0.0258 3461 CG 80.6310 117.2610 71.5020 C.3 220 ARG220 -0.0154 3462 CD 81.1330 116.3230 70.4080 C.3 220 ARG220 0.1045 3463 NE 81.7770 117.0700 69.3260 N.pl3 220 ARG220 -0.4450 3464 CZ 81.1590 117.6430 68.3000 C.cat 220 ARG220 0.5062 3465 NH1 79.8580 117.6390 68.1910 N.pl3 220 ARG220 -0.4573 3466 NH2 81.8860 118.2200 67.3830 N.pl3 220 ARG220 -0.4573 3467 C 81.8250 120.5210 73.0470 C.2 220 ARG220 0.2185 3468 O 81.2390 121.4630 72.5090 O.2 220 ARG220 -0.2778 3469 H 79.4590 119.4070 71.9730 H 220 ARG220 0.1312 3470 HA 81.3430 118.7690 74.1850 H 220 ARG220 0.0557 3471 HB1 82.5440 117.6280 72.4810 H 220 ARG220 0.0286 3472 HB2 82.1280 118.7840 71.2520 H 220 ARG220 0.0286 3473 HG1 79.8150 117.8260 71.0500 H 220 ARG220 0.0299 3474 HG2 80.1910 116.6700 72.3070 H 220 ARG220 0.0299 3475 HD1 80.3360 115.6990 69.9970 H 220 ARG220 0.0711 3476 HD2 81.8770 115.6500 70.8210 H 220 ARG220 0.0711 3477 HE 82.7770 117.1570 69.3500 H 220 ARG220 0.3153 3478 HH11 79.4110 118.0710 67.4110 H 220 ARG220 0.3114 3479 HH12 79.3090 117.1960 68.8960 H 220 ARG220 0.3114 3480 HH21 81.4660 118.6950 66.6090 H 220 ARG220 0.3114 3481 HH22 82.8770 118.1710 67.4710 H 220 ARG220 0.3114 3482 N 83.0630 120.6380 73.5730 N.am 221 GLY221 -0.2485 3483 CA 83.8470 121.8370 73.4550 C.3 221 GLY221 0.0765 3484 C 84.4360 121.8820 72.0850 C.2 221 GLY221 0.2153 3485 O 85.0240 120.9050 71.6180 O.2 221 GLY221 -0.2781 3486 H 83.4580 119.8430 74.0750 H 221 GLY221 0.1309 3487 HA1 84.6350 121.7970 74.2050 H 221 GLY221 0.0521 3488 HA2 83.2070 122.7020 73.6470 H 221 GLY221 0.0521 3489 N 84.2790 123.0440 71.4160 N.am 222 GLY222 -0.2487 3490 CA 84.7850 123.2580 70.0890 C.3 222 GLY222 0.0767 3491 C 83.6730 123.0740 69.1000 C.2 222 GLY222 0.2182 3492 O 82.8810 122.1340 69.1830 O.2 222 GLY222 -0.2779 3493 H 83.7780 123.8050 71.8740 H 222 GLY222 0.1309 3494 HA1 85.5910 122.5530 69.8960 H 222 GLY222 0.0521 3495 HA2 85.2190 124.2520 70.1300 H 222 GLY222 0.0521 3496 N 83.6280 123.9880 68.1550 N.am 223 PRO223 -0.2318 3497 CA 82.6790 123.9420 67.0670 C.3 223 PRO223 0.0907 3498 CD 84.4660 125.1990 68.1020 C.3 223 PRO223 0.0071 3499 CB 82.5350 125.4190 66.6870 C.3 223 PRO223 -0.0276 3500 CG 83.9330 125.9880 66.9050 C.3 223 PRO223 -0.0379 3501 C 83.2590 123.1860 65.9140 C.2 223 PRO223 0.2187 3502 O 84.4450 122.8650 65.9620 O.2 223 PRO223 -0.2778 3503 HA 81.7350 123.5000 67.3920 H 223 PRO223 0.0559 3504 HD1 85.5170 124.9280 67.9920 H 223 PRO223 0.0431 3505 HD2 84.2990 125.7700 69.0180 H 223 PRO223 0.0431 3506 HB1 81.8390 125.9010 67.3750 H 223 PRO223 0.0285 3507 HB2 82.1600 125.5890 65.6770 H 223 PRO223 0.0285 3508 HG1 84.5510 125.7950 66.0270 H 223 PRO223 0.0278 3509 HG2 83.9260 127.0650 67.0770 H 223 PRO223 0.0278 3510 N 82.4330 122.8800 64.8860 N.am 224 GLY224 -0.2485 3511 CA 82.8720 122.2220 63.6810 C.3 224 GLY224 0.0765 3512 C 82.6930 120.7430 63.7930 C.2 224 GLY224 0.2155 3513 O 82.1710 120.2240 64.7790 O.2 224 GLY224 -0.2781 3514 H 81.4470 123.1280 64.9690 H 224 GLY224 0.1309 3515 HA1 83.9170 122.4700 63.4860 H 224 GLY224 0.0521 3516 HA2 82.2610 122.6050 62.8630 H 224 GLY224 0.0521 3517 N 83.1220 120.0300 62.7410 N.am 225 ALA225 -0.2462 3518 CA 83.0730 118.6020 62.7380 C.3 225 ALA225 0.0850 3519 CB 82.4620 118.1150 61.4190 C.3 225 ALA225 -0.0411 3520 C 84.4980 118.1930 62.8500 C.2 225 ALA225 0.2184 3521 O 85.3840 118.8880 62.3600 O.2 225 ALA225 -0.2778 3522 H 83.4910 120.5180 61.9250 H 225 ALA225 0.1311 3523 HA 82.5070 118.2210 63.5900 H 225 ALA225 0.0554 3524 HB1 82.4550 117.0260 61.3620 H 225 ALA225 0.0249 3525 HB2 83.0140 118.4920 60.5570 H 225 ALA225 0.0249 3526 HB3 81.4300 118.4550 61.3230 H 225 ALA225 0.0249 3527 N 84.7760 117.0770 63.5350 N.am 226 ARG226 -0.2457 3528 CA 86.1570 116.7250 63.6870 C.3 226 ARG226 0.0879 3529 CB 86.5520 116.7930 65.1690 C.3 226 ARG226 -0.0258 3530 CG 86.4750 118.2400 65.6660 C.3 226 ARG226 -0.0154 3531 CD 87.1690 118.4820 67.0080 C.3 226 ARG226 0.1045 3532 NE 87.2630 119.9250 67.1960 N.pl3 226 ARG226 -0.4450 3533 CZ 86.2710 120.6810 67.6460 C.cat 226 ARG226 0.5062 3534 NH1 85.1990 120.1700 68.2050 N.pl3 226 ARG226 -0.4573 3535 NH2 86.3910 121.9700 67.5040 N.pl3 226 ARG226 -0.4573 3536 C 86.3600 115.3610 63.1170 C.2 226 ARG226 0.2187 3537 O 85.4120 114.5900 62.9780 O.2 226 ARG226 -0.2778 3538 H 84.0350 116.5000 63.9330 H 226 ARG226 0.1312 3539 HA 86.8180 117.3800 63.1160 H 226 ARG226 0.0557 3540 HB1 87.5710 116.4230 65.2900 H 226 ARG226 0.0286 3541 HB2 85.9110 116.1460 65.7720 H 226 ARG226 0.0286 3542 HG1 85.4340 118.5600 65.7250 H 226 ARG226 0.0299 3543 HG2 86.9420 118.8860 64.9210 H 226 ARG226 0.0299 3544 HD1 88.1920 118.1030 66.9890 H 226 ARG226 0.0711 3545 HD2 86.6460 118.0200 67.8440 H 226 ARG226 0.0711 3546 HE 88.0950 120.4110 66.9300 H 226 ARG226 0.3153 3547 HH11 84.4350 120.7650 68.4570 H 226 ARG226 0.3114 3548 HH12 85.1440 119.1840 68.3900 H 226 ARG226 0.3114 3549 HH21 85.6190 122.5700 67.7120 H 226 ARG226 0.3114 3550 HH22 87.2360 122.3720 67.1600 H 226 ARG226 0.3114 3551 N 87.6300 115.0670 62.7400 N.am 227 ARG227 -0.2457 3552 CA 88.1280 113.7990 62.2460 C.3 227 ARG227 0.0879 3553 CB 89.4810 113.9730 61.5360 C.3 227 ARG227 -0.0258 3554 CG 89.3600 114.8040 60.2470 C.3 227 ARG227 -0.0154 3555 CD 90.6580 114.8380 59.4290 C.3 227 ARG227 0.1045 3556 NE 90.4420 115.6070 58.2010 N.pl3 227 ARG227 -0.4450 3557 CZ 91.3850 115.8500 57.2930 C.cat 227 ARG227 0.5062 3558 NH1 92.6030 115.3970 57.4400 N.pl3 227 ARG227 -0.4573 3559 NH2 91.0910 116.5550 56.2340 N.pl3 227 ARG227 -0.4573 3560 C 88.1820 112.7540 63.3440 C.2 227 ARG227 0.2187 3561 O 87.8540 111.5930 63.1000 O.2 227 ARG227 -0.2778 3562 H 88.3110 115.8230 62.8120 H 227 ARG227 0.1312 3563 HA 87.3870 113.4440 61.5270 H 227 ARG227 0.0557 3564 HB1 89.8760 112.9880 61.2780 H 227 ARG227 0.0286 3565 HB2 90.2060 114.4280 62.2130 H 227 ARG227 0.0286 3566 HG1 89.0540 115.8220 60.4920 H 227 ARG227 0.0299 3567 HG2 88.5650 114.3850 59.6280 H 227 ARG227 0.0299 3568 HD1 90.9640 113.8260 59.1500 H 227 ARG227 0.0711 3569 HD2 91.4640 115.3090 59.9990 H 227 ARG227 0.0711 3570 HE 89.5310 115.9760 58.0180 H 227 ARG227 0.3153 3571 HH11 93.3020 115.5930 56.7560 H 227 ARG227 0.3114 3572 HH12 92.8330 114.8500 58.2410 H 227 ARG227 0.3114 3573 HH21 91.7880 116.7460 55.5470 H 227 ARG227 0.3114 3574 HH22 90.1660 116.9060 56.1040 H 227 ARG227 0.3114 3575 N 88.6150 113.1640 64.5660 N.am 228 ARG228 -0.2457 3576 CA 88.7920 112.3670 65.7620 C.3 228 ARG228 0.0879 3577 CB 89.8050 113.0290 66.7090 C.3 228 ARG228 -0.0258 3578 CG 89.5260 114.5180 66.9630 C.3 228 ARG228 -0.0154 3579 CD 90.2810 115.0520 68.1880 C.3 228 ARG228 0.1045 3580 NE 89.6420 114.6030 69.4270 N.pl3 228 ARG228 -0.4450 3581 CZ 88.5170 115.1310 69.9020 C.cat 228 ARG228 0.5062 3582 NH1 87.8620 116.0370 69.2400 N.pl3 228 ARG228 -0.4573 3583 NH2 88.0300 114.7530 71.0450 N.pl3 228 ARG228 -0.4573 3584 C 87.4860 112.0980 66.4480 C.2 228 ARG228 0.2185 3585 O 86.4740 112.7500 66.1940 O.2 228 ARG228 -0.2778 3586 H 88.8430 114.1550 64.6510 H 228 ARG228 0.1312 3587 HA 89.1840 111.4030 65.4310 H 228 ARG228 0.0557 3588 HB1 90.8050 112.9290 66.2860 H 228 ARG228 0.0286 3589 HB2 89.8320 112.4820 67.6520 H 228 ARG228 0.0286 3590 HG1 88.4540 114.6800 67.0770 H 228 ARG228 0.0299 3591 HG2 89.8240 115.0890 66.0830 H 228 ARG228 0.0299 3592 HD1 90.3280 116.1430 68.1940 H 228 ARG228 0.0711 3593 HD2 91.3110 114.6880 68.1990 H 228 ARG228 0.0711 3594 HE 90.0350 113.8500 69.9540 H 228 ARG228 0.3153 3595 HH11 87.0040 116.3860 69.6360 H 228 ARG228 0.3114 3596 HH12 88.2000 116.3490 68.3640 H 228 ARG228 0.3114 3597 HH21 87.1700 115.1870 71.3300 H 228 ARG228 0.3114 3598 HH22 88.4700 114.0520 71.5960 H 228 ARG228 0.3114 3599 N 87.5000 111.0800 67.3380 N.am 229 GLY229 -0.2485 3600 CA 86.3550 110.7530 68.1380 C.3 229 GLY229 0.0765 3601 C 86.2920 111.8010 69.1960 C.2 229 GLY229 0.2155 3602 O 87.2910 112.4640 69.4890 O.2 229 GLY229 -0.2781 3603 H 88.3510 110.5280 67.4440 H 229 GLY229 0.1309 3604 HA1 86.5160 109.7690 68.5780 H 229 GLY229 0.0521 3605 HA2 85.4590 110.7490 67.5150 H 229 GLY229 0.0521 3606 N 85.0990 111.9970 69.7860 N.am 230 GLU230 -0.2459 3607 CA 85.0050 113.0190 70.7820 C.3 230 GLU230 0.0883 3608 CB 83.8540 113.9760 70.4500 C.3 230 GLU230 -0.0193 3609 CG 84.2540 114.9810 69.3380 C.3 230 GLU230 0.0356 3610 CD 84.9200 116.2860 69.8680 C.2 230 GLU230 0.1760 3611 OE1 85.6170 116.2460 70.8810 O.co2 230 GLU230 -0.6478 3612 OE2 84.7560 117.3500 69.2630 O.co2 230 GLU230 -0.6478 3613 C 84.9930 112.4190 72.1430 C.2 230 GLU230 0.2187 3614 O 85.0090 111.2020 72.3330 O.2 230 GLU230 -0.2778 3615 H 84.2870 111.4350 69.5310 H 230 GLU230 0.1312 3616 HA 85.8930 113.6370 70.7760 H 230 GLU230 0.0557 3617 HB1 83.5440 114.5190 71.3410 H 230 GLU230 0.0290 3618 HB2 82.9880 113.3920 70.1340 H 230 GLU230 0.0290 3619 HG1 83.3790 115.2430 68.7490 H 230 GLU230 0.0374 3620 HG2 84.9410 114.5160 68.6310 H 230 GLU230 0.0374 3621 N 84.9960 113.3420 73.1250 N.am 231 ARG231 -0.2457 3622 CA 85.1010 113.1170 74.5360 C.3 231 ARG231 0.0879 3623 CB 85.2450 114.5040 75.2010 C.3 231 ARG231 -0.0258 3624 CG 86.2550 115.4820 74.5670 C.3 231 ARG231 -0.0154 3625 CD 85.9300 116.9070 75.0290 C.3 231 ARG231 0.1045 3626 NE 86.8580 117.9010 74.4930 N.pl3 231 ARG231 -0.4450 3627 CZ 86.5870 118.6750 73.4450 C.cat 231 ARG231 0.5062 3628 NH1 85.6500 118.3810 72.5880 N.pl3 231 ARG231 -0.4573 3629 NH2 87.2730 119.7680 73.2590 N.pl3 231 ARG231 -0.4573 3630 C 83.8450 112.5330 75.0910 C.2 231 ARG231 0.2187 3631 O 82.7280 112.8310 74.6690 O.2 231 ARG231 -0.2778 3632 H 84.9140 114.3150 72.8290 H 231 ARG231 0.1312 3633 HA 85.9590 112.4660 74.7140 H 231 ARG231 0.0557 3634 HB1 85.4670 114.3820 76.2620 H 231 ARG231 0.0286 3635 HB2 84.2710 114.9990 75.1660 H 231 ARG231 0.0286 3636 HG1 86.2110 115.4720 73.4800 H 231 ARG231 0.0299 3637 HG2 87.2740 115.2040 74.8360 H 231 ARG231 0.0299 3638 HD1 85.9870 116.9810 76.1160 H 231 ARG231 0.0711 3639 HD2 84.9060 117.1850 74.7660 H 231 ARG231 0.0711 3640 HE 87.7290 118.0080 74.9720 H 231 ARG231 0.3153 3641 HH11 85.3410 119.0550 71.9210 H 231 ARG231 0.3114 3642 HH12 85.2400 117.4670 72.5620 H 231 ARG231 0.3114 3643 HH21 87.0440 120.3530 72.4840 H 231 ARG231 0.3114 3644 HH22 88.0080 120.0180 73.8840 H 231 ARG231 0.3114 3645 N 84.0510 111.6490 76.0750 N.am 232 VAL232 -0.2454 3646 CA 83.0160 111.0240 76.8280 C.3 232 VAL232 0.0901 3647 CB 83.3020 109.5140 76.9680 C.3 232 VAL232 -0.0227 3648 CG1 82.2170 108.7970 77.7860 C.3 232 VAL232 -0.0608 3649 CG2 83.4390 108.8460 75.5900 C.3 232 VAL232 -0.0608 3650 C 83.0900 111.7610 78.1350 C.2 232 VAL232 0.2190 3651 O 84.1840 112.0550 78.6060 O.2 232 VAL232 -0.2778 3652 H 85.0160 111.4060 76.3010 H 232 VAL232 0.1312 3653 HA 82.0500 111.2020 76.3510 H 232 VAL232 0.0560 3654 HB 84.2530 109.3860 77.4880 H 232 VAL232 0.0315 3655 HG11 82.4230 107.7290 77.8560 H 232 VAL232 0.0233 3656 HG12 81.2350 108.9160 77.3270 H 232 VAL232 0.0233 3657 HG13 82.1600 109.1810 78.8020 H 232 VAL232 0.0233 3658 HG21 83.6240 107.7760 75.6900 H 232 VAL232 0.0233 3659 HG22 84.2670 109.2620 75.0150 H 232 VAL232 0.0233 3660 HG23 82.5300 108.9710 75.0010 H 232 VAL232 0.0233 3661 N 81.9450 112.0950 78.7700 N.am 233 SER233 -0.2436 3662 CA 81.9160 112.8610 79.9990 C.3 233 SER233 0.1109 3663 CB 80.4580 113.2210 80.3310 C.3 233 SER233 0.0681 3664 OG 79.7160 112.0380 80.6070 O.3 233 SER233 -0.3930 3665 C 82.5240 112.1060 81.1480 C.2 233 SER233 0.2209 3666 O 82.9330 112.7150 82.1380 O.2 233 SER233 -0.2777 3667 H 81.0590 111.7930 78.3650 H 233 SER233 0.1312 3668 HA 82.5000 113.7660 79.8280 H 233 SER233 0.0580 3669 HB1 80.0210 113.7590 79.4820 H 233 SER233 0.0577 3670 HB2 80.4250 113.8910 81.1980 H 233 SER233 0.0577 3671 HG 78.7900 112.2330 80.7470 H 233 SER233 0.2095 3672 N 82.5420 110.7620 81.0620 N.am 234 MET234 -0.2456 3673 CA 83.0390 109.9220 82.1160 C.3 234 MET234 0.0886 3674 CB 82.2940 108.5780 82.0500 C.3 234 MET234 -0.0199 3675 CG 80.7800 108.7080 82.2850 C.3 234 MET234 -0.0047 3676 SD 80.4240 109.3560 83.9310 S.3 234 MET234 -0.1641 3677 CE 78.7960 108.6250 84.2090 C.3 234 MET234 -0.0181 3678 C 84.5030 109.7090 81.9680 C.2 234 MET234 0.2187 3679 O 85.0330 109.5780 80.8650 O.2 234 MET234 -0.2778 3680 H 82.1880 110.3220 80.2120 H 234 MET234 0.1312 3681 HA 82.8320 110.4000 83.0690 H 234 MET234 0.0557 3682 HB1 82.7050 107.8950 82.7930 H 234 MET234 0.0293 3683 HB2 82.4650 108.1120 81.0790 H 234 MET234 0.0293 3684 HG1 80.3290 107.7200 82.1860 H 234 MET234 0.0377 3685 HG2 80.3080 109.3450 81.5350 H 234 MET234 0.0377 3686 HE1 78.5840 108.5740 85.2780 H 234 MET234 0.0340 3687 HE2 78.7580 107.6060 83.8260 H 234 MET234 0.0340 3688 HE3 78.0200 109.2100 83.7140 H 234 MET234 0.0340 3689 N 85.1860 109.7030 83.1200 N.am 235 ALA235 -0.2459 3690 CA 86.5730 109.3780 83.1450 C.3 235 ALA235 0.0850 3691 CB 87.4100 110.5080 82.5760 C.3 235 ALA235 -0.0411 3692 C 86.9100 109.0670 84.5700 C.2 235 ALA235 0.2184 3693 O 86.5080 109.7880 85.4930 O.2 235 ALA235 -0.2778 3694 H 84.7070 109.9340 83.9900 H 235 ALA235 0.1312 3695 HA 86.7060 108.4720 82.5490 H 235 ALA235 0.0554 3696 HB1 88.4100 110.1440 82.3430 H 235 ALA235 0.0249 3697 HB2 87.4860 111.3280 83.2860 H 235 ALA235 0.0249 3698 HB3 