#################################################################### # DELTA # # Database for Extended Ligand-Target Analyses # # 2025 # #################################################################### @MOLECULE 7FCM_min 4243 4302 273 0 0 SMALL USER_CHARGES File created by VEGA ZZ 3.2.4 @ATOM 1 N 82.1900 117.4910 116.6150 N.4 1 LEU1 -0.0641 2 CA 81.5250 116.3470 116.0030 C.3 1 LEU1 0.1932 3 C 82.5980 115.5220 115.2970 C.2 1 LEU1 0.2316 4 O 82.7100 115.5230 114.0740 O.2 1 LEU1 -0.2773 5 CB 80.4230 116.8680 115.0530 C.3 1 LEU1 -0.0142 6 CG 79.4070 115.8240 114.5450 C.3 1 LEU1 -0.0444 7 CD1 78.0970 116.5150 114.1380 C.3 1 LEU1 -0.0626 8 CD2 79.9400 115.0130 113.3570 C.3 1 LEU1 -0.0626 9 H1 82.9410 117.1690 117.2590 H 1 LEU1 0.2750 10 H2 81.4970 118.0590 117.1460 H 1 LEU1 0.2750 11 H3 82.6080 118.0850 115.8680 H 1 LEU1 0.2750 12 HA 81.0830 115.7400 116.7960 H 1 LEU1 0.0690 13 HB1 80.8580 117.4030 114.2070 H 1 LEU1 0.0292 14 HB2 79.8580 117.6220 115.6040 H 1 LEU1 0.0292 15 HG 79.1660 115.1350 115.3550 H 1 LEU1 0.0296 16 HD11 77.3570 115.7880 113.8010 H 1 LEU1 0.0232 17 HD12 78.2580 117.2230 113.3250 H 1 LEU1 0.0232 18 HD13 77.6570 117.0610 114.9740 H 1 LEU1 0.0232 19 HD21 79.1390 114.4390 112.8900 H 1 LEU1 0.0232 20 HD22 80.7060 114.3040 113.6650 H 1 LEU1 0.0232 21 HD23 80.3620 115.6580 112.5860 H 1 LEU1 0.0232 22 N 83.4340 114.8610 116.1000 N.am 2 SER2 -0.2432 23 CA 84.5330 114.0820 115.5440 C.3 2 SER2 0.1109 24 C 84.1910 112.6020 115.4490 C.2 2 SER2 0.2209 25 O 84.6030 111.9330 114.4950 O.2 2 SER2 -0.2777 26 CB 85.7590 114.2400 116.4570 C.3 2 SER2 0.0681 27 OG 85.3520 114.1150 117.8170 O.3 2 SER2 -0.3930 28 H 83.3030 114.9010 117.1110 H 2 SER2 0.1313 29 HA 84.7810 114.4320 114.5390 H 2 SER2 0.0580 30 HB1 86.2060 115.2270 116.3130 H 2 SER2 0.0577 31 HB2 86.5210 113.5000 116.1850 H 2 SER2 0.0577 32 HG 86.1060 114.0020 118.3970 H 2 SER2 0.2095 33 N 83.4530 112.0760 116.4320 N.am 3 LEU3 -0.2456 34 CA 83.2660 110.6290 116.5370 C.3 3 LEU3 0.0880 35 C 82.3630 110.0770 115.4430 C.2 3 LEU3 0.2187 36 O 82.5110 108.9140 115.0630 O.2 3 LEU3 -0.2778 37 CB 82.7080 110.2840 117.9280 C.3 3 LEU3 -0.0266 38 CG 83.6660 110.6350 119.0830 C.3 3 LEU3 -0.0449 39 CD1 82.9420 110.5460 120.4310 C.3 3 LEU3 -0.0626 40 CD2 84.9050 109.7260 119.0880 C.3 3 LEU3 -0.0626 41 H 83.0150 112.6910 117.1170 H 3 LEU3 0.1312 42 HA 84.2430 110.1620 116.4000 H 3 LEU3 0.0557 43 HB1 82.4700 109.2200 117.9810 H 3 LEU3 0.0287 44 HB2 81.7630 110.8110 118.0680 H 3 LEU3 0.0287 45 HG 84.0040 111.6650 118.9660 H 3 LEU3 0.0296 46 HD11 83.6060 110.8160 121.2530 H 3 LEU3 0.0232 47 HD12 82.5790 109.5340 120.6170 H 3 LEU3 0.0232 48 HD13 82.0840 111.2180 120.4650 H 3 LEU3 0.0232 49 HD21 85.5800 109.9890 119.9020 H 3 LEU3 0.0232 50 HD22 85.4690 109.8020 118.1600 H 3 LEU3 0.0232 51 HD23 84.6240 108.6800 119.2160 H 3 LEU3 0.0232 52 N 81.4360 110.8860 114.9260 N.am 4 ALA4 -0.2459 53 CA 80.5710 110.4410 113.8370 C.3 4 ALA4 0.0850 54 C 81.3690 110.2370 112.5530 C.2 4 ALA4 0.2184 55 O 81.3170 109.1620 111.9330 O.2 4 ALA4 -0.2778 56 CB 79.4180 111.4220 113.6240 C.3 4 ALA4 -0.0411 57 H 81.3300 111.8300 115.2970 H 4 ALA4 0.1312 58 HA 80.1650 109.4710 114.1320 H 4 ALA4 0.0554 59 HB1 78.6980 111.0290 112.9040 H 4 ALA4 0.0249 60 HB2 79.7800 112.3700 113.2390 H 4 ALA4 0.0249 61 HB3 78.8850 111.6120 114.5560 H 4 ALA4 0.0249 62 N 82.1050 111.2790 112.1400 N.am 5 LEU5 -0.2457 63 CA 82.9550 111.2090 110.9530 C.3 5 LEU5 0.0880 64 C 84.0010 110.1120 111.0820 C.2 5 LEU5 0.2187 65 O 84.1720 109.3020 110.1650 O.2 5 LEU5 -0.2778 66 CB 83.6690 112.5640 110.7590 C.3 5 LEU5 -0.0266 67 CG 82.7450 113.7970 110.7710 C.3 5 LEU5 -0.0449 68 CD1 83.5700 115.0870 110.6540 C.3 5 LEU5 -0.0626 69 CD2 81.6870 113.7310 109.6630 C.3 5 LEU5 -0.0626 70 H 82.0710 112.1490 112.6720 H 5 LEU5 0.1312 71 HA 82.3110 110.9750 110.1040 H 5 LEU5 0.0557 72 HB1 84.2290 112.5440 109.8230 H 5 LEU5 0.0287 73 HB2 84.4120 112.6960 111.5480 H 5 LEU5 0.0287 74 HG 82.2270 113.8420 111.7280 H 5 LEU5 0.0296 75 HD11 82.9320 115.9680 110.7130 H 5 LEU5 0.0232 76 HD12 84.1040 115.1280 109.7040 H 5 LEU5 0.0232 77 HD13 84.3080 115.1570 111.4530 H 5 LEU5 0.0232 78 HD21 81.0590 114.6220 109.6680 H 5 LEU5 0.0232 79 HD22 81.0290 112.8710 109.7880 H 5 LEU5 0.0232 80 HD23 82.1510 113.6570 108.6790 H 5 LEU5 0.0232 81 N 84.6610 110.0350 112.2410 N.am 6 ALA6 -0.2459 82 CA 85.6960 109.0300 112.4520 C.3 6 ALA6 0.0850 83 C 85.1150 107.6230 112.4730 C.2 6 ALA6 0.2185 84 O 85.7430 106.6880 111.9700 O.2 6 ALA6 -0.2778 85 CB 86.3870 109.3190 113.7910 C.3 6 ALA6 -0.0411 86 H 84.4370 110.6900 112.9900 H 6 ALA6 0.1312 87 HA 86.4090 109.1040 111.6280 H 6 ALA6 0.0554 88 HB1 87.1780 108.5980 113.9960 H 6 ALA6 0.0249 89 HB2 85.6780 109.2770 114.6180 H 6 ALA6 0.0249 90 HB3 86.8380 110.3110 113.7970 H 6 ALA6 0.0249 91 N 83.9040 107.4570 113.0120 N.am 7 SER7 -0.2436 92 CA 83.2930 106.1320 113.0590 C.3 7 SER7 0.1109 93 C 82.8850 105.6580 111.6690 C.2 7 SER7 0.2209 94 O 83.1210 104.4930 111.3180 O.2 7 SER7 -0.2777 95 CB 82.0770 106.1270 113.9950 C.3 7 SER7 0.0681 96 OG 82.5160 106.2140 115.3460 O.3 7 SER7 -0.3930 97 H 83.4040 108.2600 113.3930 H 7 SER7 0.1312 98 HA 84.0430 105.4370 113.4410 H 7 SER7 0.0580 99 HB1 81.5120 105.1980 113.8650 H 7 SER7 0.0577 100 HB2 81.4160 106.9640 113.7370 H 7 SER7 0.0577 101 HG 81.7800 106.3190 115.9440 H 7 SER7 0.2095 102 N 82.2930 106.5530 110.8640 N.am 8 LEU8 -0.2456 103 CA 81.9810 106.2190 109.4740 C.3 8 LEU8 0.0880 104 C 83.2370 105.8770 108.6760 C.2 8 LEU8 0.2187 105 O 83.2370 104.9160 107.8940 O.2 8 LEU8 -0.2778 106 CB 81.2140 107.3910 108.8290 C.3 8 LEU8 -0.0266 107 CG 79.6820 107.2660 108.9410 C.3 8 LEU8 -0.0449 108 CD1 79.1790 107.2130 110.3910 C.3 8 LEU8 -0.0626 109 CD2 78.9920 108.4060 108.1810 C.3 8 LEU8 -0.0626 110 H 82.0580 107.4770 111.2250 H 8 LEU8 0.1312 111 HA 81.3590 105.3250 109.4900 H 8 LEU8 0.0557 112 HB1 81.4530 107.4490 107.7660 H 8 LEU8 0.0287 113 HB2 81.5520 108.3360 109.2570 H 8 LEU8 0.0287 114 HG 79.3930 106.3300 108.4600 H 8 LEU8 0.0296 115 HD11 78.0990 107.0670 110.4190 H 8 LEU8 0.0232 116 HD12 79.3940 108.1400 110.9180 H 8 LEU8 0.0232 117 HD13 79.6290 106.3910 110.9470 H 8 LEU8 0.0232 118 HD21 77.9080 108.2990 108.2120 H 8 LEU8 0.0232 119 HD22 79.2930 108.4190 107.1330 H 8 LEU8 0.0232 120 HD23 79.2450 109.3740 108.6130 H 8 LEU8 0.0232 121 N 84.3290 106.6200 108.8890 N.am 9 ILE9 -0.2454 122 CA 85.5590 106.3580 108.1400 C.3 9 ILE9 0.0903 123 C 86.2040 105.0400 108.5720 C.2 9 ILE9 0.2189 124 O 86.6840 104.2720 107.7280 O.2 9 ILE9 -0.2778 125 CB 86.5170 107.5690 108.2070 C.3 9 ILE9 -0.0201 126 CG1 85.9350 108.8000 107.4770 C.3 9 ILE9 -0.0514 127 CG2 87.9270 107.2560 107.6680 C.3 9 ILE9 -0.0605 128 CD1 85.5670 108.5500 106.0070 C.3 9 ILE9 -0.0650 129 H 84.3040 107.3730 109.5770 H 9 ILE9 0.1312 130 HA 85.2700 106.1930 107.1030 H 9 ILE9 0.0560 131 HB 86.6350 107.8380 109.2580 H 9 ILE9 0.0318 132 HG11 86.6540 109.6190 107.5310 H 9 ILE9 0.0266 133 HG12 85.0440 109.1550 107.9880 H 9 ILE9 0.0266 134 HG21 88.5530 108.1480 107.6600 H 9 ILE9 0.0233 135 HG22 87.8910 106.8680 106.6500 H 9 ILE9 0.0233 136 HG23 88.4380 106.5160 108.2850 H 9 ILE9 0.0233 137 HD11 85.2980 109.4830 105.5140 H 9 ILE9 0.0230 138 HD12 84.7060 107.8890 105.9150 H 9 ILE9 0.0230 139 HD13 86.3930 108.1030 105.4570 H 9 ILE9 0.0230 140 N 86.2010 104.7400 109.8780 N.am 10 ILE10 -0.2454 141 CA 86.7670 103.4790 110.3620 C.3 10 ILE10 0.0903 142 C 85.9660 102.2860 109.8450 C.2 10 ILE10 0.2190 143 O 86.5440 101.2880 109.3930 O.2 10 ILE10 -0.2778 144 CB 86.8080 103.5200 111.9090 C.3 10 ILE10 -0.0201 145 CG1 87.8390 104.5510 112.4140 C.3 10 ILE10 -0.0514 146 CG2 87.0790 102.1430 112.5460 C.3 10 ILE10 -0.0605 147 CD1 87.6000 104.9560 113.8750 C.3 10 ILE10 -0.0650 148 H 85.7990 105.3990 110.5440 H 10 ILE10 0.1312 149 HA 87.7790 103.4020 109.9610 H 10 ILE10 0.0560 150 HB 85.8200 103.8430 112.2420 H 10 ILE10 0.0318 151 HG11 87.8090 105.4520 111.8030 H 10 ILE10 0.0266 152 HG12 88.8510 104.1600 112.2980 H 10 ILE10 0.0266 153 HG21 87.1130 102.2080 113.6320 H 10 ILE10 0.0233 154 HG22 88.0310 101.7360 112.2090 H 10 ILE10 0.0233 155 HG23 86.3020 101.4200 112.3010 H 10 ILE10 0.0233 156 HD11 88.2370 105.7900 114.1600 H 10 ILE10 0.0230 157 HD12 87.8070 104.1340 114.5600 H 10 ILE10 0.0230 158 HD13 86.5680 105.2720 114.0310 H 10 ILE10 0.0230 159 N 84.6280 102.3920 109.8390 N.am 11 THR11 -0.2434 160 CA 83.8100 101.3040 109.3030 C.3 11 THR11 0.1135 161 C 84.0060 101.1360 107.8000 C.2 11 THR11 0.2212 162 O 84.0730 100.0040 107.3080 O.2 11 THR11 -0.2777 163 CB 82.3210 101.4530 109.6660 C.3 11 THR11 0.0763 164 OG1 81.8160 102.6750 109.1550 O.3 11 THR11 -0.3900 165 CG2 82.1060 101.3520 111.1860 C.3 11 THR11 -0.0370 166 H 84.1820 103.2310 110.2080 H 11 THR11 0.1313 167 HA 84.1800 100.3880 109.7660 H 11 THR11 0.0583 168 HB 81.7880 100.6210 109.1910 H 11 THR11 0.0611 169 HG1 80.8930 102.7710 109.3630 H 11 THR11 0.2098 170 HG21 81.0490 101.3780 111.4510 H 11 THR11 0.0255 171 HG22 82.6020 102.1610 111.7180 H 11 THR11 0.0255 172 HG23 82.5100 100.4150 111.5700 H 11 THR11 0.0255 173 N 84.1190 102.2420 107.0570 N.am 12 ALA12 -0.2458 174 CA 84.3240 102.1440 105.6150 C.3 12 ALA12 0.0850 175 C 85.6810 101.5360 105.2770 C.2 12 ALA12 0.2184 176 O 85.7850 100.7090 104.3600 O.2 12 ALA12 -0.2778 177 CB 84.2100 103.5500 105.0190 C.3 12 ALA12 -0.0411 178 H 84.0620 103.1590 107.5000 H 12 ALA12 0.1312 179 HA 83.5410 101.4980 105.2140 H 12 ALA12 0.0554 180 HB1 84.3200 103.5230 103.9360 H 12 ALA12 0.0249 181 HB2 84.9720 104.2180 105.4250 H 12 ALA12 0.0249 182 HB3 83.2380 103.9880 105.2440 H 12 ALA12 0.0249 183 N 86.7310 101.9230 106.0120 N.am 13 ASN13 -0.2452 184 CA 88.0470 101.3320 105.7880 C.3 13 ASN13 0.0957 185 C 88.0830 99.8620 106.1820 C.2 13 ASN13 0.2191 186 O 88.7520 99.0680 105.5160 O.2 13 ASN13 -0.2778 187 CB 89.1390 102.1040 106.5440 C.3 13 ASN13 0.0446 188 CG 89.3600 103.5270 106.0130 C.2 13 ASN13 0.2000 189 OD1 89.2580 104.5040 106.7380 O.2 13 ASN13 -0.2797 190 ND2 89.6780 103.5940 104.7120 N.am 13 ASN13 -0.2723 191 H 86.6110 102.6350 106.7320 H 13 ASN13 0.1312 192 HA 88.2360 101.3700 104.7130 H 13 ASN13 0.0562 193 HB1 90.0890 101.5810 106.4510 H 13 ASN13 0.0375 194 HB2 88.8960 102.1740 107.6030 H 13 ASN13 0.0375 195 HD21 89.8280 104.4940 104.3070 H 13 ASN13 0.1266 196 HD22 89.7700 102.7730 104.1510 H 13 ASN13 0.1266 197 N 87.3660 99.4760 107.2490 N.am 14 LEU14 -0.2456 198 CA 87.2700 98.0560 107.5930 C.3 14 LEU14 0.0880 199 C 86.5670 97.2520 106.5060 C.2 14 LEU14 0.2187 200 O 87.0520 96.1830 106.1250 O.2 14 LEU14 -0.2778 201 CB 86.5490 97.8920 108.9500 C.3 14 LEU14 -0.0266 202 CG 87.4930 97.6480 110.1420 C.3 14 LEU14 -0.0449 203 CD1 88.1980 96.2870 110.0400 C.3 14 LEU14 -0.0626 204 CD2 88.4990 98.7880 110.3450 C.3 14 LEU14 -0.0626 205 H 86.8880 100.1720 107.8200 H 14 LEU14 0.1312 206 HA 88.2910 97.6790 107.6490 H 14 LEU14 0.0557 207 HB1 85.8460 97.0580 108.9170 H 14 LEU14 0.0287 208 HB2 85.9310 98.7700 109.1410 H 14 LEU14 0.0287 209 HG 86.8690 97.6120 111.0370 H 14 LEU14 0.0296 210 HD11 88.7710 96.0780 110.9440 H 14 LEU14 0.0232 211 HD12 88.8890 96.2480 109.1990 H 14 LEU14 0.0232 212 HD13 87.4760 95.4800 109.9140 H 14 LEU14 0.0232 213 HD21 89.1510 98.5880 111.1960 H 14 LEU14 0.0232 214 HD22 87.9900 99.7290 110.5450 H 14 LEU14 0.0232 215 HD23 89.1320 98.9250 109.4690 H 14 LEU14 0.0232 216 N 85.4430 97.7590 105.9810 N.am 15 LEU15 -0.2456 217 CA 84.7180 97.0410 104.9320 C.3 15 LEU15 0.0880 218 C 85.5360 96.9230 103.6500 C.2 15 LEU15 0.2187 219 O 85.6260 95.8350 103.0720 O.2 15 LEU15 -0.2778 220 CB 83.3620 97.7240 104.6600 C.3 15 LEU15 -0.0266 221 CG 82.1980 97.1140 105.4650 C.3 15 LEU15 -0.0449 222 CD1 82.3430 97.3230 106.9780 C.3 15 LEU15 -0.0626 223 CD2 80.8530 97.6670 104.9760 C.3 15 LEU15 -0.0626 224 H 85.0890 98.6550 106.3160 H 15 LEU15 0.1312 225 HA 84.5580 96.0240 105.2950 H 15 LEU15 0.0557 226 HB1 83.1050 97.6270 103.6040 H 15 LEU15 0.0287 227 HB2 83.4370 98.7970 104.8440 H 15 LEU15 0.0287 228 HG 82.1920 96.0390 105.2760 H 15 LEU15 0.0296 229 HD11 81.5460 96.8110 107.5170 H 15 LEU15 0.0232 230 HD12 82.2830 98.3780 107.2370 H 15 LEU15 0.0232 231 HD13 83.2890 96.9330 107.3530 H 15 LEU15 0.0232 232 HD21 80.0220 97.2120 105.5150 H 15 LEU15 0.0232 233 HD22 80.7080 97.4660 103.9140 H 15 LEU15 0.0232 234 HD23 80.7960 98.7460 105.1240 H 15 LEU15 0.0232 235 N 86.1950 98.0040 103.2270 N.am 16 LEU16 -0.2456 236 CA 86.9810 97.9320 101.9960 C.3 16 LEU16 0.0880 237 C 88.2550 97.1080 102.1790 C.2 16 LEU16 0.2187 238 O 88.6640 96.3850 101.2580 O.2 16 LEU16 -0.2778 239 CB 87.2300 99.3510 101.4420 C.3 16 LEU16 -0.0266 240 CG 86.1120 99.8980 100.5280 C.3 16 LEU16 -0.0449 241 CD1 86.0990 99.2060 99.1560 C.3 16 LEU16 -0.0626 242 CD2 84.7230 99.8630 101.1800 C.3 16 LEU16 -0.0626 243 H 86.1510 98.8740 103.7580 H 16 LEU16 0.1312 244 HA 86.3820 97.3810 101.2690 H 16 LEU16 0.0557 245 HB1 88.1520 99.3700 100.8620 H 16 LEU16 0.0287 246 HB2 87.3810 100.0400 102.2740 H 16 LEU16 0.0287 247 HG 86.3480 100.9470 100.3420 H 16 LEU16 0.0296 248 HD11 85.3790 99.6790 98.4880 H 16 LEU16 0.0232 249 HD12 85.8290 98.1530 99.2350 H 16 LEU16 0.0232 250 HD13 87.0760 99.2650 98.6750 H 16 LEU16 0.0232 251 HD21 83.9820 100.3340 100.5350 H 16 LEU16 0.0232 252 HD22 84.7180 100.3970 102.1300 H 16 LEU16 0.0232 253 HD23 84.3910 98.8420 101.3650 H 16 LEU16 0.0232 254 N 88.8810 97.1730 103.3620 N.am 17 ALA17 -0.2459 255 CA 90.0800 96.3810 103.6170 C.3 17 ALA17 0.0850 256 C 89.7580 94.8970 103.6770 C.2 17 ALA17 0.2184 257 O 90.4910 94.0770 103.1130 O.2 17 ALA17 -0.2778 258 CB 90.7120 96.8290 104.9410 C.3 17 ALA17 -0.0411 259 H 88.5150 97.7830 104.0930 H 17 ALA17 0.1312 260 HA 90.7720 96.5440 102.7890 H 17 ALA17 0.0554 261 HB1 91.6220 96.2670 105.1560 H 17 ALA17 0.0249 262 HB2 90.0240 96.6880 105.7760 H 17 ALA17 0.0249 263 HB3 90.9810 97.8840 104.9140 H 17 ALA17 0.0249 264 N 88.6460 94.5340 104.3210 N.am 18 LEU18 -0.2457 265 CA 88.2200 93.1390 104.3220 C.3 18 LEU18 0.0880 266 C 87.7900 92.6880 102.9310 C.2 18 LEU18 0.2185 267 O 88.0120 91.5320 102.5630 O.2 18 LEU18 -0.2778 268 CB 87.0470 92.9960 105.3060 C.3 18 LEU18 -0.0266 269 CG 87.4470 93.1730 106.7830 C.3 18 LEU18 -0.0449 270 CD1 86.2040 93.3870 107.6560 C.3 18 LEU18 -0.0626 271 CD2 88.2640 91.9800 107.2970 C.3 18 LEU18 -0.0626 272 H 88.0920 95.2350 104.8140 H 18 LEU18 0.1312 273 HA 89.0660 92.5330 104.6370 H 18 LEU18 0.0557 274 HB1 86.5710 92.0230 105.1880 H 18 LEU18 0.0287 275 HB2 86.2860 93.7340 105.0460 H 18 LEU18 0.0287 276 HG 88.0680 94.0640 106.8790 H 18 LEU18 0.0296 277 HD11 86.4800 93.5430 108.7000 H 18 LEU18 0.0232 278 HD12 85.5380 92.5250 107.6100 H 18 LEU18 0.0232 279 HD13 85.6420 94.2630 107.3310 H 18 LEU18 0.0232 280 HD21 88.5300 92.1130 108.3460 H 18 LEU18 0.0232 281 HD22 89.1930 91.8570 106.7410 H 18 LEU18 0.0232 282 HD23 87.7000 91.0510 107.2130 H 18 LEU18 0.0232 283 N 87.1930 93.5890 102.1410 N.am 19 GLY19 -0.2485 284 CA 86.8110 93.2410 100.7780 C.3 19 GLY19 0.0765 285 C 88.0000 92.9520 99.8810 C.2 19 GLY19 0.2155 286 O 87.9370 92.0750 99.0170 O.2 19 GLY19 -0.2781 287 H 87.0040 94.5260 102.4960 H 19 GLY19 0.1309 288 HA1 86.2750 94.1000 100.3790 H 19 GLY19 0.0521 289 HA2 86.1390 92.3850 100.8110 H 19 GLY19 0.0521 290 N 89.0910 93.6980 100.0600 N.am 20 ILE20 -0.2456 291 CA 90.3480 93.3250 99.4150 C.3 20 ILE20 0.0903 292 C 90.8740 92.0150 100.0000 C.2 20 ILE20 0.2189 293 O 91.4130 91.1670 99.2770 O.2 20 ILE20 -0.2778 294 CB 91.3830 94.4610 99.5720 C.3 20 ILE20 -0.0201 295 CG1 90.9250 95.7880 98.9340 C.3 20 ILE20 -0.0514 296 CG2 92.7730 94.0630 99.0440 C.3 20 ILE20 -0.0605 297 CD1 90.9090 95.7870 97.4020 C.3 20 ILE20 -0.0650 298 H 89.0480 94.5300 100.6480 H 20 ILE20 0.1312 299 HA 90.1400 93.1550 98.3590 H 20 ILE20 0.0560 300 HB 91.4810 94.6480 100.6410 H 20 ILE20 0.0318 301 HG11 91.5840 96.5880 99.2740 H 20 ILE20 0.0266 302 HG12 89.9330 96.0580 99.2880 H 20 ILE20 0.0266 303 HG21 93.4440 94.9190 99.0280 H 20 ILE20 0.0233 304 HG22 92.7160 93.6730 98.0290 H 20 ILE20 0.0233 305 HG23 93.2350 93.2960 99.6640 H 20 ILE20 0.0233 306 HD11 90.5400 96.7430 97.0340 H 20 ILE20 0.0230 307 HD12 90.2590 95.0070 97.0060 H 20 ILE20 0.0230 308 HD13 91.9080 95.6460 96.9910 H 20 ILE20 0.0230 309 N 90.6860 91.8130 101.3080 N.am 21 ALA21 -0.2459 310 CA 91.3170 90.6960 102.0050 C.3 21 ALA21 0.0850 311 C 90.6810 89.3490 101.6590 C.2 21 ALA21 0.2184 312 O 91.3490 88.3120 101.7590 O.2 21 ALA21 -0.2778 313 CB 91.2430 90.9240 103.5180 C.3 21 ALA21 -0.0411 314 H 90.0880 92.4530 101.8310 H 21 ALA21 0.1312 315 HA 92.3620 90.6700 101.6910 H 21 ALA21 0.0554 316 HB1 91.8160 90.1690 104.0570 H 21 ALA21 0.0249 317 HB2 90.2160 90.8720 103.8750 H 21 ALA21 0.0249 318 HB3 91.6480 91.8990 103.7880 H 21 ALA21 0.0249 319 N 89.3850 89.3290 101.3070 N.am 22 TRP22 -0.2453 320 CA 88.7430 88.0600 100.9520 C.3 22 TRP22 0.0918 321 C 89.3280 87.4750 99.6730 C.2 22 TRP22 0.2190 322 O 89.6780 86.2900 99.6260 O.2 22 TRP22 -0.2778 323 CB 87.2180 88.2160 100.7880 C.3 22 TRP22 -0.0021 324 CG 86.5310 88.8460 101.9870 C.ar 22 TRP22 -0.0260 325 CD1 85.5400 89.8290 101.8950 C.ar 22 TRP22 -0.0136 326 CD2 86.6680 88.5420 103.3960 C.ar 22 TRP22 -0.0028 327 NE1 85.1250 90.1750 103.1350 N.ar 22 TRP22 -0.2641 328 CE2 85.7820 89.4070 104.0850 C.ar 22 TRP22 0.0269 329 CE3 87.4270 87.6490 104.1090 C.ar 22 TRP22 -0.0528 330 CZ2 85.6990 89.3660 105.4500 C.ar 22 TRP22 -0.0430 331 CZ3 87.3470 87.6080 105.5010 C.ar 22 TRP22 -0.0611 332 CH2 86.4840 88.4700 106.1740 C.ar 22 TRP22 -0.0602 333 H 88.8480 90.1960 101.2870 H 22 TRP22 0.1312 334 HA 88.9710 87.3560 101.7490 H 22 TRP22 0.0560 335 HB1 86.7550 87.2460 100.6010 H 22 TRP22 0.0334 336 HB2 87.0020 88.8370 99.9170 H 22 TRP22 0.0334 337 HD1 85.1770 90.2580 100.9730 H 22 TRP22 0.0748 338 HE1 84.4500 90.8560 103.3350 H 22 TRP22 0.1331 339 HE3 88.0910 86.9640 103.6090 H 22 TRP22 0.0624 340 HZ2 85.0250 90.0340 105.9650 H 22 TRP22 0.0633 341 HZ3 87.9520 86.9070 106.0570 H 22 TRP22 0.0618 342 HH2 86.4200 88.4430 107.2520 H 22 TRP22 0.0618 343 N 89.4490 88.2890 98.6300 N.am 23 ASP23 -0.2451 344 CA 90.0420 87.8420 97.3710 C.3 23 ASP23 0.0974 345 C 91.5600 87.9910 97.4660 C.2 23 ASP23 0.2192 346 O 92.1720 88.9040 96.9100 O.2 23 ASP23 -0.2778 347 CB 89.4730 88.7240 96.2640 C.3 23 ASP23 0.0576 348 CG 88.5770 87.9880 95.2700 C.2 23 ASP23 0.1780 349 OD1 88.7330 86.7820 95.0830 O.co2 23 ASP23 -0.6478 350 OD2 87.7300 88.6530 94.6800 O.co2 23 ASP23 -0.6478 351 H 89.1200 89.2510 98.7100 H 23 ASP23 0.1312 352 HA 89.8120 86.7940 97.2390 H 23 ASP23 0.0563 353 HB1 90.2430 89.2230 95.6830 H 23 ASP23 0.0394 354 HB2 88.8830 89.5060 96.7320 H 23 ASP23 0.0394 355 N 92.1580 87.0710 98.2270 N.am 24 ARG24 -0.2456 356 CA 93.6010 87.0910 98.4370 C.3 24 ARG24 0.0879 357 H1 93.8521 88.1430 98.5997 H 24 ARG24 0.0557 358 C 94.3500 86.7480 97.1550 C.2 24 ARG24 0.2187 359 O 95.3750 87.3630 96.8360 O.2 24 ARG24 -0.2778 360 CB 94.0372 86.3705 99.7237 C.3 24 ARG24 -0.0258 361 H3 93.8492 87.0793 100.5301 H 24 ARG24 0.0286 362 H2 95.1191 86.2291 99.7284 H 24 ARG24 0.0286 363 CG 93.3307 85.0419 100.0565 C.3 24 ARG24 -0.0154 364 H5 92.2792 85.0676 99.7750 H 24 ARG24 0.0299 365 H4 93.7812 84.2360 99.4764 H 24 ARG24 0.0299 366 CD 93.3979 84.7245 101.5603 C.3 24 ARG24 0.1045 367 H7 92.9400 83.7568 101.7790 H 24 ARG24 0.0711 368 H6 94.4342 84.7149 101.9091 H 24 ARG24 0.0711 369 NE 92.6605 85.7553 102.2972 N.pl3 24 ARG24 -0.4450 370 H12 92.1518 86.4562 101.7919 H 24 ARG24 0.3153 371 CZ 92.6036 85.8748 103.6190 C.cat 24 ARG24 0.5062 372 NH1 93.2055 85.0264 104.4101 N.pl3 24 ARG24 -0.4573 373 H9 93.7238 84.2704 104.0203 H 24 ARG24 0.3114 374 H8 93.1501 85.1337 105.4003 H 24 ARG24 0.3114 375 NH2 91.9294 86.8682 104.1307 N.pl3 24 ARG24 -0.4573 376 H11 91.4912 87.5244 103.5147 H 24 ARG24 0.3114 377 H10 91.8492 86.9837 105.1175 H 24 ARG24 0.3114 378 H 91.5970 86.3430 98.6680 H 24 ARG24 0.1312 379 N 93.8360 85.7460 96.4450 N.am 25 ARG25 -0.2457 380 CA 94.3880 85.3060 95.1700 C.3 25 ARG25 0.0879 381 C 94.2160 86.3610 94.0710 C.2 25 ARG25 0.2187 382 O 95.1310 86.6240 93.2910 O.2 25 ARG25 -0.2778 383 CB 93.5390 84.0880 94.7200 C.3 25 ARG25 -0.0258 384 CG 93.2770 82.9850 95.7700 C.3 25 ARG25 -0.0154 385 CD 91.8830 82.3320 95.6270 C.3 25 ARG25 0.1045 386 NE 90.8490 83.0640 96.3780 N.pl3 25 ARG25 -0.4450 387 CZ 90.0070 83.9860 95.9010 C.cat 25 ARG25 0.5062 388 NH1 90.0100 84.3740 94.6620 N.pl3 25 ARG25 -0.4573 389 NH2 89.1340 84.5480 96.6850 N.pl3 25 ARG25 -0.4573 390 H 93.0160 85.2630 96.8110 H 25 ARG25 0.1312 391 HA 95.4420 85.0620 95.3110 H 25 ARG25 0.0557 392 HB1 93.9850 83.6380 93.8320 H 25 ARG25 0.0286 393 HB2 92.5660 84.4480 94.3910 H 25 ARG25 0.0286 394 HG1 93.3880 83.3410 96.7940 H 25 ARG25 0.0299 395 HG2 94.0470 82.2210 95.6540 H 25 ARG25 0.0299 396 HD1 91.9030 81.3290 96.0600 H 25 ARG25 0.0711 397 HD2 91.5800 82.2130 94.5840 H 25 ARG25 0.0711 398 HE 90.7290 82.8820 97.3530 H 25 ARG25 0.3153 399 HH11 89.4030 85.1490 94.4330 H 25 ARG25 0.3114 400 HH12 90.5780 83.9480 93.9690 H 25 ARG25 0.3114 401 HH21 88.5830 85.2890 96.2770 H 25 ARG25 0.3114 402 HH22 89.0020 84.2910 97.6370 H 25 ARG25 0.3114 403 N 93.0290 86.9620 94.0280 N.am 26 LEU26 -0.2456 404 CA 92.6770 87.9800 93.0390 C.3 26 LEU26 0.0880 405 C 93.4260 89.3080 93.1530 C.2 26 LEU26 0.2187 406 O 93.8400 89.8840 92.1480 O.2 26 LEU26 -0.2778 407 CB 91.1730 88.1390 92.7840 C.3 26 LEU26 -0.0266 408 CG 90.4800 86.8960 92.1870 C.3 26 LEU26 -0.0449 409 CD1 89.0600 87.2350 91.7160 C.3 26 LEU26 -0.0626 410 CD2 91.2550 86.2450 91.0300 C.3 26 LEU26 -0.0626 411 H 92.3280 86.6990 94.7210 H 26 LEU26 0.1312 412 HA 93.0940 87.5920 92.1100 H 26 LEU26 0.0557 413 HB1 91.0230 88.9680 92.0900 H 26 LEU26 0.0287 414 HB2 90.6840 88.4230 93.7100 H 26 LEU26 0.0287 415 HG 90.4000 86.1580 92.9780 H 26 LEU26 0.0296 416 HD11 88.5370 86.3430 91.3690 H 26 LEU26 0.0232 417 HD12 89.0780 87.9500 90.8940 H 26 LEU26 0.0232 418 HD13 88.4620 87.6680 92.5140 H 26 LEU26 0.0232 419 HD21 90.6710 85.4470 90.5710 H 26 LEU26 0.0232 420 HD22 92.1880 85.7940 91.3680 H 26 LEU26 0.0232 421 HD23 91.4880 86.9730 90.2520 H 26 LEU26 0.0232 422 N 93.5920 89.7890 94.3810 N.am 27 ARG27 -0.2457 423 CA 94.2730 91.0650 94.6250 C.3 27 ARG27 0.0879 424 C 95.7480 90.8330 94.9650 C.2 27 ARG27 0.2187 425 O 96.2870 91.3060 95.9630 O.2 27 ARG27 -0.2778 426 CB 93.4760 91.8980 95.6630 C.3 27 ARG27 -0.0258 427 CG 92.5580 92.9630 95.0180 C.3 27 ARG27 -0.0154 428 CD 91.3970 92.4240 94.1600 C.3 27 ARG27 0.1045 429 NE 90.1640 92.2910 94.9440 N.pl3 27 ARG27 -0.4450 430 CZ 89.1710 91.4520 94.6450 C.cat 27 ARG27 0.5062 431 NH1 89.2220 90.6590 93.6120 N.pl3 27 ARG27 -0.4573 432 NH2 88.1080 91.3830 95.3950 N.pl3 27 ARG27 -0.4573 433 H 93.2360 89.2560 95.1750 H 27 ARG27 0.1312 434 HA 94.2940 91.6290 93.6910 H 27 ARG27 0.0557 435 HB1 94.1620 92.4320 96.3210 H 27 ARG27 0.0286 436 HB2 92.9010 91.2450 96.3200 H 27 ARG27 0.0286 437 HG1 93.1800 93.6050 94.3930 H 27 ARG27 0.0299 438 HG2 92.1580 93.6200 95.7900 H 27 ARG27 0.0299 439 HD1 91.6590 91.4690 93.7030 H 27 ARG27 0.0711 440 HD2 91.1690 93.1270 93.3550 H 27 ARG27 0.0711 441 HE 90.0280 92.8380 95.7690 H 27 ARG27 0.3153 442 HH11 88.5150 89.9410 93.5590 H 27 ARG27 0.3114 443 HH12 89.9270 90.7320 92.9180 H 27 ARG27 0.3114 444 HH21 87.4630 90.6400 95.1820 H 27 ARG27 0.3114 445 HH22 87.9350 92.0060 96.1530 H 27 ARG27 0.3114 446 N 96.3820 90.0480 94.0970 N.am 28 SER28 -0.2436 447 CA 97.8140 89.7660 94.0100 C.3 28 SER28 0.1111 448 C 98.6910 90.8090 93.2970 C.2 28 SER28 0.2236 449 O 99.8180 91.0130 93.7670 O.2 28 SER28 -0.2775 450 CB 98.0040 88.3670 93.4020 C.3 28 SER28 0.0681 451 OG 99.3770 87.9950 93.4000 O.3 28 SER28 -0.3930 452 H 95.7940 89.5840 93.4040 H 28 SER28 0.1312 453 HA 98.1700 89.7280 95.0410 H 28 SER28 0.0580 454 HB1 97.6050 88.3400 92.3830 H 28 SER28 0.0577 455 HB2 97.4270 87.6520 93.9990 H 28 SER28 0.0577 456 HG 99.5040 87.1200 93.0410 H 28 SER28 0.2095 457 N 98.3000 91.4400 92.1700 N.am 29 PRO29 -0.2315 458 CA 99.1920 92.4600 91.5420 C.3 29 PRO29 0.0909 459 C 99.4260 93.6590 92.4470 C.2 29 PRO29 0.2216 460 O 98.6800 93.8670 93.4150 O.2 29 PRO29 -0.2776 461 CB 98.4030 92.8640 90.2840 C.3 29 PRO29 -0.0275 462 CG 97.3800 91.7480 90.0600 C.3 29 PRO29 -0.0379 463 CD 97.0560 91.2070 91.4530 C.3 29 PRO29 0.0071 464 HA 100.1170 91.9360 91.3060 H 29 PRO29 0.0560 465 HB1 99.0530 93.0100 89.4210 H 29 PRO29 0.0285 466 HB2 97.8630 93.7990 90.4420 H 29 PRO29 0.0285 467 HG1 97.8380 90.9560 89.4680 H 29 PRO29 0.0278 468 HG2 96.4930 92.0890 89.5260 H 29 PRO29 0.0278 469 HD1 96.2790 91.7850 91.9550 H 29 PRO29 0.0431 470 HD2 96.8030 90.1480 91.4410 H 29 PRO29 0.0431 471 N 100.4560 94.4760 92.1710 N.am 30 PRO30 -0.2316 472 CA 100.7530 95.6220 93.0550 C.3 30 PRO30 0.0907 473 C 99.6920 96.7180 93.0980 C.2 30 PRO30 0.2189 474 O 99.8560 97.6550 93.8830 O.2 30 PRO30 -0.2778 475 CB 102.0470 96.2020 92.4520 C.3 30 PRO30 -0.0276 476 CG 102.6000 95.1270 91.5180 C.3 30 PRO30 -0.0379 477 CD 101.3830 94.3270 91.0540 C.3 30 PRO30 0.0071 478 HA 100.9230 95.2290 94.0580 H 30 PRO30 0.0559 479 HB1 102.7620 96.4960 93.2200 H 30 PRO30 0.0285 480 HB2 101.8440 97.0950 91.8550 H 30 PRO30 0.0285 481 HG1 103.2720 94.4760 92.0760 H 30 PRO30 0.0278 482 HG2 103.1660 95.5470 90.6860 H 30 PRO30 0.0278 483 HD1 100.9050 94.7640 90.1760 H 30 PRO30 0.0431 484 HD2 101.6360 93.2830 90.8780 H 30 PRO30 0.0431 485 N 98.6390 96.6570 92.2820 N.am 31 ALA31 -0.2459 486 CA 97.5380 97.6010 92.4380 C.3 31 ALA31 0.0850 487 C 96.7790 97.3450 93.7340 C.2 31 ALA31 0.2182 488 O 96.5810 98.2610 94.5450 O.2 31 ALA31 -0.2778 489 CB 96.6110 97.4960 91.2230 C.3 31 ALA31 -0.0411 490 H 98.6030 95.9500 91.5480 H 31 ALA31 0.1312 491 HA 97.9680 98.6060 92.4790 H 31 ALA31 0.0554 492 HB1 95.7850 98.2040 91.2960 H 31 ALA31 0.0249 493 HB2 96.1940 96.4940 91.1200 H 31 ALA31 0.0249 494 HB3 97.1570 97.7260 90.3080 H 31 ALA31 0.0249 495 N 96.3720 96.0920 93.9570 N.am 32 GLY32 -0.2485 496 CA 95.5860 95.7680 95.1370 C.3 32 GLY32 0.0765 497 C 96.3810 95.8400 96.4270 C.2 32 GLY32 0.2156 498 O 95.8540 96.2530 97.4620 O.2 32 GLY32 -0.2781 499 H 96.6150 95.3560 93.2940 H 32 GLY32 0.1309 500 HA1 95.2160 94.7530 95.0050 H 32 GLY32 0.0521 501 HA2 94.7350 96.4500 95.1860 H 32 GLY32 0.0521 502 N 97.6630 95.4710 96.3780 N.am 33 CYS33 -0.2451 503 CA 98.5000 95.5170 97.5750 C.3 33 CYS33 0.0965 504 C 98.7700 96.9540 98.0170 C.2 33 CYS33 0.2195 505 O 98.6440 97.2870 99.2050 O.2 33 CYS33 -0.2778 506 CB 99.8120 94.7800 97.2810 C.3 33 CYS33 0.0147 507 SG 100.8670 94.5840 98.7410 S.3 33 CYS33 -0.1762 508 H 98.0630 95.1530 95.4950 H 33 CYS33 0.1312 509 HA 97.9580 95.0060 98.3730 H 33 CYS33 0.0565 510 HB1 100.3760 95.2940 96.5010 H 33 CYS33 0.0394 511 HB2 99.5850 93.7870 96.8900 H 33 CYS33 0.0394 512 HG 101.8650 93.7440 98.4620 H 33 CYS33 0.1017 513 N 99.1350 97.8220 97.0690 N.am 34 PHE34 -0.2453 514 CA 99.3880 99.2220 97.3970 C.3 34 PHE34 0.0917 515 C 98.1030 99.9320 97.7970 C.2 34 PHE34 0.2190 516 O 98.1180 100.8090 98.6730 O.2 34 PHE34 -0.2778 517 CB 100.0620 99.9560 96.2220 C.3 34 PHE34 -0.0036 518 CG 101.4600 99.4960 95.8660 C.ar 34 PHE34 -0.0454 519 CD1 102.2230 98.6470 96.6710 C.ar 34 PHE34 -0.0585 520 CD2 102.0280 99.9750 94.6910 C.ar 34 PHE34 -0.0585 521 CE1 103.5160 98.2940 96.3050 C.ar 34 PHE34 -0.0615 522 CE2 103.3120 99.6060 94.3110 C.ar 34 PHE34 -0.0615 523 CZ 104.0590 98.7650 95.1200 C.ar 34 PHE34 -0.0617 524 H 99.2380 97.5030 96.1060 H 34 PHE34 0.1312 525 HA 100.0350 99.2480 98.2750 H 34 PHE34 0.0560 526 HB1 100.1310 101.0210 96.4480 H 34 PHE34 0.0333 527 HB2 99.4340 99.8760 95.3320 H 34 PHE34 0.0333 528 HD1 101.8300 98.2490 97.5920 H 34 PHE34 0.0620 529 HD2 101.4560 100.6440 94.0640 H 34 PHE34 0.0620 530 HE1 104.1050 97.6540 96.9420 H 34 PHE34 0.0618 531 HE2 103.7290 99.9790 93.3880 H 34 PHE34 0.0618 532 HZ 105.0610 98.4860 94.8300 H 34 PHE34 0.0618 533 N 96.9740 99.5460 97.1960 N.am 35 PHE35 -0.2453 534 CA 95.7140 100.1440 97.6100 C.3 35 PHE35 0.0917 535 C 95.2890 99.6590 98.9900 C.2 35 PHE35 0.2190 536 O 94.6760 100.4200 99.7450 O.2 35 PHE35 -0.2778 537 CB 94.6450 99.7680 96.5640 C.3 35 PHE35 -0.0036 538 CG 93.2510 100.1870 96.9650 C.ar 35 PHE35 -0.0454 539 CD1 92.8270 101.5020 96.7970 C.ar 35 PHE35 -0.0585 540 CD2 92.3840 99.2690 97.5530 C.ar 35 PHE35 -0.0585 541 CE1 91.5610 101.8940 97.2140 C.ar 35 PHE35 -0.0615 542 CE2 91.1200 99.6590 97.9780 C.ar 35 PHE35 -0.0615 543 CZ 90.7090 100.9730 97.8080 C.ar 35 PHE35 -0.0617 544 H 96.9950 98.8420 96.4580 H 35 PHE35 0.1312 545 HA 95.8420 101.2280 97.6400 H 35 PHE35 0.0560 546 HB1 94.6550 98.6900 96.3950 H 35 PHE35 0.0333 547 HB2 94.8940 100.2240 95.6050 H 35 PHE35 0.0333 548 HD1 93.4910 102.2270 96.3480 H 35 PHE35 0.0620 549 HD2 92.7030 98.2470 97.7020 H 35 PHE35 0.0620 550 HE1 91.2390 102.9170 97.0800 H 35 PHE35 0.0618 551 HE2 90.4600 98.9410 98.4410 H 35 PHE35 0.0618 552 HZ 89.7280 101.2760 98.1410 H 35 PHE35 0.0618 553 N 95.6360 98.4220 99.3530 N.am 36 LEU36 -0.2456 554 CA 95.3680 97.9410 100.7040 C.3 36 LEU36 0.0880 555 C 96.2250 98.6750 101.7290 C.2 36 LEU36 0.2187 556 O 95.7590 98.9740 102.8350 O.2 36 LEU36 -0.2778 557 CB 95.6080 96.4260 100.7650 C.3 36 LEU36 -0.0266 558 CG 95.2040 95.7690 102.1010 C.3 36 LEU36 -0.0449 559 CD1 93.7390 96.0510 102.4730 C.3 36 LEU36 -0.0626 560 CD2 95.4640 94.2590 102.0510 C.3 36 LEU36 -0.0626 561 H 96.0930 97.8070 98.6790 H 36 LEU36 0.1312 562 HA 94.3200 98.1660 100.9080 H 36 LEU36 0.0557 563 HB1 96.6580 96.2140 100.5580 H 36 LEU36 0.0287 564 HB2 95.0530 95.9570 99.9560 H 36 LEU36 0.0287 565 HG 95.8320 96.1800 102.8920 H 36 LEU36 0.0296 566 HD11 93.4400 95.4840 103.3550 H 36 LEU36 0.0232 567 HD12 93.0690 95.7770 101.6600 H 36 LEU36 0.0232 568 HD13 93.5760 97.1040 102.7010 H 36 LEU36 0.0232 569 HD21 95.2270 93.7880 103.0050 H 36 LEU36 0.0232 570 HD22 96.5100 94.0480 101.8280 H 36 LEU36 0.0232 571 HD23 94.8570 93.7790 101.2840 H 36 LEU36 0.0232 572 N 97.4740 98.9880 101.3690 N.am 37 SER37 -0.2436 573 CA 98.3310 99.7770 102.2550 C.3 37 SER37 0.1109 574 C 97.7930 101.1950 102.4500 C.2 37 SER37 0.2209 575 O 97.7630 101.7080 103.5810 O.2 37 SER37 -0.2777 576 CB 99.7210 99.8560 101.6080 C.3 37 SER37 0.0681 577 OG 100.6050 100.5730 102.4570 O.3 37 SER37 -0.3930 578 H 97.8330 98.6740 100.4680 H 37 SER37 0.1312 579 HA 98.3800 99.2740 103.2210 H 37 SER37 0.0580 580 HB1 99.6390 100.3210 100.6170 H 37 SER37 0.0577 581 HB2 100.1160 98.8480 101.4590 H 37 SER37 0.0577 582 HG 101.3420 100.9460 101.9770 H 37 SER37 0.2095 583 N 97.3640 101.8400 101.3540 N.am 38 LEU38 -0.2456 584 CA 96.7110 103.1490 101.4350 C.3 38 LEU38 0.0880 585 C 95.4510 103.1040 102.2900 C.2 38 LEU38 0.2187 586 O 95.1840 104.0240 103.0720 O.2 38 LEU38 -0.2778 587 CB 96.4130 103.6370 100.0050 C.3 38 LEU38 -0.0266 588 CG 95.5760 104.9300 99.9090 C.3 38 LEU38 -0.0449 589 CD1 96.2080 106.0970 100.6820 C.3 38 LEU38 -0.0626 590 CD2 95.3440 105.3130 98.4420 C.3 38 LEU38 -0.0626 591 H 97.4960 101.4070 100.4400 H 38 LEU38 0.1312 592 HA 97.4080 103.8210 101.9340 H 38 LEU38 0.0557 593 HB1 95.8930 102.8450 99.4650 H 38 LEU38 0.0287 594 HB2 97.3590 103.7780 99.4810 H 38 LEU38 0.0287 595 HG 94.5970 104.7360 100.3450 H 38 LEU38 0.0296 596 HD11 95.6290 107.0120 100.5570 H 38 LEU38 0.0232 597 HD12 97.2180 106.2890 100.3300 H 38 LEU38 0.0232 598 HD13 96.2670 105.8950 101.7500 H 38 LEU38 0.0232 599 HD21 94.6910 106.1810 98.3610 H 38 LEU38 0.0232 600 HD22 94.8740 104.4950 97.8930 H 38 LEU38 0.0232 601 HD23 96.2830 105.5510 97.9420 H 38 LEU38 0.0232 602 N 94.6770 102.0340 102.1590 N.am 39 LEU39 -0.2456 603 CA 93.4290 101.9020 102.8920 C.3 39 LEU39 0.0880 604 C 93.6830 101.6870 104.3830 C.2 39 LEU39 0.2187 605 O 92.9310 102.1950 105.2260 O.2 39 LEU39 -0.2778 606 CB 92.5890 100.7990 102.2600 C.3 39 LEU39 -0.0266 607 CG 91.1150 100.9010 102.6660 C.3 39 LEU39 -0.0449 608 CD1 90.3800 102.0330 101.9320 C.3 39 LEU39 -0.0626 609 CD2 90.4310 99.5740 102.4020 C.3 39 LEU39 -0.0626 610 H 94.9650 101.2860 101.5280 H 39 LEU39 0.1312 611 HA 92.9170 102.8590 102.7850 H 39 LEU39 0.0557 612 HB1 93.0080 99.8290 102.5340 H 39 LEU39 0.0287 613 HB2 92.6550 100.8550 101.1730 H 39 LEU39 0.0287 614 HG 91.0530 101.0820 103.7400 H 39 LEU39 0.0296 615 HD11 89.3270 102.0650 102.2170 H 39 LEU39 0.0232 616 HD12 90.4230 101.8940 100.8510 H 39 LEU39 0.0232 617 HD13 90.8080 103.0090 102.1570 H 39 LEU39 0.0232 618 HD21 89.4420 99.5890 102.8510 H 39 LEU39 0.0232 619 HD22 90.9990 98.7640 102.8520 H 39 LEU39 0.0232 620 HD23 90.3440 99.3670 101.3350 H 39 LEU39 0.0232 621 N 94.7690 100.9860 104.7200 N.am 40 LEU40 -0.2456 622 CA 95.1840 100.8520 106.1140 C.3 40 LEU40 0.0880 623 C 95.6340 102.1920 106.6900 C.2 40 LEU40 0.2187 624 O 95.3670 102.4950 107.8620 O.2 40 LEU40 -0.2778 625 CB 96.2990 99.7880 106.1630 C.3 40 LEU40 -0.0266 626 CG 96.8400 99.4120 107.5600 C.3 40 LEU40 -0.0449 627 CD1 97.9510 100.3540 108.0490 C.3 40 LEU40 -0.0626 628 CD2 95.7290 99.2310 108.6050 C.3 40 LEU40 -0.0626 629 H 95.3200 100.5350 103.9890 H 40 LEU40 0.1312 630 HA 94.3110 100.5130 106.6740 H 40 LEU40 0.0557 631 HB1 97.1270 100.0880 105.5200 H 40 LEU40 0.0287 632 HB2 95.8980 98.8830 105.7050 H 40 LEU40 0.0287 633 HG 97.3170 98.4380 107.4440 H 40 LEU40 0.0296 634 HD11 98.3810 99.9940 108.9840 H 40 LEU40 0.0232 635 HD12 97.5980 101.3670 108.2280 H 40 LEU40 0.0232 636 HD13 98.7570 100.4110 107.3190 H 40 LEU40 0.0232 637 HD21 96.1360 98.8520 109.5430 H 40 LEU40 0.0232 638 HD22 94.9780 98.5210 108.2590 H 40 LEU40 0.0232 639 HD23 95.2230 100.1690 108.8270 H 40 LEU40 0.0232 640 N 96.3280 103.0060 105.8880 N.am 41 ALA41 -0.2459 641 CA 96.7230 104.3310 106.3710 C.3 41 ALA41 0.0850 642 C 95.5190 105.2470 106.5640 C.2 41 ALA41 0.2182 643 O 95.4850 106.0470 107.5080 O.2 41 ALA41 -0.2778 644 CB 97.7340 104.9380 105.3940 C.3 41 ALA41 -0.0411 645 H 96.5810 102.7060 104.9460 H 41 ALA41 0.1312 646 HA 97.2030 104.1920 107.3410 H 41 ALA41 0.0554 647 HB1 98.1360 105.8710 105.7850 H 41 ALA41 0.0249 648 HB2 97.2870 105.1340 104.4180 H 41 ALA41 0.0249 649 HB3 98.5730 104.2590 105.2430 H 41 ALA41 0.0249 650 N 94.5240 105.1400 105.6800 N.am 42 GLY42 -0.2485 651 CA 93.2800 105.8670 105.8800 C.3 42 GLY42 0.0765 652 C 92.5440 105.4240 107.1300 C.2 42 GLY42 0.2155 653 O 91.9240 106.2390 107.8220 O.2 42 GLY42 -0.2781 654 H 94.6370 104.5450 104.8590 H 42 GLY42 0.1309 655 HA1 92.6510 105.6600 105.0170 H 42 GLY42 0.0521 656 HA2 93.4930 106.9280 105.9100 H 42 GLY42 0.0521 657 N 92.6190 104.1260 107.4430 N.am 43 LEU43 -0.2459 658 CA 92.0820 103.6200 108.7050 C.3 43 LEU43 0.0880 659 C 92.8020 104.2120 109.9130 C.2 43 LEU43 0.2187 660 O 92.1600 104.5770 110.9040 O.2 43 LEU43 -0.2778 661 CB 92.1980 102.0840 108.7110 C.3 43 LEU43 -0.0266 662 CG 91.7110 101.3850 109.9940 C.3 43 LEU43 -0.0449 663 CD1 90.2450 101.7010 110.3160 C.3 43 LEU43 -0.0626 664 CD2 91.9270 99.8710 109.8870 C.3 43 LEU43 -0.0626 665 H 93.0590 103.4780 106.7900 H 43 LEU43 0.1312 666 HA 91.0350 103.9250 108.7450 H 43 LEU43 0.0557 667 HB1 93.2350 101.8020 108.5500 H 43 LEU43 0.0287 668 HB2 91.6610 101.6830 107.8550 H 43 LEU43 0.0287 669 HG 92.3150 101.7370 110.8310 H 43 LEU43 0.0296 670 HD11 89.9460 101.1970 111.2340 H 43 LEU43 0.0232 671 HD12 89.5800 101.3630 109.5230 H 43 LEU43 0.0232 672 HD13 90.0830 102.7680 110.4650 H 43 LEU43 0.0232 673 HD21 91.5990 99.3610 110.7940 H 43 LEU43 0.0232 674 HD22 92.9810 99.6360 109.7390 H 43 LEU43 0.0232 675 HD23 91.3730 99.4520 109.0470 H 43 LEU43 0.0232 676 N 94.1350 104.3040 109.8540 N.am 44 LEU44 -0.2456 677 CA 94.8780 104.9050 110.9630 C.3 44 LEU44 0.0880 678 C 94.5630 106.3920 111.1270 C.2 44 LEU44 0.2187 679 O 94.5230 106.8980 112.2550 O.2 44 LEU44 -0.2778 680 CB 96.3820 104.6550 110.7260 C.3 44 LEU44 -0.0266 681 CG 96.9270 103.3950 111.4260 C.3 44 LEU44 -0.0449 682 CD1 96.1720 102.1140 111.0470 C.3 44 LEU44 -0.0626 683 CD2 98.4270 103.2340 111.1410 C.3 44 LEU44 -0.0626 684 H 94.6340 103.9550 109.0360 H 44 LEU44 0.1312 685 HA 94.5550 104.4100 111.8800 H 44 LEU44 0.0557 686 HB1 96.9730 105.4940 111.0890 H 44 LEU44 0.0287 687 HB2 96.5820 104.6080 109.6540 H 44 LEU44 0.0287 688 HG 96.8080 103.5380 112.5010 H 44 LEU44 0.0296 689 HD11 96.5670 101.2540 111.5870 H 44 LEU44 0.0232 690 HD12 96.2710 101.9040 109.9860 H 44 LEU44 0.0232 691 HD13 95.1090 102.1810 111.2790 H 44 LEU44 0.0232 692 HD21 98.8400 102.3780 111.6740 H 44 LEU44 0.0232 693 HD22 98.9850 104.1190 111.4490 H 44 LEU44 0.0232 694 HD23 98.6070 103.0810 110.0760 H 44 LEU44 0.0232 695 N 94.3180 107.1060 110.0210 N.am 45 THR45 -0.2434 696 CA 93.9160 108.5110 110.1450 C.3 45 THR45 0.1135 697 C 92.5180 108.6470 110.7340 C.2 45 THR45 0.2210 698 O 92.2830 109.5150 111.5850 O.2 45 THR45 -0.2777 699 CB 94.1340 109.2990 108.8510 C.3 45 THR45 0.0763 700 OG1 93.4300 108.6680 107.8030 O.3 45 THR45 -0.3900 701 CG2 95.6390 109.4220 108.5460 C.3 45 THR45 -0.0370 702 H 94.4100 106.6770 109.1000 H 45 THR45 0.1313 703 HA 94.5660 108.9690 110.8880 H 45 THR45 0.0583 704 HB 93.7240 110.3040 108.9950 H 45 THR45 0.0611 705 HG1 93.6860 109.0540 106.9780 H 45 THR45 0.2098 706 HG21 95.8330 110.0780 107.7000 H 45 THR45 0.0255 707 HG22 96.0850 108.4510 108.3300 H 45 THR45 0.0255 708 HG23 96.1710 109.8450 109.3980 H 45 THR45 0.0255 709 N 91.5820 107.7960 110.3040 N.am 46 GLY46 -0.2484 710 CA 90.2590 107.8000 110.9080 C.3 46 GLY46 0.0765 711 C 90.2680 107.3920 112.3690 C.2 46 GLY46 0.2155 712 O 89.3950 107.8000 113.1380 O.2 46 GLY46 -0.2781 713 H 91.7960 107.1420 109.5510 H 46 GLY46 0.1309 714 HA1 89.6500 107.0950 110.3430 H 46 GLY46 0.0521 715 HA2 89.8310 108.7980 110.7990 H 46 GLY46 0.0521 716 N 91.2570 106.5930 112.7720 N.am 47 LEU47 -0.2459 717 CA 91.3800 106.2060 114.1710 C.3 47 LEU47 0.0880 718 C 91.9830 107.3230 115.0150 C.2 47 LEU47 0.2187 719 O 91.5250 107.5680 116.1350 O.2 47 LEU47 -0.2778 720 CB 92.2470 104.9370 114.2150 C.3 47 LEU47 -0.0266 721 CG 92.4160 104.3130 115.6120 C.3 47 LEU47 -0.0449 722 CD1 91.0720 103.8740 116.2080 C.3 47 LEU47 -0.0626 723 CD2 93.3900 103.1290 115.5490 C.3 47 LEU47 -0.0626 724 H 91.9350 106.2490 112.0930 H 47 LEU47 0.1312 725 HA 90.3810 105.9900 114.5460 H 47 LEU47 0.0557 726 HB1 93.2300 105.1640 113.7990 H 47 LEU47 0.0287 727 HB2 91.8120 104.1930 113.5470 H 47 LEU47 0.0287 728 HG 92.8540 105.0580 116.2770 H 47 LEU47 0.0296 729 HD11 91.2130 103.3840 117.1710 H 47 LEU47 0.0232 730 HD12 90.5580 103.1730 115.5490 H 47 LEU47 0.0232 731 HD13 90.4100 104.7240 116.3730 H 47 LEU47 0.0232 732 HD21 93.5490 102.6980 116.5370 H 47 LEU47 0.0232 733 HD22 94.3610 103.4400 115.1620 H 47 LEU47 0.0232 734 HD23 93.0090 102.3410 114.8980 H 47 LEU47 0.0232 735 N 93.0050 108.0090 114.5040 N.am 48 ALA48 -0.2459 736 CA 93.6390 109.0940 115.2470 C.3 48 ALA48 0.0850 737 C 92.9240 110.4300 115.0910 C.2 48 ALA48 0.2184 738 O 93.3920 111.4290 115.6450 O.2 48 ALA48 -0.2778 739 CB 95.0820 109.2250 114.7400 C.3 48 ALA48 -0.0411 740 H 93.3510 107.7710 113.5750 H 48 ALA48 0.1312 741 HA 93.6460 108.8300 116.3060 H 48 ALA48 0.0554 742 HB1 95.6380 109.9760 115.3020 H 48 ALA48 0.0249 743 HB2 95.1060 109.5080 113.6870 H 48 ALA48 0.0249 744 HB3 95.6140 108.2790 114.8400 H 48 ALA48 0.0249 745 N 91.8290 110.4740 114.3340 N.am 49 LEU49 -0.2456 746 CA 91.0640 111.7130 114.1940 C.3 49 LEU49 0.0883 747 C 90.4040 112.2650 115.4690 C.2 49 LEU49 0.2214 748 O 90.4810 113.4920 115.6580 O.2 49 LEU49 -0.2776 749 CB 90.0260 111.4930 113.0700 C.3 49 LEU49 -0.0266 750 CG 89.1500 112.7100 112.7060 C.3 49 LEU49 -0.0449 751 CD1 89.9870 113.9000 112.2140 C.3 49 LEU49 -0.0626 752 CD2 88.1110 112.3210 111.6450 C.3 49 LEU49 -0.0626 753 H 91.5200 109.6330 113.8460 H 49 LEU49 0.1312 754 HA 91.7830 112.4630 113.8610 H 49 LEU49 0.0557 755 HB1 89.3760 110.6600 113.3340 H 49 LEU49 0.0287 756 HB2 90.5510 111.1710 112.1700 H 49 LEU49 0.0287 757 HG 88.6030 113.0240 113.5950 H 49 LEU49 0.0296 758 HD11 89.3490 114.7360 111.9260 H 49 LEU49 0.0232 759 HD12 90.5880 113.6280 111.3460 H 49 LEU49 0.0232 760 HD13 90.6600 114.2570 112.9920 H 49 LEU49 0.0232 761 HD21 87.4430 113.1540 111.4280 H 49 LEU49 0.0232 762 HD22 87.4950 111.4860 111.9770 H 49 LEU49 0.0232 763 HD23 88.5930 112.0250 110.7130 H 49 LEU49 0.0232 764 N 89.7400 111.4870 116.3540 N.am 50 PRO50 -0.2316 765 CA 89.0410 112.1410 117.4840 C.3 50 PRO50 0.0907 766 C 89.9440 112.7500 118.5500 C.2 50 PRO50 0.2190 767 O 89.4390 113.5110 119.3840 O.2 50 PRO50 -0.2778 768 CB 88.2170 110.9830 118.0780 C.3 50 PRO50 -0.0276 769 CG 88.2480 109.8630 117.0340 C.3 50 PRO50 -0.0379 770 CD 89.5690 110.0460 116.2900 C.3 50 PRO50 0.0071 771 HA 88.4020 112.9160 117.0680 H 50 PRO50 0.0559 772 HB1 87.2030 111.2940 118.3250 H 50 PRO50 0.0285 773 HB2 88.6690 110.6030 118.9960 H 50 PRO50 0.0285 774 HG1 87.4210 109.9990 116.3360 H 50 PRO50 0.0278 775 HG2 88.1490 