86.9890 110.8940 81.6510 H 235 ALA235 0.0249 3699 N 87.7530 108.0260 84.7500 N.am 236 GLU236 -0.2456 3700 CA 88.2220 107.5830 86.0560 C.3 236 GLU236 0.0883 3701 CB 89.3700 106.5730 85.8110 C.3 236 GLU236 -0.0193 3702 CG 88.9940 105.3270 84.9940 C.3 236 GLU236 0.0356 3703 CD 88.0670 104.4420 85.8180 C.2 236 GLU236 0.1760 3704 OE1 88.5070 103.9220 86.8350 O.co2 236 GLU236 -0.6478 3705 OE2 86.9040 104.2840 85.4650 O.co2 236 GLU236 -0.6478 3706 C 88.8060 108.7280 86.8720 C.2 236 GLU236 0.2187 3707 O 88.3750 108.9790 88.0060 O.2 236 GLU236 -0.2778 3708 H 88.0790 107.5220 83.9250 H 236 GLU236 0.1312 3709 HA 87.3560 107.1750 86.5570 H 236 GLU236 0.0557 3710 HB1 89.8040 106.2620 86.7620 H 236 GLU236 0.0290 3711 HB2 90.1790 107.0700 85.2720 H 236 GLU236 0.0290 3712 HG1 89.8870 104.7480 84.7610 H 236 GLU236 0.0374 3713 HG2 88.5240 105.5830 84.0460 H 236 GLU236 0.0374 3714 N 89.7840 109.4370 86.3110 N.am 237 GLU237 -0.2456 3715 CA 90.3550 110.5680 87.0220 C.3 237 GLU237 0.0883 3716 CB 91.7230 110.9510 86.4280 C.3 237 GLU237 -0.0193 3717 CG 91.7630 111.9090 85.2300 C.3 237 GLU237 0.0356 3718 CD 91.0680 111.4310 83.9430 C.2 237 GLU237 0.1760 3719 OE1 89.9390 110.9740 84.0000 O.co2 237 GLU237 -0.6478 3720 OE2 91.6320 111.5370 82.8540 O.co2 237 GLU237 -0.6478 3721 C 89.3500 111.6880 87.2450 C.2 237 GLU237 0.2188 3722 O 89.5650 112.5060 88.1400 O.2 237 GLU237 -0.2778 3723 H 90.1310 109.1870 85.3850 H 237 GLU237 0.1312 3724 HA 90.5770 110.1800 88.0100 H 237 GLU237 0.0557 3725 HB1 92.2590 110.0380 86.1700 H 237 GLU237 0.0290 3726 HB2 92.3100 111.4150 87.2220 H 237 GLU237 0.0290 3727 HG1 92.8120 112.0810 84.9950 H 237 GLU237 0.0374 3728 HG2 91.3280 112.8700 85.5040 H 237 GLU237 0.0374 3729 N 88.2360 111.7160 86.5120 N.am 238 THR238 -0.2434 3730 CA 87.1690 112.6520 86.8540 C.3 238 THR238 0.1135 3731 CB 86.0930 112.8810 85.7750 C.3 238 THR238 0.0763 3732 OG1 86.7000 113.2890 84.5570 O.3 238 THR238 -0.3900 3733 CG2 85.1120 113.9840 86.2300 C.3 238 THR238 -0.0370 3734 C 86.5900 112.3280 88.2280 C.2 238 THR238 0.2212 3735 O 86.4740 113.2050 89.0970 O.2 238 THR238 -0.2777 3736 H 88.1300 111.0870 85.7170 H 238 THR238 0.1313 3737 HA 87.6750 113.6130 86.9690 H 238 THR238 0.0583 3738 HB 85.5700 111.9360 85.6210 H 238 THR238 0.0611 3739 HG1 86.0530 113.4260 83.8740 H 238 THR238 0.2098 3740 HG21 84.3970 114.2740 85.4620 H 238 THR238 0.0255 3741 HG22 85.6550 114.8860 86.5130 H 238 THR238 0.0255 3742 HG23 84.5370 113.6620 87.0970 H 238 THR238 0.0255 3743 N 86.2300 111.0610 88.4410 N.am 239 ASP239 -0.2450 3744 CA 85.7330 110.6350 89.7430 C.3 239 ASP239 0.0974 3745 CB 85.2980 109.1580 89.7030 C.3 239 ASP239 0.0576 3746 CG 84.3370 108.7710 88.5610 C.2 239 ASP239 0.1780 3747 OD1 83.1750 109.1580 88.5670 O.co2 239 ASP239 -0.6478 3748 OD2 84.7500 108.0580 87.6560 O.co2 239 ASP239 -0.6478 3749 C 86.7900 110.8340 90.8190 C.2 239 ASP239 0.2192 3750 O 86.4720 111.2030 91.9570 O.2 239 ASP239 -0.2778 3751 H 86.3030 110.3820 87.6830 H 239 ASP239 0.1312 3752 HA 84.8760 111.2660 89.9790 H 239 ASP239 0.0563 3753 HB1 84.7970 108.8970 90.6320 H 239 ASP239 0.0394 3754 HB2 86.1820 108.5290 89.6060 H 239 ASP239 0.0394 3755 N 88.0580 110.5950 90.4750 N.am 240 HIS240 -0.2453 3756 CA 89.1260 110.7740 91.4530 C.3 240 HIS240 0.0932 3757 ND1 90.9030 108.2210 89.4990 N.ar 240 HIS240 -0.2469 3758 CG 90.4330 108.7900 90.6280 C.ar 240 HIS240 0.0551 3759 CB 90.4770 110.2750 90.9130 C.3 240 HIS240 0.0146 3760 NE2 90.1800 106.5900 90.8320 N.ar 240 HIS240 -0.2539 3761 CD2 90.0200 107.7620 91.4890 C.ar 240 HIS240 0.0047 3762 CE1 90.7180 106.8980 89.6380 C.ar 240 HIS240 0.0737 3763 C 89.2690 112.2370 91.8620 C.2 240 HIS240 0.2190 3764 O 89.3960 112.5400 93.0530 O.2 240 HIS240 -0.2778 3765 H 88.2800 110.2870 89.5280 H 240 HIS240 0.1312 3766 HA 88.8440 110.2130 92.3450 H 240 HIS240 0.0561 3767 HB1 91.2690 110.4510 91.6420 H 240 HIS240 0.0348 3768 HB2 90.7590 110.8230 90.0150 H 240 HIS240 0.0348 3769 HE2 89.9830 105.6890 91.1630 H 240 HIS240 0.1339 3770 HD2 89.6460 107.9020 92.4910 H 240 HIS240 0.0764 3771 HE1 90.9910 106.1740 88.8820 H 240 HIS240 0.0963 3772 N 89.2460 113.1600 90.8940 N.am 241 LEU241 -0.2456 3773 CA 89.2520 114.5820 91.2240 C.3 241 LEU241 0.0880 3774 CB 89.1620 115.3910 89.9070 C.3 241 LEU241 -0.0266 3775 CG 90.4860 116.0080 89.4330 C.3 241 LEU241 -0.0449 3776 CD1 91.5510 114.9560 89.1190 C.3 241 LEU241 -0.0626 3777 CD2 90.2390 116.8930 88.2050 C.3 241 LEU241 -0.0626 3778 C 88.0660 114.9590 92.0950 C.2 241 LEU241 0.2187 3779 O 88.2220 115.7010 93.0690 O.2 241 LEU241 -0.2778 3780 H 89.2240 112.8680 89.9170 H 241 LEU241 0.1312 3781 HA 90.1700 114.7990 91.7730 H 241 LEU241 0.0557 3782 HB1 88.4570 116.2190 90.0090 H 241 LEU241 0.0287 3783 HB2 88.7410 114.7680 89.1170 H 241 LEU241 0.0287 3784 HG 90.8680 116.6440 90.2330 H 241 LEU241 0.0296 3785 HD11 92.4780 115.4390 88.8100 H 241 LEU241 0.0232 3786 HD12 91.2400 114.3010 88.3070 H 241 LEU241 0.0232 3787 HD13 91.7700 114.3380 89.9890 H 241 LEU241 0.0232 3788 HD21 91.1610 117.3650 87.8760 H 241 LEU241 0.0232 3789 HD22 89.5230 117.6850 88.4250 H 241 LEU241 0.0232 3790 HD23 89.8500 116.3080 87.3710 H 241 LEU241 0.0232 3791 N 86.8700 114.4810 91.7510 N.am 242 ILE242 -0.2454 3792 CA 85.6890 114.8590 92.5240 C.3 242 ILE242 0.0903 3793 CB 84.4160 114.2950 91.8480 C.3 242 ILE242 -0.0201 3794 CG1 84.1870 114.9380 90.4640 C.3 242 ILE242 -0.0514 3795 CG2 83.1640 114.4910 92.7260 C.3 242 ILE242 -0.0605 3796 CD1 83.2030 114.1570 89.5830 C.3 242 ILE242 -0.0650 3797 C 85.8270 114.4000 93.9710 C.2 242 ILE242 0.2189 3798 O 85.6560 115.1900 94.9130 O.2 242 ILE242 -0.2778 3799 H 86.7790 113.8540 90.9520 H 242 ILE242 0.1312 3800 HA 85.6470 115.9500 92.5320 H 242 ILE242 0.0560 3801 HB 84.5650 113.2230 91.7070 H 242 ILE242 0.0318 3802 HG11 85.1280 115.0280 89.9240 H 242 ILE242 0.0266 3803 HG12 83.8310 115.9610 90.5930 H 242 ILE242 0.0266 3804 HG21 82.2720 114.0860 92.2510 H 242 ILE242 0.0233 3805 HG22 82.9860 115.5470 92.9250 H 242 ILE242 0.0233 3806 HG23 83.2610 113.9880 93.6880 H 242 ILE242 0.0233 3807 HD11 83.0810 114.6460 88.6170 H 242 ILE242 0.0230 3808 HD12 82.2170 114.0890 90.0400 H 242 ILE242 0.0230 3809 HD13 83.5600 113.1420 89.4020 H 242 ILE242 0.0230 3810 N 86.1630 113.1230 94.1700 N.am 243 LEU243 -0.2456 3811 CA 86.2800 112.5810 95.5190 C.3 243 LEU243 0.0880 3812 CB 86.4810 111.0600 95.4240 C.3 243 LEU243 -0.0266 3813 CG 86.4320 110.3240 96.7770 C.3 243 LEU243 -0.0449 3814 CD1 85.0960 110.5420 97.5020 C.3 243 LEU243 -0.0626 3815 CD2 86.6790 108.8250 96.5770 C.3 243 LEU243 -0.0626 3816 C 87.3970 113.2670 96.2970 C.2 243 LEU243 0.2187 3817 O 87.2420 113.5800 97.4840 O.2 243 LEU243 -0.2778 3818 H 86.3400 112.5180 93.3680 H 243 LEU243 0.1312 3819 HA 85.3380 112.8050 96.0170 H 243 LEU243 0.0557 3820 HB1 87.4290 110.8530 94.9240 H 243 LEU243 0.0287 3821 HB2 85.7080 110.6480 94.7730 H 243 LEU243 0.0287 3822 HG 87.2280 110.7090 97.4160 H 243 LEU243 0.0296 3823 HD11 85.0370 109.9320 98.4030 H 243 LEU243 0.0232 3824 HD12 84.2520 110.2740 96.8660 H 243 LEU243 0.0232 3825 HD13 84.9730 111.5810 97.8060 H 243 LEU243 0.0232 3826 HD21 86.6700 108.2960 97.5310 H 243 LEU243 0.0232 3827 HD22 87.6440 108.6450 96.1040 H 243 LEU243 0.0232 3828 HD23 85.9050 108.3900 95.9450 H 243 LEU243 0.0232 3829 N 88.5310 113.5240 95.6410 N.am 244 LEU244 -0.2456 3830 CA 89.6630 114.1160 96.3410 C.3 244 LEU244 0.0880 3831 CB 90.9250 113.9330 95.4860 C.3 244 LEU244 -0.0266 3832 CG 92.2320 114.4380 96.1290 C.3 244 LEU244 -0.0449 3833 CD1 92.4420 113.9280 97.5630 C.3 244 LEU244 -0.0626 3834 CD2 93.4270 114.0440 95.2550 C.3 244 LEU244 -0.0626 3835 C 89.3950 115.5710 96.6970 C.2 244 LEU244 0.2187 3836 O 89.8270 116.0440 97.7520 O.2 244 LEU244 -0.2778 3837 H 88.6050 113.3050 94.6470 H 244 LEU244 0.1312 3838 HA 89.7740 113.5620 97.2750 H 244 LEU244 0.0557 3839 HB1 90.7830 114.4250 94.5220 H 244 LEU244 0.0287 3840 HB2 91.0300 112.8710 95.2640 H 244 LEU244 0.0287 3841 HG 92.1910 115.5270 96.1720 H 244 LEU244 0.0296 3842 HD11 93.4050 114.2560 97.9540 H 244 LEU244 0.0232 3843 HD12 92.4170 112.8390 97.6030 H 244 LEU244 0.0232 3844 HD13 91.6800 114.3080 98.2430 H 244 LEU244 0.0232 3845 HD21 94.3420 114.5020 95.6270 H 244 LEU244 0.0232 3846 HD22 93.2910 114.3600 94.2210 H 244 LEU244 0.0232 3847 HD23 93.5680 112.9630 95.2520 H 244 LEU244 0.0232 3848 N 88.6780 116.2970 95.8360 N.am 245 ALA245 -0.2459 3849 CA 88.3260 117.6740 96.1550 C.3 245 ALA245 0.0850 3850 CB 87.7290 118.3230 94.9020 C.3 245 ALA245 -0.0411 3851 C 87.3360 117.7300 97.3070 C.2 245 ALA245 0.2184 3852 O 87.4250 118.6130 98.1680 O.2 245 ALA245 -0.2778 3853 H 88.3760 115.8860 94.9530 H 245 ALA245 0.1312 3854 HA 89.2390 118.1920 96.4520 H 245 ALA245 0.0554 3855 HB1 87.4590 119.3640 95.0830 H 245 ALA245 0.0249 3856 HB2 86.8360 117.7930 94.5690 H 245 ALA245 0.0249 3857 HB3 88.4470 118.3040 94.0810 H 245 ALA245 0.0249 3858 N 86.3820 116.7950 97.3400 N.am 246 ILE246 -0.2454 3859 CA 85.4980 116.6880 98.4990 C.3 246 ILE246 0.0903 3860 CB 84.4670 115.5590 98.2540 C.3 246 ILE246 -0.0201 3861 CG1 83.5000 115.9410 97.1140 C.3 246 ILE246 -0.0514 3862 CG2 83.6760 115.1970 99.5270 C.3 246 ILE246 -0.0605 3863 CD1 82.7260 114.7480 96.5420 C.3 246 ILE246 -0.0650 3864 C 86.3150 116.4640 99.7660 C.2 246 ILE246 0.2189 3865 O 86.1400 117.1630 100.7750 O.2 246 ILE246 -0.2778 3866 H 86.2710 116.1540 96.5540 H 246 ILE246 0.1312 3867 HA 84.9770 117.6400 98.5960 H 246 ILE246 0.0560 3868 HB 85.0180 114.6700 97.9450 H 246 ILE246 0.0318 3869 HG11 84.0460 116.4090 96.2960 H 246 ILE246 0.0266 3870 HG12 82.8010 116.7000 97.4660 H 246 ILE246 0.0266 3871 HG21 82.9500 114.4070 99.3360 H 246 ILE246 0.0233 3872 HG22 83.1360 116.0620 99.9130 H 246 ILE246 0.0233 3873 HG23 84.3270 114.8310 100.3210 H 246 ILE246 0.0233 3874 HD11 82.0970 115.0610 95.7080 H 246 ILE246 0.0230 3875 HD12 82.0770 114.2910 97.2880 H 246 ILE246 0.0230 3876 HD13 83.4050 113.9810 96.1720 H 246 ILE246 0.0230 3877 N 87.2180 115.4790 99.7300 N.am 247 MET247 -0.2456 3878 CA 88.0970 115.2070 100.8640 C.3 247 MET247 0.0886 3879 CB 89.1150 114.1090 100.5090 C.3 247 MET247 -0.0199 3880 CG 88.4940 112.7120 100.4190 C.3 247 MET247 -0.0047 3881 SD 89.7300 111.4770 99.9620 S.3 247 MET247 -0.1641 3882 CE 88.7930 110.0010 100.3960 C.3 247 MET247 -0.0181 3883 C 88.8260 116.4640 101.3180 C.2 247 MET247 0.2188 3884 O 88.8570 116.7860 102.5110 O.2 247 MET247 -0.2778 3885 H 87.2950 114.9040 98.8910 H 247 MET247 0.1312 3886 HA 87.4620 114.8770 101.6870 H 247 MET247 0.0557 3887 HB1 89.8990 114.0740 101.2670 H 247 MET247 0.0293 3888 HB2 89.6100 114.3520 99.5700 H 247 MET247 0.0293 3889 HG1 87.6710 112.6780 99.7070 H 247 MET247 0.0377 3890 HG2 88.0700 112.4470 101.3900 H 247 MET247 0.0377 3891 HE1 89.4600 109.1490 100.5190 H 247 MET247 0.0340 3892 HE2 88.0540 109.7870 99.6250 H 247 MET247 0.0340 3893 HE3 88.2710 110.1470 101.3430 H 247 MET247 0.0340 3894 N 89.4250 117.1860 100.3680 N.am 248 THR248 -0.2434 3895 CA 90.2640 118.3280 100.7100 C.3 248 THR248 0.1135 3896 CB 90.9690 118.8240 99.4340 C.3 248 THR248 0.0763 3897 OG1 91.6680 117.7350 98.8540 O.3 248 THR248 -0.3900 3898 CG2 91.9900 119.9390 99.7080 C.3 248 THR248 -0.0370 3899 C 89.4450 119.4620 101.3080 C.2 248 THR248 0.2212 3900 O 89.8430 120.0500 102.3200 O.2 248 THR248 -0.2777 3901 H 89.2940 116.9350 99.3880 H 248 THR248 0.1313 3902 HA 90.9940 117.9880 101.4460 H 248 THR248 0.0583 3903 HB 90.1890 119.1920 98.7520 H 248 THR248 0.0611 3904 HG1 91.8420 117.8980 97.9320 H 248 THR248 0.2098 3905 HG21 92.4690 120.2680 98.7870 H 248 THR248 0.0255 3906 HG22 92.7740 119.5890 100.3790 H 248 THR248 0.0255 3907 HG23 91.5240 120.8130 100.1620 H 248 THR248 0.0255 3908 N 88.2950 119.7800 100.7100 N.am 249 ILE249 -0.2453 3909 CA 87.5080 120.8960 101.2230 C.3 249 ILE249 0.0903 3910 CB 86.4290 121.3580 100.2190 C.3 249 ILE249 -0.0201 3911 CG1 85.3350 120.2960 99.9850 C.3 249 ILE249 -0.0514 3912 CG2 87.0840 121.8370 98.9130 C.3 249 ILE249 -0.0605 3913 CD1 84.2950 120.6820 98.9280 C.3 249 ILE249 -0.0650 3914 C 86.9190 120.5530 102.5860 C.2 249 ILE249 0.2190 3915 O 86.8250 121.4200 103.4650 O.2 249 ILE249 -0.2778 3916 H 87.9700 119.2480 99.9030 H 249 ILE249 0.1312 3917 HA 88.2020 121.7240 101.3800 H 249 ILE249 0.0560 3918 HB 85.9360 122.2290 100.6530 H 249 ILE249 0.0318 3919 HG11 84.8090 120.1020 100.9200 H 249 ILE249 0.0266 3920 HG12 85.7940 119.3540 99.7050 H 249 ILE249 0.0266 3921 HG21 86.3590 122.3100 98.2510 H 249 ILE249 0.0233 3922 HG22 87.5500 121.0200 98.3660 H 249 ILE249 0.0233 3923 HG23 87.8590 122.5770 99.1170 H 249 ILE249 0.0233 3924 HD11 83.5030 119.9340 98.8790 H 249 ILE249 0.0230 3925 HD12 84.7410 120.7470 97.9360 H 249 ILE249 0.0230 3926 HD13 83.8350 121.6430 99.1600 H 249 ILE249 0.0230 3927 N 86.5510 119.2860 102.8090 N.am 250 THR250 -0.2434 3928 CA 86.0460 118.9130 104.1270 C.3 250 THR250 0.1135 3929 CB 85.3920 117.5150 104.1200 C.3 250 THR250 0.0763 3930 OG1 86.3100 116.5640 103.6120 O.3 250 THR250 -0.3900 3931 CG2 84.0970 117.4940 103.2940 C.3 250 THR250 -0.0370 3932 C 87.1520 118.9610 105.1750 C.2 250 THR250 0.2212 3933 O 86.9530 119.4930 106.2720 O.2 250 THR250 -0.2777 3934 H 86.6220 118.5890 