108.8700 117.4740 H 50 PRO50 0.0278 776 HD1 90.4120 109.6060 116.8230 H 50 PRO50 0.0431 777 HD2 89.5270 109.6850 115.2630 H 50 PRO50 0.0431 778 N 91.2440 112.4450 118.5720 N.am 51 THR51 -0.2434 779 CA 92.1230 113.0780 119.5510 C.3 51 THR51 0.1135 780 C 92.4460 114.5240 119.1980 C.2 51 THR51 0.2212 781 O 92.9030 115.2680 120.0690 O.2 51 THR51 -0.2777 782 CB 93.4390 112.2810 119.6520 C.3 51 THR51 0.0763 783 OG1 94.1200 112.3550 118.4100 O.3 51 THR51 -0.3900 784 CG2 93.1860 110.8140 120.0400 C.3 51 THR51 -0.0370 785 H 91.6220 111.7710 117.9060 H 51 THR51 0.1313 786 HA 91.6160 113.0680 120.5170 H 51 THR51 0.0583 787 HB 94.0540 112.7530 120.4290 H 51 THR51 0.0611 788 HG1 94.9390 111.8720 118.4390 H 51 THR51 0.2098 789 HG21 94.1180 110.2860 120.2440 H 51 THR51 0.0255 790 HG22 92.6700 110.2760 119.2440 H 51 THR51 0.0255 791 HG23 92.5740 110.7490 120.9390 H 51 THR51 0.0255 792 N 92.2380 114.9240 117.9440 N.am 52 LEU52 -0.2456 793 CA 92.6090 116.2710 117.5110 C.3 52 LEU52 0.0883 794 C 91.8370 117.4210 118.1700 C.2 52 LEU52 0.2214 795 O 92.4710 118.4590 118.4290 O.2 52 LEU52 -0.2776 796 CB 92.5890 116.3540 115.9760 C.3 52 LEU52 -0.0266 797 CG 93.3650 115.2210 115.2660 C.3 52 LEU52 -0.0449 798 CD1 93.4200 115.4780 113.7560 C.3 52 LEU52 -0.0626 799 CD2 94.7840 115.0190 115.8210 C.3 52 LEU52 -0.0626 800 H 91.8140 114.2810 117.2760 H 52 LEU52 0.1312 801 HA 93.6440 116.4030 117.8320 H 52 LEU52 0.0557 802 HB1 93.0090 117.3150 115.6720 H 52 LEU52 0.0287 803 HB2 91.5570 116.3460 115.6230 H 52 LEU52 0.0287 804 HG 92.8260 114.2850 115.4170 H 52 LEU52 0.0296 805 HD11 93.8620 114.6320 113.2310 H 52 LEU52 0.0232 806 HD12 94.0230 116.3590 113.5360 H 52 LEU52 0.0232 807 HD13 92.4230 115.6390 113.3470 H 52 LEU52 0.0232 808 HD21 95.3260 114.2690 115.2440 H 52 LEU52 0.0232 809 HD22 94.7700 114.6750 116.8540 H 52 LEU52 0.0232 810 HD23 95.3560 115.9440 115.7840 H 52 LEU52 0.0232 811 N 90.5210 117.3520 118.4460 N.am 53 PRO53 -0.2316 812 CA 89.9110 118.4430 119.2280 C.3 53 PRO53 0.0907 813 C 90.3660 118.5160 120.6750 C.2 53 PRO53 0.2187 814 O 90.2290 119.5810 121.2880 O.2 53 PRO53 -0.2778 815 CB 88.4110 118.1460 119.1040 C.3 53 PRO53 -0.0276 816 CG 88.3180 116.6540 118.7940 C.3 53 PRO53 -0.0379 817 CD 89.5750 116.3470 117.9820 C.3 53 PRO53 0.0071 818 HA 90.1600 119.3860 118.7410 H 53 PRO53 0.0559 819 HB1 88.0200 118.7020 118.2520 H 53 PRO53 0.0285 820 HB2 87.8280 118.4370 119.9790 H 53 PRO53 0.0285 821 HG1 87.4040 116.3880 118.2650 H 53 PRO53 0.0278 822 HG2 88.3460 116.0880 119.7260 H 53 PRO53 0.0278 823 HD1 89.9370 115.3500 118.1530 H 53 PRO53 0.0431 824 HD2 89.4330 116.5110 116.9130 H 53 PRO53 0.0431 825 N 90.8970 117.4330 121.2450 N.am 54 GLY54 -0.2485 826 CA 91.3410 117.4770 122.6260 C.3 54 GLY54 0.0765 827 C 92.7130 118.0850 122.8290 C.2 54 GLY54 0.2155 828 O 93.0210 118.5610 123.9240 O.2 54 GLY54 -0.2781 829 H 90.9910 116.5710 120.7080 H 54 GLY54 0.1309 830 HA1 91.3620 116.4460 122.9770 H 54 GLY54 0.0521 831 HA2 90.6060 118.0210 123.2230 H 54 GLY54 0.0521 832 N 93.5560 118.0660 121.8010 N.am 55 LEU55 -0.2459 833 CA 94.9600 118.4330 121.9420 C.3 55 LEU55 0.0880 834 C 95.2350 119.9240 121.8130 C.2 55 LEU55 0.2187 835 O 96.4070 120.3120 121.8100 O.2 55 LEU55 -0.2778 836 CB 95.7660 117.6060 120.9260 C.3 55 LEU55 -0.0266 837 CG 95.7900 116.1030 121.2570 C.3 55 LEU55 -0.0449 838 CD1 96.2790 115.2820 120.0550 C.3 55 LEU55 -0.0626 839 CD2 96.6370 115.8010 122.5000 C.3 55 LEU55 -0.0626 840 H 93.2090 117.7850 120.8840 H 55 LEU55 0.1312 841 HA 95.2680 118.1750 122.9540 H 55 LEU55 0.0557 842 HB1 96.7910 117.9640 120.8620 H 55 LEU55 0.0287 843 HB2 95.3290 117.7550 119.9380 H 55 LEU55 0.0287 844 HG 94.7740 115.7810 121.4750 H 55 LEU55 0.0296 845 HD11 96.2680 114.2140 120.2750 H 55 LEU55 0.0232 846 HD12 97.2980 115.5550 119.7770 H 55 LEU55 0.0232 847 HD13 95.6420 115.4430 119.1850 H 55 LEU55 0.0232 848 HD21 96.4850 114.7690 122.8070 H 55 LEU55 0.0232 849 HD22 96.3640 116.4200 123.3520 H 55 LEU55 0.0232 850 HD23 97.6990 115.9520 122.3030 H 55 LEU55 0.0232 851 N 94.2150 120.7710 121.6890 N.am 56 TRP56 -0.2453 852 CA 94.4980 122.1890 121.4960 C.3 56 TRP56 0.0918 853 C 94.8030 122.8960 122.8090 C.2 56 TRP56 0.2190 854 O 95.7610 123.6710 122.8910 O.2 56 TRP56 -0.2778 855 CB 93.3420 122.8680 120.7460 C.3 56 TRP56 -0.0021 856 CG 93.3970 122.4750 119.2830 C.ar 56 TRP56 -0.0260 857 CD1 92.6300 121.4870 118.6640 C.ar 56 TRP56 -0.0136 858 CD2 94.2780 123.0050 118.2700 C.ar 56 TRP56 -0.0028 859 NE1 92.9960 121.3850 117.3620 N.ar 56 TRP56 -0.2641 860 CE2 94.0090 122.2940 117.0770 C.ar 56 TRP56 0.0269 861 CE3 95.2480 123.9720 118.2860 C.ar 56 TRP56 -0.0528 862 CZ2 94.7220 122.5690 115.9400 C.ar 56 TRP56 -0.0430 863 CZ3 95.9700 124.2630 117.1280 C.ar 56 TRP56 -0.0611 864 CH2 95.7070 123.5580 115.9530 C.ar 56 TRP56 -0.0602 865 H 93.2530 120.4340 121.7280 H 56 TRP56 0.1312 866 HA 95.4000 122.2790 120.8860 H 56 TRP56 0.0560 867 HB1 93.4190 123.9540 120.8090 H 56 TRP56 0.0334 868 HB2 92.3790 122.5870 121.1740 H 56 TRP56 0.0334 869 HD1 91.8880 120.8810 119.1630 H 56 TRP56 0.0748 870 HE1 92.6240 120.7410 116.7240 H 56 TRP56 0.1331 871 HE3 95.4600 124.5080 119.2000 H 56 TRP56 0.0624 872 HZ2 94.5260 122.0150 115.0350 H 56 TRP56 0.0633 873 HZ3 96.7350 125.0270 117.1410 H 56 TRP56 0.0618 874 HH2 96.2720 123.7780 115.0580 H 56 TRP56 0.0618 875 N 94.0030 122.6540 123.8390 N.am 57 ASN57 -0.2452 876 CA 94.2710 123.2510 125.1370 C.3 57 ASN57 0.0957 877 C 95.4130 122.5250 125.8380 C.2 57 ASN57 0.2191 878 O 95.6150 121.3220 125.6510 O.2 57 ASN57 -0.2778 879 CB 92.9930 123.2310 125.9940 C.3 57 ASN57 0.0446 880 CG 92.3820 121.8270 126.1130 C.2 57 ASN57 0.2000 881 OD1 91.5480 121.4270 125.3140 O.2 57 ASN57 -0.2797 882 ND2 92.8370 121.1130 127.1530 N.am 57 ASN57 -0.2723 883 H 93.1940 122.0450 123.7190 H 57 ASN57 0.1312 884 HA 94.5700 124.2880 124.9700 H 57 ASN57 0.0562 885 HB1 92.2400 123.8740 125.5390 H 57 ASN57 0.0375 886 HB2 93.1810 123.6270 126.9930 H 57 ASN57 0.0375 887 HD21 92.4660 120.1970 127.2990 H 57 ASN57 0.1266 888 HD22 93.5340 121.4720 127.7740 H 57 ASN57 0.1266 889 N 96.1890 123.2770 126.6130 N.am 58 GLN58 -0.2456 890 CA 97.3580 122.7230 127.2780 C.3 58 GLN58 0.0882 891 C 96.9510 121.7920 128.4150 C.2 58 GLN58 0.2187 892 O 95.8820 121.9310 129.0130 O.2 58 GLN58 -0.2778 893 CB 98.2980 123.8550 127.7350 C.3 58 GLN58 -0.0210 894 CG 97.7660 124.7380 128.8820 C.3 58 GLN58 0.0225 895 CD 97.9150 124.0650 130.2570 C.2 58 GLN58 0.1981 896 OE1 98.8360 123.2980 130.5040 O.2 58 GLN58 -0.2798 897 NE2 96.9560 124.3970 131.1320 N.am 58 GLN58 -0.2724 898 H 95.9600 124.2620 126.7440 H 58 GLN58 0.1312 899 HA 97.8830 122.1270 126.5270 H 58 GLN58 0.0557 900 HB1 98.4870 124.4930 126.8710 H 58 GLN58 0.0289 901 HB2 99.2730 123.4410 127.9990 H 58 GLN58 0.0289 902 HG1 96.7220 125.0050 128.7160 H 58 GLN58 0.0356 903 HG2 98.3300 125.6690 128.9190 H 58 GLN58 0.0356 904 HE21 96.9700 124.0060 132.0510 H 58 GLN58 0.1266 905 HE22 96.2190 125.0260 130.8850 H 58 GLN58 0.1266 906 N 97.8210 120.8280 128.7050 N.am 59 SER59 -0.2436 907 CA 97.5570 119.8270 129.7260 C.3 59 SER59 0.1109 908 C 98.8100 119.6170 130.5610 C.2 59 SER59 0.2209 909 O 99.9100 120.0350 130.1900 O.2 59 SER59 -0.2777 910 CB 97.1810 118.5500 128.9460 C.3 59 SER59 0.0681 911 OG 97.1040 117.3320 129.6740 O.3 59 SER59 -0.3930 912 H 98.7030 120.7900 128.1940 H 59 SER59 0.1312 913 HA 96.7510 120.1630 130.3810 H 59 SER59 0.0580 914 HB1 97.9310 118.3980 128.1670 H 59 SER59 0.0577 915 HB2 96.2380 118.7140 128.4130 H 59 SER59 0.0577 916 HG 96.5770 117.4700 130.4580 H 59 SER59 0.2095 917 N 98.6320 118.9570 131.7010 N.am 60 ARG60 -0.2456 918 CA 99.7340 118.5610 132.5710 C.3 60 ARG60 0.0879 919 C 99.9060 117.0540 132.4380 C.2 60 ARG60 0.2187 920 O 99.0600 116.2830 132.9030 O.2 60 ARG60 -0.2778 921 CB 99.6440 119.0770 134.0150 C.3 60 ARG60 -0.0258 922 CG 100.8850 118.6620 134.8450 C.3 60 ARG60 -0.0154 923 CD 101.3390 119.6880 135.8980 C.3 60 ARG60 0.1045 924 NE 102.0820 120.7900 135.2710 N.pl3 60 ARG60 -0.4450 925 CZ 103.4100 120.8890 135.1430 C.cat 60 ARG60 0.5062 926 NH1 104.2210 119.9540 135.5570 N.pl3 60 ARG60 -0.4573 927 NH2 103.9190 121.9540 134.5870 N.pl3 60 ARG60 -0.4573 928 H 97.6810 118.7160 131.9800 H 60 ARG60 0.1312 929 HA 100.6430 119.0050 132.1590 H 60 ARG60 0.0557 930 HB1 98.7300 118.7260 134.4960 H 60 ARG60 0.0286 931 HB2 99.5710 120.1650 133.9790 H 60 ARG60 0.0286 932 HG1 101.7320 118.4610 134.1880 H 60 ARG60 0.0299 933 HG2 100.6660 117.7130 135.3340 H 60 ARG60 0.0299 934 HD1 101.9650 119.2240 136.6640 H 60 ARG60 0.0711 935 HD2 100.4810 120.1220 136.4150 H 60 ARG60 0.0711 936 HE 101.5750 121.5650 134.8910 H 60 ARG60 0.3153 937 HH11 105.2060 120.0650 135.4300 H 60 ARG60 0.3114 938 HH12 103.8580 119.1380 135.9950 H 60 ARG60 0.3114 939 HH21 104.9080 122.0820 134.5040 H 60 ARG60 0.3114 940 HH22 103.3050 122.6610 134.2390 H 60 ARG60 0.3114 941 N 101.0020 116.6380 131.8080 N.am 61 ARG61 -0.2457 942 CA 101.1990 115.2450 131.4400 C.3 61 ARG61 0.0879 943 C 102.6940 114.9680 131.3970 C.2 61 ARG61 0.2185 944 O 103.4810 115.8650 131.0830 O.2 61 ARG61 -0.2778 945 CB 100.5650 115.1500 130.0340 C.3 61 ARG61 -0.0258 946 CG 100.2340 113.7450 129.5130 C.3 61 ARG61 -0.0154 947 CD 99.6440 113.8000 128.0910 C.3 61 ARG61 0.1045 948 NE 98.4940 114.7110 128.0280 N.pl3 61 ARG61 -0.4450 949 CZ 97.9940 115.2380 126.9100 C.cat 61 ARG61 0.5062 950 NH1 98.4680 114.9360 125.7290 N.pl3 61 ARG61 -0.4573 951 NH2 97.0050 116.0850 127.0000 N.pl3 61 ARG61 -0.4573 952 H 101.7270 117.3170 131.5760 H 61 ARG61 0.1312 953 HA 100.7120 114.6010 132.1750 H 61 ARG61 0.0557 954 HB1 101.1970 115.6710 129.3130 H 61 ARG61 0.0286 955 HB2 99.6340 115.7170 130.0560 H 61 ARG61 0.0286 956 HG1 99.5280 113.2610 130.1880 H 61 ARG61 0.0299 957 HG2 101.1340 113.1280 129.5080 H 61 ARG61 0.0299 958 HD1 99.3270 112.8110 127.7480 H 61 ARG61 0.0711 959 HD2 100.4010 114.1830 127.4100 H 61 ARG61 0.0711 960 HE 98.0340 114.9880 128.8730 H 61 ARG61 0.3153 961 HH11 98.0940 115.3700 124.9110 H 61 ARG61 0.3114 962 HH12 99.2040 114.2710 125.6430 H 61 ARG61 0.3114 963 HH21 96.5930 116.4770 126.1800 H 61 ARG61 0.3114 964 HH22 96.6630 116.3460 127.9030 H 61 ARG61 0.3114 965 N 103.0800 113.7390 131.7470 N.am 62 GLY62 -0.2485 966 CA 104.4760 113.3470 131.6730 C.3 62 GLY62 0.0765 967 C 105.0020 113.3480 130.2500 C.2 62 GLY62 0.2155 968 O 104.2470 113.2640 129.2820 O.2 62 GLY62 -0.2781 969 H 102.3850 113.0660 132.0710 H 62 GLY62 0.1309 970 HA1 104.5520 112.3430 132.0890 H 62 GLY62 0.0521 971 HA2 105.0570 114.0310 132.2940 H 62 GLY62 0.0521 972 N 106.3330 113.4220 130.1400 N.am 63 TYR63 -0.2456 973 CA 106.9890 113.6950 128.8610 C.3 63 TYR63 0.0917 974 C 106.8180 112.5570 127.8610 C.2 63 TYR63 0.2190 975 O 106.3640 112.7730 126.7330 O.2 63 TYR63 -0.2778 976 CB 108.4750 114.0280 129.0610 C.3 63 TYR63 -0.0036 977 CG 109.1710 114.3640 127.7620 C.ar 63 TYR63 -0.0453 978 CD1 108.7150 115.4040 126.9540 C.ar 63 TYR63 -0.0561 979 CD2 110.2830 113.6340 127.3490 C.ar 63 TYR63 -0.0561 980 CE1 109.3560 115.7070 125.7580 C.ar 63 TYR63 -0.0317 981 CE2 110.9280 113.9400 126.1570 C.ar 63 TYR63 -0.0317 982 CZ 110.4680 114.9800 125.3640 C.ar 63 TYR63 0.0726 983 OH 111.1150 115.2950 124.1870 O.3 63 TYR63 -0.3598 984 H 106.9070 113.2840 130.9720 H 63 TYR63 0.1312 985 HA 106.4790 114.5650 128.4450 H 63 TYR63 0.0560 986 HB1 108.9860 113.1970 129.5480 H 63 TYR63 0.0333 987 HB2 108.5640 114.8790 129.7320 H 63 TYR63 0.0333 988 HD1 107.8640 115.9970 127.2540 H 63 TYR63 0.0621 989 HD2 110.6560 112.8250 127.9570 H 63 TYR63 0.0621 990 HE1 109.0070 116.5210 125.1400 H 63 TYR63 0.0643 991 HE2 111.7930 113.3750 125.8470 H 63 TYR63 0.0643 992 HH 111.6980 114.5900 123.9380 H 63 TYR63 0.2173 993 N 107.1810 111.3330 128.2510 N.am 64 TRP64 -0.2453 994 CA 107.1320 110.2200 127.3070 C.3 64 TRP64 0.0918 995 C 105.7090 109.7710 126.9920 C.2 64 TRP64 0.2191 996 O 105.5170 108.9900 126.0550 O.2 64 TRP64 -0.2778 997 CB 108.0060 109.0580 127.7990 C.3 64 TRP64 -0.0021 998 CG 109.4580 109.4900 127.8270 C.ar 64 TRP64 -0.0260 999 CD1 110.2460 109.6580 128.9690 C.ar 64 TRP64 -0.0136 1000 CD2 110.2990 109.8120 126.6980 C.ar 64 TRP64 -0.0028 1001 NE1 111.4880 110.0570 128.6000 N.ar 64 TRP64 -0.2641 1002 CE2 111.5670 110.1610 127.2170 C.ar 64 TRP64 0.0269 1003 CE3 110.0840 109.8360 125.3440 C.ar 64 TRP64 -0.0528 1004 CZ2 112.5800 110.5200 126.3680 C.ar 64 TRP64 -0.0430 1005 CZ3 111.1110 110.2130 124.4770 C.ar 64 TRP64 -0.0611 1006 CH2 112.3620 110.5530 124.9900 C.ar 64 TRP64 -0.0602 1007 H 107.4930 111.1750 129.2090 H 64 TRP64 0.1312 1008 HA 107.5390 110.5900 126.3640 H 64 TRP64 0.0560 1009 HB1 107.9160 108.1970 127.1330 H 64 TRP64 0.0334 1010 HB2 107.6960 108.7300 128.7920 H 64 TRP64 0.0334 1011 HD1 109.9180 109.4910 129.9850 H 64 TRP64 0.0748 1012 HE1 112.2300 110.2380 129.2140 H 64 TRP64 0.1331 1013 HE3 109.1170 109.5680 124.9440 H 64 TRP64 0.0624 1014 HZ2 113.5470 110.7860 126.7690 H 64 TRP64 0.0633 1015 HZ3 110.9410 110.2410 123.4110 H 64 TRP64 0.0618 1016 HH2 113.1580 110.8450 124.3200 H 64 TRP64 0.0618 1017 N 104.7160 110.2260 127.7570 N.am 65 SER65 -0.2436 1018 CA 103.3290 109.9940 127.3770 C.3 65 SER65 0.1109 1019 C 102.8040 111.1010 126.4720 C.2 65 SER65 0.2209 1020 O 102.0850 110.8200 125.5090 O.2 65 SER65 -0.2777 1021 CB 102.4940 109.9450 128.6690 C.3 65 SER65 0.0681 1022 OG 101.0940 109.9910 128.4030 O.3 65 SER65 -0.3930 1023 H 104.9290 110.7390 128.6120 H 65 SER65 0.1312 1024 HA 103.2420 109.0430 126.8470 H 65 SER65 0.0580 1025 HB1 102.7590 110.7970 129.3030 H 65 SER65 0.0577 1026 HB2 102.7640 109.0330 129.2160 H 65 SER65 0.0577 1027 HG 100.5840 109.7670 129.1780 H 65 SER65 0.2095 1028 N 103.1500 112.3590 126.7650 N.am 66 CYS66 -0.2448 1029 CA 102.6660 113.4860 125.9680 C.3 66 CYS66 0.0975 1030 C 103.2650 113.4740 124.5660 C.2 66 CYS66 0.2195 1031 O 102.5770 113.7830 123.5790 O.2 66 CYS66 -0.2778 1032 CB 103.0410 114.7740 126.7180 C.3 66 CYS66 0.0279 1033 SG 102.1950 116.2560 126.1220 S.3 66 CYS66 -0.0910 1034 H 103.7640 112.5360 127.5600 H 66 CYS66 0.1312 1035 HA 101.5890 113.3750 125.8660 H 66 CYS66 0.0566 1036 HB1 102.8040 114.6650 127.7760 H 66 CYS66 0.0405 1037 HB2 104.1200 114.9360 126.6720 H 66 CYS66 0.0405 1038 N 104.5440 113.1040 124.4690 N.am 67 LEU67 -0.2456 1039 CA 105.2280 113.0130 123.1840 C.3 67 LEU67 0.0880 1040 C 104.6030 111.9530 122.2860 C.2 67 LEU67 0.2187 1041 O 104.4860 112.1570 121.0740 O.2 67 LEU67 -0.2778 1042 CB 106.7110 112.7730 123.4970 C.3 67 LEU67 -0.0266 1043 CG 107.6190 112.7870 122.2560 C.3 67 LEU67 -0.0449 1044 CD1 108.8200 113.7210 122.4460 C.3 67 LEU67 -0.0626 1045 CD2 108.0830 111.3660 121.9200 C.3 67 LEU67 -0.0626 1046 H 105.0590 112.8780 125.3200 H 67 LEU67 0.1312 1047 HA 105.1090 113.9810 122.6930 H 67 LEU67 0.0557 1048 HB1 106.8300 111.8430 124.0550 H 67 LEU67 0.0287 1049 HB2 107.0320 113.5550 124.1860 H 67 LEU67 0.0287 1050 HG 107.0510 113.1750 121.4100 H 67 LEU67 0.0296 1051 HD11 109.3630 113.8540 121.5110 H 67 LEU67 0.0232 1052 HD12 109.5130 113.3260 123.1880 H 67 LEU67 0.0232 1053 HD13 108.5060 114.7130 122.7720 H 67 LEU67 0.0232 1054 HD21 108.7490 111.3720 121.0630 H 67 LEU67 0.0232 1055 HD22 107.2380 110.7180 121.6870 H 67 LEU67 0.0232 1056 HD23 108.6270 110.9210 122.7530 H 67 LEU67 0.0232 1057 N 104.1750 110.8260 122.8610 N.am 68 LEU68 -0.2456 1058 CA 103.5350 109.7860 122.0580 C.3 68 LEU68 0.0880 1059 C 102.1830 110.2520 121.5280 C.2 68 LEU68 0.2187 1060 O 101.8460 109.9900 120.3650 O.2 68 LEU68 -0.2778 1061 CB 103.4040 108.5350 122.9480 C.3 68 LEU68 -0.0266 1062 CG 102.8330 107.2650 122.2810 C.3 68 LEU68 -0.0449 1063 CD1 101.2980 107.2520 122.2040 C.3 68 LEU68 -0.0626 1064 CD2 103.4710 106.9720 120.9160 C.3 68 LEU68 -0.0626 1065 H 104.2950 110.6910 123.8650 H 68 LEU68 0.1312 1066 HA 104.1910 109.5850 121.2090 H 68 LEU68 0.0557 1067 HB1 102.8200 108.7730 123.8390 H 68 LEU68 0.0287 1068 HB2 104.4020 108.2960 123.3180 H 68 LEU68 0.0287 1069 HG 103.1020 106.4370 122.9380 H 68 LEU68 0.0296 1070 HD11 100.9370 106.2590 121.9350 H 68 LEU68 0.0232 1071 HD12 100.9120 107.9410 121.4550 H 68 LEU68 0.0232 1072 HD13 100.8530 107.5150 123.1640 H 68 LEU68 0.0232 1073 HD21 103.1520 106.0010 120.5380 H 68 LEU68 0.0232 1074 HD22 104.5590 106.9600 120.9860 H 68 LEU68 0.0232 1075 HD23 103.1910 107.7190 120.1730 H 68 LEU68 0.0232 1076 N 101.4230 110.9790 122.3510 N.am 69 VAL69 -0.2454 1077 CA 100.0960 111.4370 121.9530 C.3 69 VAL69 0.0901 1078 C 100.1990 112.4960 120.8580 C.2 69 VAL69 0.2189 1079 O 99.3990 112.5080 119.9140 O.2 69 VAL69 -0.2778 1080 CB 99.3470 111.9390 123.2040 C.3 69 VAL69 -0.0227 1081 CG1 98.0160 112.6150 122.8520 C.3 69 VAL69 -0.0608 1082 CG2 99.0890 110.7900 124.1910 C.3 69 VAL69 -0.0608 1083 H 101.7770 111.2190 123.2770 H 69 VAL69 0.1312 1084 HA 99.5710 110.5790 121.5290 H 69 VAL69 0.0560 1085 HB 99.9800 112.6770 123.7000 H 69 VAL69 0.0315 1086 HG11 97.4880 112.9320 123.7510 H 69 VAL69 0.0233 1087 HG12 97.3620 111.9350 122.3040 H 69 VAL69 0.0233 1088 HG13 98.1740 113.4940 122.2300 H 69 VAL69 0.0233 1089 HG21 98.6500 111.1590 125.1180 H 69 VAL69 0.0233 1090 HG22 100.0020 110.2560 124.4500 H 69 VAL69 0.0233 1091 HG23 98.4010 110.0590 123.7650 H 69 VAL69 0.0233 1092 N 101.2020 113.3760 120.9330 N.am 70 TYR70 -0.2453 1093 CA 101.3830 114.3240 119.8320 C.3 70 TYR70 0.0917 1094 C 101.9510 113.6600 118.5770 C.2 70 TYR70 0.2190 1095 O 101.5450 114.0020 117.4610 O.2 70 TYR70 -0.2778 1096 CB 102.2250 115.5210 120.3060 C.3 70 TYR70 -0.0036 1097 CG 101.3830 116.4950 121.0950 C.ar 70 TYR70 -0.0453 1098 CD1 100.4120 117.2570 120.4510 C.ar 70 TYR70 -0.0561 1099 CD2 101.5440 116.6440 122.4690 C.ar 70 TYR70 -0.0561 1100 CE1 99.6020 118.1260 121.1690 C.ar 70 TYR70 -0.0317 1101 CE2 100.7430 117.5240 123.1870 C.ar 70 TYR70 -0.0317 1102 CZ 99.7600 118.2550 122.5390 C.ar 70 TYR70 0.0726 1103 OH 98.9380 119.0920 123.2660 O.3 70 TYR70 -0.3598 1104 H 101.8270 113.3870 121.7390 H 70 TYR70 0.1312 1105 HA 100.3940 114.6840 119.5430 H 70 TYR70 0.0560 1106 HB1 102.6430 116.0590 119.4550 H 70 TYR70 0.0333 1107 HB2 103.0720 115.1770 120.9010 H 70 TYR70 0.0333 1108 HD1 100.2700 117.1630 119.3830 H 70 TYR70 0.0621 1109 HD2 102.3010 116.0810 122.9900 H 70 TYR70 0.0621 1110 HE1 98.8470 118.7020 120.6570 H 70 TYR70 0.0643 1111 HE2 100.8790 117.6480 124.2490 H 70 TYR70 0.0643 1112 HH 98.4280 119.6310 122.6690 H 70 TYR70 0.2173 1113 N 102.8870 112.7150 118.7200 N.am 71 LEU71 -0.2456 1114 CA 103.5760 112.1970 117.5400 C.3 71 LEU71 0.0880 1115 C 102.8120 111.0910 116.8190 C.2 71 LEU71 0.2187 1116 O 103.1970 110.7280 115.7030 O.2 71 LEU71 -0.2778 1117 CB 105.0110 111.7690 117.8900 C.3 71 LEU71 -0.0266 1118 CG 105.9110 112.9230 118.3810 C.3 71 LEU71 -0.0449 1119 CD1 107.3090 112.3930 118.7170 C.3 71 LEU71 -0.0626 1120 CD2 106.0110 114.0730 117.3720 C.3 71 LEU71 -0.0626 1121 H 103.1180 112.3580 119.6470 H 71 LEU71 0.1312 1122 HA 103.6400 113.0050 116.8100 H 71 LEU71 0.0557 1123 HB1 105.4810 111.3210 117.0120 H 71 LEU71 0.0287 1124 HB2 104.9750 110.9860 118.6490 H 71 LEU71 0.0287 1125 HG 105.4880 113.3400 119.2930 H 71 LEU71 0.0296 1126 HD11 107.9220 113.1560 119.1970 H 71 LEU71 0.0232 1127 HD12 107.8320 112.0620 117.8220 H 71 LEU71 0.0232 1128 HD13 107.2410 111.5400 119.3900 H 71 LEU71 0.0232 1129 HD21 106.6880 114.8460 117.7340 H 71 LEU71 0.0232 1130 HD22 105.0480 114.5540 117.2150 H 71 LEU71 0.0232 1131 HD23 106.3790 113.7220 116.4070 H 71 LEU71 0.0232 1132 N 101.7800 110.5020 117.4310 N.am 72 ALA72 -0.2459 1133 CA 101.0440 109.4540 116.7190 C.3 72 ALA72 0.0852 1134 C 100.2470 109.9510 115.5030 C.2 72 ALA72 0.2211 1135 O 100.3940 109.3470 114.4220 O.2 72 ALA72 -0.2776 1136 CB 100.1800 108.6560 117.7060 C.3 72 ALA72 -0.0411 1137 H 101.5100 110.7770 118.3750 H 72 ALA72 0.1312 1138 HA 101.7980 108.7660 116.3300 H 72 ALA72 0.0554 1139 HB1 99.6830 107.8230 117.2080 H 72 ALA72 0.0249 1140 HB2 99.4120 109.2600 118.1850 H 72 ALA72 0.0249 1141 HB3 100.7990 108.2380 118.5000 H 72 ALA72 0.0249 1142 N 99.4190 111.0180 115.5650 N.am 73 PRO73 -0.2316 1143 CA 98.7130 111.4180 114.3360 C.3 73 PRO73 0.0907 1144 C 99.6010 112.0690 113.2920 C.2 73 PRO73 0.2189 1145 O 99.2170 112.0780 112.1140 O.2 73 PRO73 -0.2778 1146 CB 97.6600 112.4190 114.8540 C.3 73 PRO73 -0.0276 1147 CG 97.6860 112.3110 116.3820 C.3 73 PRO73 -0.0379 1148 CD 99.0920 111.8250 116.7270 C.3 73 PRO73 0.0071 1149 HA 98.2290 110.5330 113.9240 H 73 PRO73 0.0559 1150 HB1 96.6680 112.2100 114.4520 H 73 PRO73 0.0285 1151 HB2 97.9030 113.4430 114.5680 H 73 PRO73 0.0285 1152 HG1 96.9630 111.5590 116.6990 H 73 PRO73 0.0278 1153 HG2 97.4310 113.2490 116.8760 H 73 PRO73 0.0278 1154 HD1 99.8040 112.6460 116.7500 H 73 PRO73 0.0431 1155 HD2 99.1370 111.2540 117.6500 H 73 PRO73 0.0431 1156 N 100.7910 112.5370 113.6960 N.am 74 ASN74 -0.2452 1157 CA 101.7850 113.0760 112.7550 C.3 74 ASN74 0.0957 1158 C 102.2760 111.9410 111.8380 C.2 74 ASN74 0.2191 1159 O 102.3560 112.1050 110.6200 O.2 74 ASN74 -0.2778 1160 CB 102.9360 113.6660 113.5950 C.3 74 ASN74 0.0446 1161 CG 104.1480 114.0960 112.7630 C.2 74 ASN74 0.2000 1162 OD1 105.1610 113.4120 112.7240 O.2 74 ASN74 -0.2797 1163 ND2 103.9790 115.2540 112.1140 N.am 74 ASN74 -0.2723 1164 H 101.0150 112.5190 114.6910 H 74 ASN74 0.1312 1165 HA 101.3020 113.8430 112.1470 H 74 ASN74 0.0562 1166 HB1 103.2880 112.9310 114.3180 H 74 ASN74 0.0375 1167 HB2 102.5880 114.5230 114.1700 H 74 ASN74 0.0375 1168 HD21 104.6910 115.6480 111.5270 H 74 ASN74 0.1266 1169 HD22 103.1470 115.8040 112.1440 H 74 ASN74 0.1266 1170 N 102.6000 110.7920 112.4390 N.am 75 PHE75 -0.2453 1171 CA 102.9260 109.5760 111.6990 C.3 75 PHE75 0.0917 1172 C 101.7440 109.0810 110.8840 C.2 75 PHE75 0.2191 1173 O 101.9230 108.5860 109.7670 O.2 75 PHE75 -0.2778 1174 CB 103.3590 108.5240 112.7360 C.3 75 PHE75 -0.0036 1175 CG 103.5440 107.1470 112.1530 C.ar 75 PHE75 -0.0454 1176 CD1 104.6030 106.8880 111.2930 C.ar 75 PHE75 -0.0585 1177 CD2 102.6470 106.1240 112.4480 C.ar 75 PHE75 -0.0585 1178 CE1 104.7750 105.6240 110.7420 C.ar 75 PHE75 -0.0615 1179 CE2 102.8190 104.8580 111.9050 C.ar 75 PHE75 -0.0615 1180 CZ 103.8890 104.6050 111.0580 C.ar 75 PHE75 -0.0617 1181 H 102.6200 110.7630 113.4580 H 75 PHE75 0.1312 1182 HA 103.7450 109.8150 111.0190 H 75 PHE75 0.0560 1183 HB1 102.6270 108.4730 113.5420 H 75 PHE75 0.0333 1184 HB2 104.2940 108.8360 113.2030 H 75 PHE75 0.0333 1185 HD1 105.2920 107.6810 111.0510 H 75 PHE75 0.0620 1186 HD2 101.8090 106.3140 113.1030 H 75 PHE75 0.0620 1187 HE1 105.5990 105.4350 110.0700 H 75 PHE75 0.0618 1188 HE2 102.1200 104.0690 112.1420 H 75 PHE75 0.0618 1189 HZ 104.0280 103.6190 110.6400 H 75 PHE75 0.0618 1190 N 100.5310 109.2250 111.4190 N.am 76 SER76 -0.2436 1191 CA 99.3560 108.6980 110.7330 C.3 76 SER76 0.1109 1192 C 99.0690 109.4490 109.4320 C.2 76 SER76 0.2209 1193 O 98.9220 108.8340 108.3660 O.2 76 SER76 -0.2777 1194 CB 98.1760 108.7720 111.7090 C.3 76 SER76 0.0681 1195 OG 97.1040 107.9710 111.2440 O.3 76 SER76 -0.3930 1196 H 100.4240 109.7060 112.3120 H 76 SER76 0.1312 1197 HA 99.5640 107.6550 110.4900 H 76 SER76 0.0580 1198 HB1 97.8400 109.8070 111.8240 H 76 SER76 0.0577 1199 HB2 98.5220 108.4210 112.6890 H 76 SER76 0.0577 1200 HG 96.4430 107.8450 111.9230 H 76 SER76 0.2095 1201 N 99.0280 110.7830 109.4890 N.am 77 PHE77 -0.2453 1202 CA 98.7800 111.5620 108.2770 C.3 77 PHE77 0.0917 1203 C 99.9580 111.5220 107.3080 C.2 77 PHE77 0.2190 1204 O 99.7470 111.5600 106.0850 O.2 77 PHE77 -0.2778 1205 CB 98.3700 113.0040 108.6330 C.3 77 PHE77 -0.0036 1206 CG 96.9170 113.0760 109.0370 C.ar 77 PHE77 -0.0454 1207 CD1 95.9230 113.1060 108.0610 C.ar 77 PHE77 -0.0585 1208 CD2 96.5400 113.0930 110.3760 C.ar 77 PHE77 -0.0585 1209 CE1 94.5800 113.1270 108.4160 C.ar 77 PHE77 -0.0615 1210 CE2 95.1980 113.1110 110.7350 C.ar 77 PHE77 -0.0615 1211 CZ 94.2150 113.1250 109.7550 C.ar 77 PHE77 -0.0617 1212 H 99.1700 111.2590 110.3800 H 77 PHE77 0.1312 1213 HA 97.9510 111.0820 107.7570 H 77 PHE77 0.0560 1214 HB1 98.5040 113.6650 107.7750 H 77 PHE77 0.0333 1215 HB2 99.0060 113.4010 109.4260 H 77 PHE77 0.0333 1216 HD1 96.1970 113.1050 107.0170 H 77 PHE77 0.0620 1217 HD2 97.2910 113.0890 111.1490 H 77 PHE77 0.0620 1218 HE1 93.8170 113.1320 107.6510 H 77 PHE77 0.0618 1219 HE2 94.9200 113.1090 111.7790 H 77 PHE77 0.0618 1220 HZ 93.1710 113.1310 110.0300 H 77 PHE77 0.0618 1221 N 101.1940 111.4360 107.8160 N.am 78 LEU78 -0.2456 1222 CA 102.3390 111.2770 106.9240 C.3 78 LEU78 0.0880 1223 C 102.3060 109.9390 106.1940 C.2 78 LEU78 0.2187 1224 O 102.6340 109.8720 105.0030 O.2 78 LEU78 -0.2778 1225 CB 103.6590 111.4950 107.6900 C.3 78 LEU78 -0.0266 1226 CG 104.1560 112.9570 107.7060 C.3 78 LEU78 -0.0449 1227 CD1 104.8060 113.3470 106.3700 C.3 78 LEU78 -0.0626 1228 CD2 103.0790 113.9810 108.0900 C.3 78 LEU78 -0.0626 1229 H 101.3360 111.4810 108.8250 H 78 LEU78 0.1312 1230 HA 102.2460 112.0420 106.1510 H 78 LEU78 0.0557 1231 HB1 104.4560 110.8990 107.2450 H 78 LEU78 0.0287 1232 HB2 103.5530 111.1200 108.7080 H 78 LEU78 0.0287 1233 HG 104.9380 113.0190 108.4650 H 78 LEU78 0.0296 1234 HD11 105.2210 114.3540 106.4220 H 78 LEU78 0.0232 1235 HD12 104.0840 113.3290 105.5540 H 78 LEU78 0.0232 1236 HD13 105.6210 112.6690 106.1150 H 78 LEU78 0.0232 1237 HD21 103.5170 114.9750 108.1450 H 78 LEU78 0.0232 1238 HD22 102.6430 113.7840 109.0650 H 78 LEU78 0.0232 1239 HD23 102.2700 114.0210 107.3620 H 78 LEU78 0.0232 1240 N 101.8860 108.8680 106.8770 N.am 79 SER79 -0.2436 1241 CA 101.7360 107.5800 106.2090 C.3 79 SER79 0.1109 1242 C 100.6030 107.6120 105.1930 C.2 79 SER79 0.2209 1243 O 100.6980 106.9720 104.1390 O.2 79 SER79 -0.2777 1244 CB 101.5630 106.4350 107.2200 C.3 79 SER79 0.0681 1245 OG 100.2800 106.4600 107.8330 O.3 79 SER79 -0.3930 1246 H 101.6700 108.9530 107.8700 H 79 SER79 0.1312 1247 HA 102.6530 107.4100 105.6480 H 79 SER79 0.0580 1248 HB1 102.3500 106.5100 107.9780 H 79 SER79 0.0577 1249 HB2 101.6990 105.4840 106.6930 H 79 SER79 0.0577 1250 HG 100.1860 105.7640 108.4790 H 79 SER79 0.2095 1251 N 99.5400 108.3730 105.4850 N.am 80 LEU80 -0.2456 1252 CA 98.4400 108.5390 104.5340 C.3 80 LEU80 0.0880 1253 C 98.9030 109.1900 103.2370 C.2 80 LEU80 0.2187 1254 O 98.6480 108.6700 102.1390 O.2 80 LEU80 -0.2778 1255 CB 97.3350 109.4050 105.1770 C.3 80 LEU80 -0.0266 1256 CG 96.1930 109.8360 104.2270 C.3 80 LEU80 -0.0449 1257 CD1 95.2840 108.6560 103.8670 C.3 80 LEU80 -0.0626 1258 CD2 95.3970 111.0160 104.8010 C.3 80 LEU80 -0.0626 1259 H 99.4960 108.8460 106.3880 H 80 LEU80 0.1312 1260 HA 98.0550 107.5480 104.2960 H 80 LEU80 0.0557 1261 HB1 97.7930 110.3040 105.5830 H 80 LEU80 0.0287 1262 HB2 96.9230 108.8750 106.0360 H 80 LEU80 0.0287 1263 HG 96.6120 110.2160 103.2960 H 80 LEU80 0.0296 1264 HD11 94.4600 108.9750 103.2280 H 80 LEU80 0.0232 1265 HD12 94.8600 108.2040 104.7610 H 80 LEU80 0.0232 1266 HD13 95.8360 107.8800 103.3350 H 80 LEU80 0.0232 1267 HD21 94.6510 111.3590 104.0870 H 80 LEU80 0.0232 1268 HD22 96.0490 111.8620 105.0140 H 80 LEU80 0.0232 1269 HD23 94.8860 110.7620 105.7250 H 80 LEU80 0.0232 1270 N 99.5940 110.3260 103.3420 N.am 81 LEU81 -0.2456 1271 CA 100.0220 111.0110 102.1250 C.3 81 LEU81 0.0880 1272 C 101.1400 110.2600 101.4110 C.2 81 LEU81 0.2187 1273 O 101.1950 110.2770 100.1740 O.2 81 LEU81 -0.2778 1274 CB 100.4420 112.4630 102.4510 C.3 81 LEU81 -0.0266 1275 CG 99.2630 113.4560 102.5740 C.3 81 LEU81 -0.0449 1276 CD1 98.4270 113.2540 103.8440 C.3 81 LEU81 -0.0626 1277 CD2 99.7570 114.9090 102.5140 C.3 81 LEU81 -0.0626 1278 H 99.8200 110.7110 104.2590 H 81 LEU81 0.1312 1279 HA 99.1710 111.0330 101.4420 H 81 LEU81 0.0557 1280 HB1 101.0850 112.8290 101.6490 H 81 LEU81 0.0287 1281 HB2 101.0540 112.4850 103.3540 H 81 LEU81 0.0287 1282 HG 98.6090 113.3060 101.7140 H 81 LEU81 0.0296 1283 HD11 97.5840 113.9460 103.8710 H 81 LEU81 0.0232 1284 HD12 99.0230 113.4400 104.7370 H 81 LEU81 0.0232 1285 HD13 98.0170 112.2490 103.9070 H 81 LEU81 0.0232 1286 HD21 98.9260 115.6110 102.5880 H 81 LEU81 0.0232 1287 HD22 100.2690 115.1110 101.5750 H 81 LEU81 0.0232 1288 HD23 100.4500 115.1260 103.3270 H 81 LEU81 0.0232 1289 N 101.9870 109.5410 102.1580 N.am 82 ALA82 -0.2459 1290 CA 103.0190 108.7180 101.5350 C.3 82 ALA82 0.0850 1291 C 102.4160 107.5630 100.7470 C.2 82 ALA82 0.2184 1292 O 102.8560 107.2720 99.6300 O.2 82 ALA82 -0.2778 1293 CB 103.9480 108.1840 102.6340 C.3 82 ALA82 -0.0411 1294 H 101.9100 109.5690 103.1750 H 82 ALA82 0.1312 1295 HA 103.5760 109.3550 100.8460 H 82 ALA82 0.0554 1296 HB1 104.7640 107.5930 102.2160 H 82 ALA82 0.0249 1297 HB2 103.4070 107.5550 103.3420 H 82 ALA82 0.0249 1298 HB3 104.3930 109.0040 103.1970 H 82 ALA82 0.0249 1299 N 101.3820 106.9170 101.2880 N.am 83 ASN83 -0.2452 1300 CA 100.7600 105.8120 100.5700 C.3 83 ASN83 0.0957 1301 C 99.9310 106.2840 99.3860 C.2 83 ASN83 0.2191 1302 O 99.8530 105.5770 98.3750 O.2 83 ASN83 -0.2778 1303 CB 99.9300 104.9160 101.4970 C.3 83 ASN83 0.0446 1304 CG 100.8540 103.9920 102.2980 C.2 83 ASN83 0.2000 1305 OD1 101.5340 103.1370 101.7470 O.2 83 ASN83 -0.2797 1306 ND2 100.8430 104.2080 103.6170 N.am 83 ASN83 -0.2723 1307 H 101.0270 107.1960 102.2030 H 83 ASN83 0.1312 1308 HA 101.5700 105.2170 100.1420 H 83 ASN83 0.0562 1309 HB1 99.2870 104.2640 100.9090 H 83 ASN83 0.0375 1310 HB2 99.2950 105.5030 102.1620 H 83 ASN83 0.0375 1311 HD21 101.4260 103.6410 104.1940 H 83 ASN83 0.1266 1312 HD22 100.2750 104.9170 104.0340 H 83 ASN83 0.1266 1313 N 99.3160 107.4660 99.4720 N.am 84 LEU84 -0.2456 1314 CA 98.5850 107.9640 98.3080 C.3 84 LEU84 0.0880 1315 C 99.5370 108.3800 97.1930 C.2 84 LEU84 0.2187 1316 O 99.2470 108.1640 96.0050 O.2 84 LEU84 -0.2778 1317 CB 97.7270 109.1430 98.7930 C.3 84 LEU84 -0.0266 1318 CG 96.7530 109.6980 97.7330 C.3 84 LEU84 -0.0449 1319 CD1 95.2920 109.5530 98.1810 C.3 84 LEU84 -0.0626 1320 CD2 97.0810 111.1590 97.3900 C.3 84 LEU84 -0.0626 1321 H 99.3550 108.0110 100.3330 H 84 LEU84 0.1312 1322 HA 97.9450 107.1600 97.9420 H 84 LEU84 0.0557 1323 HB1 98.3800 109.9340 99.1680 H 84 LEU84 0.0287 1324 HB2 97.1640 108.8150 99.6690 H 84 LEU84 0.0287 1325 HG 96.8590 109.1130 96.8200 H 84 LEU84 0.0296 1326 HD11 94.6120 109.9970 97.4550 H 84 LEU84 0.0232 1327 HD12 95.1200 110.0390 99.1410 H 84 LEU84 0.0232 1328 HD13 95.0210 108.5040 98.2930 H 84 LEU84 0.0232 1329 HD21 96.4060 111.5500 96.6280 H 84 LEU84 0.0232 1330 HD22 98.0990 111.2510 97.0120 H 84 LEU84 0.0232 1331 HD23 96.9970 111.7990 98.2680 H 84 LEU84 0.0232 1332 N 100.6950 108.9350 97.5580 N.am 85 LEU85 -0.2456 1333 CA 101.7280 109.2080 96.5680 C.3 85 LEU85 0.0880 1334 C 102.2750 107.9140 95.9710 C.2 85 LEU85 0.2187 1335 O 102.5820 107.8640 94.7770 O.2 85 LEU85 -0.2778 1336 CB 102.8180 110.0740 97.2170 C.3 85 LEU85 -0.0266 1337 CG 103.8570 110.6400 96.2290 C.3 85 LEU85 -0.0449 1338 CD1 103.2150 111.5250 95.1470 C.3 85 LEU85 -0.0626 1339 CD2 104.9330 111.4290 96.9870 C.3 85 LEU85 -0.0626 1340 H 100.8580 109.1700 98.5370 H 85 LEU85 0.1312 1341 HA 101.2380 109.7650 95.7690 H 85 LEU85 0.0557 1342 HB1 103.3220 109.4950 97.9930 H 85 LEU85 0.0287 1343 HB2 102.3410 110.9070 97.7340 H 85 LEU85 0.0287 1344 HG 104.3520 109.8050 95.7320 H 85 LEU85 0.0296 1345 HD11 103.9780 111.9710 94.5080 H 85 LEU85 0.0232 1346 HD12 102.6370 112.3370 95.5900 H 85 LEU85 0.0232 1347 HD13 102.5530 110.9540 94.4970 H 85 LEU85 0.0232 1348 HD21 105.7000 111.8000 96.3070 H 85 LEU85 0.0232 1349 HD22 105.4250 110.8050 97.7320 H 85 LEU85 0.0232 1350 HD23 104.5010 112.2870 97.5030 H 85 LEU85 0.0232 1351 N 102.3510 106.8470 96.7760 N.am 86 LEU86 -0.2456 1352 CA 102.7430 105.5250 96.2800 C.3 86 LEU86 0.0880 1353 C 101.7550 104.9760 95.2540 C.2 86 LEU86 0.2187 1354 O 102.1610 104.4440 94.2150 O.2 86 LEU86 -0.2778 1355 CB 102.8900 104.5520 97.4710 C.3 86 LEU86 -0.0266 1356 CG 103.1730 103.0790 97.1020 C.3 86 LEU86 -0.0449 1357 CD1 104.5040 102.9150 96.3590 C.3 86 LEU86 -0.0626 1358 CD2 103.1310 102.1800 98.3450 C.3 86 LEU86 -0.0626 1359 H 102.1290 106.9580 97.7650 H 86 LEU86 0.1312 1360 HA 103.7060 105.6490 95.7830 H 86 LEU86 0.0557 1361 HB1 101.9730 104.5720 98.0530 H 86 LEU86 0.0287 1362 HB2 103.6710 104.9160 98.1400 H 86 LEU86 0.0287 1363 HG 102.3800 102.7230 96.4420 H 86 LEU86 0.0296 1364 HD11 104.6730 101.8710 96.0990 H 86 LEU86 0.0232 1365 HD12 105.3420 103.2500 96.9720 H 86 LEU86 0.0232 1366 HD13 104.5140 103.4860 95.4310 H 86 LEU86 0.0232 1367 HD21 103.2760 101.1340 98.0750 H 86 LEU86 0.0232 1368 HD22 102.1720 102.2590 98.8570 H 86 LEU86 0.0232 1369 HD23 103.9110 102.4470 99.0570 H 86 LEU86 0.0232 1370 N 100.4540 105.0820 95.5410 N.am 87 VAL87 -0.2454 1371 CA 99.4280 104.5460 94.6430 C.3 87 VAL87 0.0901 1372 C 99.4190 105.3020 93.3150 C.2 87 VAL87 0.2189 1373 O 99.4320 104.6930 92.2310 O.2 87 VAL87 -0.2778 1374 CB 98.0610 104.5310 95.3630 C.3 87 VAL87 -0.0227 1375 CG1 96.8890 104.2410 94.4110 C.3 87 VAL87 -0.0608 1376 CG2 98.0590 103.4900 96.4970 C.3 87 VAL87 -0.0608 1377 H 100.1690 105.5460 96.4040 H 87 VAL87 0.1312 1378 HA 99.7160 103.5180 94.4070 H 87 VAL87 0.0560 1379 HB 97.8970 105.5150 95.8040 H 87 VAL87 0.0315 1380 HG11 95.9480 104.1710 94.9570 H 87 VAL87 0.0233 1381 HG12 97.0390 103.2970 93.8840 H 87 VAL87 0.0233 1382 HG13 96.7720 105.0250 93.6630 H 87 VAL87 0.0233 1383 HG21 97.1160 103.4970 97.0410 H 87 VAL87 0.0233 1384 HG22 98.8570 103.6630 97.2160 H 87 VAL87 0.0233 1385 HG23 98.1950 102.4840 96.0980 H 87 VAL87 0.0233 1386 N 99.4320 106.6400 93.3750 N.am 88 HIS88 -0.2453 1387 CA 99.4650 107.4100 92.1320 C.3 88 HIS88 0.0932 1388 C 100.7890 107.2610 91.3900 C.2 88 HIS88 0.2188 1389 O 100.8000 107.2840 90.1560 O.2 88 HIS88 -0.2778 1390 CB 99.2360 108.8970 92.4420 C.3 88 HIS88 0.0146 1391 CG 97.8680 109.1120 93.0490 C.ar 88 HIS88 0.0551 1392 ND1 96.7310 108.5190 92.6180 N.ar 88 HIS88 -0.2469 1393 CD2 97.5440 109.9470 94.1290 C.ar 88 HIS88 0.0047 1394 CE1 95.7590 108.9380 93.4490 C.ar 88 HIS88 0.0737 1395 NE2 96.2140 109.8280 94.3480 N.ar 88 HIS88 -0.2539 1396 H 99.4190 107.1160 94.2770 H 88 HIS88 0.1312 1397 HA 98.6750 107.0250 91.4860 H 88 HIS88 0.0561 1398 HB1 99.3110 109.5030 91.5380 H 88 HIS88 0.0348 1399 HB2 99.9940 109.2590 93.1380 H 88 HIS88 0.0348 1400 HD2 98.2430 110.5410 94.6990 H 88 HIS88 0.0764 1401 HE1 94.7340 108.5950 93.4090 H 88 HIS88 0.0963 1402 HE2 95.6990 110.2610 95.0610 H 88 HIS88 0.1339 1403 N 101.8970 107.0460 92.1020 N.am 89 GLY89 -0.2485 1404 CA 103.1650 106.8380 91.4250 C.3 89 GLY89 0.0765 1405 C 103.2490 105.4910 90.7410 C.2 89 GLY89 0.2155 1406 O 103.8410 105.3690 89.6650 O.2 89 GLY89 -0.2781 1407 H 101.8530 107.0280 93.1210 H 89 GLY89 0.1309 1408 HA1 103.9400 106.8990 92.1880 H 89 GLY89 0.0521 1409 HA2 103.3190 107.6410 90.7030 H 89 GLY89 0.0521 1410 N 102.6360 104.4670 91.3360 N.am 90 GLU90 -0.2459 1411 CA 102.6110 103.1620 90.6890 C.3 90 GLU90 0.0883 1412 C 101.7210 103.1780 89.4540 C.2 90 GLU90 0.2187 1413 O 102.0750 102.5840 88.4250 O.2 90 GLU90 -0.2778 1414 CB 101.9920 102.1650 91.7100 C.3 90 GLU90 -0.0193 1415 CG 101.2010 100.9440 91.1530 C.3 90 GLU90 0.0356 1416 CD 99.7050 101.2360 90.8580 C.2 90 GLU90 0.1760 1417 OE1 99.0050 101.7200 91.7450 O.co2 90 GLU90 -0.6478 1418 OE2 99.2470 100.9780 89.7440 O.co2 90 GLU90 -0.6478 1419 H 102.1860 104.5970 92.2420 H 90 GLU90 0.1312 1420 HA 103.6240 102.8740 90.4040 H 90 GLU90 0.0557 1421 HB1 101.3370 102.7030 92.3980 H 90 GLU90 0.0290 1422 HB2 102.8060 101.8030 92.3360 H 90 GLU90 0.0290 1423 HG1 101.2070 100.1350 91.8810 H 90 GLU90 0.0374 1424 HG2 101.6760 100.5440 90.2580 H 90 GLU90 0.0374 1425 N 100.5690 103.8560 89.5290 N.am 91 ARG91 -0.2457 1426 CA 99.7160 103.9620 88.3470 C.3 91 ARG91 0.0879 1427 C 100.3860 104.7910 87.2540 C.2 91 ARG91 0.2187 1428 O 100.2740 104.4690 86.0630 O.2 91 ARG91 -0.2778 1429 CB 98.4300 104.5890 88.8820 C.3 91 ARG91 -0.0258 1430 CG 97.3010 104.7260 87.8600 C.3 91 ARG91 -0.0154 1431 CD 95.9740 105.0340 88.5630 C.3 91 ARG91 0.1045 1432 NE 96.0930 106.2320 89.4040 N.pl3 91 ARG91 -0.4450 1433 CZ 95.8890 107.4790 88.9890 C.cat 91 ARG91 0.5062 1434 NH1 95.5920 107.7400 87.7450 N.pl3 91 ARG91 -0.4573 1435 NH2 95.9810 108.4700 89.8310 N.pl3 91 ARG91 -0.4573 1436 H 100.2880 104.2960 90.4060 H 91 ARG91 0.1312 1437 HA 99.5350 102.9490 87.9810 H 91 ARG91 0.0557 1438 HB1 98.6580 105.5590 89.3270 H 91 ARG91 0.0286 1439 HB2 98.0840 103.9580 89.7040 H 91 ARG91 0.0286 1440 HG1 97.2030 103.7930 87.3020 H 91 ARG91 0.0299 1441 HG2 97.5470 105.5010 87.1340 H 91 ARG91 0.0299 1442 HD1 95.7160 104.2090 89.2340 H 91 ARG91 0.0711 1443 HD2 95.1460 105.1430 87.8610 H 91 ARG91 0.0711 1444 HE 96.3570 106.0690 90.3570 H 91 ARG91 0.3153 1445 HH11 95.4170 108.6760 87.4520 H 91 ARG91 0.3114 1446 HH12 95.5490 106.9840 87.0970 H 91 ARG91 0.3114 1447 HH21 95.7910 109.4070 89.5410 H 91 ARG91 0.3114 1448 HH22 96.2440 108.2850 90.7780 H 91 ARG91 0.3114 1449 N 101.1190 105.8370 87.6500 N.am 92 TYR92 -0.2453 1450 CA 101.8880 106.6420 86.7060 C.3 92 TYR92 0.0917 1451 C 102.9610 105.8210 86.0110 C.2 92 TYR92 0.2190 1452 O 103.1420 105.9370 84.7970 O.2 92 TYR92 -0.2778 1453 CB 102.5070 107.8230 87.4750 C.3 92 TYR92 -0.0036 1454 CG 103.1620 108.8620 86.5940 C.ar 92 TYR92 -0.0453 1455 CD1 102.5210 110.0680 86.3360 C.ar 92 TYR92 -0.0561 1456 CD2 104.4440 108.6680 86.0890 C.ar 92 TYR92 -0.0561 1457 CE1 103.1760 111.0810 85.6480 C.ar 92 TYR92 -0.0317 1458 CE2 105.0750 109.6580 85.3420 C.ar 92 TYR92 -0.0317 1459 CZ 104.4440 110.8760 85.1340 C.ar 92 TYR92 0.0726 1460 OH 105.0710 111.8900 84.4350 O.3 92 TYR92 -0.3598 1461 H 101.1410 106.0790 88.6410 H 92 TYR92 0.1312 1462 HA 101.1850 106.9980 85.9550 H 92 TYR92 0.0560 1463 HB1 103.2370 107.4610 88.2000 H 92 TYR92 0.0333 1464 HB2 101.7300 108.3130 88.0610 H 92 TYR92 0.0333 1465 HD1 101.5310 110.2390 86.7290 H 92 TYR92 0.0621 1466 HD2 104.9510 107.7370 86.2810 H 92 TYR92 0.0621 1467 HE1 102.7180 112.0460 85.5300 H 92 TYR92 0.0643 1468 HE2 106.0670 109.4880 84.9520 H 92 TYR92 0.0643 1469 HH 105.8970 111.5580 84.1050 H 92 TYR92 0.2173 1470 N 103.6950 105.0000 86.7730 N.am 93 MET93 -0.2456 1471 CA 104.7090 104.1320 86.1770 C.3 93 MET93 0.0885 1472 C 104.0920 103.1450 85.1970 C.2 93 MET93 0.2187 1473 O 104.5300 103.0640 84.0440 O.2 93 MET93 -0.2778 1474 CB 105.4780 103.3870 87.2810 C.3 93 MET93 -0.0199 1475 CG 106.4430 104.2840 88.0690 C.3 93 MET93 -0.0047 1476 SD 107.8630 104.8160 87.0790 S.3 93 MET93 -0.1641 1477 CE 107.3780 106.5160 86.7250 C.3 93 MET93 -0.0181 1478 H 103.5450 104.9800 87.7820 H 93 MET93 0.1312 1479 HA 105.3850 104.7680 85.6070 H 93 MET93 0.0557 1480 HB1 106.0520 102.5630 86.8520 H 93 MET93 0.0293 1481 HB2 104.7640 102.9300 87.9680 H 93 MET93 0.0293 1482 HG1 106.8270 103.7210 88.9200 H 93 MET93 0.0377 1483 HG2 105.9350 105.1450 88.4980 H 93 MET93 0.0377 1484 HE1 108.2660 107.1430 86.6460 H 93 MET93 0.0340 1485 HE2 106.7700 106.9260 87.5320 H 93 MET93 0.0340 1486 HE3 106.8260 106.5670 85.7880 H 93 MET93 0.0340 1487 N 103.0170 102.4650 85.6120 N.am 94 ALA94 -0.2459 1488 CA 102.4160 101.4160 84.7920 C.3 94 ALA94 0.0850 1489 C 101.7950 101.9660 83.5120 C.2 94 ALA94 0.2184 1490 O 101.7790 101.2800 82.4840 O.2 94 ALA94 -0.2778 1491 CB 101.3470 100.7160 85.6400 C.3 94 ALA94 -0.0411 1492 H 102.6080 102.6840 86.5210 H 94 ALA94 0.1312 1493 HA 103.2080 100.7160 84.5220 H 94 ALA94 0.0554 1494 HB1 100.8790 99.8950 85.0960 H 94 ALA94 0.0249 1495 HB2 100.5640 101.4110 85.9450 H 94 ALA94 0.0249 1496 HB3 101.7850 100.3030 86.5500 H 94 ALA94 0.0249 1497 N 101.2800 103.1950 83.5430 N.am 95 VAL95 -0.2454 1498 CA 100.7110 103.7470 82.3180 C.3 95 VAL95 0.0901 1499 C 101.7810 104.4150 81.4550 C.2 95 VAL95 0.2189 1500 O 101.8610 104.1630 80.2480 O.2 95 VAL95 -0.2778 1501 CB 99.5950 104.7280 82.7460 C.3 95 VAL95 -0.0227 1502 CG1 99.0740 105.5900 81.5870 C.3 95 VAL95 -0.0608 1503 CG2 98.4290 103.9790 83.4120 C.3 95 VAL95 -0.0608 1504 H 101.2840 103.7390 84.4060 H 95 VAL95 0.1312 1505 HA 100.2650 102.9420 81.7300 H 95 VAL95 0.0560 1506 HB 100.0080 105.4000 83.4990 H 95 VAL95 0.0315 1507 HG11 98.2480 106.2250 81.9020 H 95 VAL95 0.0233 1508 HG12 98.7230 104.9700 80.7610 H 95 VAL95 0.0233 1509 HG13 99.8550 106.2470 81.2110 H 95 VAL95 0.0233 1510 HG21 97.6650 104.6730 83.7620 H 95 VAL95 0.0233 1511 HG22 98.7580 103.4000 84.2740 H 95 VAL95 0.0233 1512 HG23 97.9570 103.2890 82.7120 H 95 VAL95 0.0233 1513 N 102.6440 105.2460 82.0420 N.am 96 LEU96 -0.2456 1514 CA 103.5070 106.0980 81.2390 C.3 96 LEU96 0.0880 1515 C 104.8410 105.4680 80.8660 C.2 96 LEU96 0.2187 1516 O 105.4760 105.9440 79.9200 O.2 96 LEU96 -0.2778 1517 CB 103.8150 107.4220 81.9880 C.3 96 LEU96 -0.0266 1518 CG 102.6750 108.4580 82.1040 C.3 96 LEU96 -0.0449 1519 CD1 101.9990 108.7420 80.7640 C.3 96 LEU96 -0.0626 1520 CD2 101.6340 108.1270 83.1730 C.3 96 LEU96 -0.0626 1521 H 102.6990 105.2840 83.0600 H 96 LEU96 0.1312 