102.0670 H 250 THR250 0.1313 3935 HA 85.2850 119.6420 104.3980 H 250 THR250 0.0583 3936 HB 85.1370 117.2660 105.1590 H 250 THR250 0.0611 3937 HG1 86.0020 115.6710 103.7450 H 250 THR250 0.2098 3938 HG21 83.6200 116.5140 103.3230 H 250 THR250 0.0255 3939 HG22 84.2830 117.7420 102.2500 H 250 THR250 0.0255 3940 HG23 83.3800 118.2180 103.6810 H 250 THR250 0.0255 3941 N 88.3320 118.4290 104.8540 N.am 251 PHE251 -0.2453 3942 CA 89.4350 118.4800 105.8080 C.3 251 PHE251 0.0917 3943 CB 90.5440 117.5990 105.2210 C.3 251 PHE251 -0.0036 3944 CG 91.7400 117.5200 106.1210 C.ar 251 PHE251 -0.0454 3945 CD1 91.7920 116.6050 107.1680 C.ar 251 PHE251 -0.0585 3946 CD2 92.7980 118.3940 105.9270 C.ar 251 PHE251 -0.0585 3947 CE1 92.8950 116.5690 108.0130 C.ar 251 PHE251 -0.0615 3948 CE2 93.8920 118.3640 106.7690 C.ar 251 PHE251 -0.0615 3949 CZ 93.9480 117.4500 107.8130 C.ar 251 PHE251 -0.0617 3950 C 89.8790 119.9110 106.0800 C.2 251 PHE251 0.2190 3951 O 90.4050 120.2020 107.1590 O.2 251 PHE251 -0.2778 3952 H 88.4630 117.9870 103.9440 H 251 PHE251 0.1312 3953 HA 89.0760 118.0470 106.7440 H 251 PHE251 0.0560 3954 HB1 90.8440 117.9720 104.2410 H 251 PHE251 0.0333 3955 HB2 90.1610 116.5900 105.0560 H 251 PHE251 0.0333 3956 HD1 90.9730 115.9170 107.3300 H 251 PHE251 0.0620 3957 HD2 92.7660 119.1110 105.1200 H 251 PHE251 0.0620 3958 HE1 92.9300 115.8520 108.8210 H 251 PHE251 0.0618 3959 HE2 94.7000 119.0460 106.5690 H 251 PHE251 0.0618 3960 HZ 94.8100 117.4180 108.4630 H 251 PHE251 0.0618 3961 N 89.6790 120.8150 105.1250 N.am 252 ALA252 -0.2459 3962 CA 90.0730 122.2010 105.3210 C.3 252 ALA252 0.0850 3963 CB 90.2950 122.8270 103.9380 C.3 252 ALA252 -0.0411 3964 C 89.0290 123.0200 106.0640 C.2 252 ALA252 0.2184 3965 O 89.3880 123.9900 106.7410 O.2 252 ALA252 -0.2778 3966 H 89.2450 120.5330 104.2460 H 252 ALA252 0.1312 3967 HA 91.0060 122.2230 105.8880 H 252 ALA252 0.0554 3968 HB1 90.6420 123.8580 104.0190 H 252 ALA252 0.0249 3969 HB2 89.3760 122.8240 103.3510 H 252 ALA252 0.0249 3970 HB3 91.0410 122.2730 103.3720 H 252 ALA252 0.0249 3971 N 87.7490 122.6620 105.9630 N.am 253 VAL253 -0.2454 3972 CA 86.7120 123.5000 106.5560 C.3 253 VAL253 0.0901 3973 CB 85.4290 123.4400 105.6980 C.3 253 VAL253 -0.0227 3974 CG1 84.6790 122.1070 105.8240 C.3 253 VAL253 -0.0608 3975 CG2 84.4860 124.6140 106.0000 C.3 253 VAL253 -0.0608 3976 C 86.4330 123.1460 108.0170 C.2 253 VAL253 0.2189 3977 O 86.1090 124.0330 108.8120 O.2 253 VAL253 -0.2778 3978 H 87.4950 121.8050 105.4730 H 253 VAL253 0.1312 3979 HA 87.0700 124.5320 106.5390 H 253 VAL253 0.0560 3980 HB 85.7410 123.5430 104.6580 H 253 VAL253 0.0315 3981 HG11 83.9190 122.0080 105.0490 H 253 VAL253 0.0233 3982 HG12 84.1830 122.0150 106.7900 H 253 VAL253 0.0233 3983 HG13 85.3660 121.2730 105.7310 H 253 VAL253 0.0233 3984 HG21 83.6210 124.6010 105.3360 H 253 VAL253 0.0233 3985 HG22 84.9920 125.5700 105.8650 H 253 VAL253 0.0233 3986 HG23 84.1170 124.5740 107.0250 H 253 VAL253 0.0233 3987 N 86.5590 121.8760 108.4020 N.am 254 CYS254 -0.2449 3988 CA 86.1380 121.4400 109.7270 C.3 254 CYS254 0.0965 3989 CB 85.0850 120.3330 109.5800 C.3 254 CYS254 0.0147 3990 SG 85.6910 118.7830 108.8710 S.3 254 CYS254 -0.1762 3991 C 87.2910 121.0380 110.6350 C.2 254 CYS254 0.2195 3992 O 87.0470 120.6410 111.7780 O.2 254 CYS254 -0.2778 3993 H 86.9580 121.1960 107.7560 H 254 CYS254 0.1312 3994 HA 85.6600 122.2740 110.2360 H 254 CYS254 0.0565 3995 HB1 84.2710 120.6960 108.9540 H 254 CYS254 0.0394 3996 HB2 84.6360 120.1220 110.5480 H 254 CYS254 0.0394 3997 HG 84.7840 117.8180 109.0400 H 254 CYS254 0.1017 3998 N 88.5360 121.1270 110.1680 N.am 255 SER255 -0.2436 3999 CA 89.6910 120.8890 111.0200 C.3 255 SER255 0.1109 4000 CB 90.6330 119.8770 110.3470 C.3 255 SER255 0.0681 4001 OG 89.9120 118.6970 110.0270 O.3 255 SER255 -0.3930 4002 C 90.4790 122.1530 111.3240 C.2 255 SER255 0.2209 4003 O 91.2610 122.1600 112.2780 O.2 255 SER255 -0.2777 4004 H 88.6830 121.3680 109.1880 H 255 SER255 0.1312 4005 HA 89.3610 120.4750 111.9720 H 255 SER255 0.0580 4006 HB1 91.4570 119.6310 111.0250 H 255 SER255 0.0577 4007 HB2 91.0690 120.3160 109.4440 H 255 SER255 0.0577 4008 HG 90.4540 118.0630 109.5600 H 255 SER255 0.2095 4009 N 90.2900 123.2060 110.5420 N.am 256 LEU256 -0.2456 4010 CA 90.9160 124.5080 110.7320 C.3 256 LEU256 0.0883 4011 CB 90.9140 125.3460 109.4360 C.3 256 LEU256 -0.0266 4012 CG 91.9470 124.9140 108.3760 C.3 256 LEU256 -0.0449 4013 CD1 91.8470 125.8120 107.1330 C.3 256 LEU256 -0.0626 4014 CD2 93.3860 124.9710 108.9110 C.3 256 LEU256 -0.0626 4015 C 90.3230 125.3220 111.8830 C.2 256 LEU256 0.2214 4016 O 91.0680 126.0690 112.5330 O.2 256 LEU256 -0.2776 4017 H 89.6590 123.0970 109.7480 H 256 LEU256 0.1312 4018 HA 91.9420 124.3070 111.0350 H 256 LEU256 0.0557 4019 HB1 91.1180 126.3910 109.6770 H 256 LEU256 0.0287 4020 HB2 89.9130 125.3340 109.0020 H 256 LEU256 0.0287 4021 HG 91.7280 123.8890 108.0740 H 256 LEU256 0.0296 4022 HD11 92.4780 125.4360 106.3280 H 256 LEU256 0.0232 4023 HD12 92.1680 126.8290 107.3600 H 256 LEU256 0.0232 4024 HD13 90.8290 125.8760 106.7530 H 256 LEU256 0.0232 4025 HD21 94.1080 124.8080 108.1110 H 256 LEU256 0.0232 4026 HD22 93.5700 124.2080 109.6650 H 256 LEU256 0.0232 4027 HD23 93.6040 125.9430 109.3550 H 256 LEU256 0.0232 4028 N 89.0080 125.2620 112.1490 N.am 257 PRO257 -0.2316 4029 CA 88.4670 126.0870 113.2440 C.3 257 PRO257 0.0907 4030 CD 87.9880 124.5000 111.4350 C.3 257 PRO257 0.0071 4031 CB 86.9740 125.7190 113.2570 C.3 257 PRO257 -0.0276 4032 CG 86.6900 125.1790 111.8590 C.3 257 PRO257 -0.0379 4033 C 89.0900 125.8190 114.6020 C.2 257 PRO257 0.2189 4034 O 89.2860 126.7650 115.3700 O.2 257 PRO257 -0.2778 4035 HA 88.5990 127.1250 112.9480 H 257 PRO257 0.0559 4036 HD1 88.0310 123.4730 111.7980 H 257 PRO257 0.0431 4037 HD2 88.1460 124.5540 110.3570 H 257 PRO257 0.0431 4038 HB1 86.3390 126.5670 113.5140 H 257 PRO257 0.0285 4039 HB2 86.7660 124.9260 113.9780 H 257 PRO257 0.0285 4040 HG1 85.8420 124.4980 111.8390 H 257 PRO257 0.0278 4041 HG2 86.4740 126.0060 111.1820 H 257 PRO257 0.0278 4042 N 89.4160 124.5690 114.9320 N.am 258 PHE258 -0.2453 4043 CA 90.0350 124.3210 116.2300 C.3 258 PHE258 0.0917 4044 CB 89.9890 122.8230 116.5630 C.3 258 PHE258 -0.0036 4045 CG 90.0560 122.5810 118.0500 C.ar 258 PHE258 -0.0454 4046 CD1 89.0140 123.0060 118.8710 C.ar 258 PHE258 -0.0585 4047 CD2 91.1390 121.9220 118.6240 C.ar 258 PHE258 -0.0585 4048 CE1 89.0590 122.7950 120.2410 C.ar 258 PHE258 -0.0615 4049 CE2 91.1690 121.6810 119.9920 C.ar 258 PHE258 -0.0615 4050 CZ 90.1340 122.1240 120.8020 C.ar 258 PHE258 -0.0617 4051 C 91.4370 124.9120 116.2930 C.2 258 PHE258 0.2191 4052 O 91.8210 125.5140 117.3040 O.2 258 PHE258 -0.2778 4053 H 89.2360 123.7990 114.2880 H 258 PHE258 0.1312 4054 HA 89.4270 124.8660 116.9550 H 258 PHE258 0.0560 4055 HB1 90.7770 122.2790 116.0410 H 258 PHE258 0.0333 4056 HB2 89.0450 122.4040 116.2100 H 258 PHE258 0.0333 4057 HD1 88.1620 123.5160 118.4450 H 258 PHE258 0.0620 4058 HD2 91.9540 121.5780 118.0030 H 258 PHE258 0.0620 4059 HE1 88.2530 123.1460 120.8690 H 258 PHE258 0.0618 4060 HE2 91.9980 121.1490 120.4330 H 258 PHE258 0.0618 4061 HZ 90.1580 121.9440 121.8670 H 258 PHE258 0.0618 4062 N 92.2130 124.7580 115.2180 N.am 259 THR259 -0.2434 4063 CA 93.5500 125.3400 115.1780 C.3 259 THR259 0.1135 4064 CB 94.3860 124.8510 113.9810 C.3 259 THR259 0.0763 4065 OG1 93.8100 125.2760 112.7580 O.3 259 THR259 -0.3900 4066 CG2 94.5410 123.3240 113.9970 C.3 259 THR259 -0.0370 4067 C 93.5030 126.8590 115.2480 C.2 259 THR259 0.2212 4068 O 94.3930 127.4800 115.8390 O.2 259 THR259 -0.2777 4069 H 91.8680 124.2290 114.4170 H 259 THR259 0.1313 4070 HA 94.0480 125.0090 116.0910 H 259 THR259 0.0583 4071 HB 95.3830 125.2990 114.0890 H 259 THR259 0.0611 4072 HG1 94.3610 125.0230 112.0240 H 259 THR259 0.2098 4073 HG21 95.3000 122.9960 113.2880 H 259 THR259 0.0255 4074 HG22 93.6040 122.8260 113.7450 H 259 THR259 0.0255 4075 HG23 94.8500 122.9780 114.9830 H 259 THR259 0.0255 4076 N 92.4790 127.4780 114.6570 N.am 260 ILE260 -0.2453 4077 CA 92.3820 128.9320 114.7020 C.3 260 ILE260 0.0903 4078 CB 91.6880 129.4930 113.4390 C.3 260 ILE260 -0.0201 4079 CG1 92.1830 130.9150 113.1130 C.3 260 ILE260 -0.0514 4080 CG2 90.1580 129.4600 113.5330 C.3 260 ILE260 -0.0605 4081 CD1 91.6930 131.4340 111.7560 C.3 260 ILE260 -0.0650 4082 C 91.7680 129.4220 116.0080 C.2 260 ILE260 0.2189 4083 O 91.9300 130.5970 116.3590 O.2 260 ILE260 -0.2778 4084 H 91.7640 126.9340 114.1740 H 260 ILE260 0.1312 4085 HA 93.4060 129.3090 114.6910 H 260 ILE260 0.0560 4086 HB 91.9830 128.8500 112.6080 H 260 ILE260 0.0318 4087 HG11 93.2730 130.9260 113.1090 H 260 ILE260 0.0266 4088 HG12 91.8750 131.6050 113.8990 H 260 ILE260 0.0266 4089 HG21 89.6900 129.6110 112.5610 H 260 ILE260 0.0233 4090 HG22 89.7810 130.2250 114.2120 H 260 ILE260 0.0233 4091 HG23 89.8310 128.5010 113.9100 H 260 ILE260 0.0233 4092 HD11 92.1250 132.4110 111.5380 H 260 ILE260 0.0230 4093 HD12 90.6090 131.5440 111.7370 H 260 ILE260 0.0230 4094 HD13 91.9790 130.7570 110.9510 H 260 ILE260 0.0230 4095 N 91.0660 128.5560 116.7400 N.am 261 PHE261 -0.2453 4096 CA 90.5550 128.9040 118.0570 C.3 261 PHE261 0.0917 4097 CB 89.2160 128.1850 118.3140 C.3 261 PHE261 -0.0036 4098 CG 88.0490 129.0580 117.9260 C.ar 261 PHE261 -0.0454 4099 CD1 87.7590 129.3160 116.5890 C.ar 261 PHE261 -0.0585 4100 CD2 87.2860 129.6800 118.9090 C.ar 261 PHE261 -0.0585 4101 CE1 86.7180 130.1650 116.2380 C.ar 261 PHE261 -0.0615 4102 CE2 86.2560 130.5420 118.5600 C.ar 261 PHE261 -0.0615 4103 CZ 85.9650 130.7810 117.2260 C.ar 261 PHE261 -0.0617 4104 C 91.5540 128.6250 119.1680 C.2 261 PHE261 0.2190 4105 O 91.3710 129.1210 120.2850 O.2 261 PHE261 -0.2778 4106 H 90.8820 127.6250 116.3660 H 261 PHE261 0.1312 4107 HA 90.3830 129.9820 118.0820 H 261 PHE261 0.0560 4108 HB1 89.1020 127.9250 119.3680 H 261 PHE261 0.0333 4109 HB2 89.1710 127.2390 117.7750 H 261 PHE261 0.0333 4110 HD1 88.3580 128.8800 115.8080 H 261 PHE261 0.0620 4111 HD2 87.5030 129.5090 119.9540 H 261 PHE261 0.0620 4112 HE1 86.5070 130.3590 115.1970 H 261 PHE261 0.0618 4113 HE2 85.6840 131.0330 119.3290 H 261 PHE261 0.0618 4114 HZ 85.1600 131.4510 116.9610 H 261 PHE261 0.0618 4115 N 92.5980 127.8430 118.8930 N.am 262 ALA262 -0.2459 4116 CA 93.6340 127.5630 119.8790 C.3 262 ALA262 0.0850 4117 CB 94.2860 126.2260 119.5030 C.3 262 ALA262 -0.0411 4118 C 94.6880 128.6600 119.9580 C.2 262 ALA262 0.2184 4119 O 95.7800 128.4160 120.4830 O.2 262 ALA262 -0.2778 4120 H 92.6740 127.4280 117.9640 H 262 ALA262 0.1312 4121 HA 93.1590 127.4740 120.8580 H 262 ALA262 0.0554 4122 HB1 95.0400 125.9270 120.2320 H 262 ALA262 0.0249 4123 HB2 94.7650 126.2810 118.5240 H 262 ALA262 0.0249 4124 HB3 93.5400 125.4320 119.4590 H 262 ALA262 0.0249 4125 N 94.3910 129.8510 119.4510 N.am 263 TYR263 -0.2453 4126 CA 95.2960 130.9910 119.5110 C.3 263 TYR263 0.0917 4127 CB 95.8090 131.3540 118.1060 C.3 263 TYR263 -0.0036 4128 CG 96.7650 130.3220 117.5600 C.ar 263 TYR263 -0.0453 4129 CD1 97.9820 130.0770 118.1920 C.ar 263 TYR263 -0.0561 4130 CD2 96.4570 129.6120 116.4040 C.ar 263 TYR263 -0.0561 4131 CE1 98.8620 129.1240 117.6930 C.ar 263 TYR263 -0.0317 4132 CE2 97.3360 128.6610 115.9010 C.ar 263 TYR263 -0.0317 4133 CZ 98.5400 128.4150 116.5460 C.ar 263 TYR263 0.0726 4134 OH 99.4020 127.4490 116.0680 O.3 263 TYR263 -0.3598 4135 C 94.6910 132.2020 120.2000 C.2 263 TYR263 0.2190 4136 O 95.3980 132.9150 120.9160 O.2 263 TYR263 -0.2778 4137 H 93.4860 129.9730 118.9980 H 263 TYR263 0.1312 4138 HA 96.1440 130.7210 120.1420 H 263 TYR263 0.0560 4139 HB1 96.3420 132.3060 118.1310 H 263 TYR263 0.0333 4140 HB2 94.9690 131.4880 117.4230 H 263 TYR263 0.0333 4141 HD1 98.2490 130.6220 119.0860 H 263 TYR263 0.0621 4142 HD2 95.5200 129.7890 115.8970 H 263 TYR263 0.0621 4143 HE1 99.7960 128.9280 118.1990 H 263 TYR263 0.0643 4144 HE2 97.0760 128.1020 115.0140 H 263 TYR263 0.0643 4145 HH 99.0200 127.0280 115.3090 H 263 TYR263 0.2173 4146 N 93.3990 132.4540 120.0030 N.am 264 MET264 -0.2456 4147 CA 92.7810 133.6880 120.4620 C.3 264 MET264 0.0885 4148 CB 91.3510 133.7310 119.8880 C.3 264 MET264 -0.0199 4149 CG 91.2870 133.7130 118.3530 C.3 264 MET264 -0.0047 4150 SD 89.5890 133.5090 117.7750 S.3 264 MET264 -0.1641 4151 CE 88.8600 135.0290 118.4100 C.3 264 MET264 -0.0181 4152 C 92.6890 133.7150 121.9880 C.2 264 MET264 0.2187 4153 O 92.9470 132.7240 122.6790 O.2 264 MET264 -0.2778 4154 H 92.8270 131.7630 119.5170 H 264 MET264 0.1312 4155 HA 93.3850 134.5250 120.1090 H 264 MET264 0.0557 4156 HB1 90.8280 134.6160 120.2510 H 264 MET264 0.0293 4157 HB2 90.7900 132.8730 120.2650 H 264 MET264 0.0293 4158 HG1 91.8840 132.9040 117.9320 H 264 MET264 0.0377 4159 HG2 91.6900 134.6450 117.9580 H 264 MET264 0.0377 4160 HE1 87.9800 135.2920 117.8240 H 264 MET264 0.0340 4161 HE2 89.5680 135.8530 118.3290 H 264 MET264 0.0340 4162 HE3 88.5730 134.9100 119.4560 H 264 MET264 0.0340 4163 N 92.3120 134.8770 122.5140 N.am 265 ASN265 -0.2452 4164 CA 92.2100 135.0600 123.9550 C.3 265 ASN265 0.0957 4165 CB 92.3290 136.5570 124.2790 C.3 265 ASN265 0.0446 4166 CG 92.5480 136.7790 125.7810 C.2 265 ASN265 0.2000 4167 OD1 91.6100 136.9060 126.5510 O.2 265 ASN265 -0.2797 4168 ND2 93.8380 136.8150 126.1470 N.am 265 ASN265 -0.2723 4169 C 90.9060 134.4750 124.4830 C.2 265 ASN265 0.2191 4170 O 89.8620 134.5470 123.8280 O.2 265 ASN265 -0.2778 4171 H 92.0900 135.6560 121.8950 H 265 ASN265 0.1312 4172 HA 93.0460 134.5170 124.4050 H 265 ASN265 0.0562 4173 HB1 91.4380 137.1000 123.9670 H 265 ASN265 0.0375 4174 HB2 93.1710 136.9920 123.7410 H 265 ASN265 0.0375 4175 HD21 94.0570 136.9530 127.1130 H 265 ASN265 0.1266 4176 HD22 94.5810 136.7100 125.4880 H 265 ASN265 0.1266 4177 N 90.9690 133.8990 125.6840 N.am 266 GLU266 -0.2456 4178 CA 89.8200 133.2280 126.2780 C.3 266 GLU266 0.0883 4179 CB 90.4360 132.3710 127.4370 C.3 266 GLU266 -0.0193 4180 CG 89.5280 131.3770 128.2160 C.3 266 GLU266 0.0356 4181 CD 90.2200 130.6650 129.4200 C.2 266 GLU266 0.1760 4182 OE1 89.9310 129.5030 129.6950 O.co2 266 GLU266 -0.6478 4183 OE2 91.0470 131.2560 130.1060 O.co2 266 GLU266 -0.6478 4184 C 88.7880 134.1870 126.8570 C.2 266 GLU266 0.2188 4185 O 87.8970 133.7390 127.5860 O.2 266 GLU266 -0.2778 4186 H 91.8470 133.9290 126.2020 H 266 GLU266 0.1312 4187 HA 89.3550 132.5940 125.5210 H 266 GLU266 0.0557 4188 HB1 90.9080 133.0460 128.1520 H 266 GLU266 0.0290 4189 HB2 91.2500 131.7870 127.0150 H 266 GLU266 0.0290 4190 HG1 89.1460 130.6170 127.5350 H 266 GLU266 0.0374 4191 HG2 88.6680 131.8810 128.6420 H 266 GLU266 0.0374 4192 N 88.8830 135.4840 126.5630 N.am 267 THR267 -0.2434 4193 CA 87.9270 136.4380 127.1130 C.3 267 THR267 0.1135 4194 CB 88.6390 137.7900 127.3280 C.3 267 THR267 0.0763 4195 OG1 87.7970 138.6300 128.1020 O.3 267 THR267 -0.3900 4196 CG2 89.0330 138.4870 126.0100 C.3 267 THR267 -0.0370 4197 C 86.7010 136.6100 126.2220 C.2 267 THR267 0.2213 4198 O 85.6310 136.9820 126.7170 O.2 267 THR267 -0.2777 4199 H 89.6290 135.8110 125.9490 H 267 THR267 0.1313 4200 HA 87.5880 136.0740 128.0840 H 267 THR267 0.0583 4201 HB 89.5460 137.5740 127.9040 H 267 THR267 0.0611 4202 HG1 88.2180 139.4680 128.2690 H 267 THR267 0.2098 4203 HG21 89.7020 139.3290 126.1890 H 267 THR267 0.0255 4204 HG22 88.1560 138.8680 125.4880 H 267 THR267 0.0255 4205 HG23 89.5470 137.8050 125.3340 H 267 THR267 0.0255 4206 N 86.8270 136.3400 124.9230 N.am 268 SER268 -0.2435 4207 CA 85.7300 136.5780 123.9910 C.3 268 SER268 0.1109 4208 CB 86.2670 137.3190 122.7560 C.3 268 SER268 0.0681 4209 OG 86.8920 138.5350 123.1490 O.3 268 SER268 -0.3930 4210 C 85.0570 135.2860 123.5390 C.2 268 SER268 0.2210 4211 O 83.8260 135.1910 123.5520 O.2 268 SER268 -0.2777 4212 H 87.7070 135.9600 124.5740 H 268 SER268 0.1312 4213 HA 84.9710 137.2010 124.4680 H 268 SER268 0.0580 4214 HB1 85.4370 137.5230 122.0690 H 268 SER268 0.0577 4215 HB2 86.9920 136.6870 122.2310 H 268 SER268 0.0577 4216 HG 87.1810 139.0400 122.3920 H 268 SER268 0.2095 4217 N 85.8450 134.2890 123.1280 N.am 269 SER269 -0.2435 4218 CA 85.2590 133.0490 122.6300 C.3 269 SER269 0.1109 4219 CB 86.3610 132.1880 121.9970 C.3 269 SER269 0.0681 4220 OG 86.9890 132.9100 120.9420 O.3 269 SER269 -0.3930 4221 C 84.5710 132.2630 123.7380 C.2 269 SER269 0.2209 4222 O 83.6050 131.5390 123.4730 O.2 269 SER269 -0.2777 4223 H 86.8590 134.3940 123.1620 H 269 SER269 0.1312 4224 HA 84.5130 133.3120 121.8790 H 269 SER269 0.0580 4225 HB1 85.9240 131.2580 121.6150 H 269 SER269 0.0577 4226 HB2 87.1010 131.9190 122.7610 H 269 SER269 0.0577 4227 HG 87.6840 132.3950 120.5360 H 269 SER269 0.2095 4228 N 85.0510 132.3850 124.9770 N.am 270 ARG270 -0.2456 4229 CA 84.3720 131.7330 126.0900 C.3 270 ARG270 0.0879 4230 CB 85.3970 131.6550 127.2340 C.3 270 ARG270 -0.0258 4231 CG 85.0520 130.6290 128.3190 C.3 270 ARG270 -0.0154 4232 CD 86.2610 130.3050 129.2110 C.3 270 ARG270 0.1045 4233 NE 85.8200 129.4400 130.3070 N.pl3 270 ARG270 -0.4450 4234 CZ 86.5100 128.4230 130.8140 C.cat 270 ARG270 0.5062 4235 NH1 87.7180 128.1240 130.4240 N.pl3 270 ARG270 -0.4573 4236 NH2 85.9490 127.6940 131.7410 N.pl3 270 ARG270 -0.4573 4237 C 83.0850 132.4580 126.4620 C.2 270 ARG270 0.2187 4238 O 82.2110 131.8740 127.1120 O.2 270 ARG270 -0.2778 4239 H 85.8940 132.9350 125.1450 H 270 ARG270 0.1312 4240 HA 84.1170 130.7200 125.7640 H 270 ARG270 0.0557 4241 HB1 85.5520 132.6400 127.6760 H 270 ARG270 0.0286 4242 HB2 86.3570 131.3690 126.8020 H 270 ARG270 0.0286 4243 HG1 84.7080 129.7050 127.8500 H 270 ARG270 0.0299 4244 HG2 84.2210 131.0000 128.9190 H 270 ARG270 0.0299 4245 HD1 86.6850 131.2080 129.6550 H 270 ARG270 0.0711 4246 HD2 87.0400 129.8110 128.6240 H 270 ARG270 0.0711 4247 HE 84.9220 129.6250 130.6970 H 270 ARG270 0.3153 4248 HH11 88.1600 127.2810 130.7080 H 270 ARG270 0.3114 4249 HH12 88.2400 128.7490 129.8300 H 270 ARG270 0.3114 4250 HH21 86.4300 126.8990 132.1100 H 270 ARG270 0.3114 4251 HH22 85.0410 127.9210 132.0800 H 270 ARG270 0.3114 4252 N 82.9520 133.7260 126.0660 N.am 271 LYS271 -0.2457 4253 CA 81.7350 134.4730 126.3620 C.3 271 LYS271 0.0878 4254 CB 82.0930 135.9680 126.2680 C.3 271 LYS271 -0.0289 4255 CG 80.9030 136.9260 126.4240 C.3 271 LYS271 -0.0496 4256 CD 81.2880 138.3800 126.1130 C.3 271 LYS271 -0.0278 4257 CE 80.0650 139.2280 125.7510 C.3 271 LYS271 0.1103 4258 NZ 79.4540 138.7450 124.5200 N.4 271 LYS271 -0.0749 4259 C 80.6090 134.1330 125.3940 C.2 271 LYS271 0.2187 4260 O 79.4340 134.1800 125.7730 O.2 271 LYS271 -0.2778 4261 H 83.7090 134.1760 125.5520 H 271 LYS271 0.1312 4262 HA 81.4100 134.2290 127.3750 H 271 LYS271 0.0557 4263 HB1 82.5480 136.1580 125.2980 H 271 LYS271 0.0285 4264 HB2 82.8570 136.2080 127.0070 H 271 LYS271 0.0285 4265 HG1 80.4760 136.8460 127.4240 H 271 LYS271 0.0266 4266 HG2 80.1170 136.6260 125.7330 H 271 LYS271 0.0266 4267 HD1 81.9870 138.4050 125.2750 H 271 LYS271 0.0282 4268 HD2 81.8160 138.8100 126.9650 H 271 LYS271 0.0282 4269 HE1 80.3490 140.2700 125.6030 H 271 LYS271 0.0559 4270 HE2 79.3170 139.1890 126.5450 H 271 LYS271 0.0559 4271 HZ1 78.5910 139.2460 124.2490 H 271 LYS271 0.2742 4272 HZ2 79.2190 137.7280 124.5850 H 271 LYS271 0.2742 4273 HZ3 80.1280 138.7340 123.7240 H 271 LYS271 0.2742 4274 N 80.9410 133.7930 124.1490 N.am 272 GLU272 -0.2456 4275 CA 79.9480 133.5050 123.1240 C.3 272 GLU272 0.0883 4276 CB 80.3580 134.2830 121.8540 C.3 272 GLU272 -0.0193 4277 CG 79.4850 135.5130 121.5460 C.3 272 GLU272 0.0356 4278 CD 79.5070 136.5920 122.6420 C.2 272 GLU272 0.1760 4279 OE1 78.4890 136.8070 123.2960 O.co2 272 GLU272 -0.6478 4280 OE2 80.5310 137.2400 122.8530 O.co2 272 GLU272 -0.6478 4281 C 79.8030 132.0140 122.8420 C.2 272 GLU272 0.2187 4282 O 79.0500 131.6390 121.9380 O.2 272 GLU272 -0.2778 4283 H 81.9290 133.7320 123.9050 H 272 GLU272 0.1312 4284 HA 78.9710 133.8570 123.4610 H 272 GLU272 0.0557 4285 HB1 80.2970 133.6330 120.9850 H 272 GLU272 0.0290 4286 HB2 81.4060 134.5810 121.9120 H 272 GLU272 0.0290 4287 HG1 78.4540 135.2010 121.3830 H 272 GLU272 0.0374 4288 HG2 79.8190 135.9790 120.6200 H 272 GLU272 0.0374 4289 N 80.5130 131.1630 123.5860 N.am 273 LYS273 -0.2457 4290 CA 80.3710 129.7080 123.4910 C.3 273 LYS273 0.0878 4291 CB 78.9580 129.3430 124.0180 C.3 273 LYS273 -0.0289 4292 CG 78.7700 127.9310 124.6100 C.3 273 LYS273 -0.0496 4293 CD 77.3540 127.7760 125.2120 C.3 273 LYS273 -0.0278 4294 CE 77.1240 126.4950 126.0360 C.3 273 LYS273 0.1103 4295 NZ 75.7860 126.4350 126.6400 N.4 273 LYS273 -0.0749 4296 C 80.6480 129.2040 122.0740 C.2 273 LYS273 0.2187 4297 O 79.8300 128.5140 121.4630 O.2 273 LYS273 -0.2778 4298 H 81.1860 131.5440 124.2520 H 273 LYS273 0.1312 4299 HA 81.1410 129.3010 124.1490 H 273 LYS273 0.0557 4300 HB1 78.2130 129.5200 123.2410 H 273 LYS273 0.0285 4301 HB2 78.7140 130.0530 124.8100 H 273 LYS273 0.0285 4302 HG1 79.5210 127.7670 125.3850 H 273 LYS273 0.0266 4303 HG2 78.9440 127.1750 123.8440 H 273 LYS273 0.0266 4304 HD1 76.6200 127.8270 124.4070 H 273 LYS273 0.0282 4305 HD2 77.1540 128.6340 125.8550 H 273 LYS273 0.0282 4306 HE1 77.8500 126.4400 126.8490 H 273 LYS273 0.0559 4307 HE2 77.2590 125.6070 125.4140 H 273 LYS273 0.0559 4308 HZ1 75.6300 125.5500 127.1680 H 273 LYS273 0.2742 4309 HZ2 75.0380 126.4300 125.9100 H 273 LYS273 0.2742 4310 HZ3 75.6160 127.2360 127.2740 H 273 LYS273 0.2742 4311 N 81.8220 129.5560 121.5520 N.am 274 TRP274 -0.2453 4312 CA 82.2490 129.0980 120.2360 C.3 274 TRP274 0.0918 4313 CB 82.9240 130.2730 119.5090 C.3 274 TRP274 -0.0021 4314 CG 81.9660 131.3830 119.1280 C.ar 274 TRP274 -0.0260 4315 CD2 82.3100 132.7710 118.9320 C.ar 274 TRP274 -0.0028 4316 CD1 80.6060 131.2680 118.8220 C.ar 274 TRP274 -0.0136 4317 NE1 80.1280 132.4780 118.4410 N.ar 274 TRP274 -0.2641 4318 CE2 81.1390 133.4290 118.4900 C.ar 274 TRP274 0.0269 4319 CE3 83.4740 133.4760 119.0880 C.ar 274 TRP274 -0.0528 4320 CZ2 81.1660 134.7720 118.2290 C.ar 274 TRP274 -0.0430 4321 CZ3 83.5030 134.8460 118.8310 C.ar 274 TRP274 -0.0611 4322 CH2 82.3460 135.4960 118.4010 C.ar 274 TRP274 -0.0602 4323 C 83.2650 127.9660 120.2870 C.2 274 TRP274 0.2190 4324 O 83.3940 127.2270 119.3060 O.2 274 TRP274 -0.2778 4325 H 82.4400 130.1640 122.0890 H 274 TRP274 0.1312 4326 HA 81.3900 128.7350 119.6710 H 274 TRP274 0.0560 4327 HB1 83.4030 129.9330 118.5900 H 274 TRP274 0.0334 4328 HB2 83.7020 130.6860 120.1520 H 274 TRP274 0.0334 4329 HD1 80.0210 130.3610 118.8730 H 274 TRP274 0.0748 4330 HE1 79.2000 132.6630 118.1880 H 274 TRP274 0.1331 4331 HE3 84.3680 132.9750 119.4290 H 274 TRP274 0.0624 4332 HZ2 80.2630 135.2720 117.9110 H 274 TRP274 0.0633 4333 HZ3 84.4180 135.4020 118.9710 H 274 TRP274 0.0618 4334 HH2 82.3600 136.5590 118.2110 H 274 TRP274 0.0618 4335 N 83.9930 127.8190 121.3970 N.am 275 ASP275 -0.2451 4336 CA 84.9880 126.7550 121.4950 C.3 275 ASP275 0.0974 4337 CB 85.7030 126.9060 122.8660 C.3 275 ASP275 0.0576 4338 CG 84.8100 127.2520 124.0970 C.2 275 ASP275 0.1780 4339 OD1 83.6140 126.9600 124.1040 O.co2 275 ASP275 -0.6478 4340 OD2 85.3280 127.8220 125.0570 O.co2 275 ASP275 -0.6478 4341 C 84.3460 125.3810 121.3530 C.2 275 ASP275 0.2192 4342 O 84.9190 124.4800 120.7270 O.2 275 ASP275 -0.2778 4343 H 83.8530 128.4550 122.1820 H 275 ASP275 0.1312 4344 HA 85.6980 126.8870 120.6780 H 275 ASP275 0.0563 4345 HB1 86.4280 127.7150 122.7810 H 275 ASP275 0.0394 4346 HB2 86.2800 126.0150 123.1040 H 275 ASP275 0.0394 4347 N 83.1530 125.2010 121.9230 N.am 276 LEU276 -0.2456 4348 CA 82.4830 123.9080 121.8330 C.3 276 LEU276 0.0880 4349 CB 81.2060 124.1810 122.6490 C.3 276 LEU276 -0.0266 4350 CG 80.1560 123.0710 122.7000 C.3 276 LEU276 -0.0449 4351 CD1 80.6720 121.8670 123.4870 C.3 276 LEU276 -0.0626 4352 CD2 78.8630 123.6250 123.3190 C.3 276 LEU276 -0.0626 4353 C 82.1470 123.5580 120.3900 C.2 276 LEU276 0.2187 4354 O 82.3540 122.4180 119.9600 O.2 276 LEU276 -0.2778 4355 H 82.7080 125.9700 122.4230 H 276 LEU276 0.1312 4356 HA 83.1210 123.1460 122.2840 H 276 LEU276 0.0557 4357 HB1 80.7290 125.0780 122.2500 H 276 LEU276 0.0287 4358 HB2 81.4950 124.4450 123.6680 H 276 LEU276 0.0287 4359 HG 79.9300 122.7510 121.6840 H 276 LEU276 0.0296 4360 HD11 80.9610 122.1490 124.4980 H 276 LEU276 0.0232 4361 HD12 81.5350 121.4110 123.0030 H 276 LEU276 0.0232 4362 HD13 79.8950 121.1140 123.5740 H 276 LEU276 0.0232 4363 HD21 78.0990 122.8590 123.4320 H 276 LEU276 0.0232 4364 HD22 78.4440 124.4200 122.7010 H 276 LEU276 0.0232 4365 HD23 79.0460 124.0400 124.3080 H 276 LEU276 0.0232 4366 N 81.6270 124.5210 119.6250 N.am 277 GLN277 -0.2456 4367 CA 81.3230 124.2620 118.2210 C.3 277 GLN277 0.0882 4368 CB 80.4840 125.4330 117.6830 C.3 277 GLN277 -0.0210 4369 CG 79.2230 125.7190 118.5250 C.3 277 GLN277 0.0225 4370 CD 78.2920 124.4970 118.6040 C.2 277 GLN277 0.1981 4371 OE1 78.3820 123.6690 119.5020 O.2 277 GLN277 -0.2798 4372 NE2 77.3930 124.4380 117.6110 N.am 277 GLN277 -0.2724 4373 C 82.5960 124.0510 117.4090 C.2 277 GLN277 0.2187 4374 O 82.6290 123.2130 116.5000 O.2 277 GLN277 -0.2778 4375 H 81.4410 125.4410 120.0240 H 277 GLN277 0.1312 4376 HA 80.7420 123.3410 118.1830 H 277 GLN277 0.0557 4377 HB1 80.1980 125.2340 116.6490 H 277 GLN277 0.0289 4378 HB2 81.0960 126.3360 117.6620 H 277 GLN277 0.0289 4379 HG1 78.6700 126.5560 118.0980 H 277 GLN277 0.0356 4380 HG2 79.4860 126.0160 119.5410 H 277 GLN277 0.0356 4381 HE21 76.7340 123.6880 117.5800 H 277 GLN277 0.1266 4382 HE22 77.3650 125.1380 116.8970 H 277 GLN277 0.1266 4383 N 83.6500 124.8100 117.7170 N.am 278 ALA278 -0.2459 4384 CA 84.9180 124.6250 117.0220 C.3 278 ALA278 0.0850 4385 CB 85.9100 125.6940 117.4990 C.3 278 ALA278 -0.0411 4386 C 85.4810 123.2320 117.2670 C.2 278 ALA278 0.2184 4387 O 86.1340 122.6540 116.3900 O.2 278 ALA278 -0.2778 4388 H 83.5680 125.5230 118.4420 H 278 ALA278 0.1312 4389 HA 84.7260 124.7390 115.9540 H 278 ALA278 0.0554 4390 HB1 86.8620 125.6190 116.9710 H 278 ALA278 0.0249 4391 HB2 86.1110 125.6040 118.5670 H 278 ALA278 0.0249 4392 HB3 85.5160 126.6960 117.3240 H 278 ALA278 0.0249 4393 N 85.2420 122.6770 118.4570 N.am 279 LEU279 -0.2457 4394 CA 85.6810 121.3110 118.7260 C.3 279 LEU279 0.0880 4395 CB 85.6840 121.1130 120.2550 C.3 279 LEU279 -0.0266 4396 CG 86.0410 119.6920 120.7410 C.3 279 LEU279 -0.0449 4397 CD1 87.4100 119.2250 120.2260 C.3 279 LEU279 -0.0626 4398 CD2 85.9910 119.6200 122.2720 C.3 279 LEU279 -0.0626 4399 C 84.7530 120.2960 118.0710 C.2 279 LEU279 0.2187 4400 O 