1522 HA 103.0000 106.3190 80.2990 H 96 LEU96 0.0557 1523 HB1 104.6240 107.9350 81.4650 H 96 LEU96 0.0287 1524 HB2 104.2150 107.2030 82.9780 H 96 LEU96 0.0287 1525 HG 103.1420 109.3910 82.4250 H 96 LEU96 0.0296 1526 HD11 101.3130 109.5860 80.8530 H 96 LEU96 0.0232 1527 HD12 101.4240 107.8770 80.4360 H 96 LEU96 0.0232 1528 HD13 102.7370 108.9820 79.9990 H 96 LEU96 0.0232 1529 HD21 100.8850 108.9170 83.2410 H 96 LEU96 0.0232 1530 HD22 102.0980 108.0370 84.1500 H 96 LEU96 0.0232 1531 HD23 101.1160 107.1980 82.9530 H 96 LEU96 0.0232 1532 N 105.3060 104.4340 81.5680 N.am 97 ARG97 -0.2456 1533 CA 106.5380 103.7330 81.2070 C.3 97 ARG97 0.0881 1534 C 106.2300 102.2430 81.1550 C.2 97 ARG97 0.2213 1535 O 106.5910 101.4880 82.0640 O.2 97 ARG97 -0.2776 1536 CB 107.5900 103.9980 82.3030 C.3 97 ARG97 -0.0258 1537 CG 107.8320 105.4870 82.5890 C.3 97 ARG97 -0.0154 1538 CD 108.8950 105.7010 83.6710 C.3 97 ARG97 0.1045 1539 NE 110.2310 105.4490 83.1300 N.pl3 97 ARG97 -0.4450 1540 CZ 111.3340 105.4520 83.8730 C.cat 97 ARG97 0.5062 1541 NH1 111.2830 105.6430 85.1650 N.pl3 97 ARG97 -0.4573 1542 NH2 112.4930 105.2590 83.3040 N.pl3 97 ARG97 -0.4573 1543 H 104.7840 104.1210 82.3860 H 97 ARG97 0.1312 1544 HA 106.9000 104.0710 80.2360 H 97 ARG97 0.0557 1545 HB1 108.5280 103.5160 82.0240 H 97 ARG97 0.0286 1546 HB2 107.2740 103.5310 83.2380 H 97 ARG97 0.0286 1547 HG1 106.9030 105.9430 82.9340 H 97 ARG97 0.0299 1548 HG2 108.1090 106.0110 81.6730 H 97 ARG97 0.0299 1549 HD1 108.7190 105.0250 84.5120 H 97 ARG97 0.0711 1550 HD2 108.8700 106.7310 84.0340 H 97 ARG97 0.0711 1551 HE 110.3200 105.2620 82.1530 H 97 ARG97 0.3153 1552 HH11 112.1140 105.6900 85.7120 H 97 ARG97 0.3114 1553 HH12 110.3920 105.7280 85.6050 H 97 ARG97 0.3114 1554 HH21 113.3240 105.2490 83.8550 H 97 ARG97 0.3114 1555 HH22 112.5480 105.1190 82.3180 H 97 ARG97 0.3114 1556 N 105.5490 101.7830 80.0940 N.am 98 PRO98 -0.2316 1557 CA 104.9680 100.4340 80.1230 C.3 98 PRO98 0.0907 1558 C 105.9810 99.3250 79.8960 C.2 98 PRO98 0.2189 1559 O 105.7760 98.1930 80.3420 O.2 98 PRO98 -0.2778 1560 CB 103.9550 100.5000 78.9740 C.3 98 PRO98 -0.0276 1561 CG 104.5370 101.5220 77.9970 C.3 98 PRO98 -0.0379 1562 CD 105.2560 102.5420 78.8820 C.3 98 PRO98 0.0071 1563 HA 104.4710 100.2770 81.0830 H 98 PRO98 0.0559 1564 HB1 103.0090 100.8790 79.3620 H 98 PRO98 0.0285 1565 HB2 103.7510 99.5350 78.5090 H 98 PRO98 0.0285 1566 HG1 103.7740 101.9790 77.3660 H 98 PRO98 0.0278 1567 HG2 105.2570 101.0300 77.3440 H 98 PRO98 0.0278 1568 HD1 106.1820 102.9140 78.4400 H 98 PRO98 0.0431 1569 HD2 104.5940 103.3640 79.1530 H 98 PRO98 0.0431 1570 N 107.0740 99.6360 79.2000 N.am 99 LEU99 -0.2456 1571 CA 108.1180 98.6530 78.9440 C.3 99 LEU99 0.0880 1572 C 109.0940 98.5190 80.1050 C.2 99 LEU99 0.2187 1573 O 109.9180 97.6000 80.1000 O.2 99 LEU99 -0.2778 1574 CB 108.8770 99.0450 77.6630 C.3 99 LEU99 -0.0266 1575 CG 107.9780 99.2570 76.4290 C.3 99 LEU99 -0.0449 1576 CD1 108.8190 99.6800 75.2180 C.3 99 LEU99 -0.0626 1577 CD2 107.1460 98.0110 76.0960 C.3 99 LEU99 -0.0626 1578 H 107.1820 100.5840 78.8380 H 99 LEU99 0.1312 1579 HA 107.6430 97.6800 78.8070 H 99 LEU99 0.0557 1580 HB1 109.6170 98.2770 77.4330 H 99 LEU99 0.0287 1581 HB2 109.4380 99.9620 77.8450 H 99 LEU99 0.0287 1582 HG 107.2860 100.0740 76.6360 H 99 LEU99 0.0296 1583 HD11 108.1890 99.8740 74.3500 H 99 LEU99 0.0232 1584 HD12 109.5330 98.9020 74.9450 H 99 LEU99 0.0232 1585 HD13 109.3820 100.5900 75.4280 H 99 LEU99 0.0232 1586 HD21 106.5550 98.1660 75.1920 H 99 LEU99 0.0232 1587 HD22 106.4480 97.7690 76.8970 H 99 LEU99 0.0232 1588 HD23 107.7840 97.1430 75.9320 H 99 LEU99 0.0232 1589 N 109.0420 99.4360 81.0640 N.am 100 GLN100 -0.2456 1590 CA 109.8100 99.3040 82.2910 C.3 100 GLN100 0.0885 1591 C 109.3090 98.0960 83.0820 C.2 100 GLN100 0.2214 1592 O 108.1030 97.8210 83.0870 O.2 100 GLN100 -0.2776 1593 CB 109.5390 100.5800 83.1070 C.3 100 GLN100 -0.0210 1594 CG 110.2760 100.6660 84.4530 C.3 100 GLN100 0.0225 1595 CD 109.7850 101.8890 85.2370 C.2 100 GLN100 0.1981 1596 OE1 110.3050 102.9880 85.1050 O.2 100 GLN100 -0.2798 1597 NE2 108.7550 101.6280 86.0550 N.am 100 GLN100 -0.2724 1598 H 108.4470 100.2550 80.9360 H 100 GLN100 0.1312 1599 HA 110.8580 99.2060 82.0080 H 100 GLN100 0.0557 1600 HB1 108.4670 100.6430 83.2940 H 100 GLN100 0.0289 1601 HB2 109.7900 101.4510 82.5010 H 100 GLN100 0.0289 1602 HG1 111.3500 100.7570 84.3020 H 100 GLN100 0.0356 1603 HG2 110.1050 99.7790 85.0610 H 100 GLN100 0.0356 1604 HE21 108.3490 102.3490 86.6150 H 100 GLN100 0.1266 1605 HE22 108.3720 100.7050 86.1160 H 100 GLN100 0.1266 1606 N 110.1990 97.3310 83.7270 N.am 101 PRO101 -0.2316 1607 CA 109.7370 96.2030 84.5360 C.3 101 PRO101 0.0909 1608 C 109.0040 96.6790 85.7760 C.2 101 PRO101 0.2216 1609 O 109.2850 97.7710 86.3000 O.2 101 PRO101 -0.2776 1610 CB 111.0430 95.4790 84.8850 C.3 101 PRO101 -0.0275 1611 CG 112.1240 96.5550 84.8030 C.3 101 PRO101 -0.0379 1612 CD 111.6460 97.5100 83.7080 C.3 101 PRO101 0.0071 1613 HA 109.1060 95.6100 83.8790 H 101 PRO101 0.0560 1614 HB1 111.2400 94.7190 84.1280 H 101 PRO101 0.0285 1615 HB2 111.0210 94.9730 85.8520 H 101 PRO101 0.0285 1616 HG1 113.1140 96.1450 84.6020 H 101 PRO101 0.0278 1617 HG2 112.1710 97.0890 85.7530 H 101 PRO101 0.0278 1618 HD1 111.9070 98.5460 83.9150 H 101 PRO101 0.0431 1619 HD2 111.9950 97.2130 82.7170 H 101 PRO101 0.0431 1620 N 108.0340 95.8980 86.2760 N.am 102 PRO102 -0.2316 1621 CA 107.1380 96.4070 87.3300 C.3 102 PRO102 0.0907 1622 C 107.7940 96.5900 88.6880 C.2 102 PRO102 0.2187 1623 O 107.2250 97.2860 89.5360 O.2 102 PRO102 -0.2778 1624 CB 106.0470 95.3230 87.4330 C.3 102 PRO102 -0.0276 1625 CG 106.2280 94.4270 86.2110 C.3 102 PRO102 -0.0379 1626 CD 107.7040 94.5410 85.8420 C.3 102 PRO102 0.0071 1627 HA 106.7240 97.3560 86.9850 H 102 PRO102 0.0559 1628 HB1 105.0470 95.7550 87.4810 H 102 PRO102 0.0285 1629 HB2 106.1700 94.7080 88.3270 H 102 PRO102 0.0285 1630 HG1 105.6240 94.8170 85.3900 H 102 PRO102 0.0278 1631 HG2 105.9170 93.3980 86.3900 H 102 PRO102 0.0278 1632 HD1 108.3330 93.8570 86.4140 H 102 PRO102 0.0431 1633 HD2 107.8430 94.3820 84.7760 H 102 PRO102 0.0431 1634 N 108.9440 95.9810 88.9370 N.am 103 GLY103 -0.2485 1635 CA 109.6510 96.1980 90.1790 C.3 103 GLY103 0.0765 1636 C 109.2720 95.2040 91.2580 C.2 103 GLY103 0.2156 1637 O 108.7730 94.1060 91.0020 O.2 103 GLY103 -0.2781 1638 H 109.3370 95.3480 88.2400 H 103 GLY103 0.1309 1639 HA1 109.4840 97.2210 90.5230 H 103 GLY103 0.0521 1640 HA2 110.7110 96.0880 89.9550 H 103 GLY103 0.0521 1641 N 109.5160 95.6170 92.4990 N.am 104 SER104 -0.2439 1642 CA 109.2850 94.7900 93.6730 C.3 104 SER104 0.1109 1643 C 108.3180 95.4820 94.6230 C.2 104 SER104 0.2209 1644 O 108.3540 96.7060 94.7790 O.2 104 SER104 -0.2777 1645 CB 110.6260 94.4600 94.3450 C.3 104 SER104 0.0681 1646 OG 111.3130 95.6420 94.7390 O.3 104 SER104 -0.3930 1647 H 109.8830 96.5590 92.6340 H 104 SER104 0.1312 1648 HA 108.8140 93.8580 93.3560 H 104 SER104 0.0580 1649 HB1 111.2290 93.8860 93.6310 H 104 SER104 0.0577 1650 HB2 110.4570 93.8240 95.2200 H 104 SER104 0.0577 1651 HG 112.2030 95.4480 95.0250 H 104 SER104 0.2095 1652 N 107.4500 94.6860 95.2510 N.am 105 ILE105 -0.2453 1653 CA 106.4310 95.2290 96.1450 C.3 105 ILE105 0.0903 1654 C 107.0330 95.5720 97.5050 C.2 105 ILE105 0.2189 1655 O 106.7370 96.6270 98.0840 O.2 105 ILE105 -0.2778 1656 CB 105.2540 94.2230 96.2300 C.3 105 ILE105 -0.0201 1657 CG1 104.5020 94.1640 94.8820 C.3 105 ILE105 -0.0514 1658 CG2 104.2780 94.5260 97.3820 C.3 105 ILE105 -0.0605 1659 CD1 103.3670 93.1310 94.8390 C.3 105 ILE105 -0.0650 1660 H 107.4990 93.6780 95.1030 H 105 ILE105 0.1312 1661 HA 106.0690 96.1650 95.7130 H 105 ILE105 0.0560 1662 HB 105.6750 93.2360 96.4240 H 105 ILE105 0.0318 1663 HG11 105.2040 93.9310 94.0800 H 105 ILE105 0.0266 1664 HG12 104.0950 95.1480 94.6470 H 105 ILE105 0.0266 1665 HG21 103.5040 93.7640 97.4550 H 105 ILE105 0.0233 1666 HG22 103.7840 95.4870 97.2500 H 105 ILE105 0.0233 1667 HG23 104.7850 94.5330 98.3450 H 105 ILE105 0.0233 1668 HD11 102.9500 93.0490 93.8350 H 105 ILE105 0.0230 1669 HD12 102.5450 93.4070 95.5000 H 105 ILE105 0.0230 1670 HD13 103.7210 92.1420 95.1310 H 105 ILE105 0.0230 1671 N 107.8880 94.6860 98.0290 N.am 106 ARG106 -0.2456 1672 CA 108.3620 94.8050 99.4070 C.3 106 ARG106 0.0879 1673 H12 107.4746 95.0023 100.0134 H 106 ARG106 0.0557 1674 C 109.2740 96.0110 99.5940 C.2 106 ARG106 0.2187 1675 O 109.2090 96.6850 100.6300 O.2 106 ARG106 -0.2778 1676 CB 108.9990 93.4946 99.9076 C.3 106 ARG106 -0.0258 1677 H11 108.2299 92.7221 99.9174 H 106 ARG106 0.0286 1678 H10 109.2954 93.6296 100.9493 H 106 ARG106 0.0286 1679 CG 110.2083 92.9950 99.0961 C.3 106 ARG106 -0.0154 1680 H7 109.8925 92.7140 98.0909 H 106 ARG106 0.0299 1681 H6 110.9276 93.8045 98.9732 H 106 ARG106 0.0299 1682 CD 110.9335 91.8160 99.7671 C.3 106 ARG106 0.1045 1683 H9 111.7992 91.5136 99.1717 H 106 ARG106 0.0711 1684 H8 111.2813 92.1050 100.7630 H 106 ARG106 0.0711 1685 NE 110.0440 90.6572 99.9007 N.pl3 106 ARG106 -0.4450 1686 H5 109.1231 90.7001 99.5160 H 106 ARG106 0.3153 1687 CZ 110.3877 89.5248 100.5159 C.cat 106 ARG106 0.5062 1688 NH1 111.5718 89.3716 101.0491 N.pl3 106 ARG106 -0.4573 1689 H2 112.2385 90.1105 100.9974 H 106 ARG106 0.3114 1690 H1 111.8145 88.5195 101.5086 H 106 ARG106 0.3114 1691 NH2 109.5267 88.5445 100.5906 N.pl3 106 ARG106 -0.4573 1692 H4 108.6174 88.6363 100.1910 H 106 ARG106 0.3114 1693 H3 109.7747 87.6937 101.0504 H 106 ARG106 0.3114 1694 H 108.2160 93.9100 97.4540 H 106 ARG106 0.1312 1695 N 110.1070 96.3110 98.5940 N.am 107 LEU107 -0.2456 1696 CA 110.9640 97.4910 98.6620 C.3 107 LEU107 0.0880 1697 C 110.1460 98.7760 98.6500 C.2 107 LEU107 0.2187 1698 O 110.4300 99.7020 99.4190 O.2 107 LEU107 -0.2778 1699 CB 111.9420 97.4600 97.4780 C.3 107 LEU107 -0.0266 1700 CG 112.9350 98.6380 97.4220 C.3 107 LEU107 -0.0449 1701 CD1 113.7920 98.7350 98.6910 C.3 107 LEU107 -0.0626 1702 CD2 113.8230 98.5260 96.1770 C.3 107 LEU107 -0.0626 1703 H 110.1450 95.7080 97.7720 H 107 LEU107 0.1312 1704 HA 111.5050 97.4360 99.6080 H 107 LEU107 0.0557 1705 HB1 111.3660 97.4430 96.5520 H 107 LEU107 0.0287 1706 HB2 112.5010 96.5240 97.5090 H 107 LEU107 0.0287 1707 HG 112.3700 99.5660 97.3300 H 107 LEU107 0.0296 1708 HD11 114.5170 99.5460 98.6100 H 107 LEU107 0.0232 1709 HD12 114.3430 97.8120 98.8680 H 107 LEU107 0.0232 1710 HD13 113.1830 98.9390 99.5720 H 107 LEU107 0.0232 1711 HD21 114.4990 99.3770 96.0990 H 107 LEU107 0.0232 1712 HD22 113.2210 98.4970 95.2680 H 107 LEU107 0.0232 1713 HD23 114.4280 97.6190 96.2050 H 107 LEU107 0.0232 1714 N 109.1100 98.8330 97.8060 N.am 108 ALA108 -0.2459 1715 CA 108.2610 100.0170 97.7310 C.3 108 ALA108 0.0850 1716 C 107.4760 100.2280 99.0200 C.2 108 ALA108 0.2184 1717 O 107.3970 101.3550 99.5180 O.2 108 ALA108 -0.2778 1718 CB 107.3000 99.8480 96.5490 C.3 108 ALA108 -0.0411 1719 H 108.9100 98.0340 97.2040 H 108 ALA108 0.1312 1720 HA 108.9110 100.8790 97.5740 H 108 ALA108 0.0554 1721 HB1 106.6610 100.7230 96.4280 H 108 ALA108 0.0249 1722 HB2 106.6580 98.9770 96.6810 H 108 ALA108 0.0249 1723 HB3 107.8510 99.7100 95.6180 H 108 ALA108 0.0249 1724 N 106.9310 99.1520 99.6000 N.am 109 LEU109 -0.2457 1725 CA 106.1830 99.2830 100.8500 C.3 109 LEU109 0.0880 1726 C 107.0870 99.6480 102.0220 C.2 109 LEU109 0.2187 1727 O 106.7130 100.4850 102.8550 O.2 109 LEU109 -0.2778 1728 CB 105.4350 97.9750 101.1510 C.3 109 LEU109 -0.0266 1729 CG 104.2570 97.7000 100.2010 C.3 109 LEU109 -0.0449 1730 CD1 103.7330 96.2750 100.4080 C.3 109 LEU109 -0.0626 1731 CD2 103.1180 98.7130 100.3940 C.3 109 LEU109 -0.0626 1732 H 107.0380 98.2350 99.1670 H 109 LEU109 0.1312 1733 HA 105.4790 100.1060 100.7230 H 109 LEU109 0.0557 1734 HB1 105.0530 97.9870 102.1740 H 109 LEU109 0.0287 1735 HB2 106.1460 97.1490 101.1040 H 109 LEU109 0.0287 1736 HG 104.6150 97.7720 99.1740 H 109 LEU109 0.0296 1737 HD11 102.9670 96.0330 99.6730 H 109 LEU109 0.0232 1738 HD12 103.2960 96.1570 101.4000 H 109 LEU109 0.0232 1739 HD13 104.5350 95.5440 100.3120 H 109 LEU109 0.0232 1740 HD21 102.2490 98.4510 99.7910 H 109 LEU109 0.0232 1741 HD22 103.4160 99.7210 100.1090 H 109 LEU109 0.0232 1742 HD23 102.7940 98.7390 101.4350 H 109 LEU109 0.0232 1743 N 108.2790 99.0440 102.1060 N.am 110 LEU110 -0.2456 1744 CA 109.1940 99.3640 103.1970 C.3 110 LEU110 0.0880 1745 C 109.7080 100.7920 103.0810 C.2 110 LEU110 0.2187 1746 O 109.7820 101.5120 104.0830 O.2 110 LEU110 -0.2778 1747 CB 110.3430 98.3400 103.1470 C.3 110 LEU110 -0.0266 1748 CG 111.3550 98.4190 104.3110 C.3 110 LEU110 -0.0449 1749 CD1 111.9740 97.0390 104.5730 C.3 110 LEU110 -0.0626 1750 CD2 112.4760 99.4410 104.0560 C.3 110 LEU110 -0.0626 1751 H 108.5490 98.3560 101.4030 H 110 LEU110 0.1312 1752 HA 108.6390 99.2670 104.1320 H 110 LEU110 0.0557 1753 HB1 110.8650 98.3990 102.1900 H 110 LEU110 0.0287 1754 HB2 109.8800 97.3530 103.1590 H 110 LEU110 0.0287 1755 HG 110.8210 98.7110 105.2160 H 110 LEU110 0.0296 1756 HD11 112.6710 97.0730 105.4110 H 110 LEU110 0.0232 1757 HD12 112.5190 96.6800 103.7000 H 110 LEU110 0.0232 1758 HD13 111.2070 96.3020 104.8150 H 110 LEU110 0.0232 1759 HD21 113.2160 99.4110 104.8570 H 110 LEU110 0.0232 1760 HD22 112.1090 100.4640 104.0090 H 110 LEU110 0.0232 1761 HD23 112.9950 99.2300 103.1210 H 110 LEU110 0.0232 1762 N 110.0350 101.2360 101.8660 N.am 111 LEU111 -0.2456 1763 CA 110.5430 102.5910 101.7000 C.3 111 LEU111 0.0880 1764 C 109.4260 103.6220 101.8240 C.2 111 LEU111 0.2187 1765 O 109.6900 104.7840 102.1520 O.2 111 LEU111 -0.2778 1766 CB 111.2070 102.6560 100.3140 C.3 111 LEU111 -0.0266 1767 CG 111.8670 104.0030 99.9610 C.3 111 LEU111 -0.0449 1768 CD1 112.9560 104.3930 100.9700 C.3 111 LEU111 -0.0626 1769 CD2 112.4420 103.9570 98.5400 C.3 111 LEU111 -0.0626 1770 H 109.9290 100.6270 101.0540 H 111 LEU111 0.1312 1771 HA 111.2780 102.7690 102.4860 H 111 LEU111 0.0557 1772 HB1 110.4630 102.4130 99.5530 H 111 LEU111 0.0287 1773 HB2 111.9590 101.8690 100.2510 H 111 LEU111 0.0287 1774 HG 111.1030 104.7810 99.9730 H 111 LEU111 0.0296 1775 HD11 113.4440 105.3230 100.6770 H 111 LEU111 0.0232 1776 HD12 113.7230 103.6220 101.0400 H 111 LEU111 0.0232 1777 HD13 112.5410 104.5480 101.9660 H 111 LEU111 0.0232 1778 HD21 112.8780 104.9160 98.2610 H 111 LEU111 0.0232 1779 HD22 111.6660 103.7210 97.8110 H 111 LEU111 0.0232 1780 HD23 113.2210 103.1980 98.4550 H 111 LEU111 0.0232 1781 N 108.1730 103.2140 101.6000 N.am 112 THR112 -0.2434 1782 CA 107.0470 104.1100 101.8340 C.3 112 THR112 0.1135 1783 C 106.7720 104.2720 103.3230 C.2 112 THR112 0.2212 1784 O 106.5730 105.3890 103.8060 O.2 112 THR112 -0.2777 1785 CB 105.7940 103.6200 101.0730 C.3 112 THR112 0.0763 1786 OG1 106.0060 103.7100 99.6760 O.3 112 THR112 -0.3900 1787 CG2 104.5410 104.4670 101.3460 C.3 112 THR112 -0.0370 1788 H 108.0030 102.2670 101.2620 H 112 THR112 0.1313 1789 HA 107.3210 105.0920 101.4440 H 112 THR112 0.0583 1790 HB 105.5660 102.5820 101.3460 H 112 THR112 0.0611 1791 HG1 106.7720 103.1990 99.4300 H 112 THR112 0.2098 1792 HG21 103.7100 104.1360 100.7240 H 112 THR112 0.0255 1793 HG22 104.7220 105.5160 101.1160 H 112 THR112 0.0255 1794 HG23 104.2180 104.3960 102.3850 H 112 THR112 0.0255 1795 N 106.7610 103.1690 104.0710 N.am 113 TRP113 -0.2453 1796 CA 106.4820 103.2380 105.5030 C.3 113 TRP113 0.0918 1797 C 107.7020 103.5820 106.3520 C.2 113 TRP113 0.2190 1798 O 107.5580 103.7310 107.5690 O.2 113 TRP113 -0.2778 1799 CB 105.8760 101.9030 105.9690 C.3 113 TRP113 -0.0021 1800 CG 104.4020 101.8520 105.6200 C.ar 113 TRP113 -0.0260 1801 CD1 103.8560 101.4380 104.4020 C.ar 113 TRP113 -0.0136 1802 CD2 103.2890 102.2210 106.4650 C.ar 113 TRP113 -0.0028 1803 NE1 102.5070 101.5180 104.4740 N.ar 113 TRP113 -0.2641 1804 CE2 102.1130 101.9760 105.7200 C.ar 113 TRP113 0.0269 1805 CE3 103.1970 102.7130 107.7400 C.ar 113 TRP113 -0.0528 1806 CZ2 100.8830 102.2240 106.2690 C.ar 113 TRP113 -0.0430 1807 CZ3 101.9440 102.9710 108.3030 C.ar 113 TRP113 -0.0611 1808 CH2 100.7850 102.7260 107.5660 C.ar 113 TRP113 -0.0602 1809 H 106.9500 102.2650 103.6380 H 113 TRP113 0.1312 1810 HA 105.7550 104.0360 105.6720 H 113 TRP113 0.0560 1811 HB1 105.9700 101.7730 107.0480 H 113 TRP113 0.0334 1812 HB2 106.3950 101.0620 105.5080 H 113 TRP113 0.0334 1813 HD1 104.4160 101.1080 103.5400 H 113 TRP113 0.0748 1814 HE1 101.8880 101.2870 103.7500 H 113 TRP113 0.1331 1815 HE3 104.0960 102.9030 108.3070 H 113 TRP113 0.0624 1816 HZ2 99.9920 102.0390 105.6870 H 113 TRP113 0.0633 1817 HZ3 101.8680 103.3590 109.3070 H 113 TRP113 0.0618 1818 HH2 99.8130 102.9230 107.9930 H 113 TRP113 0.0618 1819 N 108.8930 103.7010 105.7610 N.am 114 ALA114 -0.2459 1820 CA 110.0630 104.0970 106.5390 C.3 114 ALA114 0.0850 1821 C 110.2100 105.6090 106.6480 C.2 114 ALA114 0.2182 1822 O 110.8340 106.0950 107.5970 O.2 114 ALA114 -0.2778 1823 CB 111.3110 103.5070 105.8700 C.3 114 ALA114 -0.0411 1824 H 108.9860 103.5150 104.7630 H 114 ALA114 0.1312 1825 HA 109.9730 103.6890 107.5480 H 114 ALA114 0.0554 1826 HB1 112.2210 103.7980 106.3950 H 114 ALA114 0.0249 1827 HB2 111.3990 103.8360 104.8330 H 114 ALA114 0.0249 1828 HB3 111.2710 102.4180 105.8710 H 114 ALA114 0.0249 1829 N 109.6730 106.3590 105.6890 N.am 115 GLY115 -0.2485 1830 CA 109.7310 107.8060 105.6940 C.3 115 GLY115 0.0767 1831 C 108.9980 108.4850 106.8400 C.2 115 GLY115 0.2182 1832 O 109.5980 109.2310 107.6240 O.2 115 GLY115 -0.2779 1833 H 109.1990 105.8940 104.9150 H 115 GLY115 0.1309 1834 HA1 109.3360 108.1510 104.7400 H 115 GLY115 0.0521 1835 HA2 110.7840 108.0880 105.7340 H 115 GLY115 0.0521 1836 N 107.6740 108.2810 106.9230 N.am 116 PRO116 -0.2318 1837 CA 106.9060 108.8030 108.0680 C.3 116 PRO116 0.0907 1838 C 107.3770 108.3380 109.4320 C.2 116 PRO116 0.2189 1839 O 107.2950 109.1260 110.3800 O.2 116 PRO116 -0.2778 1840 CB 105.4960 108.2420 107.7970 C.3 116 PRO116 -0.0276 1841 CG 105.4510 107.9560 106.2980 C.3 116 PRO116 -0.0379 1842 CD 106.8780 107.5560 105.9390 C.3 116 PRO116 0.0071 1843 HA 106.9290 109.8920 108.0100 H 116 PRO116 0.0559 1844 HB1 104.7000 108.9060 108.1330 H 116 PRO116 0.0285 1845 HB2 105.3440 107.2920 108.3130 H 116 PRO116 0.0285 1846 HG1 105.1720 108.8610 105.7580 H 116 PRO116 0.0278 1847 HG2 104.7410 107.1720 106.0400 H 116 PRO116 0.0278 1848 HD1 107.0520 106.4910 106.0990 H 116 PRO116 0.0431 1849 HD2 107.1510 107.8480 104.9240 H 116 PRO116 0.0431 1850 N 107.8820 107.1080 109.5570 N.am 117 LEU117 -0.2456 1851 CA 108.3200 106.6040 110.8570 C.3 117 LEU117 0.0880 1852 C 109.5310 107.3740 111.3700 C.2 117 LEU117 0.2187 1853 O 109.5220 107.8880 112.4970 O.2 117 LEU117 -0.2778 1854 CB 108.6300 105.1050 110.7050 C.3 117 LEU117 -0.0266 1855 CG 109.0340 104.3970 112.0110 C.3 117 LEU117 -0.0449 1856 CD1 107.9300 104.4810 113.0740 C.3 117 LEU117 -0.0626 1857 CD2 109.4040 102.9360 111.7320 C.3 117 LEU117 -0.0626 1858 H 107.9630 106.5120 108.7330 H 117 LEU117 0.1312 1859 HA 107.4970 106.7610 111.5540 H 117 LEU117 0.0557 1860 HB1 109.4200 104.9760 109.9630 H 117 LEU117 0.0287 1861 HB2 107.7570 104.6020 110.2870 H 117 LEU117 0.0287 1862 HG 109.9230 104.8860 112.4120 H 117 LEU117 0.0296 1863 HD11 108.2080 103.9270 113.9700 H 117 LEU117 0.0232 1864 HD12 106.9920 104.0670 112.7020 H 117 LEU117 0.0232 1865 HD13 107.7450 105.5110 113.3790 H 117 LEU117 0.0232 1866 HD21 109.7290 102.4320 112.6430 H 117 LEU117 0.0232 1867 HD22 110.2160 102.8680 111.0080 H 117 LEU117 0.0232 1868 HD23 108.5530 102.3840 111.3310 H 117 LEU117 0.0232 1869 N 110.5570 107.5100 110.5270 N.am 118 LEU118 -0.2456 1870 CA 111.7350 108.2930 110.8810 C.3 118 LEU118 0.0880 1871 C 111.3970 109.7660 111.0690 C.2 118 LEU118 0.2187 1872 O 111.8910 110.4130 112.0050 O.2 118 LEU118 -0.2778 1873 CB 112.7950 108.1030 109.7830 C.3 118 LEU118 -0.0266 1874 CG 114.1100 108.8730 110.0170 C.3 118 LEU118 -0.0449 1875 CD1 114.7710 108.5010 111.3520 C.3 118 LEU118 -0.0626 1876 CD2 115.0800 108.6410 108.8520 C.3 118 LEU118 -0.0626 1877 H 110.5160 107.0560 109.6150 H 118 LEU118 0.1312 1878 HA 112.0960 107.8980 111.8310 H 118 LEU118 0.0557 1879 HB1 112.3690 108.4020 108.8230 H 118 LEU118 0.0287 1880 HB2 113.0140 107.0390 109.6900 H 118 LEU118 0.0287 1881 HG 113.8880 109.9410 110.0410 H 118 LEU118 0.0296 1882 HD11 115.7200 109.0220 111.4750 H 118 LEU118 0.0232 1883 HD12 114.9680 107.4310 111.4100 H 118 LEU118 0.0232 1884 HD13 114.1440 108.7750 112.2010 H 118 LEU118 0.0232 1885 