85.2070 119.2450 117.6030 O.2 279 LEU279 -0.2778 4401 H 84.7530 123.2070 119.1780 H 279 LEU279 0.1312 4402 HA 86.6870 121.1850 118.3220 H 279 LEU279 0.0557 4403 HB1 84.7020 121.3800 120.6490 H 279 LEU279 0.0287 4404 HB2 86.3740 121.8280 120.7020 H 279 LEU279 0.0287 4405 HG 85.2890 118.9960 120.3650 H 279 LEU279 0.0296 4406 HD11 87.6510 118.2320 120.6070 H 279 LEU279 0.0232 4407 HD12 88.2020 119.9020 120.5420 H 279 LEU279 0.0232 4408 HD13 87.4300 119.1660 119.1390 H 279 LEU279 0.0232 4409 HD21 86.1830 118.6070 122.6260 H 279 LEU279 0.0232 4410 HD22 85.0150 119.9250 122.6510 H 279 LEU279 0.0232 4411 HD23 86.7420 120.2740 122.7150 H 279 LEU279 0.0232 4412 N 83.4500 120.5880 118.0350 N.am 280 ARG280 -0.2457 4413 CA 82.5080 119.7170 117.3390 C.3 280 ARG280 0.0879 4414 CB 81.0670 120.2250 117.5230 C.3 280 ARG280 -0.0258 4415 CG 80.4390 119.8030 118.8600 C.3 280 ARG280 -0.0154 4416 CD 79.0120 120.3460 119.0230 C.3 280 ARG280 0.1045 4417 NE 78.2440 119.4870 119.9270 N.pl3 280 ARG280 -0.4450 4418 CZ 77.7440 119.8460 121.1050 C.cat 280 ARG280 0.5062 4419 NH1 77.8820 121.0380 121.5980 N.pl3 280 ARG280 -0.4573 4420 NH2 77.0950 118.9800 121.8150 N.pl3 280 ARG280 -0.4573 4421 C 82.8380 119.6110 115.8600 C.2 280 ARG280 0.2187 4422 O 82.5750 118.5740 115.2400 O.2 280 ARG280 -0.2778 4423 H 83.1090 121.4300 118.4990 H 280 ARG280 0.1312 4424 HA 82.6160 118.7180 117.7660 H 280 ARG280 0.0557 4425 HB1 80.4320 119.8310 116.7280 H 280 ARG280 0.0286 4426 HB2 81.0460 121.3080 117.4140 H 280 ARG280 0.0286 4427 HG1 81.0560 120.1320 119.6980 H 280 ARG280 0.0299 4428 HG2 80.4210 118.7140 118.9040 H 280 ARG280 0.0299 4429 HD1 78.4740 120.3450 118.0730 H 280 ARG280 0.0711 4430 HD2 79.0350 121.3760 119.3790 H 280 ARG280 0.0711 4431 HE 78.0610 118.5310 119.7040 H 280 ARG280 0.3153 4432 HH11 77.5680 121.1560 122.5500 H 280 ARG280 0.3114 4433 HH12 78.2830 121.7930 121.0910 H 280 ARG280 0.3114 4434 HH21 76.7850 119.2590 122.7380 H 280 ARG280 0.3114 4435 HH22 76.9010 118.0440 121.5380 H 280 ARG280 0.3114 4436 N 83.3980 120.6730 115.2780 N.am 281 PHE281 -0.2453 4437 CA 83.7950 120.6160 113.8760 C.3 281 PHE281 0.0917 4438 CB 84.2000 122.0110 113.3600 C.3 281 PHE281 -0.0036 4439 CG 83.0240 122.8010 112.8210 C.ar 281 PHE281 -0.0454 4440 CD1 81.8090 122.8650 113.5030 C.ar 281 PHE281 -0.0585 4441 CD2 83.1320 123.4760 111.6070 C.ar 281 PHE281 -0.0585 4442 CE1 80.7390 123.5870 112.9910 C.ar 281 PHE281 -0.0615 4443 CE2 82.0660 124.1990 111.0910 C.ar 281 PHE281 -0.0615 4444 CZ 80.8660 124.2560 111.7840 C.ar 281 PHE281 -0.0617 4445 C 84.8490 119.5450 113.6390 C.2 281 PHE281 0.2190 4446 O 84.8850 118.9400 112.5620 O.2 281 PHE281 -0.2778 4447 H 83.5490 121.5270 115.8150 H 281 PHE281 0.1312 4448 HA 82.9200 120.2760 113.3230 H 281 PHE281 0.0560 4449 HB1 84.9320 121.9120 112.5580 H 281 PHE281 0.0333 4450 HB2 84.6920 122.5830 114.1470 H 281 PHE281 0.0333 4451 HD1 81.6710 122.3470 114.4380 H 281 PHE281 0.0620 4452 HD2 84.0510 123.4480 111.0450 H 281 PHE281 0.0620 4453 HE1 79.8050 123.6250 113.5330 H 281 PHE281 0.0618 4454 HE2 82.1720 124.7170 110.1490 H 281 PHE281 0.0618 4455 HZ 80.0350 124.8180 111.3830 H 281 PHE281 0.0618 4456 N 85.7080 119.2910 114.6270 N.am 282 LEU282 -0.2456 4457 CA 86.6690 118.2010 114.4990 C.3 282 LEU282 0.0880 4458 CB 87.7110 118.2050 115.6340 C.3 282 LEU282 -0.0266 4459 CG 88.8450 119.2280 115.4460 C.3 282 LEU282 -0.0449 4460 CD1 89.6540 119.3600 116.7410 C.3 282 LEU282 -0.0626 4461 CD2 89.7830 118.8290 114.2940 C.3 282 LEU282 -0.0626 4462 C 85.9680 116.8510 114.4400 C.2 282 LEU282 0.2187 4463 O 86.3630 115.9730 113.6660 O.2 282 LEU282 -0.2778 4464 H 85.6930 119.8600 115.4740 H 282 LEU282 0.1312 4465 HA 87.1650 118.3390 113.5430 H 282 LEU282 0.0557 4466 HB1 88.1720 117.2190 115.7240 H 282 LEU282 0.0287 4467 HB2 87.2080 118.3780 116.5840 H 282 LEU282 0.0287 4468 HG 88.4070 120.2000 115.2160 H 282 LEU282 0.0296 4469 HD11 90.5140 120.0120 116.5980 H 282 LEU282 0.0232 4470 HD12 90.0320 118.3910 117.0700 H 282 LEU282 0.0232 4471 HD13 89.0450 119.7730 117.5460 H 282 LEU282 0.0232 4472 HD21 90.5670 119.5740 114.1520 H 282 LEU282 0.0232 4473 HD22 89.2560 118.7300 113.3470 H 282 LEU282 0.0232 4474 HD23 90.2670 117.8720 114.4960 H 282 LEU282 0.0232 4475 N 84.9270 116.6650 115.2530 N.am 283 SER283 -0.2436 4476 CA 84.1950 115.4040 115.2540 C.3 283 SER283 0.1109 4477 CB 83.1520 115.4370 116.3800 C.3 283 SER283 0.0681 4478 OG 82.3870 114.2390 116.3770 O.3 283 SER283 -0.3930 4479 C 83.4890 115.1430 113.9310 C.2 283 SER283 0.2209 4480 O 83.2500 113.9790 113.5870 O.2 283 SER283 -0.2777 4481 H 84.6390 117.4150 115.8820 H 283 SER283 0.1312 4482 HA 84.9130 114.6000 115.4260 H 283 SER283 0.0580 4483 HB1 82.4830 116.2900 116.2430 H 283 SER283 0.0577 4484 HB2 83.6680 115.5710 117.3350 H 283 SER283 0.0577 4485 HG 81.8290 114.1600 117.1460 H 283 SER283 0.2095 4486 N 83.1510 116.1960 113.1840 N.am 284 ILE284 -0.2453 4487 CA 82.5070 116.0070 111.8880 C.3 284 ILE284 0.0903 4488 CB 82.0690 117.3810 111.3200 C.3 284 ILE284 -0.0201 4489 CG1 81.0120 118.0460 112.2230 C.3 284 ILE284 -0.0514 4490 CG2 81.5550 117.2720 109.8740 C.3 284 ILE284 -0.0605 4491 CD1 80.6380 119.4720 111.7950 C.3 284 ILE284 -0.0650 4492 C 83.4310 115.2630 110.9350 C.2 284 ILE284 0.2189 4493 O 82.9950 114.3720 110.1990 O.2 284 ILE284 -0.2778 4494 H 83.3440 117.1390 113.5210 H 284 ILE284 0.1312 4495 HA 81.6320 115.3760 112.0530 H 284 ILE284 0.0560 4496 HB 82.9460 118.0280 111.3010 H 284 ILE284 0.0318 4497 HG11 81.3840 118.0900 113.2430 H 284 ILE284 0.0266 4498 HG12 80.1140 117.4290 112.2600 H 284 ILE284 0.0266 4499 HG21 81.2290 118.2350 109.4830 H 284 ILE284 0.0233 4500 HG22 80.7200 116.5750 109.8000 H 284 ILE284 0.0233 4501 HG23 82.3440 116.9280 109.2100 H 284 ILE284 0.0233 4502 HD11 80.0470 119.9650 112.5670 H 284 ILE284 0.0230 4503 HD12 80.0440 119.4730 110.8820 H 284 ILE284 0.0230 4504 HD13 81.5240 120.0810 111.6140 H 284 ILE284 0.0230 4505 N 84.7240 115.5940 110.9420 N.am 285 ASN285 -0.2452 4506 CA 85.6430 114.8690 110.0710 C.3 285 ASN285 0.0957 4507 CB 86.9980 115.5530 109.8030 C.3 285 ASN285 0.0446 4508 CG 87.6980 116.1100 111.0460 C.2 285 ASN285 0.2000 4509 OD1 88.3260 115.4010 111.8200 O.2 285 ASN285 -0.2797 4510 ND2 87.5620 117.4360 111.1820 N.am 285 ASN285 -0.2723 4511 C 85.8150 113.4280 110.5360 C.2 285 ASN285 0.2192 4512 O 85.9330 112.5170 109.7110 O.2 285 ASN285 -0.2778 4513 H 85.0640 116.3420 111.5470 H 285 ASN285 0.1312 4514 HA 85.1570 114.7990 109.0980 H 285 ASN285 0.0562 4515 HB1 86.8580 116.3720 109.0990 H 285 ASN285 0.0375 4516 HB2 87.6840 114.8610 109.3100 H 285 ASN285 0.0375 4517 HD21 88.0220 117.8900 111.9410 H 285 ASN285 0.1266 4518 HD22 87.0270 117.9820 110.5400 H 285 ASN285 0.1266 4519 N 85.8020 113.1950 111.8510 N.am 286 SER286 -0.2436 4520 CA 85.8810 111.8260 112.3530 C.3 286 SER286 0.1109 4521 CB 86.0220 111.8460 113.8840 C.3 286 SER286 0.0681 4522 OG 86.0340 110.5670 114.4960 O.3 286 SER286 -0.3930 4523 C 84.6750 111.0080 111.9180 C.2 286 SER286 0.2209 4524 O 84.7950 109.8030 111.6680 O.2 286 SER286 -0.2777 4525 H 85.7370 113.9750 112.5060 H 286 SER286 0.1312 4526 HA 86.7690 111.3710 111.9060 H 286 SER286 0.0580 4527 HB1 85.1900 112.3990 114.3200 H 286 SER286 0.0577 4528 HB2 86.9290 112.3900 114.1630 H 286 SER286 0.0577 4529 HG 86.6990 110.0170 114.0720 H 286 SER286 0.2095 4530 N 83.5070 111.6430 111.8300 N.am 287 ILE287 -0.2453 4531 CA 82.3290 110.9680 111.2920 C.3 287 ILE287 0.0903 4532 CB 81.0680 111.7850 111.6490 C.3 287 ILE287 -0.0201 4533 CG1 80.8720 111.8100 113.1780 C.3 287 ILE287 -0.0514 4534 CG2 79.8040 111.2490 110.9490 C.3 287 ILE287 -0.0605 4535 CD1 79.8520 112.8420 113.6550 C.3 287 ILE287 -0.0650 4536 C 82.4820 110.7420 109.7920 C.2 287 ILE287 0.2189 4537 O 82.1240 109.6800 109.2690 O.2 287 ILE287 -0.2778 4538 H 83.4350 112.6110 112.1420 H 287 ILE287 0.1312 4539 HA 82.2740 109.9850 111.7640 H 287 ILE287 0.0560 4540 HB 81.2310 112.8100 111.3120 H 287 ILE287 0.0318 4541 HG11 81.8140 112.0200 113.6820 H 287 ILE287 0.0266 4542 HG12 80.5790 110.8230 113.5270 H 287 ILE287 0.0266 4543 HG21 78.9190 111.8200 111.2230 H 287 ILE287 0.0233 4544 HG22 79.6220 110.2060 111.2100 H 287 ILE287 0.0233 4545 HG23 79.8910 111.3080 109.8640 H 287 ILE287 0.0233 4546 HD11 79.8100 112.8190 114.7400 H 287 ILE287 0.0230 4547 HD12 78.8510 112.6340 113.2810 H 287 ILE287 0.0230 4548 HD13 80.1370 113.8490 113.3500 H 287 ILE287 0.0230 4549 N 83.0310 111.7280 109.0840 N.am 288 ILE288 -0.2454 4550 CA 82.9720 111.7460 107.6260 C.3 288 ILE288 0.0903 4551 CB 83.1750 113.1850 107.0860 C.3 288 ILE288 -0.0201 4552 CG1 81.8910 114.0150 107.2800 C.3 288 ILE288 -0.0514 4553 CG2 83.6300 113.2330 105.6100 C.3 288 ILE288 -0.0605 4554 CD1 82.0610 115.4940 106.9110 C.3 288 ILE288 -0.0650 4555 C 83.9690 110.7690 107.0160 C.2 288 ILE288 0.2189 4556 O 83.6270 110.0300 106.0870 O.2 288 ILE288 -0.2778 4557 H 83.5040 112.4880 109.5730 H 288 ILE288 0.1312 4558 HA 81.9810 111.3920 107.3370 H 288 ILE288 0.0560 4559 HB 83.9730 113.6400 107.6720 H 288 ILE288 0.0318 4560 HG11 81.5650 113.9460 108.3170 H 288 ILE288 0.0266 4561 HG12 81.0830 113.5860 106.6880 H 288 ILE288 0.0266 4562 HG21 83.7350 114.2540 105.2470 H 288 ILE288 0.0233 4563 HG22 82.9280 112.7120 104.9590 H 288 ILE288 0.0233 4564 HG23 84.6120 112.7770 105.4840 H 288 ILE288 0.0233 4565 HD11 81.2030 116.0770 107.2440 H 288 ILE288 0.0230 4566 HD12 82.1460 115.6320 105.8330 H 288 ILE288 0.0230 4567 HD13 82.9580 115.9090 107.3700 H 288 ILE288 0.0230 4568 N 85.2080 110.7520 107.5140 N.am 289 ASP289 -0.2451 4569 CA 86.2660 109.9980 106.8400 C.3 289 ASP289 0.0977 4570 CB 87.6780 110.3250 107.3680 C.3 289 ASP289 0.0576 4571 CG 88.1980 111.6390 106.7090 C.2 289 ASP289 0.1780 4572 OD1 88.2330 111.7130 105.4770 O.co2 289 ASP289 -0.6478 4573 OD2 88.5600 112.5780 107.4130 O.co2 289 ASP289 -0.6478 4574 C 85.8970 108.5590 106.4940 C.2 289 ASP289 0.2219 4575 O 86.2320 108.1270 105.3790 O.2 289 ASP289 -0.2776 4576 H 85.4180 111.2670 108.3690 H 289 ASP289 0.1312 4577 HA 86.2490 110.4230 105.8440 H 289 ASP289 0.0563 4578 HB1 88.3810 109.5360 107.1090 H 289 ASP289 0.0394 4579 HB2 87.6820 110.4250 108.4540 H 289 ASP289 0.0394 4580 N 85.2250 107.7780 107.3470 N.am 290 PRO290 -0.2316 4581 CA 84.8110 106.4420 106.8890 C.3 290 PRO290 0.0907 4582 CD 84.9710 108.0660 108.7460 C.3 290 PRO290 0.0071 4583 CB 84.1220 105.8730 108.1410 C.3 290 PRO290 -0.0276 4584 CG 84.7140 106.6710 109.3070 C.3 290 PRO290 -0.0379 4585 C 83.9010 106.4910 105.6760 C.2 290 PRO290 0.2189 4586 O 84.0830 105.7010 104.7440 O.2 290 PRO290 -0.2778 4587 HA 85.7220 105.8900 106.6550 H 290 PRO290 0.0559 4588 HD1 84.0970 108.6980 108.7980 H 290 PRO290 0.0431 4589 HD2 85.8330 108.5600 109.2010 H 290 PRO290 0.0431 4590 HB1 84.2750 104.8000 108.2530 H 290 PRO290 0.0285 4591 HB2 83.0460 106.0510 108.1130 H 290 PRO290 0.0285 4592 HG1 84.0630 106.7040 110.1730 H 290 PRO290 0.0278 4593 HG2 85.6600 106.2310 109.6220 H 290 PRO290 0.0278 4594 N 82.9500 107.4260 105.6450 N.am 291 TRP291 -0.2453 4595 CA 82.0860 107.5800 104.4790 C.3 291 TRP291 0.0918 4596 CB 81.0250 108.6710 104.7020 C.3 291 TRP291 -0.0021 4597 CG 79.9750 108.1720 105.6710 C.ar 291 TRP291 -0.0260 4598 CD2 78.7030 107.5690 105.3550 C.ar 291 TRP291 -0.0028 4599 CD1 80.0720 108.1820 107.0630 C.ar 291 TRP291 -0.0136 4600 NE1 78.9460 107.6500 107.5960 N.ar 291 TRP291 -0.2641 4601 CE2 78.0900 107.2360 106.5860 C.ar 291 TRP291 0.0269 4602 CE3 78.0700 107.2830 104.1740 C.ar 291 TRP291 -0.0528 4603 CZ2 76.8670 106.6210 106.5990 C.ar 291 TRP291 -0.0430 4604 CZ3 76.8230 106.6570 104.1840 C.ar 291 TRP291 -0.0611 4605 CH2 76.2220 106.3230 105.3980 C.ar 291 TRP291 -0.0602 4606 C 82.9020 107.8560 103.2220 C.2 291 TRP291 0.2190 4607 O 82.9150 107.0530 102.2820 O.2 291 TRP291 -0.2778 4608 H 82.8250 108.0420 106.4480 H 291 TRP291 0.1312 4609 HA 81.5980 106.6170 104.3300 H 291 TRP291 0.0560 4610 HB1 80.5360 108.9350 103.7640 H 291 TRP291 0.0334 4611 HB2 81.4710 109.5860 105.0900 H 291 TRP291 0.0334 4612 HD1 80.9220 108.5520 107.6160 H 291 TRP291 0.0748 4613 HE1 78.7730 107.5600 108.5560 H 291 TRP291 0.1331 4614 HE3 78.5430 107.5340 103.2360 H 291 TRP291 0.0624 4615 HZ2 76.4070 106.3680 107.5430 H 291 TRP291 0.0633 4616 HZ3 76.3240 106.4310 103.2530 H 291 TRP291 0.0618 4617 HH2 75.2560 105.8390 105.4120 H 291 TRP291 0.0618 4618 N 83.6190 108.9760 103.2050 N.am 292 VAL292 -0.2454 4619 CA 84.2880 109.4740 102.0080 C.3 292 VAL292 0.0901 4620 CB 84.6420 110.9700 102.1540 C.3 292 VAL292 -0.0227 4621 CG1 85.6470 111.2340 103.2750 C.3 292 VAL292 -0.0608 4622 CG2 85.1030 111.6090 100.8350 C.3 292 VAL292 -0.0608 4623 C 85.4680 108.5790 101.6420 C.2 292 VAL292 0.2189 4624 O 86.0330 108.6970 100.5500 O.2 292 VAL292 -0.2778 4625 H 83.7050 109.5110 104.0690 H 292 VAL292 0.1312 4626 HA 83.5640 109.3790 101.1980 H 292 VAL292 0.0560 4627 HB 83.7230 111.4850 102.4360 H 292 VAL292 0.0315 4628 HG11 85.9070 112.2910 103.3450 H 292 VAL292 0.0233 4629 HG12 86.5720 110.6720 103.1490 H 292 VAL292 0.0233 4630 HG13 85.1960 110.9510 104.2190 H 292 VAL292 0.0233 4631 HG21 85.2900 112.6750 100.9630 H 292 VAL292 0.0233 4632 HG22 84.3390 111.5000 100.0660 H 292 VAL292 0.0233 4633 HG23 86.0240 111.1600 100.4670 H 292 VAL292 0.0233 4634 N 85.8380 107.6640 102.5380 N.am 293 PHE293 -0.2453 4635 CA 86.9900 106.8000 102.3170 C.3 293 PHE293 0.0917 4636 CB 87.9880 106.6610 103.4980 C.3 293 PHE293 -0.0036 4637 CG 89.1570 107.6070 103.4250 C.ar 293 PHE293 -0.0454 4638 CD1 90.3350 107.1880 102.8130 C.ar 293 PHE293 -0.0585 4639 CD2 89.1260 108.8550 104.0370 C.ar 293 PHE293 -0.0585 4640 CE1 91.4700 107.9830 102.8400 C.ar 293 PHE293 -0.0615 4641 CE2 90.2620 109.6530 104.0630 C.ar 293 PHE293 -0.0615 4642 CZ 91.4380 109.2160 103.4750 C.ar 293 PHE293 -0.0617 4643 C 86.6360 105.3720 101.9330 C.2 293 PHE293 0.2190 4644 O 87.4230 104.7300 101.2370 O.2 293 PHE293 -0.2778 4645 H 85.3010 107.5660 103.4000 H 293 PHE293 0.1312 4646 HA 87.5530 107.1940 101.4700 H 293 PHE293 0.0560 4647 HB1 88.4550 105.6730 103.5050 H 293 PHE293 0.0333 4648 HB2 87.5190 106.6700 104.4700 H 293 PHE293 0.0333 4649 HD1 90.3870 106.2140 102.3530 H 293 PHE293 0.0620 4650 HD2 88.2340 109.2100 104.5320 H 293 PHE293 0.0620 4651 HE1 92.3840 107.6140 102.4060 H 293 PHE293 0.0618 4652 HE2 90.2370 110.6050 104.5740 H 293 PHE293 0.0618 4653 HZ 92.3210 109.8320 103.5410 H 293 PHE293 0.0618 4654 N 85.4830 104.8510 102.3590 N.am 294 ALA294 -0.2459 4655 CA 85.1430 103.4640 102.0810 C.3 294 ALA294 0.0850 4656 CB 85.2740 102.6800 103.3930 C.3 294 ALA294 -0.0411 4657 C 83.7560 103.2530 101.4940 C.2 294 ALA294 0.2184 4658 O 83.4460 102.1220 101.1070 O.2 294 ALA294 -0.2778 4659 H 84.8320 105.4330 102.8860 H 294 ALA294 0.1312 4660 HA 85.8280 103.0710 101.3510 H 294 ALA294 0.0554 4661 HB1 85.0860 101.6140 103.2550 H 294 ALA294 0.0249 4662 HB2 84.5670 103.0510 104.1360 H 294 ALA294 0.0249 4663 HB3 86.2730 102.7880 103.8150 H 294 ALA294 0.0249 4664 N 82.9140 104.2820 101.4140 N.am 295 ILE295 -0.2454 4665 CA 81.5750 104.1130 100.8620 C.3 295 ILE295 0.0903 4666 CB 80.5430 104.5930 101.9100 C.3 295 ILE295 -0.0201 4667 CG1 80.6520 103.7130 103.1810 C.3 295 ILE295 -0.0514 4668 CG2 79.1100 104.5800 101.3480 C.3 295 ILE295 -0.0605 4669 CD1 79.7400 104.1270 104.3420 C.3 295 ILE295 -0.0650 4670 C 81.4930 104.7970 99.5040 C.2 295 ILE295 0.2189 4671 O 81.2230 104.1490 98.4870 O.2 295 ILE295 -0.2778 4672 H 83.2100 105.2010 101.7430 H 295 ILE295 0.1312 4673 HA 81.3840 103.0550 100.6740 H 295 ILE295 0.0560 4674 HB 80.7810 105.6210 102.1870 H 295 ILE295 0.0318 4675 HG11 81.6740 103.7310 103.5610 H 295 ILE295 0.0266 4676 HG12 80.4480 102.6730 102.9250 H 295 ILE295 0.0266 4677 HG21 78.3940 104.9560 102.0770 H 295 ILE295 0.0233 4678 HG22 78.8070 103.5720 101.0680 H 295 ILE295 0.0233 4679 HG23 79.0200 105.2160 100.4670 H 295 ILE295 0.0233 4680 HD11 79.9120 103.4900 105.2100 H 295 ILE295 0.0230 4681 HD12 78.6850 104.0460 104.0850 H 295 ILE295 0.0230 4682 HD13 79.9400 105.1500 104.6510 H 295 ILE295 0.0230 4683 N 81.7360 106.1080 99.4750 N.am 296 LEU296 -0.2456 4684 CA 81.6040 106.8980 98.2520 C.3 296 LEU296 0.0880 4685 CB 81.4160 108.3710 98.6690 C.3 296 LEU296 -0.0266 4686 CG 80.2940 108.6090 99.7000 C.3 296 LEU296 -0.0449 4687 CD1 80.2820 110.0750 100.1490 C.3 296 LEU296 -0.0626 4688 CD2 78.9200 108.1940 99.1580 C.3 296 LEU296 -0.0626 4689 C 82.8530 106.7580 97.3770 C.2 296 LEU296 0.2187 4690 O 83.5280 107.7260 97.0300 O.2 296 LEU296 -0.2778 4691 H 82.0240 106.5750 100.3350 H 296 LEU296 0.1312 4692 HA 80.7370 106.5400 97.6950 H 296 LEU296 0.0557 4693 HB1 81.2310 108.9820 97.7840 H 296 LEU296 0.0287 4694 HB2 82.3490 108.7420 99.0990 H 296 LEU296 0.0287 4695 HG 80.4960 108.0160 100.5930 H 296 LEU296 0.0296 4696 HD11 79.5170 110.2480 100.9060 H 296 LEU296 0.0232 4697 HD12 80.0810 110.7430 99.3110 H 296 LEU296 0.0232 4698 HD13 81.2420 110.3610 100.5810 H 296 LEU296 0.0232 4699 HD21 78.1380 108.3850 99.8920 H 296 LEU296 0.0232 4700 HD22 78.8890 107.1320 98.9180 H 296 LEU296 0.0232 4701 HD23 78.6720 108.7490 98.2530 H 296 LEU296 0.0232 4702 N 83.1410 105.5080 97.0170 N.am 297 ARG297 -0.2456 4703 CA 84.2850 105.1530 96.1750 C.3 297 ARG297 0.0881 4704 CB 84.6030 103.6590 96.3370 C.3 297 ARG297 -0.0258 4705 CG 84.9580 103.2780 97.7870 C.3 297 ARG297 -0.0154 4706 CD 85.5270 101.8500 97.8800 C.3 297 ARG297 0.1045 4707 NE 86.1240 101.5630 99.1880 N.pl3 297 ARG297 -0.4450 4708 CZ 87.3020 102.0350 99.5980 C.cat 297 ARG297 0.5062 4709 NH1 87.9680 102.8980 98.8800 N.pl3 297 ARG297 -0.4573 4710 NH2 87.7960 101.6370 100.7410 N.pl3 297 ARG297 -0.4573 4711 C 84.0790 105.6060 94.7320 C.2 297 ARG297 0.2213 4712 O 82.9430 105.7350 94.2770 O.2 297 ARG297 -0.2776 4713 H 82.5320 104.7580 97.3450 H 297 ARG297 0.1312 4714 HA 85.1070 105.7290 96.5960 H 297 ARG297 0.0557 4715 HB1 85.4570 103.4150 95.7060 H 297 ARG297 0.0286 4716 HB2 83.7650 103.0560 95.9840 H 297 ARG297 0.0286 4717 HG1 84.0830 103.3680 98.4320 H 297 ARG297 0.0299 4718 HG2 85.6840 103.9950 98.1700 H 297 ARG297 0.0299 4719 HD1 86.2840 101.6640 97.1150 H 297 ARG297 0.0711 4720 HD2 84.7310 101.1180 97.7260 H 297 ARG297 0.0711 4721 HE 85.6240 100.9800 99.8310 H 297 ARG297 0.3153 4722 HH11 88.8300 103.2720 99.2150 H 297 ARG297 0.3114 4723 HH12 87.6030 103.1950 98.0040 H 297 ARG297 0.3114 4724 HH21 88.6550 102.0190 101.0750 H 297 ARG297 0.3114 4725 HH22 87.3120 100.9590 101.2910 H 297 ARG297 0.3114 4726 N 85.1820 105.8490 94.0040 N.am 298 PRO298 -0.2316 4727 CA 85.0650 106.3260 92.6190 C.3 298 PRO298 0.0909 4728 HA 84.6786 107.3449 92.6836 H 298 PRO298 0.0560 4729 CD 86.5666 105.7239 94.4585 C.3 298 PRO298 0.0071 4730 HD1 86.8079 104.6647 94.5299 H 298 PRO298 0.0431 4731 HD2 86.7119 106.2214 95.4161 H 298 PRO298 0.0431 4732 CB 86.5066 106.3299 92.0957 C.3 298 PRO298 -0.0275 4733 HB1 86.6961 107.1577 91.4125 H 298 PRO298 0.0285 4734 HB2 86.7419 105.4118 91.5574 H 298 PRO298 0.0285 4735 CG 87.3673 106.4176 93.3546 C.3 298 PRO298 -0.0379 4736 HG1 88.3561 105.9797 93.2191 H 298 PRO298 0.0278 4737 HG2 87.5017 107.4678 93.6187 H 298 PRO298 0.0278 4738 C 84.1090 105.4910 91.7810 C.2 298 PRO298 0.2216 4739 O 83.3800 106.0570 90.9540 O.2 298 PRO298 -0.2776 4740 N 84.0690 104.1410 91.9300 N.am 299 PRO299 -0.2316 4741 CA 83.0480 103.3850 91.1860 C.3 299 PRO299 0.0907 4742 CD 84.9750 103.3010 92.7010 C.3 299 PRO299 0.0071 4743 CB 83.3750 101.9150 91.5130 C.3 299 PRO299 -0.0276 4744 CG 84.7950 101.9140 92.0870 C.3 299 PRO299 -0.0379 4745 C 81.6330 103.7560 91.5990 C.2 299 PRO299 0.2189 4746 O 80.7480 103.9290 90.7520 O.2 299 PRO299 -0.2778 4747 HA 83.1620 103.6110 90.1280 H 299 PRO299 0.0559 4748 HD1 84.6180 103.2940 93.7250 H 299 PRO299 0.0431 4749 HD2 85.9980 103.6730 92.6270 H 299 PRO299 0.0431 4750 HB1 83.2840 101.2690 90.6400 H 299 PRO299 0.0285 4751 HB2 82.6990 101.5200 92.2730 H 299 PRO299 0.0285 4752 HG1 84.9450 101.1180 92.8170 H 299 PRO299 0.0278 4753 HG2 85.5310 101.7610 91.2990 H 299 PRO299 0.0278 4754 N 81.4110 103.8700 92.9100 N.am 300 VAL300 -0.2454 4755 CA 80.0940 104.2410 93.4180 C.3 300 VAL300 0.0901 4756 CB 80.1040 104.1450 94.9620 C.3 300 VAL300 -0.0227 4757 CG1 78.7450 104.5070 95.5820 C.3 300 VAL300 -0.0608 4758 CG2 80.5410 102.7490 95.4360 C.3 300 VAL300 -0.0608 4759 C 79.7100 105.6360 92.9500 C.2 300 VAL300 0.2189 4760 O 78.5430 105.8980 92.6340 O.2 300 VAL300 -0.2778 4761 H 82.1720 103.6950 93.5660 H 300 VAL300 0.1312 4762 HA 79.3750 103.5360 92.9980 H 300 VAL300 0.0560 4763 HB 80.8330 104.8600 95.3460 H 300 VAL300 0.0315 4764 HG11 78.7770 104.4200 96.6680 H 300 VAL300 0.0233 4765 HG12 77.9560 103.8510 95.2120 H 300 VAL300 0.0233 4766 HG13 78.4600 105.5340 95.3520 H 300 VAL300 0.0233 4767 HG21 80.5140 102.6780 96.5230 H 300 VAL300 0.0233 4768 HG22 81.5590 102.5160 95.1260 H 300 VAL300 0.0233 4769 HG23 79.8830 101.9770 95.0350 H 300 VAL300 0.0233 4770 N 80.6820 106.5440 92.8570 N.am 301 LEU301 -0.2456 4771 CA 80.3660 107.8950 92.4090 C.3 301 LEU301 0.0880 4772 CB 81.5800 108.7610 92.8020 C.3 301 LEU301 -0.0266 4773 CG 81.4100 110.2800 92.5970 C.3 301 LEU301 -0.0449 4774 CD1 82.1880 111.0560 93.6700 C.3 301 LEU301 -0.0626 4775 CD2 81.8630 110.7410 91.2020 C.3 301 LEU301 -0.0626 4776 C 80.1170 107.9290 90.9060 C.2 301 LEU301 0.2187 4777 O 79.3030 108.7240 90.4240 O.2 301 LEU301 -0.2778 4778 H 81.6410 106.2950 93.0980 H 301 LEU301 0.1312 4779 HA 79.4700 108.2330 92.9330 H 301 LEU301 0.0557 4780 HB1 82.4800 108.4120 92.2930 H 301 LEU301 0.0287 4781 HB2 81.7650 108.5740 93.8610 H 301 LEU301 0.0287 4782 HG 80.3550 110.5290 92.7200 H 301 LEU301 0.0296 4783 HD11 81.9920 112.1230 93.5930 H 301 LEU301 0.0232 4784 HD12 83.2640 110.9020 93.5720 H 301 LEU301 0.0232 4785 HD13 81.8970 110.7460 94.6740 H 301 LEU301 0.0232 4786 HD21 81.7550 111.8200 91.0930 H 301 LEU301 0.0232 4787 HD22 81.2870 110.2770 90.4030 H 301 LEU301 0.0232 4788 HD23 82.9120 110.4970 91.0340 H 301 LEU301 0.0232 4789 N 80.7990 107.0670 90.1480 N.am 302 ARG302 -0.2457 4790 CA 80.4830 106.9350 88.7290 C.3 302 ARG302 0.0879 4791 CB 81.5440 105.9810 88.1620 C.3 302 ARG302 -0.0258 4792 CG 81.4690 105.6640 86.6630 C.3 302 ARG302 -0.0154 4793 CD 82.1460 106.7050 85.7550 C.3 302 ARG302 0.1045 4794 NE 82.8810 105.9930 84.7000 N.pl3 302 ARG302 -0.4450 4795 CZ 84.1720 105.6670 84.7890 C.cat 302 ARG302 0.5062 4796 NH1 84.9450 106.1390 85.7150 N.pl3 302 ARG302 -0.4573 4797 NH2 84.7070 104.8400 83.9380 N.pl3 302 ARG302 -0.4573 4798 C 79.0690 106.4040 88.5380 C.2 302 ARG302 0.2187 4799 O 78.3430 106.8550 87.6460 O.2 302 ARG302 -0.2778 4800 H 81.5410 106.5010 90.5600 H 302 ARG302 0.1312 4801 HA 80.5690 107.9240 88.2770 H 302 ARG302 0.0557 4802 HB1 81.4900 105.0410 88.7100 H 302 ARG302 0.0286 4803 HB2 82.5250 106.3940 88.3900 H 302 ARG302 0.0286 4804 HG1 80.4420 105.4860 86.3450 H 302 ARG302 0.0299 4805 HG2 81.9790 104.7090 86.5240 H 302 ARG302 0.0299 4806 HD1 82.8120 107.3750 86.3010 H 302 ARG302 0.0711 4807 HD2 81.3970 107.3320 85.2730 H 302 ARG302 0.0711 4808 HE 82.4110 105.6860 83.8760 H 302 ARG302 0.3153 4809 HH11 85.8730 105.7560 85.7720 H 302 ARG302 0.3114 4810 HH12 84.6550 106.8530 86.3570 H 302 ARG302 0.3114 4811 HH21 85.6610 104.5710 84.1290 H 302 ARG302 0.3114 4812 HH22 84.2270 104.4730 83.1500 H 302 ARG302 0.3114 4813 N 78.6620 105.4460 89.3710 N.am 303 LEU303 -0.2456 4814 CA 77.2840 104.9640 89.3320 C.3 303 LEU303 0.0880 4815 CB 77.1640 103.7830 90.3120 C.3 303 LEU303 -0.0266 4816 CG 75.8260 103.0150 90.2600 C.3 303 LEU303 -0.0449 4817 CD1 76.0280 101.5590 90.7020 C.3 303 LEU303 -0.0626 4818 CD2 74.7310 103.6640 91.1230 C.3 303 LEU303 -0.0626 4819 C 76.3040 106.0880 89.6570 C.2 303 LEU303 0.2187 4820 O 75.2750 106.2470 88.9890 O.2 303 LEU303 -0.2778 4821 H 79.3190 105.0460 90.0410 H 303 LEU303 0.1312 4822 HA 77.0910 104.6260 88.3130 H 303 LEU303 0.0557 4823 HB1 77.3670 104.1070 91.3330 H 303 LEU303 0.0287 4824 HB2 77.9700 103.0900 90.0670 H 303 LEU303 0.0287 4825 HG 75.4790 102.9930 89.2260 H 303 LEU303 0.0296 4826 HD11 75.0950 100.9970 90.6420 H 303 LEU303 0.0232 4827 HD12 76.3850 101.5060 91.7300 H 303 LEU303 0.0232 4828 HD13 76.7560 101.0520 90.0670 H 303 LEU303 0.0232 4829 HD21 73.8270 103.0560 91.1240 H 303 LEU303 0.0232 4830 HD22 74.4430 104.6490 90.7630 H 303 LEU303 0.0232 4831 HD23 75.0580 103.7710 92.1580 H 303 LEU303 0.0232 4832 N 76.6110 106.8800 90.6880 N.am 304 MET304 -0.2456 4833 CA 75.7390 107.9850 91.0710 C.3 304 MET304 0.0885 4834 CB 76.2710 108.5610 92.3920 C.3 304 MET304 -0.0199 4835 CG 75.3620 109.6320 93.0070 C.3 304 MET304 -0.0047 4836 SD 75.9790 110.1600 94.6150 S.3 304 MET304 -0.1641 4837 CE 74.7890 111.4750 94.9340 C.3 304 MET304 -0.0181 4838 C 75.6580 109.0630 89.9990 C.2 304 MET304 0.2187 4839 O 74.6070 109.6940 89.8510 O.2 304 MET304 -0.2778 4840 H 77.4680 106.7100 91.2150 H 304 MET304 0.1312 4841 HA 74.7400 107.5700 91.2160 H 304 MET304 0.0557 4842 HB1 77.2710 108.9710 92.2430 H 304 MET304 0.0293 4843 HB2 76.3850 107.7470 93.1080 H 304 MET304 0.0293 4844 HG1 74.3440 109.2620 93.1220 H 304 MET304 0.0377 4845 HG2 75.2970 110.5040 92.3550 H 304 MET304 0.0377 4846 HE1 74.9670 111.9240 95.9100 H 304 MET304 0.0340 4847 HE2 73.7750 111.0760 94.9050 H 304 MET304 0.0340 4848 HE3 74.8640 112.2430 94.1640 H 304 MET304 0.0340 4849 N 76.7370 109.2890 89.2510 N.am 305 ARG305 -0.2457 4850 CA 76.7080 110.2300 88.1400 C.3 305 ARG305 0.0879 4851 CB 78.2370 110.3710 87.9710 C.3 305 ARG305 -0.0258 4852 CG 78.8600 111.2260 86.8700 C.3 305 ARG305 -0.0154 4853 CD 80.3910 111.0750 87.0060 C.3 305 ARG305 0.1045 4854 NE 81.1090 111.7370 85.9220 N.pl3 305 ARG305 -0.4450 4855 CZ 82.4250 111.6060 85.7600 C.cat 305 ARG305 0.5062 4856 NH1 83.1640 110.8800 86.5510 N.pl3 305 ARG305 -0.4573 4857 NH2 83.0040 112.2180 84.7710 N.pl3 305 ARG305 -0.4573 4858 C 76.0220 109.6590 86.9090 C.2 305 ARG305 0.2187 4859 O 75.4610 110.4250 86.1170 O.2 305 ARG305 -0.2778 4860 H 77.6030 108.7920 89.4610 H 305 ARG305 0.1312 4861 HA 76.2280 111.1580 88.4560 H 305 ARG305 0.0557 4862 HB1 78.6500 109.3670 87.8540 H 305 ARG305 0.0286 4863 HB2 78.6360 110.7340 88.9210 H 305 ARG305 0.0286 4864 HG1 78.5600 112.2690 86.9760 H 305 ARG305 0.0299 4865 HG2 78.5230 110.8890 85.8910 H 305 ARG305 0.0299 4866 HD1 80.6670 110.0160 86.9910 H 305 ARG305 0.0711 4867 HD2 80.7420 111.4940 87.9540 H 305 ARG305 0.0711 4868 HE 80.5950 112.2990 