HD21 115.9970 109.2160 108.9840 H 118 LEU118 0.0232 1886 HD22 114.6330 108.9440 107.9040 H 118 LEU118 0.0232 1887 HD23 115.3540 107.5890 108.7700 H 118 LEU118 0.0232 1888 N 110.5380 110.3090 110.2030 N.am 119 PHE119 -0.2453 1889 CA 110.2670 111.7410 110.2460 C.3 119 PHE119 0.0917 1890 C 109.4350 112.1180 111.4680 C.2 119 PHE119 0.2190 1891 O 109.6140 113.2020 112.0330 O.2 119 PHE119 -0.2778 1892 CB 109.5410 112.1410 108.9490 C.3 119 PHE119 -0.0036 1893 CG 109.4340 113.6360 108.7880 C.ar 119 PHE119 -0.0454 1894 CD1 110.4440 114.3520 108.1500 C.ar 119 PHE119 -0.0585 1895 CD2 108.3410 114.3260 109.3020 C.ar 119 PHE119 -0.0585 1896 CE1 110.3660 115.7340 108.0340 C.ar 119 PHE119 -0.0615 1897 CE2 108.2680 115.7080 109.2000 C.ar 119 PHE119 -0.0615 1898 CZ 109.2800 116.4150 108.5650 C.ar 119 PHE119 -0.0617 1899 H 110.0710 109.7220 109.5110 H 119 PHE119 0.1312 1900 HA 111.2270 112.2570 110.3100 H 119 PHE119 0.0560 1901 HB1 108.5460 111.6950 108.9120 H 119 PHE119 0.0333 1902 HB2 110.0830 111.7420 108.0910 H 119 PHE119 0.0333 1903 HD1 111.3010 113.8320 107.7490 H 119 PHE119 0.0620 1904 HD2 107.5530 113.7980 109.8210 H 119 PHE119 0.0620 1905 HE1 111.1540 116.2840 107.5400 H 119 PHE119 0.0618 1906 HE2 107.4300 116.2290 109.6410 H 119 PHE119 0.0618 1907 HZ 109.2230 117.4910 108.4940 H 119 PHE119 0.0618 1908 N 108.5200 111.2430 111.8940 N.am 120 ALA120 -0.2459 1909 CA 107.8250 111.4570 113.1570 C.3 120 ALA120 0.0850 1910 C 108.7220 111.1590 114.3510 C.2 120 ALA120 0.2185 1911 O 108.4630 111.6560 115.4510 O.2 120 ALA120 -0.2778 1912 CB 106.5760 110.5680 113.1840 C.3 120 ALA120 -0.0411 1913 H 108.3060 110.4190 111.3320 H 120 ALA120 0.1312 1914 HA 107.5280 112.5070 113.2030 H 120 ALA120 0.0554 1915 HB1 105.9940 110.7280 114.0930 H 120 ALA120 0.0249 1916 HB2 106.8390 109.5110 113.1290 H 120 ALA120 0.0249 1917 HB3 105.9270 110.7910 112.3370 H 120 ALA120 0.0249 1918 N 109.7550 110.3290 114.1720 N.am 121 SER121 -0.2436 1919 CA 110.7000 110.0940 115.2570 C.3 121 SER121 0.1109 1920 C 111.6580 111.2610 115.4680 C.2 121 SER121 0.2209 1921 O 112.2710 111.3420 116.5370 O.2 121 SER121 -0.2777 1922 CB 111.5020 108.8130 114.9850 C.3 121 SER121 0.0681 1923 OG 110.6480 107.6820 115.1010 O.3 121 SER121 -0.3930 1924 H 109.8820 109.8600 113.2750 H 121 SER121 0.1312 1925 HA 110.1280 109.9620 116.1770 H 121 SER121 0.0580 1926 HB1 112.3130 108.7170 115.7140 H 121 SER121 0.0577 1927 HB2 111.9510 108.8710 113.9880 H 121 SER121 0.0577 1928 HG 111.0710 106.8890 114.7830 H 121 SER121 0.2095 1929 N 111.8340 112.1140 114.4560 N.am 122 LEU122 -0.2456 1930 CA 112.7030 113.2910 114.5730 C.3 122 LEU122 0.0883 1931 C 112.4420 114.2290 115.7600 C.2 122 LEU122 0.2214 1932 O 113.4300 114.7400 116.3140 O.2 122 LEU122 -0.2776 1933 CB 112.6290 114.0570 113.2320 C.3 122 LEU122 -0.0266 1934 CG 113.9700 114.5940 112.6970 C.3 122 LEU122 -0.0449 1935 CD1 114.6710 115.5410 113.6770 C.3 122 LEU122 -0.0626 1936 CD2 114.9010 113.4600 112.2450 C.3 122 LEU122 -0.0626 1937 H 111.3500 111.9430 113.5750 H 122 LEU122 0.1312 1938 HA 113.7020 112.8790 114.7110 H 122 LEU122 0.0557 1939 HB1 111.9150 114.8780 113.3020 H 122 LEU122 0.0287 1940 HB2 112.2160 113.4000 112.4650 H 122 LEU122 0.0287 1941 HG 113.7300 115.1790 111.8080 H 122 LEU122 0.0296 1942 HD11 115.4880 116.0740 113.1910 H 122 LEU122 0.0232 1943 HD12 115.0940 114.9980 114.5220 H 122 LEU122 0.0232 1944 HD13 113.9760 116.2830 114.0670 H 122 LEU122 0.0232 1945 HD21 115.7960 113.8590 111.7660 H 122 LEU122 0.0232 1946 HD22 114.4040 112.8070 111.5270 H 122 LEU122 0.0232 1947 HD23 115.2250 112.8450 113.0840 H 122 LEU122 0.0232 1948 N 111.1910 114.5350 116.1980 N.am 123 PRO123 -0.2316 1949 CA 111.0560 115.2500 117.4780 C.3 123 PRO123 0.0907 1950 C 111.4500 114.4070 118.6770 C.2 123 PRO123 0.2189 1951 O 111.9900 114.9260 119.6600 O.2 123 PRO123 -0.2778 1952 CB 109.5660 115.6400 117.4890 C.3 123 PRO123 -0.0276 1953 CG 109.1080 115.4760 116.0360 C.3 123 PRO123 -0.0379 1954 CD 109.9420 114.3070 115.5210 C.3 123 PRO123 0.0071 1955 HA 111.6740 116.1380 117.4340 H 123 PRO123 0.0559 1956 HB1 109.4030 116.6500 117.8660 H 123 PRO123 0.0285 1957 HB2 108.9880 114.9610 118.1180 H 123 PRO123 0.0285 1958 HG1 109.3570 116.3760 115.4740 H 123 PRO123 0.0278 1959 HG2 108.0370 115.3090 115.9310 H 123 PRO123 0.0278 1960 HD1 109.5990 113.3820 115.9450 H 123 PRO123 0.0431 1961 HD2 110.0550 114.2600 114.4380 H 123 PRO123 0.0431 1962 N 111.1630 113.1050 118.6090 N.am 124 ALA124 -0.2459 1963 CA 111.3930 112.2210 119.7490 C.3 124 ALA124 0.0850 1964 C 112.8770 112.0260 120.0260 C.2 124 ALA124 0.2184 1965 O 113.2860 111.9470 121.1900 O.2 124 ALA124 -0.2778 1966 CB 110.7550 110.8620 119.4330 C.3 124 ALA124 -0.0411 1967 H 110.7770 112.7210 117.7470 H 124 ALA124 0.1312 1968 HA 110.9300 112.6730 120.6240 H 124 ALA124 0.0554 1969 HB1 110.7750 110.2040 120.3020 H 124 ALA124 0.0249 1970 HB2 111.2700 110.3520 118.6180 H 124 ALA124 0.0249 1971 HB3 109.7170 110.9800 119.1240 H 124 ALA124 0.0249 1972 N 113.6950 111.9300 118.9750 N.am 125 LEU125 -0.2457 1973 CA 115.1130 111.6460 119.1710 C.3 125 LEU125 0.0880 1974 C 115.8480 112.8420 119.7670 C.2 125 LEU125 0.2185 1975 O 116.4020 112.7540 120.8680 O.2 125 LEU125 -0.2778 1976 CB 115.7010 111.2630 117.7990 C.3 125 LEU125 -0.0266 1977 CG 115.1340 109.9470 117.2280 C.3 125 LEU125 -0.0449 1978 CD1 115.3430 109.8710 115.7090 C.3 125 LEU125 -0.0626 1979 CD2 115.7430 108.7230 117.9230 C.3 125 LEU125 -0.0626 1980 H 113.3280 112.0560 118.0320 H 125 LEU125 0.1312 1981 HA 115.1970 110.8140 119.8720 H 125 LEU125 0.0557 1982 HB1 116.7880 111.1900 117.8550 H 125 LEU125 0.0287 1983 HB2 115.4900 112.0730 117.0970 H 125 LEU125 0.0287 1984 HG 114.0590 109.9150 117.3980 H 125 LEU125 0.0296 1985 HD11 114.9210 108.9520 115.3000 H 125 LEU125 0.0232 1986 HD12 116.4030 109.8960 115.4540 H 125 LEU125 0.0232 1987 HD13 114.8570 110.7060 115.2050 H 125 LEU125 0.0232 1988 HD21 115.3290 107.7990 117.5200 H 125 LEU125 0.0232 1989 HD22 115.5410 108.7320 118.9940 H 125 LEU125 0.0232 1990 HD23 116.8250 108.6900 117.7870 H 125 LEU125 0.0232 1991 N 115.8580 113.9720 119.0660 N.am 126 GLY126 -0.2485 1992 CA 116.6610 115.0830 119.5390 C.3 126 GLY126 0.0765 1993 C 115.9600 116.4020 119.7810 C.2 126 GLY126 0.2155 1994 O 116.4100 117.1900 120.6180 O.2 126 GLY126 -0.2781 1995 H 115.3100 114.0560 118.2100 H 126 GLY126 0.1309 1996 HA1 117.4080 115.2500 118.7640 H 126 GLY126 0.0521 1997 HA2 117.2120 114.8330 120.4470 H 126 GLY126 0.0521 1998 N 114.8550 116.6590 119.0790 N.am 127 TRP127 -0.2456 1999 CA 114.1730 117.9550 119.1610 C.3 127 TRP127 0.0918 2000 C 113.1280 117.9260 120.2760 C.2 127 TRP127 0.2190 2001 O 111.9190 117.8510 120.0570 O.2 127 TRP127 -0.2778 2002 CB 113.6580 118.3940 117.7900 C.3 127 TRP127 -0.0021 2003 CG 114.7930 118.7240 116.8290 C.ar 127 TRP127 -0.0260 2004 CD1 116.1580 118.8460 117.1280 C.ar 127 TRP127 -0.0136 2005 CD2 114.6730 119.0010 115.4170 C.ar 127 TRP127 -0.0028 2006 NE1 116.8450 119.1580 116.0040 N.ar 127 TRP127 -0.2641 2007 CE2 115.9750 119.2670 114.9300 C.ar 127 TRP127 0.0269 2008 CE3 113.6060 119.0450 114.5610 C.ar 127 TRP127 -0.0528 2009 CZ2 116.1700 119.5640 113.6090 C.ar 127 TRP127 -0.0430 2010 CZ3 113.8000 119.3560 113.2130 C.ar 127 TRP127 -0.0611 2011 CH2 115.0840 119.6140 112.7360 C.ar 127 TRP127 -0.0602 2012 H 114.4750 115.9350 118.4690 H 127 TRP127 0.1312 2013 HA 114.8980 118.7000 119.4930 H 127 TRP127 0.0560 2014 HB1 113.0520 119.2790 117.9410 H 127 TRP127 0.0334 2015 HB2 113.0250 117.6380 117.3410 H 127 TRP127 0.0334 2016 HD1 116.6160 118.7120 118.0970 H 127 TRP127 0.0748 2017 HE1 117.8150 119.2920 115.9550 H 127 TRP127 0.1331 2018 HE3 112.6150 118.8290 114.9340 H 127 TRP127 0.0624 2019 HZ2 117.1680 119.7630 113.2470 H 127 TRP127 0.0633 2020 HZ3 112.9630 119.3980 112.5330 H 127 TRP127 0.0618 2021 HH2 115.2370 119.8500 111.6930 H 127 TRP127 0.0618 2022 N 113.6370 117.9820 121.5050 N.am 128 ASN128 -0.2452 2023 CA 112.7780 117.9350 122.6800 C.3 128 ASN128 0.0957 2024 C 112.0160 119.2460 122.8840 C.2 128 ASN128 0.2191 2025 O 110.7820 119.2330 122.9820 O.2 128 ASN128 -0.2778 2026 CB 113.6090 117.4620 123.8880 C.3 128 ASN128 0.0446 2027 CG 114.6280 118.5060 124.3780 C.2 128 ASN128 0.2000 2028 OD1 115.4200 119.0400 123.6150 O.2 128 ASN128 -0.2797 2029 ND2 114.5580 118.7680 125.6920 N.am 128 ASN128 -0.2723 2030 H 114.6470 118.0590 121.6260 H 128 ASN128 0.1312 2031 HA 112.0270 117.1670 122.4800 H 128 ASN128 0.0562 2032 HB1 114.1670 116.5680 123.6090 H 128 ASN128 0.0375 2033 HB2 112.9630 117.1590 124.7070 H 128 ASN128 0.0375 2034 HD21 115.1880 119.4350 126.0880 H 128 ASN128 0.1266 2035 HD22 113.8930 118.3180 126.2860 H 128 ASN128 0.1266 2036 N 112.7310 120.3790 122.8980 N.am 129 HIS129 -0.2453 2037 CA 112.2190 121.7480 123.0140 C.3 129 HIS129 0.0932 2038 C 111.2650 121.9520 124.1990 C.2 129 HIS129 0.2190 2039 O 110.2080 122.5720 124.0570 O.2 129 HIS129 -0.2778 2040 CB 111.5860 122.0820 121.6480 C.3 129 HIS129 0.0146 2041 CG 111.3690 123.5650 121.4670 C.ar 129 HIS129 0.0551 2042 ND1 112.3520 124.4540 121.2060 N.ar 129 HIS129 -0.2469 2043 CD2 110.1420 124.2440 121.4440 C.ar 129 HIS129 0.0047 2044 CE1 111.7420 125.6420 121.0570 C.ar 129 HIS129 0.0737 2045 NE2 110.4070 125.5460 121.1900 N.ar 129 HIS129 -0.2539 2046 H 113.7430 120.2780 122.8190 H 129 HIS129 0.1312 2047 HA 113.0970 122.3720 123.1810 H 129 HIS129 0.0561 2048 HB1 110.6460 121.5510 121.5060 H 129 HIS129 0.0348 2049 HB2 112.2460 121.7480 120.8460 H 129 HIS129 0.0348 2050 HD2 109.1790 123.7840 121.6010 H 129 HIS129 0.0764 2051 HE1 112.2660 126.5640 120.8490 H 129 HIS129 0.0963 2052 HE2 109.7500 126.2700 121.1170 H 129 HIS129 0.1339 2053 N 111.6140 121.4480 125.3830 N.am 130 TRP130 -0.2453 2054 CA 110.7020 121.5810 126.5120 C.3 130 TRP130 0.0918 2055 C 111.4870 121.7060 127.8100 C.2 130 TRP130 0.2191 2056 O 112.6290 121.2500 127.9120 O.2 130 TRP130 -0.2778 2057 CB 109.6780 120.4250 126.5480 C.3 130 TRP130 -0.0021 2058 CG 110.2930 119.1740 127.1400 C.ar 130 TRP130 -0.0260 2059 CD1 111.3280 118.4370 126.5710 C.ar 130 TRP130 -0.0136 2060 CD2 110.0030 118.5560 128.4100 C.ar 130 TRP130 -0.0028 2061 NE1 111.7110 117.4570 127.4240 N.ar 130 TRP130 -0.2641 2062 CE2 110.9320 117.5010 128.5720 C.ar 130 TRP130 0.0269 2063 CE3 109.0810 118.8140 129.3880 C.ar 130 TRP130 -0.0528 2064 CZ2 110.9230 116.7520 129.7170 C.ar 130 TRP130 -0.0430 2065 CZ3 109.0470 118.0280 130.5390 C.ar 130 TRP130 -0.0611 2066 CH2 109.9840 117.0100 130.7150 C.ar 130 TRP130 -0.0602 2067 H 112.5100 120.9740 125.4970 H 130 TRP130 0.1312 2068 HA 110.1650 122.5250 126.3950 H 130 TRP130 0.0560 2069 HB1 109.3110 120.2090 125.5440 H 130 TRP130 0.0334 2070 HB2 108.8100 120.7150 127.1420 H 130 TRP130 0.0334 2071 HD1 111.7570 118.6690 125.6100 H 130 TRP130 0.0748 2072 HE1 112.4290 116.8110 127.2570 H 130 TRP130 0.1331 2073 HE3 108.3780 119.6250 129.2660 H 130 TRP130 0.0624 2074 HZ2 111.6390 115.9520 129.8350 H 130 TRP130 0.0633 2075 HZ3 108.3080 118.2240 131.3020 H 130 TRP130 0.0618 2076 HH2 109.9730 116.4120 131.6150 H 130 TRP130 0.0618 2077 N 110.8570 122.3380 128.8030 N.am 131 THR131 -0.2434 2078 CA 111.3550 122.4800 130.1620 C.3 131 THR131 0.1137 2079 C 110.3880 121.8170 131.1450 C.2 131 THR131 0.2239 2080 O 109.1780 121.7850 130.8890 O.2 131 THR131 -0.2775 2081 CB 111.5520 123.9760 130.4820 C.3 131 THR131 0.0763 2082 OG1 112.0960 124.1020 131.7870 O.3 131 THR131 -0.3900 2083 CG2 110.2540 124.7970 130.3680 C.3 131 THR131 -0.0370 2084 H 109.9510 122.7560 128.5910 H 131 THR131 0.1313 2085 HA 112.3210 121.9870 130.1820 H 131 THR131 0.0583 2086 HB 112.2740 124.3560 129.7490 H 131 THR131 0.0611 2087 HG1 112.2990 125.0120 131.9840 H 131 THR131 0.2098 2088 HG21 110.4380 125.8630 130.4990 H 131 THR131 0.0255 2089 HG22 109.5350 124.4920 131.1260 H 131 THR131 0.0255 2090 HG23 109.7830 124.6740 129.3930 H 131 THR131 0.0255 2091 N 110.8930 121.2220 132.2350 N.am 132 PRO132 -0.2315 2092 CA 109.9960 120.4750 133.1390 C.3 132 PRO132 0.0907 2093 C 109.0000 121.3380 133.8980 C.2 132 PRO132 0.2187 2094 O 107.9220 120.8470 134.2590 O.2 132 PRO132 -0.2778 2095 CB 110.9620 119.7980 134.1290 C.3 132 PRO132 -0.0276 2096 CG 112.3480 119.9120 133.5010 C.3 132 PRO132 -0.0379 2097 CD 112.2980 121.1720 132.6410 C.3 132 PRO132 0.0071 2098 HA 109.4620 119.7400 132.5430 H 132 PRO132 0.0559 2099 HB1 110.6860 118.7630 134.3290 H 132 PRO132 0.0285 2100 HB2 110.9830 120.3160 135.0900 H 132 PRO132 0.0285 2101 HG1 112.5210 119.0480 132.8580 H 132 PRO132 0.0278 2102 HG2 113.1480 119.9390 134.2410 H 132 PRO132 0.0278 2103 HD1 112.5070 122.0760 133.2140 H 132 PRO132 0.0431 2104 HD2 112.9820 121.0800 131.8020 H 132 PRO132 0.0431 2105 N 109.3380 122.5990 134.1760 N.am 133 GLY133 -0.2485 2106 CA 108.4330 123.4490 134.9340 C.3 133 GLY133 0.0765 2107 C 107.1840 123.8350 134.1620 C.2 133 GLY133 0.2155 2108 O 106.0860 123.8740 134.7230 O.2 133 GLY133 -0.2781 2109 H 110.2330 122.9680 133.8560 H 133 GLY133 0.1309 2110 HA1 108.9870 124.3510 135.1930 H 133 GLY133 0.0521 2111 HA2 108.1620 122.9340 135.8570 H 133 GLY133 0.0521 2112 N 107.3300 124.1250 132.8730 N.am 134 ALA134 -0.2462 2113 CA 106.1860 124.4810 132.0480 C.3 134 ALA134 0.0850 2114 C 105.4410 123.2330 131.5860 C.2 134 ALA134 0.2184 2115 O 106.0030 122.1360 131.5080 O.2 134 ALA134 -0.2778 2116 CB 106.6900 125.2600 130.8270 C.3 134 ALA134 -0.0411 2117 H 108.2600 124.0970 132.4550 H 134 ALA134 0.1311 2118 HA 105.5180 125.1100 132.6390 H 134 ALA134 0.0554 2119 HB1 105.8630 125.6050 130.2050 H 134 ALA134 0.0249 2120 HB2 107.3410 124.6450 130.2050 H 134 ALA134 0.0249 2121 HB3 107.2590 126.1380 131.1350 H 134 ALA134 0.0249 2122 N 104.1570 123.4150 131.2860 N.am 135 ASN135 -0.2452 2123 CA 103.2810 122.3180 130.9050 C.3 135 ASN135 0.0957 2124 C 103.6150 121.8090 129.5040 C.2 135 ASN135 0.2192 2125 O 104.2690 122.4850 128.7070 O.2 135 ASN135 -0.2778 2126 CB 101.8280 122.8300 130.9060 C.3 135 ASN135 0.0446 2127 CG 101.4410 123.4000 132.2780 C.2 135 ASN135 0.2000 2128 OD1 101.6290 122.7700 133.3090 O.2 135 ASN135 -0.2797 2129 ND2 100.8990 124.6260 132.2350 N.am 135 ASN135 -0.2723 2130 H 103.7730 124.3590 131.3250 H 135 ASN135 0.1312 2131 HA 103.4210 121.5090 131.6240 H 135 ASN135 0.0562 2132 HB1 101.1320 122.0300 130.6690 H 135 ASN135 0.0375 2133 HB2 101.6910 123.6030 130.1480 H 135 ASN135 0.0375 2134 HD21 100.6340 125.0900 133.0800 H 135 ASN135 0.1266 2135 HD22 100.7410 125.0900 131.3650 H 135 ASN135 0.1266 2136 N 103.1540 120.5950 129.2090 N.am 136 CYS136 -0.2448 2137 CA 103.3540 120.0110 127.8890 C.3 136 CYS136 0.0975 2138 C 102.2740 120.5120 126.9400 C.2 136 CYS136 0.2196 2139 O 101.0900 120.5330 127.2900 O.2 136 CYS136 -0.2778 2140 CB 103.2810 118.4780 127.9570 C.3 136 CYS136 0.0279 2141 SG 103.6050 117.7170 126.3400 S.3 136 CYS136 -0.0910 2142 H 102.6510 120.0640 129.9200 H 136 CYS136 0.1312 2143 HA 104.3370 120.3160 127.5210 H 136 CYS136 0.0566 2144 HB1 104.0120 118.1000 128.6720 H 136 CYS136 0.0405 2145 HB2 102.3010 118.1580 128.3130 H 136 CYS136 0.0405 2146 N 102.6850 120.9200 125.7420 N.am 137 SER137 -0.2436 2147 CA 101.7630 121.4560 124.7490 C.3 137 SER137 0.1109 2148 C 102.3810 121.2800 123.3700 C.2 137 SER137 0.2210 2149 O 103.5220 120.8320 123.2320 O.2 137 SER137 -0.2777 2150 CB 101.4850 122.9380 125.0560 C.3 137 SER137 0.0681 2151 OG 100.4490 123.4350 124.2190 O.3 137 SER137 -0.3930 2152 H 103.6760 120.8560 125.5110 H 137 SER137 0.1312 2153 HA 100.8420 120.8700 124.7830 H 137 SER137 0.0580 2154 HB1 102.4050 123.5210 124.9250 H 137 SER137 0.0577 2155 HB2 101.1800 123.0320 126.1040 H 137 SER137 0.0577 2156 HG 100.2920 124.3650 124.3630 H 137 SER137 0.2095 2157 N 101.6030 121.6450 122.3440 N.am 138 SER138 -0.2435 2158 CA 102.0540 121.5030 120.9620 C.3 138 SER138 0.1109 2159 C 103.1970 122.4500 120.6300 C.2 138 SER138 0.2209 2160 O 103.9780 122.1720 119.7130 O.2 138 SER138 -0.2777 2161 CB 100.8830 121.8390 120.0230 C.3 138 SER138 0.0681 2162 OG 99.7600 121.0170 120.3130 O.3 138 SER138 -0.3930 2163 H 100.6770 122.0300 122.5310 H 138 SER138 0.1312 2164 HA 102.3810 120.4720 120.8180 H 138 SER138 0.0580 2165 HB1 101.1890 121.6870 118.9820 H 138 SER138 0.0577 2166 HB2 100.6160 122.8970 120.1410 H 138 SER138 0.0577 2167 HG 98.9960 121.2840 119.8070 H 138 SER138 0.2095 2168 N 103.3110 123.5680 121.3480 N.am 139 GLN139 -0.2456 2169 CA 104.4590 124.4430 121.1510 C.3 139 GLN139 0.0882 2170 C 105.7250 123.8310 121.7330 C.2 139 GLN139 0.2187 2171 O 106.8300 124.1300 121.2670 O.2 139 GLN139 -0.2778 2172 CB 104.1460 125.8650 121.6490 C.3 139 GLN139 -0.0210 2173 CG 103.3530 126.7070 120.6220 C.3 139 GLN139 0.0225 2174 CD 101.9260 126.1890 120.3600 C.2 139 GLN139 0.1981 2175 OE1 101.7140 125.1760 119.7080 O.2 139 GLN139 -0.2798 2176 NE2 100.9630 126.9470 120.9020 N.am 139 GLN139 -0.2724 2177 H 102.5960 123.8100 122.0340 H 139 GLN139 0.1312 2178 HA 104.6380 124.5040 120.0760 H 139 GLN139 0.0557 2179 HB1 105.0840 126.3900 121.8380 H 139 GLN139 0.0289 2180 HB2 103.6250 125.8260 122.6060 H 139 GLN139 0.0289 2181 HG1 103.8770 126.7310 119.6670 H 139 GLN139 0.0356 2182 HG2 103.2900 127.7420 120.9610 H 139 GLN139 0.0356 2183 HE21 100.0080 126.6840 120.7660 H 139 GLN139 0.1266 2184 HE22 101.1750 127.7730 121.4220 H 139 GLN139 0.1266 2185 N 105.5860 122.9780 122.7490 N.am 140 ALA140 -0.2459 2186 CA 106.7500 122.3690 123.3810 C.3 140 ALA140 0.0850 2187 C 107.2570 121.1630 122.6010 C.2 140 ALA140 0.2184 2188 O 108.4700 120.9820 122.4580 O.2 140 ALA140 -0.2778 2189 CB 106.3740 121.9490 124.8070 C.3 140 ALA140 -0.0411 2190 H 104.6520 122.7490 123.0890 H 140 ALA140 0.1312 2191 HA 107.5500 123.1110 123.4190 H 140 ALA140 0.0554 2192 HB1 107.2350 121.5400 125.3360 H 140 ALA140 0.0249 2193 HB2 105.5890 121.1930 124.8090 H 140 ALA140 0.0249 2194 HB3 106.0120 122.8030 125.3800 H 140 ALA140 0.0249 2195 N 106.3540 120.3260 122.0920 N.am 141 ILE141 -0.2454 2196 CA 106.7770 119.0940 121.4370 C.3 141 ILE141 0.0903 2197 C 107.3430 119.3770 120.0510 C.2 141 ILE141 0.2189 2198 O 108.4370 118.9150 119.7120 O.2 141 ILE141 -0.2778 2199 CB 105.6180 118.0710 121.3990 C.3 141 ILE141 -0.0201 2200 CG1 105.1430 117.6820 122.8140 C.3 141 ILE141 -0.0514 2201 CG2 105.9600 116.8120 120.5760 C.3 141 ILE141 -0.0605 2202 CD1 106.1960 116.9630 123.6710 C.3 141 ILE141 -0.0650 2203 H 105.3610 120.5480 122.1610 H 141 ILE141 0.1312 2204 HA 107.6010 118.6790 122.0200 H 141 ILE141 0.0560 2205 HB 104.7730 118.5520 120.9030 H 141 ILE141 0.0318 2206 HG11 104.2800 117.0280 122.7200 H 141 ILE141 0.0266 2207 HG12 104.7890 118.5650 123.3470 H 141 ILE141 0.0266 2208 HG21 105.1650 116.0700 120.6370 H 141 ILE141 0.0233 2209 HG22 106.8800 116.3430 120.9280 H 141 ILE141 0.0233 2210 HG23 106.0960 117.0470 119.5200 H 141 ILE141 0.0233 2211 HD11 105.7760 116.6730 124.6340 H 141 ILE141 0.0230 2212 HD12 107.0570 117.6010 123.8710 H 141 ILE141 0.0230 2213 HD13 106.5530 116.0540 123.1880 H 141 ILE141 0.0230 2214 N 106.6210 120.1410 119.2320 N.am 142 PHE142 -0.2453 2215 CA 107.0810 120.4480 117.8850 C.3 142 PHE142 0.0920 2216 C 107.8510 121.7580 117.9050 C.2 142 PHE142 0.2217 2217 O 107.2600 122.8030 118.2140 O.2 142 PHE142 -0.2776 2218 CB 105.8520 120.6140 116.9720 C.3 142 PHE142 -0.0036 2219 CG 104.9990 119.3730 116.9170 C.ar 142 PHE142 -0.0454 2220 CD1 105.3990 118.2800 116.1560 C.ar 142 PHE142 -0.0585 2221 CD2 103.7840 119.3130 117.5940 C.ar 142 PHE142 -0.0585 2222 CE1 104.5950 117.1530 116.0560 C.ar 142 PHE142 -0.0615 2223 CE2 102.9800 118.1840 117.5030 C.ar 142 PHE142 -0.0615 2224 CZ 103.3840 117.1030 116.7320 C.ar 142 PHE142 -0.0617 2225 H 105.7300 120.5180 119.5550 H 142 PHE142 0.1312 2226 HA 107.6790 119.6130 117.5260 H 142 PHE142 0.0560 2227 HB1 106.1710 120.8560 115.9560 H 142 PHE142 0.0333 2228 HB2 105.2360 121.4510 117.3050 H 142 PHE142 0.0333 2229 HD1 106.3380 118.3100 115.6240 H 142 PHE142 0.0620 2230 HD2 103.4510 120.1560 118.1820 H 142 PHE142 0.0620 2231 HE1 104.9120 116.3200 115.4430 H 142 PHE142 0.0618 2232 HE2 102.0330 118.1550 118.0200 H 142 PHE142 0.0618 2233 HZ 102.7550 116.2280 116.6500 H 142 PHE142 0.0618 2234 N 109.1440 121.7630 117.5990 N.am 143 PRO143 -0.2316 2235 CA 109.8460 123.0310 117.4030 C.3 143 PRO143 0.0907 2236 C 109.3860 123.7050 116.1210 C.2 143 PRO143 0.2189 2237 O 108.8120 123.0770 115.2290 O.2 143 PRO143 -0.2778 2238 CB 111.3130 122.6160 117.3480 C.3 143 