85.2770 H 305 ARG305 0.3153 4869 HH11 84.1460 110.7600 86.4300 H 305 ARG305 0.3114 4870 HH12 82.7700 110.3880 87.3360 H 305 ARG305 0.3114 4871 HH21 83.9920 112.1560 84.6710 H 305 ARG305 0.3114 4872 HH22 82.4710 112.7400 84.1070 H 305 ARG305 0.3114 4873 N 76.0550 108.3370 86.7310 N.am 306 SER306 -0.2436 4874 CA 75.2900 107.7040 85.6660 C.3 306 SER306 0.1109 4875 CB 75.8010 106.2640 85.5140 C.3 306 SER306 0.0681 4876 OG 75.3490 105.7000 84.2900 O.3 306 SER306 -0.3930 4877 C 73.8000 107.7020 85.9680 C.2 306 SER306 0.2209 4878 O 72.9890 107.6960 85.0360 O.2 306 SER306 -0.2777 4879 H 76.6250 107.7610 87.3510 H 306 SER306 0.1312 4880 HA 75.4630 108.2640 84.7460 H 306 SER306 0.0580 4881 HB1 75.4810 105.6650 86.3760 H 306 SER306 0.0577 4882 HB2 76.8940 106.2750 85.5130 H 306 SER306 0.0577 4883 HG 75.5190 104.7620 84.2490 H 306 SER306 0.2095 4884 N 73.4240 107.6960 87.2490 N.am 307 VAL307 -0.2453 4885 CA 72.0200 107.8760 87.6100 C.3 307 VAL307 0.0901 4886 CB 71.8290 107.5240 89.1030 C.3 307 VAL307 -0.0227 4887 CG1 70.4610 107.9590 89.6570 C.3 307 VAL307 -0.0608 4888 CG2 72.0170 106.0170 89.3400 C.3 307 VAL307 -0.0608 4889 C 71.5750 109.2960 87.2830 C.2 307 VAL307 0.2190 4890 O 70.5080 109.5130 86.6950 O.2 307 VAL307 -0.2778 4891 H 74.1220 107.5650 87.9810 H 307 VAL307 0.1312 4892 HA 71.4290 107.1970 86.9930 H 307 VAL307 0.0560 4893 HB 72.5960 108.0490 89.6740 H 307 VAL307 0.0315 4894 HG11 70.3430 107.6460 90.6950 H 307 VAL307 0.0233 4895 HG12 69.6460 107.5190 89.0810 H 307 VAL307 0.0233 4896 HG13 70.3410 109.0420 89.6340 H 307 VAL307 0.0233 4897 HG21 71.9970 105.7820 90.4040 H 307 VAL307 0.0233 4898 HG22 72.9610 105.6530 88.9410 H 307 VAL307 0.0233 4899 HG23 71.2230 105.4460 88.8590 H 307 VAL307 0.0233 4900 N 72.4554 110.2558 87.6762 N.am 308 LEU308 -0.2440 4901 CA 72.2972 111.6791 87.3434 C.3 308 LEU308 0.1008 4902 CB 71.0699 112.2696 88.0692 C.3 308 LEU308 -0.0248 4903 CG 70.7804 113.7497 87.7457 C.3 308 LEU308 -0.0448 4904 CD1 69.5827 114.2557 88.5589 C.3 308 LEU308 -0.0626 4905 CD2 70.5487 113.9796 86.2457 C.3 308 LEU308 -0.0626 4906 C 73.5812 112.5000 87.6864 C.2 308 LEU308 0.1943 4907 O 74.0253 112.4789 88.8361 O.co2 308 LEU308 -0.6467 4908 OXT 74.1239 113.1670 86.7997 O.co2 308 LEU308 -0.6467 4909 H 73.2726 110.0354 88.2094 H 308 LEU308 0.1312 4910 HA 72.1632 111.7149 86.2629 H 308 LEU308 0.0576 4911 HB1 71.2186 112.1599 89.1439 H 308 LEU308 0.0288 4912 HB2 70.1851 111.6826 87.8284 H 308 LEU308 0.0288 4913 HG 71.6485 114.3403 88.0422 H 308 LEU308 0.0296 4914 HD11 69.4011 115.3137 88.3700 H 308 LEU308 0.0232 4915 HD12 69.7594 114.1345 89.6277 H 308 LEU308 0.0232 4916 HD13 68.6758 113.7073 88.3038 H 308 LEU308 0.0232 4917 HD21 70.2989 115.0211 86.0440 H 308 LEU308 0.0232 4918 HD22 69.7354 113.3579 85.8720 H 308 LEU308 0.0232 4919 HD23 71.4438 113.7474 85.6685 H 308 LEU308 0.0232 @BOND 1 1 2 1 2 1 10 1 3 1 11 1 4 1 12 1 5 2 3 1 6 2 8 1 7 2 13 1 8 3 4 1 9 3 14 1 10 3 15 1 11 4 5 1 12 4 16 1 13 4 17 1 14 5 6 ar 15 5 7 ar 16 8 9 2 17 8 18 am 18 18 19 1 19 18 24 1 20 19 20 1 21 19 22 1 22 19 25 1 23 20 21 1 24 20 26 1 25 20 27 1 26 21 28 1 27 22 23 2 28 22 29 am 29 29 31 1 30 29 30 1 31 30 32 1 32 30 34 1 33 30 36 1 34 31 33 1 35 31 37 1 36 31 38 1 37 32 33 1 38 32 39 1 39 32 40 1 40 33 41 1 41 33 42 1 42 34 35 2 43 34 43 am 44 43 44 1 45 43 48 1 46 44 45 1 47 44 46 1 48 44 49 1 49 45 50 1 50 45 51 1 51 45 52 1 52 46 47 2 53 46 53 am 54 53 54 1 55 53 61 1 56 54 55 1 57 54 59 1 58 54 62 1 59 55 57 1 60 55 56 1 61 55 63 1 62 56 58 1 63 56 64 1 64 56 65 1 65 57 66 1 66 57 67 1 67 57 68 1 68 58 69 1 69 58 70 1 70 58 71 1 71 59 60 2 72 59 72 am 73 72 73 1 74 72 78 1 75 73 74 1 76 73 76 1 77 73 79 1 78 74 75 1 79 74 80 1 80 74 81 1 81 75 82 1 82 76 77 2 83 76 83 am 84 83 84 1 85 83 89 1 86 84 85 1 87 84 87 1 88 84 90 1 89 85 86 1 90 85 91 1 91 85 92 1 92 86 93 1 93 87 88 2 94 87 94 am 95 94 95 1 96 94 101 1 97 95 96 1 98 95 99 1 99 95 102 1 100 96 97 1 101 96 98 1 102 96 103 1 103 97 104 1 104 97 105 1 105 97 106 1 106 98 107 1 107 98 108 1 108 98 109 1 109 99 100 2 110 99 110 am 111 110 111 1 112 110 118 1 113 111 112 1 114 111 116 1 115 111 119 1 116 112 113 1 117 112 120 1 118 112 121 1 119 113 114 1 120 113 122 1 121 113 123 1 122 114 115 1 123 115 124 1 124 115 125 1 125 115 126 1 126 116 117 2 127 116 127 am 128 127 128 1 129 127 138 1 130 128 129 1 131 128 136 1 132 128 139 1 133 129 130 1 134 129 140 1 135 129 141 1 136 130 131 ar 137 130 132 ar 138 131 133 ar 139 131 142 1 140 132 134 ar 141 132 143 1 142 133 135 ar 143 133 144 1 144 134 135 ar 145 134 145 1 146 135 146 1 147 136 137 2 148 136 147 am 149 147 148 1 150 147 153 1 151 148 149 1 152 148 151 1 153 148 154 1 154 149 150 1 155 149 155 1 156 149 156 1 157 150 157 1 158 151 152 2 159 151 158 am 160 158 159 1 161 158 163 1 162 159 160 1 163 159 161 1 164 159 164 1 165 160 165 1 166 160 166 1 167 160 167 1 168 161 162 2 169 161 168 am 170 168 169 1 171 168 172 1 172 169 170 1 173 169 173 1 174 169 174 1 175 170 171 2 176 170 175 am 177 175 176 1 178 175 182 1 179 176 177 1 180 176 180 1 181 176 183 1 182 177 178 1 183 177 179 1 184 177 184 1 185 178 185 1 186 178 186 1 187 178 187 1 188 179 188 1 189 179 189 1 190 179 190 1 191 180 181 2 192 180 191 am 193 191 192 1 194 191 199 1 195 192 193 1 196 192 197 1 197 192 200 1 198 193 194 1 199 193 201 1 200 193 202 1 201 194 195 1 202 194 196 1 203 194 203 1 204 195 204 1 205 195 205 1 206 195 206 1 207 196 207 1 208 196 208 1 209 196 209 1 210 197 198 2 211 197 210 am 212 210 211 1 213 210 214 1 214 211 212 1 215 211 215 1 216 211 216 1 217 212 213 2 218 212 217 am 219 217 218 1 220 217 225 1 221 218 219 1 222 218 223 1 223 218 226 1 224 219 220 1 225 219 227 1 226 219 228 1 227 220 221 2 228 220 222 am 229 222 229 1 230 222 230 1 231 223 224 2 232 223 231 am 233 231 232 1 234 231 239 1 235 232 233 1 236 232 237 1 237 232 240 1 238 233 234 1 239 233 241 1 240 233 242 1 241 234 235 1 242 234 236 1 243 234 243 1 244 235 244 1 245 235 245 1 246 235 246 1 247 236 247 1 248 236 248 1 249 236 249 1 250 237 238 2 251 237 250 am 252 250 251 1 253 250 258 1 254 251 252 1 255 251 256 1 256 251 259 1 257 252 254 1 258 252 253 1 259 252 260 1 260 253 255 1 261 253 261 1 262 253 262 1 263 254 263 1 264 254 264 1 265 254 265 1 266 255 266 1 267 255 267 1 268 255 268 1 269 256 257 2 270 256 269 am 271 269 270 1 272 269 274 1 273 270 271 1 274 270 272 1 275 270 275 1 276 271 276 1 277 271 277 1 278 271 278 1 279 272 273 2 280 272 279 am 281 279 280 1 282 279 287 1 283 280 281 1 284 280 285 1 285 280 288 1 286 281 282 1 287 281 289 1 288 281 290 1 289 282 283 1 290 282 284 1 291 282 291 1 292 283 292 1 293 283 293 1 294 283 294 1 295 284 295 1 296 284 296 1 297 284 297 1 298 285 286 2 299 285 298 am 300 298 299 1 301 298 303 1 302 299 300 1 303 299 301 1 304 299 304 1 305 300 305 1 306 300 306 1 307 300 307 1 308 301 302 2 309 301 308 am 310 308 309 1 311 308 316 1 312 309 310 1 313 309 314 1 314 309 317 1 315 310 311 1 316 310 318 1 317 310 319 1 318 311 312 1 319 311 313 1 320 311 320 1 321 312 321 1 322 312 322 1 323 312 323 1 324 313 324 1 325 313 325 1 326 313 326 1 327 314 315 2 328 314 327 am 329 327 328 1 330 327 335 1 331 328 329 1 332 328 333 1 333 328 336 1 334 329 330 1 335 329 337 1 336 329 338 1 337 330 331 1 338 330 332 1 339 330 339 1 340 331 340 1 341 331 341 1 342 331 342 1 343 332 343 1 344 332 344 1 345 332 345 1 346 333 334 2 347 333 346 am 348 346 347 1 349 346 351 1 350 347 348 1 351 347 349 1 352 347 352 1 353 348 353 1 354 348 354 1 355 348 355 1 356 349 350 2 357 349 356 am 358 356 357 1 359 356 367 1 360 357 358 1 361 357 365 1 362 357 368 1 363 358 359 1 364 358 369 1 365 358 370 1 366 359 360 1 367 359 371 1 368 359 372 1 369 360 361 1 370 360 373 1 371 360 374 1 372 361 362 ar 373 361 375 1 374 362 363 ar 375 362 364 ar 376 363 376 1 377 363 377 1 378 364 378 1 379 364 379 1 380 365 366 2 381 365 380 am 382 380 381 1 383 380 391 1 384 381 382 1 385 381 389 1 386 381 392 1 387 382 383 1 388 382 393 1 389 382 394 1 390 383 384 1 391 383 395 1 392 383 396 1 393 384 385 1 394 384 397 1 395 384 398 1 396 385 386 ar 397 385 399 1 398 386 387 ar 399 386 388 ar 400 387 400 1 401 387 401 1 402 388 402 1 403 388 403 1 404 389 390 2 405 389 404 am 406 404 405 1 407 404 418 1 408 405 406 1 409 405 416 1 410 405 419 1 411 406 407 1 412 406 420 1 413 406 421 1 414 407 409 ar 415 407 408 ar 416 408 411 ar 417 408 412 ar 418 409 410 ar 419 409 422 1 420 410 411 ar 421 410 423 1 422 411 413 ar 423 412 414 ar 424 412 424 1 425 413 415 ar 426 413 425 1 427 414 415 ar 428 414 426 1 429 415 427 1 430 416 417 2 431 416 428 am 432 428 429 1 433 428 439 1 434 429 430 1 435 429 437 1 436 429 440 1 437 430 431 1 438 430 441 1 439 430 442 1 440 431 432 1 441 431 443 1 442 431 444 1 443 432 433 1 444 432 445 1 445 432 446 1 446 433 434 ar 447 433 447 1 448 434 435 ar 449 434 436 ar 450 435 448 1 451 435 449 1 452 436 450 1 453 436 451 1 454 437 438 2 455 437 452 am 456 452 453 1 457 452 456 1 458 453 454 1 459 453 457 1 460 453 458 1 461 454 455 2 462 454 459 am 463 459 460 1 464 459 467 1 465 460 461 1 466 460 465 1 467 460 468 1 468 461 462 1 469 461 469 1 470 461 470 1 471 462 463 ar 472 462 464 ar 473 465 466 2 474 465 471 am 475 471 472 1 476 471 478 1 477 472 473 1 478 472 476 1 479 472 479 1 480 473 474 1 481 473 475 1 482 473 480 1 483 474 481 1 484 474 482 1 485 474 483 1 486 475 484 1 487 475 485 1 488 475 486 1 489 476 477 2 490 476 487 am 491 487 488 1 492 487 491 1 493 488 489 1 494 488 492 1 495 488 493 1 496 489 490 2 497 489 494 am 498 494 495 1 499 494 500 1 500 495 496 1 501 495 498 1 502 495 501 1 503 496 497 1 504 496 502 1 505 496 503 1 506 497 504 1 507 498 499 2 508 498 505 am 509 505 506 1 510 505 511 1 511 506 507 1 512 506 509 1 513 506 512 1 514 507 508 1 515 507 513 1 516 507 514 1 517 508 515 1 518 509 510 2 519 509 516 am 520 516 517 1 521 516 521 1 522 517 518 1 523 517 519 1 524 517 522 1 525 518 523 1 526 518 524 1 527 518 525 1 528 519 520 2 529 519 526 am 530 526 527 1 531 526 530 1 532 527 528 1 533 527 531 1 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4591 1 4640 4584 4592 1 4641 4584 4593 1 4642 4585 4586 2 4643 4585 4594 am 4644 4594 4595 1 4645 4594 4608 1 4646 4595 4596 1 4647 4595 4606 1 4648 4595 4609 1 4649 4596 4597 1 4650 4596 4610 1 4651 4596 4611 1 4652 4597 4599 ar 4653 4597 4598 ar 4654 4598 4601 ar 4655 4598 4602 ar 4656 4599 4600 ar 4657 4599 4612 1 4658 4600 4601 ar 4659 4600 4613 1 4660 4601 4603 ar 4661 4602 4604 ar 4662 4602 4614 1 4663 4603 4605 ar 4664 4603 4615 1 4665 4604 4605 ar 4666 4604 4616 1 4667 4605 4617 1 4668 4606 4607 2 4669 4606 4618 am 4670 4618 4619 1 4671 4618 4625 1 4672 4619 4620 1 4673 4619 4623 1 4674 4619 4626 1 4675 4620 4621 1 4676 4620 4622 1 4677 4620 4627 1 4678 4621 4628 1 4679 4621 4629 1 4680 4621 4630 1 4681 4622 4631 1 4682 4622 4632 1 4683 4622 4633 1 4684 4623 4624 2 4685 4623 4634 am 4686 4634 4635 1 4687 4634 4645 1 4688 4635 4636 1 4689 4635 4643 1 4690 4635 4646 1 4691 4636 4637 1 4692 4636 4647 1 4693 4636 4648 1 4694 4637 4638 ar 4695 4637 4639 ar 4696 4638 4640 ar 4697 4638 4649 1 4698 4639 4641 ar 4699 4639 4650 1 4700 4640 4642 ar 4701 4640 4651 1 4702 4641 4642 ar 4703 4641 4652 1 4704 4642 4653 1 4705 4643 4644 2 4706 4643 4654 am 4707 4654 4655 1 4708 4654 4659 1 4709 4655 4656 1 4710 4655 4657 1 4711 4655 4660 1 4712 4656 4661 1 4713 4656 4662 1 4714 4656 4663 1 4715 4657 4658 2 4716 4657 4664 am 4717 4664 4665 1 4718 4664 4672 1 4719 4665 4666 1 4720 4665 4670 1 4721 4665 4673 1 4722 4666 4668 1 4723 4666 4667 1 4724 4666 4674 1 4725 4667 4669 1 4726 4667 4675 1 4727 4667 4676 1 4728 4668 4677 1 4729 4668 4678 1 4730 4668 4679 1 4731 4669 4680 1 4732 4669 4681 1 4733 4669 4682 1 4734 4670 4671 2 4735 4670 4683 am 4736 4683 4684 1 4737 4683 4691 1 4738 4684 4685 1 4739 4684 4689 1 4740 4684 4692 1 4741 4685 4686 1 4742 4685 4693 1 4743 4685 4694 1 4744 4686 4687 1 4745 4686 4688 1 4746 4686 4695 1 4747 4687 4696 1 4748 4687 4697 1 4749 4687 4698 1 4750 4688 4699 1 4751 4688 4700 1 4752 4688 4701 1 4753 4689 4690 2 4754 4689 4702 am 4755 4702 4703 1 4756 4702 4713 1 4757 4703 4704 1 4758 4703 4711 1 4759 4703 4714 1 4760 4704 4705 1 4761 4704 4715 1 4762 4704 4716 1 4763 4705 4706 1 4764 4705 4717 1 4765 4705 4718 1 4766 4706 4707 1 4767 4706 4719 1 4768 4706 4720 1 4769 4707 4708 ar 4770 4707 4721 1 4771 4708 4709 ar 4772 4708 4710 ar 4773 4709 4722 1 4774 4709 4723 1 4775 4710 4724 1 4776 4710 4725 1 4777 4711 4712 2 4778 4711 4726 am 4779 4726 4729 1 4780 4726 4727 1 4781 4727 4732 1 4782 4727 4738 1 4783 4727 4728 1 4784 4729 4735 1 4785 4729 4730 1 4786 4729 4731 1 4787 4732 4735 1 4788 4732 4733 1 4789 4732 4734 1 4790 4735 4736 1 4791 4735 4737 1 4792 4738 4739 2 4793 4738 4740 am 4794 4740 4742 1 4795 4740 4741 1 4796 4741 4743 1 4797 4741 4745 1 4798 4741 4747 1 4799 4742 4744 1 4800 4742 4748 1 4801 4742 4749 1 4802 4743 4744 1 4803 4743 4750 1 4804 4743 4751 1 4805 4744 4752 1 4806 4744 4753 1 4807 4745 4746 2 4808 4745 4754 am 4809 4754 4755 1 4810 4754 4761 1 4811 4755 4756 1 4812 4755 4759 1 4813 4755 4762 1 4814 4756 4757 1 4815 4756 4758 1 4816 4756 4763 1 4817 4757 4764 1 4818 4757 4765 1 4819 4757 4766 1 4820 4758 4767 1 4821 4758 4768 1 4822 4758 4769 1 4823 4759 4760 2 4824 4759 4770 am 4825 4770 4771 1 4826 4770 4778 1 4827 4771 4772 1 4828 4771 4776 1 4829 4771 4779 1 4830 4772 4773 1 4831 4772 4780 1 4832 4772 4781 1 4833 4773 4774 1 4834 4773 4775 1 4835 4773 4782 1 4836 4774 4783 1 4837 4774 4784 1 4838 4774 4785 1 4839 4775 4786 1 4840 4775 4787 1 4841 4775 4788 1 4842 4776 4777 2 4843 4776 4789 am 4844 4789 4790 1 4845 4789 4800 1 4846 4790 4791 1 4847 4790 4798 1 4848 4790 4801 1 4849 4791 4792 1 4850 4791 4802 1 4851 4791 4803 1 4852 4792 4793 1 4853 4792 4804 1 4854 4792 4805 1 4855 4793 4794 1 4856 4793 4806 1 4857 4793 4807 1 4858 4794 4795 ar 4859 4794 4808 1 4860 4795 4796 ar 4861 4795 4797 ar 4862 4796 4809 1 4863 4796 4810 1 4864 4797 4811 1 4865 4797 4812 1 4866 4798 4799 2 4867 4798 4813 am 4868 4813 4814 1 4869 4813 4821 1 4870 4814 4815 1 4871 4814 4819 1 4872 4814 4822 1 4873 4815 4816 1 4874 4815 4823 1 4875 4815 4824 1 4876 4816 4817 1 4877 4816 4818 1 4878 4816 4825 1 4879 4817 4826 1 4880 4817 4827 1 4881 4817 4828 1 4882 4818 4829 1 4883 4818 4830 1 4884 4818 4831 1 4885 4819 4820 2 4886 4819 4832 am 4887 4832 4833 1 4888 4832 4840 1 4889 4833 4834 1 4890 4833 4838 1 4891 4833 4841 1 4892 4834 4835 1 4893 4834 4842 1 4894 4834 4843 1 4895 4835 4836 1 4896 4835 4844 1 4897 4835 4845 1 4898 4836 4837 1 4899 4837 4846 1 4900 4837 4847 1 4901 4837 4848 1 4902 4838 4839 2 4903 4838 4849 am 4904 4849 4850 1 4905 4849 4860 1 4906 4850 4851 1 4907 4850 4858 1 4908 4850 4861 1 4909 4851 4852 1 4910 4851 4862 1 4911 4851 4863 1 4912 4852 4853 1 4913 4852 4864 1 4914 4852 4865 1 4915 4853 4854 1 4916 4853 4866 1 4917 4853 4867 1 4918 4854 4855 ar 4919 4854 4868 1 4920 4855 4856 ar 4921 4855 4857 ar 4922 4856 4869 1 4923 4856 4870 1 4924 4857 4871 1 4925 4857 4872 1 4926 4858 4859 2 4927 4858 4873 am 4928 4873 4874 1 4929 4873 4879 1 4930 4874 4875 1 4931 4874 4877 1 4932 4874 4880 1 4933 4875 4876 1 4934 4875 4881 1 4935 4875 4882 1 4936 4876 4883 1 4937 4877 4878 2 4938 4877 4884 am 4939 4884 4885 1 4940 4884 4891 1 4941 4885 4886 1 4942 4885 4889 1 4943 4885 4892 1 4944 4886 4887 1 4945 4886 4888 1 4946 4886 4893 1 4947 4887 4894 1 4948 4887 4895 1 4949 4887 4896 1 4950 4888 4897 1 4951 4888 4898 1 4952 4888 4899 1 4953 4889 4890 2 4954 4889 4900 am 4955 4900 4901 1 4956 4900 4909 1 4957 4901 4902 1 4958 4901 4906 1 4959 4901 4910 1 4960 4902 4903 1 4961 4902 4911 1 4962 4902 4912 1 4963 4903 4904 1 4964 4903 4905 1 4965 4903 4913 1 4966 4904 4914 1 4967 4904 4915 1 4968 4904 4916 1 4969 4905 4917 1 4970 4905 4918 1 4971 4905 4919 1 4972 4906 4907 ar 4973 4906 4908 ar @SUBSTRUCTURE 1 GLU1 2 RESIDUE 1 R GLU 1 ROOT 2 SER2 19 RESIDUE 1 R SER 2 3 PRO3 30 RESIDUE 1 R PRO 2 4 ALA4 44 RESIDUE 1 R ALA 2 5 ILE5 54 RESIDUE 1 R ILE 2 6 SER6 73 RESIDUE 1 R SER 2 7 SER7 84 RESIDUE 1 R SER 2 8 VAL8 95 RESIDUE 1 R VAL 2 9 MET9 111 RESIDUE 1 R MET 2 10 PHE10 128 RESIDUE 1 R PHE 2 11 SER11 148 RESIDUE 1 R SER 2 12 ALA12 159 RESIDUE 1 R ALA 2 13 GLY13 169 RESIDUE 1 R GLY 2 14 VAL14 176 RESIDUE 1 R VAL 2 15 LEU15 192 RESIDUE 1 R LEU 2 16 GLY16 211 RESIDUE 1 R GLY 2 17 ASN17 218 RESIDUE 1 R ASN 2 18 LEU18 232 RESIDUE 1 R LEU 2 19 ILE19 251 RESIDUE 1 R ILE 2 20 ALA20 270 RESIDUE 1 R ALA 2 21 LEU21 280 RESIDUE 1 R LEU 2 22 ALA22 299 RESIDUE 1 R ALA 2 23 LEU23 309 RESIDUE 1 R LEU 2 24 LEU24 328 RESIDUE 1 R LEU 2 25 ALA25 347 RESIDUE 1 R ALA 2 26 ARG26 357 RESIDUE 1 R ARG 2 27 ARG27 381 RESIDUE 1 R ARG 2 28 TRP28 405 RESIDUE 1 R TRP 2 29 ARG29 429 RESIDUE 1 R ARG 2 30 GLY30 453 RESIDUE 1 R GLY 2 31 ASP31 460 RESIDUE 1 R ASP 2 32 VAL32 472 RESIDUE 1 R VAL 2 33 GLY33 488 RESIDUE 1 R GLY 2 34 CYS34 495 RESIDUE 1 R CYS 2 35 SER35 506 RESIDUE 1 R SER 2 36 ALA36 517 RESIDUE 1 R ALA 2 37 GLY37 527 RESIDUE 1 R GLY 2 38 ARG38 534 RESIDUE 1 R ARG 2 39 ARG39 558 RESIDUE 1 R ARG 2 40 SER40 582 RESIDUE 1 R SER 2 41 SER41 593 RESIDUE 1 R SER 2 42 LEU42 604 RESIDUE 1 R LEU 2 43 SER43 623 RESIDUE 1 R SER 2 44 LEU44 634 RESIDUE 1 R LEU 2 45 PHE45 653 RESIDUE 1 R PHE 2 46 HIS46 673 RESIDUE 1 R HIS 2 47 VAL47 690 RESIDUE 1 R VAL 2 48 LEU48 706 RESIDUE 1 R LEU 2 49 VAL49 725 RESIDUE 1 R VAL 2 50 THR50 741 RESIDUE 1 R THR 2 51 GLU51 755 RESIDUE 1 R GLU 2 52 LEU52 770 RESIDUE 1 R LEU 2 53 VAL53 789 RESIDUE 1 R VAL 2 54 PHE54 805 RESIDUE 1 R PHE 2 55 THR55 825 RESIDUE 1 R THR 2 56 ASP56 839 RESIDUE 1 R ASP 2 57 LEU57 851 RESIDUE 1 R LEU 2 58 LEU58 870 RESIDUE 1 R LEU 2 59 GLY59 889 RESIDUE 1 R GLY 2 60 THR60 896 RESIDUE 1 R THR 2 61 CYS61 910 RESIDUE 1 R CYS 2 62 LEU62 921 RESIDUE 1 R LEU 2 63 ILE63 940 RESIDUE 1 R ILE 2 64 SER64 959 RESIDUE 1 R SER 2 65 PRO65 970 RESIDUE 1 R PRO 2 66 VAL66 984 RESIDUE 1 R VAL 2 67 VAL67 1000 RESIDUE 1 R VAL 2 68 LEU68 1016 RESIDUE 1 R LEU 2 69 ALA69 1035 RESIDUE 1 R ALA 2 70 SER70 1045 RESIDUE 1 R SER 2 71 TYR71 1056 RESIDUE 1 R TYR 2 72 ALA72 1077 RESIDUE 1 R ALA 2 73 ARG73 1087 RESIDUE 1 R ARG 2 74 ASN74 1111 RESIDUE 1 R ASN 2 75 GLN75 1125 RESIDUE 1 R GLN 2 76 THR76 1142 RESIDUE 1 R THR 2 77 LEU77 1156 RESIDUE 1 R LEU 2 78 VAL78 1175 RESIDUE 1 R VAL 2 79 ALA79 1191 RESIDUE 1 R ALA 2 80 LEU80 1201 RESIDUE 1 R LEU 2 81 ALA81 1220 RESIDUE 1 R ALA 2 82 PRO82 1230 RESIDUE 1 R PRO 2 83 GLU83 1244 RESIDUE 1 R GLU 2 84 SER84 1259 RESIDUE 1 R SER 2 85 ARG85 1270 RESIDUE 1 R ARG 2 86 ALA86 1294 RESIDUE 1 R ALA 2 87 CYS87 1304 RESIDUE 1 R CYS 2 88 THR88 1315 RESIDUE 1 R THR 2 89 TYR89 1329 RESIDUE 1 R TYR 2 90 PHE90 1350 RESIDUE 1 R PHE 2 91 ALA91 1370 RESIDUE 1 R ALA 2 92 PHE92 1380 RESIDUE 1 R PHE 2 93 ALA93 1400 RESIDUE 1 R ALA 2 94 MET94 1410 RESIDUE 1 R MET 2 95 THR95 1427 RESIDUE 1 R THR 2 96 PHE96 1441 RESIDUE 1 R PHE 2 97 PHE97 1461 RESIDUE 1 R PHE 2 98 SER98 1481 RESIDUE 1 R SER 2 99 LEU99 1492 RESIDUE 1 R LEU 2 100 ALA100 1511 RESIDUE 1 R ALA 2 101 THR101 1521 RESIDUE 1 R THR 2 102 MET102 1535 RESIDUE 1 R MET 2 103 LEU103 1552 RESIDUE 1 R LEU 2 104 MET104 1571 RESIDUE 1 R MET 2 105 LEU105 1588 RESIDUE 1 R LEU 2 106 PHE106 1607 RESIDUE 1 R PHE 2 107 ALA107 1627 RESIDUE 1 R ALA 2 108 MET108 1637 RESIDUE 1 R MET 2 109 ALA109 1654 RESIDUE 1 R ALA 2 110 LEU110 1664 RESIDUE 1 R LEU 2 111 GLU111 1683 RESIDUE 1 R GLU 2 112 ARG112 1698 RESIDUE 1 R ARG 2 113 TYR113 1722 RESIDUE 1 R TYR 2 114 LEU114 1743 RESIDUE 1 R LEU 2 115 SER115 1762 RESIDUE 1 R SER 2 116 ILE116 1773 RESIDUE 1 R ILE 2 117 GLY117 1792 RESIDUE 1 R GLY 2 118 HIS118 1799 RESIDUE 1 R HIS 2 119 PRO119 1816 RESIDUE 1 R PRO 2 120 TYR120 1830 RESIDUE 1 R TYR 2 121 PHE121 1851 RESIDUE 1 R PHE 2 122 TYR122 1871 RESIDUE 1 R TYR 2 123 GLN123 1892 RESIDUE 1 R GLN 2 124 ARG124 1909 RESIDUE 1 R ARG 2 125 ARG125 1933 RESIDUE 1 R ARG 2 126 VAL126 1957 RESIDUE 1 R VAL 2 127 SER127 1973 RESIDUE 1 R SER 2 128 ARG128 1984 RESIDUE 1 R ARG 2 129 SER129 2008 RESIDUE 1 R SER 2 130 GLY130 2019 RESIDUE 1 R GLY 2 131 GLY131 2026 RESIDUE 1 R GLY 2 132 LEU132 2033 RESIDUE 1 R LEU 2 133 ALA133 2052 RESIDUE 1 R ALA 2 134 VAL134 2062 RESIDUE 1 R VAL 2 135 LEU135 2078 RESIDUE 1 R LEU 2 136 PRO136 2097 RESIDUE 1 R PRO 2 137 VAL137 2111 RESIDUE 1 R VAL 2 138 ILE138 2127 RESIDUE 1 R ILE 2 139 TYR139 2146 RESIDUE 1 R TYR 2 140 ALA140 2167 RESIDUE 1 R ALA 2 141 VAL141 2177 RESIDUE 1 R VAL 2 142 SER142 2193 RESIDUE 1 R SER 2 143 LEU143 2204 RESIDUE 1 R LEU 2 144 LEU144 2223 RESIDUE 1 R LEU 2 145 PHE145 2242 RESIDUE 1 R PHE 2 146 CYS146 2262 RESIDUE 1 R CYS 2 147 SER147 2273 RESIDUE 1 R SER 2 148 LEU148 2284 RESIDUE 1 R LEU 2 149 PRO149 2303 RESIDUE 1 R PRO 2 150 LEU150 2317 RESIDUE 1 R LEU 2 151 LEU151 2336 RESIDUE 1 R LEU 2 152 ASP152 2355 RESIDUE 1 R ASP 2 153 TYR153 2367 RESIDUE 1 R TYR 2 154 GLY154 2388 RESIDUE 1 R GLY 2 155 GLN155 2395 RESIDUE 1 R GLN 2 156 TYR156 2412 RESIDUE 1 R TYR 2 157 VAL157 2433 RESIDUE 1 R VAL 2 158 GLN158 2449 RESIDUE 1 R GLN 2 159 TYR159 2466 RESIDUE 1 R TYR 2 160 CYS160 2487 RESIDUE 1 R CYS 2 161 PRO161 2498 RESIDUE 1 R PRO 2 162 GLY162 2512 RESIDUE 1 R GLY 2 163 THR163 2519 RESIDUE 1 R THR 2 164 TRP164 2533 RESIDUE 1 R TRP 2 165 CYS165 2557 RESIDUE 1 R CYS 2 166 PHE166 2568 RESIDUE 1 R PHE 2 167 ILE167 2588 RESIDUE 1 R ILE 2 168 ARG168 2607 RESIDUE 1 R ARG 2 169 HIS169 2631 RESIDUE 1 R HIS 2 170 GLY170 2648 RESIDUE 1 R GLY 2 171 ARG171 2655 RESIDUE 1 R ARG 2 172 THR172 2679 RESIDUE 1 R THR 2 173 ALA173 2693 RESIDUE 1 R ALA 2 174 TYR174 2703 RESIDUE 1 R TYR 2 175 LEU175 2724 RESIDUE 1 R LEU 2 176 GLN176 2743 RESIDUE 1 R GLN 2 177 LEU177 2760 RESIDUE 1 R LEU 2 178 TYR178 2779 RESIDUE 1 R TYR 2 179 ALA179 2800 RESIDUE 1 R ALA 2 180 THR180 2810 RESIDUE 1 R THR 2 181 LEU181 2824 RESIDUE 1 R LEU 2 182 LEU182 2843 RESIDUE 1 R LEU 2 183 LEU183 2862 RESIDUE 1 R LEU 2 184 LEU184 2881 RESIDUE 1 R LEU 2 185 LEU185 2900 RESIDUE 1 R LEU 2 186 ILE186 2919 RESIDUE 1 R ILE 2 187 VAL187 2938 RESIDUE 1 R VAL 2 188 SER188 2954 RESIDUE 1 R SER 2 189 VAL189 2965 RESIDUE 1 R VAL 2 190 LEU190 2981 RESIDUE 1 R LEU 2 191 ALA191 3000 RESIDUE 1 R ALA 2 192 CYS192 3010 RESIDUE 1 R CYS 2 193 ASN193 3021 RESIDUE 1 R ASN 2 194 PHE194 3035 RESIDUE 1 R PHE 2 195 SER195 3055 RESIDUE 1 R SER 2 196 VAL196 3066 RESIDUE 1 R VAL 2 197 ILE197 3082 RESIDUE 1 R ILE 2 198 LEU198 3101 RESIDUE 1 R LEU 2 199 ASN199 3120 RESIDUE 1 R ASN 2 200 LEU200 3134 RESIDUE 1 R LEU 2 201 ILE201 3153 RESIDUE 1 R ILE 2 202 ARG202 3172 RESIDUE 1 R ARG 2 203 MET203 3196 RESIDUE 1 R MET 2 204 HIS204 3213 RESIDUE 1 R HIS 2 205 ARG205 3230 RESIDUE 1 R ARG 2 206 ARG206 3254 RESIDUE 1 R ARG 2 207 SER207 3278 RESIDUE 1 R SER 2 208 ARG208 3289 RESIDUE 1 R ARG 2 209 ARG209 3313 RESIDUE 1 R ARG 2 210 SER210 3337 RESIDUE 1 R SER 2 211 ARG211 3348 RESIDUE 1 R ARG 2 212 CYS212 3372 RESIDUE 1 R CYS 2 213 GLY213 3383 RESIDUE 1 R GLY 2 214 PRO214 3390 RESIDUE 1 R PRO 2 215 SER215 3404 RESIDUE 1 R SER 2 216 LEU216 3415 RESIDUE 1 R LEU 2 217 GLY217 3434 RESIDUE 1 R GLY 2 218 SER218 3441 RESIDUE 1 R SER 2 219 GLY219 3452 RESIDUE 1 R GLY 2 220 ARG220 3459 RESIDUE 1 R ARG 2 221 GLY221 3483 RESIDUE 1 R GLY 2 222 GLY222 3490 RESIDUE 1 R GLY 2 223 PRO223 3497 RESIDUE 1 R PRO 2 224 GLY224 3511 RESIDUE 1 R GLY 2 225 ALA225 3518 RESIDUE 1 R ALA 2 226 ARG226 3528 RESIDUE 1 R ARG 2 227 ARG227 3552 RESIDUE 1 R ARG 2 228 ARG228 3576 RESIDUE 1 R ARG 2 229 GLY229 3600 RESIDUE 1 R GLY 2 230 GLU230 3607 RESIDUE 1 R GLU 2 231 ARG231 3622 RESIDUE 1 R ARG 2 232 VAL232 3646 RESIDUE 1 R VAL 2 233 SER233 3662 RESIDUE 1 R SER 2 234 MET234 3673 RESIDUE 1 R MET 2 235 ALA235 3690 RESIDUE 1 R ALA 2 236 GLU236 3700 RESIDUE 1 R GLU 2 237 GLU237 3715 RESIDUE 1 R GLU 2 238 THR238 3730 RESIDUE 1 R THR 2 239 ASP239 3744 RESIDUE 1 R ASP 2 240 HIS240 3756 RESIDUE 1 R HIS 2 241 LEU241 3773 RESIDUE 1 R LEU 2 242 ILE242 3792 RESIDUE 1 R ILE 2 243 LEU243 3811 RESIDUE 1 R LEU 2 244 LEU244 3830 RESIDUE 1 R LEU 2 245 ALA245 3849 RESIDUE 1 R ALA 2 246 ILE246 3859 RESIDUE 1 R ILE 2 247 MET247 3878 RESIDUE 1 R MET 2 248 THR248 3895 RESIDUE 1 R THR 2 249 ILE249 3909 RESIDUE 1 R ILE 2 250 THR250 3928 RESIDUE 1 R THR 2 251 PHE251 3942 RESIDUE 1 R PHE 2 252 ALA252 3962 RESIDUE 1 R ALA 2 253 VAL253 3972 RESIDUE 1 R VAL 2 254 CYS254 3988 RESIDUE 1 R CYS 2 255 SER255 3999 RESIDUE 1 R SER 2 256 LEU256 4010 RESIDUE 1 R LEU 2 257 PRO257 4029 RESIDUE 1 R PRO 2 258 PHE258 4043 RESIDUE 1 R PHE 2 259 THR259 4063 RESIDUE 1 R THR 2 260 ILE260 4077 RESIDUE 1 R ILE 2 261 PHE261 4096 RESIDUE 1 R PHE 2 262 ALA262 4116 RESIDUE 1 R ALA 2 263 TYR263 4126 RESIDUE 1 R TYR 2 264 MET264 4147 RESIDUE 1 R MET 2 265 ASN265 4164 RESIDUE 1 R ASN 2 266 GLU266 4178 RESIDUE 1 R GLU 2 267 THR267 4193 RESIDUE 1 R THR 2 268 SER268 4207 RESIDUE 1 R SER 2 269 SER269 4218 RESIDUE 1 R SER 2 270 ARG270 4229 RESIDUE 1 R ARG 2 271 LYS271 4253 RESIDUE 1 R LYS 2 272 GLU272 4275 RESIDUE 1 R GLU 2 273 LYS273 4290 RESIDUE 1 R LYS 2 274 TRP274 4312 RESIDUE 1 R TRP 2 275 ASP275 4336 RESIDUE 1 R ASP 2 276 LEU276 4348 RESIDUE 1 R LEU 2 277 GLN277 4367 RESIDUE 1 R GLN 2 278 ALA278 4384 RESIDUE 1 R ALA 2 279 LEU279 4394 RESIDUE 1 R LEU 2 280 ARG280 4413 RESIDUE 1 R ARG 2 281 PHE281 4437 RESIDUE 1 R PHE 2 282 LEU282 4457 RESIDUE 1 R LEU 2 283 SER283 4476 RESIDUE 1 R SER 2 284 ILE284 4487 RESIDUE 1 R ILE 2 285 ASN285 4506 RESIDUE 1 R ASN 2 286 SER286 4520 RESIDUE 1 R SER 2 287 ILE287 4531 RESIDUE 1 R ILE 2 288 ILE288 4550 RESIDUE 1 R ILE 2 289 ASP289 4569 RESIDUE 1 R ASP 2 290 PRO290 4581 RESIDUE 1 R PRO 2 291 TRP291 4595 RESIDUE 1 R TRP 2 292 VAL292 4619 RESIDUE 1 R VAL 2 293 PHE293 4635 RESIDUE 1 R PHE 2 294 ALA294 4655 RESIDUE 1 R ALA 2 295 ILE295 4665 RESIDUE 1 R ILE 2 296 LEU296 4684 RESIDUE 1 R LEU 2 297 ARG297 4703 RESIDUE 1 R ARG 2 298 PRO298 4727 RESIDUE 1 R PRO 2 299 PRO299 4741 RESIDUE 1 R PRO 2 300 VAL300 4755 RESIDUE 1 R VAL 2 301 LEU301 4771 RESIDUE 1 R LEU 2 302 ARG302 4790 RESIDUE 1 R ARG 2 303 LEU303 4814 RESIDUE 1 R LEU 2 304 MET304 4833 RESIDUE 1 R MET 2 305 ARG305 4850 RESIDUE 1 R ARG 2 306 SER306 4874 RESIDUE 1 R SER 2 307 VAL307 4885 RESIDUE 1 R VAL 2 308 LEU308 4901 RESIDUE 1 R LEU 1