PRO143 -0.0276 2239 CG 111.2430 121.2350 116.7270 C.3 143 PRO143 -0.0379 2240 CD 109.9910 120.5970 117.3430 C.3 143 PRO143 0.0071 2241 HA 109.6450 123.6810 118.2580 H 143 PRO143 0.0559 2242 HB1 111.7060 122.5380 118.3630 H 143 PRO143 0.0285 2243 HB2 111.9520 123.3070 116.7990 H 143 PRO143 0.0285 2244 HG1 112.1550 120.6690 116.8540 H 143 PRO143 0.0278 2245 HG2 111.1050 121.3610 115.6570 H 143 PRO143 0.0278 2246 HD1 109.5130 119.9140 116.6400 H 143 PRO143 0.0431 2247 HD2 110.1880 120.1090 118.2990 H 143 PRO143 0.0431 2248 N 109.6310 125.0140 116.0530 N.am 144 ALA144 -0.2459 2249 CA 109.1400 125.8100 114.9280 C.3 144 ALA144 0.0852 2250 C 109.7350 125.4350 113.5670 C.2 144 ALA144 0.2211 2251 O 108.9470 125.3090 112.6160 O.2 144 ALA144 -0.2776 2252 CB 109.2810 127.3050 115.2400 C.3 144 ALA144 -0.0411 2253 H 110.1670 125.4660 116.7940 H 144 ALA144 0.1312 2254 HA 108.0710 125.5920 114.8640 H 144 ALA144 0.0554 2255 HB1 108.7990 127.9120 114.4750 H 144 ALA144 0.0249 2256 HB2 110.3200 127.6230 115.3130 H 144 ALA144 0.0249 2257 HB3 108.7970 127.5410 116.1880 H 144 ALA144 0.0249 2258 N 111.0590 125.2400 113.3780 N.am 145 PRO145 -0.2316 2259 CA 111.5220 124.8590 112.0260 C.3 145 PRO145 0.0907 2260 C 111.0680 123.4820 111.5650 C.2 145 PRO145 0.2189 2261 O 110.9520 123.2640 110.3510 O.2 145 PRO145 -0.2778 2262 CB 113.0550 124.8930 112.1830 C.3 145 PRO145 -0.0276 2263 CG 113.3290 125.6560 113.4810 C.3 145 PRO145 -0.0379 2264 CD 112.1130 125.3910 114.3660 C.3 145 PRO145 0.0071 2265 HA 111.1740 125.6220 111.3270 H 145 PRO145 0.0559 2266 HB1 113.5450 125.3520 111.3230 H 145 PRO145 0.0285 2267 HB2 113.4670 123.8870 112.2860 H 145 PRO145 0.0285 2268 HG1 113.3890 126.7240 113.2660 H 145 PRO145 0.0278 2269 HG2 114.2660 125.3610 113.9550 H 145 PRO145 0.0278 2270 HD1 112.1890 124.4440 114.8990 H 145 PRO145 0.0431 2271 HD2 111.9010 126.2070 115.0540 H 145 PRO145 0.0431 2272 N 110.8080 122.5570 112.4950 N.am 146 TYR146 -0.2453 2273 CA 110.2960 121.2360 112.1340 C.3 146 TYR146 0.0917 2274 C 108.9320 121.3210 111.4690 C.2 146 TYR146 0.2190 2275 O 108.6880 120.6620 110.4510 O.2 146 TYR146 -0.2778 2276 CB 110.1550 120.3620 113.3990 C.3 146 TYR146 -0.0036 2277 CG 109.4720 119.0320 113.1630 C.ar 146 TYR146 -0.0453 2278 CD1 110.1900 117.9080 112.7580 C.ar 146 TYR146 -0.0561 2279 CD2 108.0930 118.9170 113.3290 C.ar 146 TYR146 -0.0561 2280 CE1 109.5410 116.7030 112.5160 C.ar 146 TYR146 -0.0317 2281 CE2 107.4410 117.7190 113.0660 C.ar 146 TYR146 -0.0317 2282 CZ 108.1660 116.6090 112.6680 C.ar 146 TYR146 0.0726 2283 OH 107.5200 115.4190 112.4150 O.3 146 TYR146 -0.3598 2284 H 110.9700 122.7780 113.4770 H 146 TYR146 0.1312 2285 HA 110.9960 120.7860 111.4290 H 146 TYR146 0.0560 2286 HB1 109.5800 120.9010 114.1520 H 146 TYR146 0.0333 2287 HB2 111.1350 120.1840 113.8300 H 146 TYR146 0.0333 2288 HD1 111.2570 117.9610 112.6160 H 146 TYR146 0.0621 2289 HD2 107.5050 119.7730 113.6270 H 146 TYR146 0.0621 2290 HE1 110.0910 115.8340 112.1890 H 146 TYR146 0.0643 2291 HE2 106.3670 117.6500 113.1570 H 146 TYR146 0.0643 2292 HH 106.6270 115.6050 112.1430 H 146 TYR146 0.2173 2293 N 108.0330 122.1320 112.0250 N.am 147 LEU147 -0.2456 2294 CA 106.6740 122.1860 111.5060 C.3 147 LEU147 0.0880 2295 C 106.6180 122.8910 110.1570 C.2 147 LEU147 0.2187 2296 O 105.9090 122.4360 109.2520 O.2 147 LEU147 -0.2778 2297 CB 105.7910 122.9450 112.5130 C.3 147 LEU147 -0.0266 2298 CG 104.3230 123.1070 112.0670 C.3 147 LEU147 -0.0449 2299 CD1 103.6230 121.7530 111.9460 C.3 147 LEU147 -0.0626 2300 CD2 103.5600 124.0200 113.0280 C.3 147 LEU147 -0.0626 2301 H 108.2980 122.7170 112.8170 H 147 LEU147 0.1312 2302 HA 106.3250 121.1580 111.3820 H 147 LEU147 0.0557 2303 HB1 106.2230 123.9310 112.6920 H 147 LEU147 0.0287 2304 HB2 105.8230 122.4300 113.4740 H 147 LEU147 0.0287 2305 HG 104.2880 123.5890 111.0900 H 147 LEU147 0.0296 2306 HD11 102.5800 121.8820 111.6580 H 147 LEU147 0.0232 2307 HD12 103.6520 121.2220 112.8970 H 147 LEU147 0.0232 2308 HD13 104.0900 121.1150 111.1950 H 147 LEU147 0.0232 2309 HD21 102.5170 124.1310 112.7300 H 147 LEU147 0.0232 2310 HD22 104.0080 125.0130 113.0410 H 147 LEU147 0.0232 2311 HD23 103.5800 123.6220 114.0420 H 147 LEU147 0.0232 2312 N 107.3730 123.9830 109.9930 N.am 148 TYR148 -0.2453 2313 CA 107.4120 124.6460 108.6920 C.3 148 TYR148 0.0917 2314 C 108.0910 123.7720 107.6480 C.2 148 TYR148 0.2190 2315 O 107.6470 123.7380 106.4950 O.2 148 TYR148 -0.2778 2316 CB 108.1070 126.0120 108.8160 C.3 148 TYR148 -0.0036 2317 CG 107.5570 126.8760 109.9280 C.ar 148 TYR148 -0.0453 2318 CD1 106.1900 126.9450 110.2040 C.ar 148 TYR148 -0.0561 2319 CD2 108.4310 127.6350 110.7030 C.ar 148 TYR148 -0.0561 2320 CE1 105.7170 127.7190 111.2570 C.ar 148 TYR148 -0.0317 2321 CE2 107.9580 128.4120 111.7520 C.ar 148 TYR148 -0.0317 2322 CZ 106.6030 128.4470 112.0370 C.ar 148 TYR148 0.0726 2323 OH 106.1460 129.2070 113.0920 O.3 148 TYR148 -0.3598 2324 H 107.9190 124.3510 110.7720 H 148 TYR148 0.1312 2325 HA 106.3770 124.7800 108.3720 H 148 TYR148 0.0560 2326 HB1 108.0240 126.5620 107.8780 H 148 TYR148 0.0333 2327 HB2 109.1720 125.8560 108.9940 H 148 TYR148 0.0333 2328 HD1 105.4780 126.3820 109.6180 H 148 TYR148 0.0621 2329 HD2 109.4920 127.6060 110.5080 H 148 TYR148 0.0621 2330 HE1 104.6610 127.7540 111.4790 H 148 TYR148 0.0643 2331 HE2 108.6430 128.9890 112.3550 H 148 TYR148 0.0643 2332 HH 105.2160 129.3730 112.9910 H 148 TYR148 0.2173 2333 N 109.1340 123.0320 108.0480 N.am 149 LEU149 -0.2456 2334 CA 109.7940 122.1000 107.1370 C.3 149 LEU149 0.0880 2335 C 108.8360 121.0200 106.6610 C.2 149 LEU149 0.2187 2336 O 108.7010 120.7950 105.4550 O.2 149 LEU149 -0.2778 2337 CB 110.9950 121.4760 107.8730 C.3 149 LEU149 -0.0266 2338 CG 111.7400 120.3680 107.1030 C.3 149 LEU149 -0.0449 2339 CD1 112.3080 120.8800 105.7720 C.3 149 LEU149 -0.0626 2340 CD2 112.8490 119.7650 107.9740 C.3 149 LEU149 -0.0626 2341 H 109.4730 123.1210 109.0060 H 149 LEU149 0.1312 2342 HA 110.1250 122.6750 106.2720 H 149 LEU149 0.0557 2343 HB1 110.6510 121.0660 108.8240 H 149 LEU149 0.0287 2344 HB2 111.6990 122.2680 108.1290 H 149 LEU149 0.0287 2345 HG 111.0400 119.5620 106.8810 H 149 LEU149 0.0296 2346 HD11 112.8510 120.0910 105.2520 H 149 LEU149 0.0232 2347 HD12 112.9950 121.7110 105.9300 H 149 LEU149 0.0232 2348 HD13 111.5150 121.2200 105.1070 H 149 LEU149 0.0232 2349 HD21 113.3580 118.9530 107.4550 H 149 LEU149 0.0232 2350 HD22 112.4410 119.3600 108.9010 H 149 LEU149 0.0232 2351 HD23 113.5960 120.5150 108.2370 H 149 LEU149 0.0232 2352 N 108.1170 120.3960 107.6000 N.am 150 GLU150 -0.2456 2353 CA 107.1310 119.3660 107.2810 C.3 150 GLU150 0.0883 2354 C 106.0320 119.8980 106.3690 C.2 150 GLU150 0.2187 2355 O 105.8490 119.4040 105.2520 O.2 150 GLU150 -0.2778 2356 CB 106.4940 118.9140 108.6160 C.3 150 GLU150 -0.0193 2357 CG 105.4040 117.8280 108.4700 C.3 150 GLU150 0.0356 2358 CD 104.6740 117.5090 109.7880 C.2 150 GLU150 0.1760 2359 OE1 105.1370 117.8990 110.8570 O.co2 150 GLU150 -0.6478 2360 OE2 103.6310 116.8650 109.7340 O.co2 150 GLU150 -0.6478 2361 H 108.2630 120.6490 108.5770 H 150 GLU150 0.1312 2362 HA 107.6480 118.5390 106.7980 H 150 GLU150 0.0557 2363 HB1 106.0640 119.7790 109.1240 H 150 GLU150 0.0290 2364 HB2 107.2730 118.5550 109.2870 H 150 GLU150 0.0290 2365 HG1 105.8270 116.9040 108.0810 H 150 GLU150 0.0374 2366 HG2 104.6440 118.1450 107.7590 H 150 GLU150 0.0374 2367 N 105.3530 120.9620 106.8050 N.am 151 VAL151 -0.2454 2368 CA 104.1820 121.4950 106.1160 C.3 151 VAL151 0.0901 2369 C 104.5330 122.0410 104.7310 C.2 151 VAL151 0.2189 2370 O 103.8390 121.7530 103.7470 O.2 151 VAL151 -0.2778 2371 CB 103.4080 122.5050 106.9790 C.3 151 VAL151 -0.0227 2372 CG1 102.2110 123.0660 106.1890 C.3 151 VAL151 -0.0608 2373 CG2 102.9330 121.8450 108.2850 C.3 151 VAL151 -0.0608 2374 H 105.6670 121.4230 107.6590 H 151 VAL151 0.1312 2375 HA 103.5360 120.6340 105.9420 H 151 VAL151 0.0560 2376 HB 104.0700 123.3320 107.2390 H 151 VAL151 0.0315 2377 HG11 101.5500 123.6610 106.8120 H 151 VAL151 0.0233 2378 HG12 101.6170 122.2590 105.7590 H 151 VAL151 0.0233 2379 HG13 102.5350 123.7050 105.3680 H 151 VAL151 0.0233 2380 HG21 102.3550 122.5350 108.8980 H 151 VAL151 0.0233 2381 HG22 103.7630 121.4890 108.8910 H 151 VAL151 0.0233 2382 HG23 102.3110 120.9760 108.0840 H 151 VAL151 0.0233 2383 N 105.6240 122.7970 104.6100 N.am 152 TYR152 -0.2453 2384 CA 105.9330 123.4300 103.3420 C.3 152 TYR152 0.0917 2385 C 106.9020 122.6320 102.4810 C.2 152 TYR152 0.2188 2386 O 107.2000 123.0630 101.3610 O.2 152 TYR152 -0.2778 2387 CB 106.3600 124.8820 103.5970 C.3 152 TYR152 -0.0036 2388 CG 105.2280 125.6330 104.2570 C.ar 152 TYR152 -0.0453 2389 CD1 104.0700 125.9240 103.5400 C.ar 152 TYR152 -0.0561 2390 CD2 105.2760 125.9530 105.6110 C.ar 152 TYR152 -0.0561 2391 CE1 102.9690 126.4920 104.1700 C.ar 152 TYR152 -0.0317 2392 CE2 104.1790 126.5260 106.2420 C.ar 152 TYR152 -0.0317 2393 CZ 103.0190 126.7840 105.5240 C.ar 152 TYR152 0.0726 2394 OH 101.9090 127.3180 106.1460 O.3 152 TYR152 -0.3598 2395 H 106.2420 122.9310 105.4100 H 152 TYR152 0.1312 2396 HA 105.0210 123.4730 102.7440 H 152 TYR152 0.0560 2397 HB1 106.6080 125.3800 102.6590 H 152 TYR152 0.0333 2398 HB2 107.2530 124.9180 104.2210 H 152 TYR152 0.0333 2399 HD1 104.0050 125.6690 102.4930 H 152 TYR152 0.0621 2400 HD2 106.1600 125.7290 106.1880 H 152 TYR152 0.0621 2401 HE1 102.0640 126.6900 103.6160 H 152 TYR152 0.0643 2402 HE2 104.2270 126.7490 107.2970 H 152 TYR152 0.0643 2403 HH 102.1110 127.5210 107.0500 H 152 TYR152 0.2173 2404 N 107.4030 121.4890 102.9470 N.am 153 GLY153 -0.2485 2405 CA 108.2820 120.7040 102.1140 C.3 153 GLY153 0.0765 2406 C 107.7820 119.3140 101.7930 C.2 153 GLY153 0.2155 2407 O 108.2670 118.6940 100.8430 O.2 153 GLY153 -0.2781 2408 H 107.1670 121.1710 103.8870 H 153 GLY153 0.1309 2409 HA1 109.2090 120.6030 102.6780 H 153 GLY153 0.0521 2410 HA2 108.5270 121.2090 101.1790 H 153 GLY153 0.0521 2411 N 106.8350 118.7880 102.5700 N.am 154 LEU154 -0.2459 2412 CA 106.3380 117.4430 102.3350 C.3 154 LEU154 0.0880 2413 C 104.8540 117.4120 102.0170 C.2 154 LEU154 0.2187 2414 O 104.4610 116.8060 101.0170 O.2 154 LEU154 -0.2778 2415 CB 106.5450 116.5940 103.6150 C.3 154 LEU154 -0.0266 2416 CG 107.9880 116.1540 103.9430 C.3 154 LEU154 -0.0449 2417 CD1 108.9520 117.3190 104.2120 C.3 154 LEU154 -0.0626 2418 CD2 107.9680 115.2090 105.1550 C.3 154 LEU154 -0.0626 2419 H 106.4540 119.3370 103.3400 H 154 LEU154 0.1312 2420 HA 106.8590 116.9770 101.4980 H 154 LEU154 0.0557 2421 HB1 105.9560 115.6790 103.5270 H 154 LEU154 0.0287 2422 HB2 106.1290 117.1150 104.4770 H 154 LEU154 0.0287 2423 HG 108.3740 115.5880 103.0950 H 154 LEU154 0.0296 2424 HD11 109.8560 116.9750 104.7140 H 154 LEU154 0.0232 2425 HD12 108.4950 118.0820 104.8400 H 154 LEU154 0.0232 2426 HD13 109.2750 117.7900 103.2870 H 154 LEU154 0.0232 2427 HD21 108.9670 114.8400 105.3870 H 154 LEU154 0.0232 2428 HD22 107.3340 114.3410 104.9700 H 154 LEU154 0.0232 2429 HD23 107.5860 115.7150 106.0420 H 154 LEU154 0.0232 2430 N 104.0180 118.0520 102.8350 N.am 155 LEU155 -0.2456 2431 CA 102.5740 117.8770 102.7190 C.3 155 LEU155 0.0880 2432 C 102.0110 118.6000 101.5000 C.2 155 LEU155 0.2187 2433 O 101.1010 118.0930 100.8350 O.2 155 LEU155 -0.2778 2434 CB 101.9060 118.3640 104.0180 C.3 155 LEU155 -0.0266 2435 CG 102.5800 117.8340 105.3000 C.3 155 LEU155 -0.0449 2436 CD1 101.8580 118.3350 106.5520 C.3 155 LEU155 -0.0626 2437 CD2 102.6880 116.3030 105.3250 C.3 155 LEU155 -0.0626 2438 H 104.3930 118.6730 103.5520 H 155 LEU155 0.1312 2439 HA 102.3850 116.8100 102.5880 H 155 LEU155 0.0557 2440 HB1 100.8540 118.0740 104.0120 H 155 LEU155 0.0287 2441 HB2 101.9220 119.4550 104.0520 H 155 LEU155 0.0287 2442 HG 103.5930 118.2330 105.3500 H 155 LEU155 0.0296 2443 HD11 102.4210 118.0780 107.4480 H 155 LEU155 0.0232 2444 HD12 100.8650 117.8940 106.6430 H 155 LEU155 0.0232 2445 HD13 101.7440 119.4170 106.5390 H 155 LEU155 0.0232 2446 HD21 103.1980 115.9820 106.2300 H 155 LEU155 0.0232 2447 HD22 103.2650 115.9170 104.4850 H 155 LEU155 0.0232 2448 HD23 101.7040 115.8330 105.3090 H 155 LEU155 0.0232 2449 N 102.5140 119.7950 101.2020 N.am 156 LEU156 -0.2456 2450 CA 102.0870 120.4830 99.9820 C.3 156 LEU156 0.0883 2451 C 102.6800 119.8890 98.6980 C.2 156 LEU156 0.2214 2452 O 101.9240 119.7480 97.7160 O.2 156 LEU156 -0.2776 2453 CB 102.3700 121.9930 100.1310 C.3 156 LEU156 -0.0266 2454 CG 101.2120 122.7960 100.7610 C.3 156 LEU156 -0.0449 2455 CD1 100.0180 122.9210 99.8030 C.3 156 LEU156 -0.0626 2456 CD2 100.7680 122.2560 102.1290 C.3 156 LEU156 -0.0626 2457 H 103.1960 120.2310 101.8220 H 156 LEU156 0.1312 2458 HA 101.0090 120.3460 99.9010 H 156 LEU156 0.0557 2459 HB1 102.5950 122.4350 99.1590 H 156 LEU156 0.0287 2460 HB2 103.2670 122.1400 100.7330 H 156 LEU156 0.0287 2461 HG 101.5880 123.8070 100.9250 H 156 LEU156 0.0296 2462 HD11 99.2890 123.6320 100.1890 H 156 LEU156 0.0232 2463 HD12 99.5080 121.9690 99.6610 H 156 LEU156 0.0232 2464 HD13 100.3350 123.2810 98.8240 H 156 LEU156 0.0232 2465 HD21 100.0090 122.8990 102.5750 H 156 LEU156 0.0232 2466 HD22 101.6030 122.2060 102.8260 H 156 LEU156 0.0232 2467 HD23 100.3380 121.2570 102.0490 H 156 LEU156 0.0232 2468 N 103.9820 119.5310 98.6070 N.am 157 PRO157 -0.2316 2469 CA 104.4250 118.8160 97.3940 C.3 157 PRO157 0.0907 2470 C 103.8090 117.4400 97.2070 C.2 157 PRO157 0.2189 2471 O 103.7580 116.9720 96.0660 O.2 157 PRO157 -0.2778 2472 CB 105.9460 118.7490 97.5930 C.3 157 PRO157 -0.0276 2473 CG 106.2480 119.8910 98.5630 C.3 157 PRO157 -0.0379 2474 CD 105.0540 119.9010 99.5160 C.3 157 PRO157 0.0071 2475 HA 104.1770 119.4450 96.5380 H 157 PRO157 0.0559 2476 HB1 106.4950 118.8370 96.6560 H 157 PRO157 0.0285 2477 HB2 106.2380 117.8090 98.0640 H 157 PRO157 0.0285 2478 HG1 106.2750 120.8330 98.0130 H 157 PRO157 0.0278 2479 HG2 107.2080 119.7860 99.0600 H 157 PRO157 0.0278 2480 HD1 105.1300 119.1390 100.2760 H 157 PRO157 0.0431 2481 HD2 104.8770 120.8800 99.9600 H 157 PRO157 0.0431 2482 N 103.3480 116.7750 98.2730 N.am 158 ALA158 -0.2459 2483 CA 102.6610 115.4960 98.1020 C.3 158 ALA158 0.0850 2484 C 101.3600 115.6560 97.3240 C.2 158 ALA158 0.2184 2485 O 101.0960 114.8980 96.3810 O.2 158 ALA158 -0.2778 2486 CB 102.3940 114.8970 99.4860 C.3 158 ALA158 -0.0411 2487 H 103.4760 117.1620 99.2080 H 158 ALA158 0.1312 2488 HA 103.3230 114.8410 97.5330 H 158 ALA158 0.0554 2489 HB1 101.8400 113.9590 99.4210 H 158 ALA158 0.0249 2490 HB2 101.8240 115.5900 100.1040 H 158 ALA158 0.0249 2491 HB3 103.3290 114.6900 100.0050 H 158 ALA158 0.0249 2492 N 100.5600 116.6680 97.6600 N.am 159 VAL159 -0.2454 2493 CA 99.3040 116.8270 96.9370 C.3 159 VAL159 0.0901 2494 C 99.5420 117.4770 95.5780 C.2 159 VAL159 0.2187 2495 O 98.7980 117.2020 94.6220 O.2 159 VAL159 -0.2778 2496 CB 98.2990 117.6270 97.7950 C.3 159 VAL159 -0.0227 2497 CG1 97.9190 116.8530 99.0660 C.3 159 VAL159 -0.0608 2498 CG2 98.7980 119.0320 98.1630 C.3 159 VAL159 -0.0608 2499 H 100.8200 117.3150 98.4040 H 159 VAL159 0.1312 2500 HA 98.8850 115.8350 96.7570 H 159 VAL159 0.0560 2501 HB 97.3840 117.7460 97.2110 H 159 VAL159 0.0315 2502 HG11 97.1650 117.3940 99.6380 H 159 VAL159 0.0233 2503 HG12 98.7800 116.7040 99.7180 H 159 VAL159 0.0233 2504 HG13 97.5100 115.8710 98.8240 H 159 VAL159 0.0233 2505 HG21 98.0450 119.5770 98.7330 H 159 VAL159 0.0233 2506 HG22 99.0330 119.6270 97.2810 H 159 VAL159 0.0233 2507 HG23 99.6930 118.9770 98.7800 H 159 VAL159 0.0233 2508 N 100.6100 118.2730 95.4400 N.am 160 GLY160 -0.2485 2509 CA 100.9750 118.7740 94.1220 C.3 160 GLY160 0.0765 2510 C 101.4130 117.6720 93.1730 C.2 160 GLY160 0.2155 2511 O 101.0000 117.6400 92.0100 O.2 160 GLY160 -0.2781 2512 H 101.1660 118.5280 96.2560 H 160 GLY160 0.1309 2513 HA1 101.7950 119.4770 94.2650 H 160 GLY160 0.0521 2514 HA2 100.1200 119.3090 93.7060 H 160 GLY160 0.0521 2515 N 102.2160 116.7280 93.6710 N.am 161 ALA161 -0.2462 2516 CA 102.6460 115.5990 92.8580 C.3 161 ALA161 0.0850 2517 C 101.4920 114.6550 92.5550 C.2 161 ALA161 0.2184 2518 O 101.4340 114.0860 91.4600 O.2 161 ALA161 -0.2778 2519 CB 103.7510 114.8530 93.6140 C.3 161 ALA161 -0.0411 2520 H 102.5340 116.7990 94.6380 H 161 ALA161 0.1311 2521 HA 103.0320 115.9950 91.9170 H 161 ALA161 0.0554 2522 HB1 104.1180 113.9990 93.0440 H 161 ALA161 0.0249 2523 HB2 103.3940 114.4880 94.5780 H 161 ALA161 0.0249 2524 HB3 104.5970 115.5110 93.8080 H 161 ALA161 0.0249 2525 N 100.5670 114.4690 93.5060 N.am 162 ALA162 -0.2459 2526 CA 99.4000 113.6290 93.2430 C.3 162 ALA162 0.0850 2527 C 98.5290 114.2240 92.1430 C.2 162 ALA162 0.2184 2528 O 98.0820 113.5010 91.2390 O.2 162 ALA162 -0.2778 2529 CB 98.6130 113.4860 94.5510 C.3 162 ALA162 -0.0411 2530 H 100.6770 114.9150 94.4170 H 162 ALA162 0.1312 2531 HA 99.7660 112.6550 92.9120 H 162 ALA162 0.0554 2532 HB1 97.7160 112.8820 94.4190 H 162 ALA162 0.0249 2533 HB2 98.3100 114.4590 94.9360 H 162 ALA162 0.0249 2534 HB3 99.2240 113.0090 95.3180 H 162 ALA162 0.0249 2535 N 98.3440 115.5500 92.1620 N.am 163 ALA163 -0.2459 2536 CA 97.5760 116.2170 91.1130 C.3 163 ALA163 0.0850 2537 C 98.2720 116.1210 89.7570 C.2 163 ALA163 0.2184 2538 O 97.6270 115.8160 88.7460 O.2 163 ALA163 -0.2778 2539 CB 97.3770 117.6810 91.5200 C.3 163 ALA163 -0.0411 2540 H 98.7450 116.1020 92.9200 H 163 ALA163 0.1312 2541 HA 96.6100 115.7130 91.0450 H 163 ALA163 0.0554 2542 HB1 96.7830 118.2220 90.7830 H 163 ALA163 0.0249 2543 HB2 98.3320 118.1970 91.6310 H 163 ALA163 0.0249 2544 HB3 96.8580 117.7460 92.4770 H 163 ALA163 0.0249 2545 N 99.5930 116.3560 89.7220 N.am 164 PHE164 -0.2453 2546 CA 100.3460 116.2780 88.4670 C.3 164 PHE164 0.0917 2547 C 100.3350 114.8730 87.8730 C.2 164 PHE164 0.2190 2548 O 100.1710 114.7050 86.6570 O.2 164 PHE164 -0.2778 2549 CB 101.7690 116.7020 88.8670 C.3 164 PHE164 -0.0036 2550 CG 102.6920 117.0360 87.7270 C.ar 164 PHE164 -0.0454 2551 CD1 102.4330 118.1380 86.9190 C.ar 164 PHE164 -0.0585 2552 CD2 103.9050 116.3680 87.5920 C.ar 164 PHE164 -0.0585 2553 CE1 103.3840 118.5900 86.0150 C.ar 164 PHE164 -0.0615 2554 CE2 104.8630 116.8220 86.6950 C.ar 164 PHE164 -0.0615 2555 CZ 104.6100 117.9460 85.9210 C.ar 164 PHE164 -0.0617 2556 H 100.0820 116.5930 90.5850 H 164 PHE164 0.1312 2557 HA 99.8890 116.9800 87.7690 H 164 PHE164 0.0560 2558 HB1 102.2240 115.9470 89.5100 H 164 PHE164 0.0333 2559 HB2 101.7080 117.6000 89.4840 H 164 PHE164 0.0333 2560 HD1 101.5130 118.6920 87.0430 H 164 PHE164 0.0620 2561 HD2 104.1380 115.5350 88.2400 H 164 PHE164 0.0620 2562 HE1 103.1890 119.4760 85.4280 H 164 PHE164 0.0618 2563 HE2 105.8220 116.3280 86.6380 H 164 PHE164 0.0618 2564 HZ 105.3710 118.3290 85.2580 H 164 PHE164 0.0618 2565 N 100.5050 113.8510 88.7140 N.am 165 LEU165 -0.2456 2566 CA 100.5560 112.4790 88.2190 C.3 165 LEU165 0.0880 2567 C 99.1930 112.0020 87.7330 C.2 165 LEU165 0.2187 2568 O 99.1010 111.3480 86.6810 O.2 165 LEU165 -0.2778 2569 CB 101.0380 111.5820 89.3830 C.3 165 LEU165 -0.0266 2570 CG 102.5680 111.4700 89.5750 C.3 165 LEU165 -0.0449 2571 CD1 103.3630 112.7470 89.2520 C.3 165 LEU165 -0.0626 2572 CD2 102.8900 110.9640 90.9890 C.3 165 LEU165 -0.0626 2573 H 100.6000 114.0310 89.7140 H 165 LEU165 0.1312 2574 HA 101.2450 112.4470 87.3770 H 165 LEU165 0.0557 2575 HB1 100.6640 110.5630 89.2600 H 165 LEU165 0.0287 2576 HB2 100.5770 111.9400 90.3050 H 165 LEU165 0.0287 2577 HG 102.9290 110.7080 88.8890 H 165 LEU165 0.0296 2578 HD11 104.4300 112.5790 89.3960 H 165 LEU165 0.0232 2579 HD12 103.0830 113.5830 89.8870 H 165 LEU165 0.0232 2580 HD13 103.2290 113.0570 88.2160 H 165 LEU165 0.0232 2581 HD21 103.9590 110.7900 91.1120 H 165 LEU165 0.0232 2582 HD22 102.3780 110.0230 91.1950 H 165 LEU165 0.0232 2583 HD23 102.5810 111.6840 91.7470 H 165 LEU165 0.0232 2584 N 98.1190 112.3500 88.4570 N.am 166 SER166 -0.2436 2585 CA 96.7800 112.0260 87.9760 C.3 166 SER166 0.1109 2586 C 96.4670 112.7630 86.6780 C.2 166 SER166 0.2209 2587 O 95.8250 112.2040 85.7770 O.2 166 SER166 -0.2777 2588 CB 95.7280 112.2530 89.0730 C.3 166 SER166 0.0681 2589 OG 94.8310 111.1410 89.0900 O.3 166 SER166 -0.3930 2590 H 98.2380 112.8410 89.3430 H 166 SER166 0.1312 2591 HA 96.8060 110.9620 87.7380 H 166 SER166 0.0580 2592 HB1 95.2060 113.2080 88.9200 H 166 SER166 0.0577 2593 HB2 96.2210 112.3150 90.0470 H 166 SER166 0.0577 2594 HG 94.0550 111.3460 89.6130 H 166 SER166 0.2095 2595 N 96.9710 113.9960 86.5450 N.am 167 VAL167 -0.2453 2596 CA 96.8010 114.7690 85.3190 C.3 167 VAL167 0.0901 2597 C 97.4710 114.1020 84.1300 C.2 167 VAL167 0.2189 2598 O 96.8790 114.0030 83.0470 O.2 167 VAL167 -0.2778 2599 CB 97.2650 116.2260 85.5530 C.3 167 VAL167 -0.0227 2600 CG1 97.5850 116.9970 84.2600 C.3 167 VAL167 -0.0608 2601 CG2 96.2080 117.0020 86.3550 C.3 167 VAL167 -0.0608 2602 H 97.4880 114.4070 87.3220 H 167 VAL167 0.1312 2603 HA 95.7310 114.7710 85.1000 H 167 VAL167 0.0560 2604 HB 98.1800 116.1970 86.1450 H 167 VAL167 0.0315 2605 HG11 97.8430 118.0330 84.4790 H 167 VAL167 0.0233 2606 HG12 96.7280 117.0040 83.5850 H 167 VAL167 0.0233 2607 HG13 98.4310 116.5620 83.7270 H 167 VAL167 0.0233 2608 HG21 96.5920 117.9700 86.6780 H 167 VAL167 0.0233 2609 HG22 95.8850 116.4600 87.2420 H 167 VAL167 0.0233 2610 HG23 95.3180 117.1830 85.7520 H 167 VAL167 0.0233 2611 N 98.7030 113.6340 84.3200 N.am 168 ARG168 -0.2456 2612 CA 99.4440 113.0370 83.2170 C.3 168 ARG168 0.0879 2613 C 98.8250 111.7080 82.7900 C.2 168 ARG168 0.2187 2614 O 98.7350 111.4180 81.5880 O.2 168 ARG168 -0.2778 2615 CB 100.8810 112.7510 83.6840 C.3 168 ARG168 -0.0258 2616 CG 101.9060 113.7950 83.2360 C.3 168 ARG168 -0.0154 2617 CD 102.0120 115.0110 84.1650 C.3 168 ARG168 0.1045 2618 NE 102.9040 116.0100 83.5740 N.pl3 168 ARG168 -0.4450 2619 CZ 104.2200 115.8610 83.4260 C.cat 168 ARG168 0.5062 2620 NH1 104.9020 116.8030 82.8290 N.pl3 168 ARG168 -0.4573 2621 NH2 104.8520 114.8010 83.8590 N.pl3 168 ARG168 -0.4573 2622 H 99.1310 113.6940 85.2440 H 168 ARG168 0.1312 2623 HA 99.4110 113.7220 82.3670 H 168 ARG168 0.0557 2624 HB1 101.2330 111.7920 83.2940 H 168 ARG168 0.0286 2625 HB2 100.8810 112.6380 84.7680 H 168 ARG168 0.0286 2626 HG1 101.6830 114.1170 82.2180 H 168 ARG168 0.0299 2627 HG2 102.8760 113.3030 83.1800 H 168 ARG168 0.0299 2628 HD1 102.3760 114.7490 85.1620 H 168 ARG168 0.0711 2629 HD2 101.0370 115.4880 84.2910 H 168 ARG168 0.0711 2630 HE 102.5020 116.8670 83.2570 H 168 ARG168 0.3153 2631 HH11 105.8870 116.7090 82.7060 H 168 ARG168 0.3114 2632 HH12 104.4360 117.6190 82.4970 H 168 ARG168 0.3114 2633 HH21 105.8380 114.7190 83.7530 H 168 ARG168 0.3114 2634 HH22 104.3450 114.0630 84.3010 H 168 ARG168 0.3114 2635 N 98.3320 110.9180 83.7520 N.am 169 VAL169 -0.2454 2636 CA 97.7230 109.6350 83.3960 C.3 169 VAL169 0.0901 2637 C 96.3830 109.8390 82.6820 C.2 169 VAL169 0.2189 2638 O 96.0770 109.1420 81.7010 O.2 169 VAL169 -0.2778 2639 CB 97.5430 108.7990 84.6870 C.3 169 VAL169 -0.0227 2640 CG1 96.6740 107.5460 84.4760 C.3 169 VAL169 -0.0608 2641 CG2 98.8960 108.3770 85.2770 C.3 169 VAL169 -0.0608 2642 H 98.3810 111.2090 84.7280 H 169 VAL169 0.1312 2643 HA 98.3970 109.1190 82.7090 H 169 VAL169 0.0560 2644 HB 97.0430 109.4280 85.4250 H 169 VAL169 0.0315 2645 HG11 96.6690 106.9120 85.3620 H 169 VAL169 0.0233 2646 HG12 97.0520 106.9450 83.6510 H 169 VAL169 0.0233 2647 HG13 95.6380 107.8020 84.2530 H 169 VAL169 0.0233 2648 HG21 98.7710 107.9050 86.2530 H 169 VAL169 0.0233 2649 HG22 99.5720 109.2220 85.4070 H 169 VAL169 0.0233 2650 HG23 99.3870 107.6530 84.6280 H 169 VAL169 0.0233 2651 N 95.5860 110.8270 83.1140 N.am 170 LEU170 -0.2456 2652 CA 94.3240 111.0880 82.4180 C.3 170 LEU170 0.0880 2653 C 94.5380 111.6840 81.0270 C.2 170 LEU170 0.2187 2654 O 93.7730 111.3760 80.1020 O.2 170 LEU170 -0.2778 2655 CB 93.4100 111.9870 83.2780 C.3 170 LEU170 -0.0266 2656 CG 92.4320 111.2210 84.1940 C.3 170 LEU170 -0.0449 2657 CD1 91.4230 110.3850 83.3900 C.3 170 LEU170 -0.0626 2658 CD2 93.1380 110.3640 85.2540 C.3 170 LEU170 -0.0626 2659 H 95.8560 111.3910 83.9190 H 170 LEU170 0.1312 2660 HA 93.8430 110.1230 82.2570 H 170 LEU170 0.0557 2661 HB1 92.8040 112.6290 82.6360 H 170 LEU170 0.0287 2662 HB2 94.0210 112.6710 83.8690 H 170 LEU170 0.0287 2663 HG 91.8540 111.9770 84.7280 H 170 LEU170 0.0296 2664 HD11 90.5900 110.0690 84.0190 H 170 LEU170 0.0232 2665 HD12 91.8770 109.4870 82.9740 H 170 LEU170 0.0232 2666 HD13 91.0120 110.9570 82.5590 H 170 LEU170 0.0232 2667 HD21 92.4090 109.8550 85.8850 H 170 LEU170 0.0232 2668 HD22 93.7570 110.9770 85.9060 H 170 LEU170 0.0232 2669 HD23 93.7700 109.6030 84.7970 H 170 LEU170 0.0232 2670 N 95.5790 112.5050 80.8440 N.am 171 ALA171 -0.2459 2671 CA 95.8990 113.0100 79.5090 C.3 171 ALA171 0.0850 2672 C 96.3460 111.8890 78.5750 C.2 171 ALA171 0.2185 2673 O 95.9960 111.8820 77.3840 O.2 171 ALA171 -0.2778 2674 CB 97.0020 114.0650 79.6480 C.3 171 ALA171 -0.0411 2675 H 96.1530 112.7800 81.6410 H 171 ALA171 0.1312 2676 HA 94.9920 113.4630 79.1030 H 171 ALA171 0.0554 2677 HB1 97.2620 114.5000 78.6830 H 171 ALA171 0.0249 2678 HB2 97.9070 113.6380 80.0840 H 171 ALA171 0.0249 2679 HB3 96.6770 114.8760 80.3000 H 171 ALA171 0.0249 2680 N 97.1030 110.9230 79.1050 N.am 172 THR172 -0.2434 2681 CA 97.5150 109.7680 78.3090 C.3 172 THR172 0.1135 2682 C 96.3240 108.8990 77.8970 C.2 172 THR172 0.2212 2683 O 96.2320 108.4660 76.7340 O.2 172 THR172 -0.2777 2684 CB 98.7620 109.0340 78.8530 C.3 172 THR172 0.0763 2685 OG1 99.8450 109.4060 78.0010 O.3 172 THR172 -0.3900 2686 CG2 98.6400 107.4990 78.8580 C.3 172 THR172 -0.0370 2687 H 97.3970 110.9930 80.0790 H 172 THR172 0.1313 2688 HA 97.8220 110.2060 77.3580 H 172 THR172 0.0583 2689 HB 98.9420 109.3860 79.8770 H 172 THR172 0.0611 2690 HG1 100.6740 109.1010 78.3560 H 172 THR172 0.2098 2691 HG21 99.5590 107.0200 79.1930 H 172 THR172 0.0255 2692 HG22 98.4250 107.1140 77.8610 H 172 THR172 0.0255 2693 HG23 97.8410 107.1730 79.5240 H 172 THR172 0.0255 2694 N 95.3950 108.6560 78.8270 N.am 173 ALA173 -0.2458 2695 CA 94.1810 107.9170 78.4860 C.3 173 ALA173 0.0850 2696 C 93.3310 108.6550 77.4560 C.2 173 ALA173 0.2184 2697 O 92.7110 108.0180 76.5940 O.2 173 ALA173 -0.2778 2698 CB 93.3950 107.6780 79.7790 C.3 173 ALA173 -0.0411 2699 H 95.5340 108.9890 79.7810 H 173 ALA173 0.1312 2700 HA 94.4900 106.9630 78.0550 H 173 ALA173 0.0554 2701 HB1 92.4990 107.0850 79.5950 H 173 ALA173 0.0249 2702 HB2 93.0950 108.6190 80.2430 H 173 ALA173 0.0249 2703 HB3 94.0030 107.1370 80.5040 H 173 ALA173 0.0249 2704 N 93.3300 109.9920 77.4970 N.am 174 HIS174 -0.2453 2705 CA 92.6020 110.7670 76.4930 C.3 174 HIS174 0.0932 2706 C 93.2320 110.6390 75.1070 C.2 174 HIS174 0.2190 2707 O 92.5130 110.5350 74.1000 O.2 174 HIS174 -0.2778 2708 CB 92.4910 112.2280 76.9420 C.3 174 HIS174 0.0146 2709 CG 91.3850 112.9000 76.1610 C.ar 174 HIS174 0.0551 2710 ND1 90.0750 112.7010 76.4130 N.ar 174 HIS174 -0.2469 2711 CD2 91.4980 113.7360 75.0380 C.ar 174 HIS174 0.0047 2712 CE1 89.4080 113.4220 75.4970 C.ar 174 HIS174 0.0737 2713 NE2 90.2410 114.0530 74.6480 N.ar 174 HIS174 -0.2539 2714 H 93.8420 110.4750 78.2350 H 174 HIS174 0.1312 2715 HA 91.6010 110.3310 76.4430 H 174 HIS174 0.0561 2716 HB1 93.4320 112.7660 76.8170 H 174 HIS174 0.0348 2717 HB2 92.2350 112.2750 78.0010 H 174 HIS174 0.0348 2718 HD2 92.4190 114.0620 74.5780 H 174 HIS174 0.0764 2719 HE1 88.3290 113.4850 75.4570 H 174 HIS174 0.0963 2720 HE2 89.9850 114.6430 73.9090 H 174 HIS174 0.1339 2721 N 94.5690 110.6450 75.0340 N.am 175 ARG175 -0.2456 2722 CA 95.2380 110.4580 73.7430 C.3 175 ARG175 0.0879 2723 C 94.9660 109.0760 73.1530 C.2 175 ARG175 0.2187 2724 O 94.7360 108.9430 71.9400 O.2 175 ARG175 -0.2778 2725 CB 96.7650 110.4620 73.8980 C.3 175 ARG175 -0.0258 2726 CG 97.4580 111.7500 74.3460 C.3 175 ARG175 -0.0154 2727 CD 98.9950 111.5930 74.3210 C.3 175 ARG175 0.1045 2728 NE 99.4250 110.4210 75.0990 N.pl3 175 ARG175 -0.4450 2729 CZ 99.5480 109.1790 74.6210 C.cat 175 ARG175 0.5062 2730 NH1 99.3900 108.8890 73.3560 N.pl3 175 ARG175 -0.4573 2731 NH2 99.8210 108.2100 75.4470 N.pl3 175 ARG175 -0.4573 2732 H 95.1240 110.7800 75.8790 H 175 ARG175 0.1312 2733 HA 94.8900 111.2290 73.0530 H 175 ARG175 0.0557 2734 HB1 97.2050 110.1910 72.9370 H 175 ARG175 0.0286 2735 HB2 97.0150 109.6730 74.6070 H 175 ARG175 0.0286 2736 HG1 97.1360 112.0170 75.3490 H 175 ARG175 0.0299 2737 HG2 97.1630 112.5750 73.6980 H 175 ARG175 0.0299 2738 HD1 99.4740 112.4680 74.7660 H 175 ARG175 0.0711 2739 HD2 99.3740 111.5110 73.2990 H 175 ARG175 0.0711 2740 HE 99.6290 110.5120 76.0750 H 175 ARG175 0.3153 2741 HH11 99.4320 107.9350 73.0580 H 175 ARG175 0.3114 2742 HH12 99.2170 109.6040 72.6850 H 175 ARG175 0.3114 2743 HH21 99.8740 107.2760 75.0950 H 175 ARG175 0.3114 2744 HH22 99.9610 108.4040 76.4160 H 175 ARG175 0.3114 2745 N 94.9730 108.0350 73.9940 N.am 176 GLN176 -0.2456 2746 CA 94.6490 106.7000 73.4910 C.3 176 GLN176 0.0882 2747 C 93.1860 106.5910 73.0580 C.2 176 GLN176 0.2187 2748 O 92.8760 105.8700 72.0970 O.2 176 GLN176 -0.2778 2749 CB 94.9800 105.6180 74.5340 C.3 176 GLN176 -0.0210 2750 CG 96.4480 105.5910 75.0080 C.3 176 GLN176 0.0225 2751 CD 97.4940 105.5550 73.8820 C.2 176 GLN176 0.1981 2752 OE1 98.4990 106.2550 73.9250 O.2 176 GLN176 -0.2798 2753 NE2 97.2100 104.7080 72.8810 N.am 176 GLN176 -0.2724 2754 H 95.2030 108.1710 74.9790 H 176 GLN176 0.1312 2755 HA 95.2530 106.5450 72.5950 H 176 GLN176 0.0557 2756 HB1 94.7240 104.6390 74.1240 H 176 GLN176 0.0289 2757 HB2 94.3380 105.7510 75.4060 H 176 GLN176 0.0289 2758 HG1 96.6120 104.7250 75.6490 H 176 GLN176 0.0356 2759 HG2 96.6620 106.4640 75.6170 H 176 GLN176 0.0356 2760 HE21 97.8310 104.6300 72.1010 H 176 GLN176 0.1266 2761 HE22 96.3820 104.1480 72.8850 H 176 GLN176 0.1266 2762 N 92.2820 107.3140 73.7320 N.am 177 LEU177 -0.2456 2763 CA 90.8880 107.3660 73.2910 C.3 177 LEU177 0.0880 2764 C 90.7520 108.0130 71.9170 C.2 177 LEU177 0.2187 2765 O 89.9600 107.5490 71.0850 O.2 177 LEU177 -0.2778 2766 CB 90.0830 108.1910 74.3210 C.3 177 LEU177 -0.0266 2767 CG 88.5710 108.3250 74.0230 C.3 177 LEU177 -0.0449 2768 CD1 87.8110 107.0470 74.3890 C.3 177 LEU177 -0.0626 2769 CD2 87.9620 109.5440 74.7320 C.3 177 LEU177 -0.0626 2770 H 92.5690 107.8340 74.5620 H 177 LEU177 0.1312 2771 HA 90.5170 106.3420 73.2370 H 177 LEU177 0.0557 2772 HB1 90.5140 109.1900 74.3760 H 177 LEU177 0.0287 2773 HB2 90.2200 107.7670 75.3160 H 177 LEU177 0.0287 2774 HG 88.4260 108.4980 72.9570 H 177 LEU177 0.0296 2775 HD11 86.7510 107.1390 74.1500 H 177 LEU177 0.0232 2776 HD12 87.8950 106.8340 75.4540 H 177 LEU177 0.0232 2777 HD13 88.1970 106.1870 73.8400 H 177 LEU177 0.0232 2778 HD21 86.9010 109.6430 74.4980 H 177 LEU177 0.0232 2779 HD22 88.4550 110.4650 74.4170 H 177 LEU177 0.0232 2780 HD23 88.0540 109.4760 75.8130 H 177 LEU177 0.0232 2781 N 91.5100 109.0860 71.6670 N.am 178 GLN178 -0.2456 2782 CA 91.4910 109.7150 70.3450 C.3 178 GLN178 0.0882 2783 C 92.0260 108.7720 69.2710 C.2 178 GLN178 0.2187 2784 O 91.4880 108.7220 68.1540 O.2 178 GLN178 -0.2778 2785 CB 92.2030 111.0730 70.3600 C.3 178 GLN178 -0.0210 2786 CG 91.4340 112.1330 71.1690 C.3 178 GLN178 0.0225 2787 CD 90.0120 112.3860 70.6190 C.2 178 GLN178 0.1981 2788 OE1 89.7080 112.1880 69.4460 O.2 178 GLN178 -0.2798 2789 NE2 89.1630 112.8320 71.5570 N.am 178 GLN178 -0.2724 2790 H 92.1050 109.4680 72.4020 H 178 GLN178 0.1312 2791 HA 90.4380 109.8540 70.0990 H 178 GLN178 0.0557 2792 HB1 92.3340 111.4360 69.3390 H 178 GLN178 0.0289 2793 HB2 93.2070 110.9520 70.7700 H 178 GLN178 0.0289 2794 HG1 91.9760 113.0780 71.1590 H 178 GLN178 0.0356 2795 HG2 91.3560 111.8250 72.2120 H 178 GLN178 0.0356 2796 HE21 88.2130 113.0360 71.3280 H 178 GLN178 0.1266 2797 HE22 89.4700 112.9620 72.5000 H 178 GLN178 0.1266 2798 N 93.0650 107.9960 69.6040 N.am 179 ASP179 -0.2451 2799 CA 93.6040 107.0310 68.6460 C.3 179 ASP179 0.0974 2800 C 92.6090 105.9130 68.3320 C.2 179 ASP179 0.2192 2801 O 92.5650 105.4200 67.2000 O.2 179 ASP179 -0.2778 2802 CB 94.9420 106.4850 69.1770 C.3 179 ASP179 0.0576 2803 CG 96.0810 107.3480 68.6180 C.2 179 ASP179 0.1780 2804 OD1 96.8950 106.8420 67.8560 O.co2 179 ASP179 -0.6478 2805 OD2 96.1470 108.5360 68.9020 O.co2 179 ASP179 -0.6478 2806 H 93.4830 108.0780 70.5310 H 179 ASP179 0.1312 2807 HA 93.7450 107.5730 67.7120 H 179 ASP179 0.0563 2808 HB1 95.1130 105.4550 68.8640 H 179 ASP179 0.0394 2809 HB2 94.9780 106.5000 70.2660 H 179 ASP179 0.0394 2810 N 91.8120 105.4900 69.3180 N.am 180 ILE180 -0.2454 2811 CA 90.7500 104.5150 69.0470 C.3 180 ILE180 0.0903 2812 C 89.6660 105.1230 68.1640 C.2 180 ILE180 0.2190 2813 O 89.2750 104.5440 67.1390 O.2 180 ILE180 -0.2778 2814 CB 90.2050 103.9690 70.3900 C.3 180 ILE180 -0.0201 2815 CG1 91.3040 103.2420 71.1920 C.3 180 ILE180 -0.0514 2816 CG2 89.0130 103.0180 70.1860 C.3 180 ILE180 -0.0605 2817 CD1 90.9530 103.0670 72.6750 C.3 180 ILE180 -0.0650 2818 H 91.9430 105.8470 70.2650 H 180 ILE180 0.1312 2819 HA 91.2000 103.6920 68.4900 H 180 ILE180 0.0560 2820 HB 89.8600 104.8230 70.9750 H 180 ILE180 0.0318 2821 HG11 92.2490 103.7780 71.1310 H 180 ILE180 0.0266 2822 HG12 91.5000 102.2680 70.7440 H 180 ILE180 0.0266 2823 HG21 88.6010 102.6740 71.1340 H 180 ILE180 0.0233 2824 HG22 89.2990 102.1410 69.6050 H 180 ILE180 0.0233 2825 HG23 88.2040 103.5090 69.6570 H 180 ILE180 0.0233 2826 HD11 91.7730 102.5910 73.2120 H 180 ILE180 0.0230 2827 HD12 90.0680 102.4470 72.8080 H 180 ILE180 0.0230 2828 HD13 90.7630 104.0300 73.1470 H 180 ILE180 0.0230 2829 N 89.1780 106.3080 68.5420 N.am 181 CYS181 -0.2449 2830 CA 88.0360 106.9070 67.8650 C.3 181 CYS181 0.0965 2831 C 88.3540 107.3440 66.4450 C.2 181 CYS181 0.2195 2832 O 87.4270 107.4660 65.6430 O.2 181 CYS181 -0.2778 2833 CB 87.4910 108.0530 68.7240 C.3 181 CYS181 0.0147 2834 SG 86.8860 107.5040 70.3390 S.3 181 CYS181 -0.1762 2835 H 89.6140 106.8030 69.3200 H 181 CYS181 0.1312 2836 HA 87.2770 106.1310 67.8110 H 181 CYS181 0.0565 2837 HB1 86.6620 108.5380 68.2100 H 181 CYS181 0.0394 2838 HB2 88.2660 108.8000 68.8920 H 181 CYS181 0.0394 2839 HG 86.3690 106.2720 70.2170 H 181 CYS181 0.1017 2840 N 89.6340 107.5290 66.1060 N.am 182 ARG182 -0.2456 2841 CA 90.0050 107.7770 64.7120 C.3 182 ARG182 0.0879 2842 C 89.6510 106.5930 63.8100 C.2 182 ARG182 0.2187 2843 O 88.9680 106.7590 62.7920 O.2 182 ARG182 -0.2778 2844 CB 91.5450 107.9450 64.7500 C.3 182 ARG182 -0.0258 2845 CG 92.2390 108.1930 63.3970 C.3 182 ARG182 -0.0154 2846 CD 93.7300 107.8040 63.4060 C.3 182 ARG182 0.1045 2847 NE 94.4950 108.6020 64.3720 N.pl3 182 ARG182 -0.4450 2848 CZ 95.2270 108.1200 65.3810 C.cat 182 ARG182 0.5062 2849 NH1 95.8760 108.9400 66.1550 N.pl3 182 ARG182 -0.4573 2850 NH2 95.3190 106.8450 65.6310 N.pl3 182 ARG182 -0.4573 2851 H 90.3580 107.4970 66.8240 H 182 ARG182 0.1312 2852 HA 89.4980 108.6780 64.3650 H 182 ARG182 0.0557 2853 HB1 91.9760 107.0490 65.2030 H 182 ARG182 0.0286 2854 HB2 91.8030 108.7540 65.4340 H 182 ARG182 0.0286 2855 HG1 92.1220 109.2380 63.1090 H 182 ARG182 0.0299 2856 HG2 91.7560 107.6110 62.6130 H 182 ARG182 0.0299 2857 HD1 94.1780 107.9860 62.4270 H 182 ARG182 0.0711 2858 HD2 93.8410 106.7370 63.6110 H 182 ARG182 0.0711 2859 HE 94.5190 109.5970 64.3220 H 182 ARG182 0.3153 2860 HH11 96.3430 108.5430 66.9650 H 182 ARG182 0.3114 2861 HH12 95.9310 109.9190 66.0110 H 182 ARG182 0.3114 2862 HH21 95.9130 106.5930 66.4070 H 182 ARG182 0.3114 2863 HH22 94.8440 106.1470 65.1130 H 182 ARG182 0.3114 2864 N 90.0930 105.3840 64.1780 N.am 183 LEU183 -0.2456 2865 CA 89.7490 104.1900 63.4060 C.3 183 LEU183 0.0880 2866 C 88.2600 103.8730 63.4890 C.2 183 LEU183 0.2187 2867 O 87.6700 103.3850 62.5140 O.2 183 LEU183 -0.2778 2868 CB 90.5760 103.0090 63.9440 C.3 183 LEU183 -0.0266 2869 CG 92.0920 103.2850 64.0360 C.3 183 LEU183 -0.0449 2870 CD1 92.8230 102.0650 64.6100 C.3 183 LEU183 -0.0626 2871 CD2 92.6930 103.6890 62.6830 C.3 183 LEU183 -0.0626 2872 H 90.6780 105.2940 65.0090 H 183 LEU183 0.1312 2873 HA 89.9980 104.3870 62.3630 H 183 LEU183 0.0557 2874 HB1 90.4040 102.1320 63.3190 H 183 LEU183 0.0287 2875 HB2 90.2170 102.7450 64.9410 H 183 LEU183 0.0287 2876 HG 92.2590 104.1040 64.7360 H 183 LEU183 0.0296 2877 HD11 93.8900 102.2620 64.7220 H 183 LEU183 0.0232 2878 HD12 92.7090 101.1950 63.9630 H 183 LEU183 0.0232 2879 HD13 92.4320 101.8020 65.5940 H 183 LEU183 0.0232 2880 HD21 93.7700 103.8340 62.7630 H 183 LEU183 0.0232 2881 HD22 92.2670 104.6230 62.3180 H 183 LEU183 0.0232 2882 HD23 92.5160 102.9200 61.9300 H 183 LEU183 0.0232 2883 N 87.6400 104.1310 64.6470 N.am 184 GLU184 -0.2456 2884 CA 86.2020 103.8990 64.7830 C.3 184 GLU184 0.0883 2885 C 85.3950 104.8080 63.8580 C.2 184 GLU184 0.2187 2886 O 84.3970 104.3740 63.2710 O.2 184 GLU184 -0.2778 2887 CB 85.7140 104.1370 66.2140 C.3 184 GLU184 -0.0193 2888 CG 86.2730 103.1450 67.2400 C.3 184 GLU184 0.0356 2889 CD 85.6780 103.4800 68.6070 C.2 184 GLU184 0.1760 2890 OE1 86.0420 104.5110 69.1710 O.co2 184 GLU184 -0.6478 2891 OE2 84.8490 102.7160 69.0880 O.co2 184 GLU184 -0.6478 2892 H 88.1730 104.4910 65.4390 H 184 GLU184 0.1312 2893 HA 86.0100 102.8630 64.4960 H 184 GLU184 0.0557 2894 HB1 84.6240 104.0590 66.2380 H 184 GLU184 0.0290 2895 HB2 85.9420 105.1600 66.5080 H 184 GLU184 0.0290 2896 HG1 87.3550 103.1880 67.3100 H 184 GLU184 0.0374 2897 HG2 86.0060 102.1220 66.9750 H 184 GLU184 0.0374 2898 N 85.8230 106.0650 63.6930 N.am 185 ARG185 -0.2457 2899 CA 85.1520 106.9510 62.7480 C.3 185 ARG185 0.0879 2900 C 85.4880 106.6010 61.3080 C.2 185 ARG185 0.2187 2901 O 84.6640 106.8320 60.4160 O.2 185 ARG185 -0.2778 2902 CB 85.5340 108.3990 63.1220 C.3 185 ARG185 -0.0258 2903 CG 84.8710 108.8460 64.4440 C.3 185 ARG185 -0.0154 2904 CD 85.3340 110.2140 64.9860 C.3 185 ARG185 0.1045 2905 NE 86.6640 110.1020 65.5940 N.pl3 185 ARG185 -0.4450 2906 CZ 87.1910 110.9130 66.5130 C.cat 185 ARG185 0.5062 2907 NH1 88.3720 110.6550 67.0110 N.pl3 185 ARG185 -0.4573 2908 NH2 86.5490 111.9680 66.9370 N.pl3 185 ARG185 -0.4573 2909 H 86.6210 106.4050 64.2300 H 185 ARG185 0.1312 2910 HA 84.0790 106.8200 62.8820 H 185 ARG185 0.0557 2911 HB1 85.2270 109.0830 62.3290 H 185 ARG185 0.0286 2912 HB2 86.6190 108.4780 63.1960 H 185 ARG185 0.0286 2913 HG1 85.0190 108.0930 65.2190 H 185 ARG185 0.0299 2914 HG2 83.7920 108.8820 64.2830 H 185 ARG185 0.0299 2915 HD1 84.6310 110.5480 65.7540 H 185 ARG185 0.0711 2916 HD2 85.3730 110.9670 64.1960 H 185 ARG185 0.0711 2917 HE 87.2180 109.3220 65.3050 H 185 ARG185 0.3153 2918 HH11 88.7810 111.2580 67.6980 H 185 ARG185 0.3114 2919 HH12 88.8750 109.8430 66.7190 H 185 ARG185 0.3114 2920 HH21 86.9610 112.5550 67.6310 H 185 ARG185 0.3114 2921 HH22 85.6500 112.1780 66.5650 H 185 ARG185 0.3114 2922 N 86.6930 106.0810 61.0570 N.am 186 ALA186 -0.2459 2923 CA 87.0430 105.6400 59.7090 C.3 186 ALA186 0.0850 2924 C 86.1930 104.4570 59.2640 C.2 186 ALA186 0.2184 2925 O 85.8830 104.3260 58.0750 O.2 186 ALA186 -0.2778 2926 CB 88.5280 105.2610 59.6920 C.3 186 ALA186 -0.0411 2927 H 87.3730 105.9910 61.8120 H 186 ALA186 0.1312 2928 HA 86.8610 106.4770 59.0330 H 186 ALA186 0.0554 2929 HB1 88.8560 104.9860 58.6890 H 186 ALA186 0.0249 2930 HB2 88.7320 104.4190 60.3530 H 186 ALA186 0.0249 2931 HB3 89.1450 106.0970 60.0240 H 186 ALA186 0.0249 2932 N 85.8110 103.5880 60.1980 N.am 187 VAL187 -0.2454 2933 CA 84.9030 102.4960 59.8570 C.3 187 VAL187 0.0901 2934 C 83.4650 102.9880 59.7790 C.2 187 VAL187 0.2189 2935 O 82.8010 102.8480 58.7470 O.2 187 VAL187 -0.2778 2936 CB 85.0730 101.3680 60.9010 C.3 187 VAL187 -0.0227 2937 CG1 84.0430 100.2380 60.7320 C.3 187 VAL187 -0.0608 2938 CG2 86.4900 100.7740 60.8460 C.3 187 VAL187 -0.0608 2939 H 86.1530 103.6850 61.1540 H 187 VAL187 0.1312 2940 HA 85.1820 102.1100 58.8750 H 187 VAL187 0.0560 2941 HB 84.9340 101.7980 61.8940 H 187 VAL187 0.0315 2942 HG11 84.2140 99.4450 61.4610 H 187 VAL187 0.0233 2943 HG12 84.1040 99.7940 59.7380 H 187 VAL187 0.0233 2944 HG13 83.0230 100.5900 60.8800 H 187 VAL187 0.0233 2945 HG21 86.6280 100.0260 61.6270 H 187 VAL187 0.0233 2946 HG22 87.2600 101.5300 60.9840 H 187 VAL187 0.0233 2947 HG23 86.6750 100.2890 59.8870 H 187 VAL187 0.0233 2948 N 82.9600 103.5650 60.8690 N.am 188 CYS188 -0.2449 2949 CA 81.5790 104.0260 60.9620 C.3 188 CYS188 0.0965 2950 C 81.5850 105.5480 60.9160 C.2 188 CYS188 0.2195 2951 O 82.0390 106.2010 61.8620 O.2 188 CYS188 -0.2778 2952 CB 80.9870 103.5420 62.2930 C.3 188 CYS188 0.0147 2953 SG 80.8760 101.7370 62.3920 S.3 188 CYS188 -0.1762 2954 H 83.5690 103.6900 61.6780 H 188 CYS188 0.1312 2955 HA 80.9950 103.6300 60.1300 H 188 CYS188 0.0565 2956 HB1 79.9880 103.9560 62.4390 H 188 CYS188 0.0394 2957 HB2 81.5930 103.8970 63.1290 H 188 CYS188 0.0394 2958 HG 80.4390 101.3890 63.6070 H 188 CYS188 0.1017 2959 N 81.0720 106.1090 59.8280 N.am 189 ARG189 -0.2456 2960 CA 81.1400 107.5410 59.5830 C.3 189 ARG189 0.0879 2961 C 79.8810 108.2310 60.0900 C.2 189 ARG189 0.2187 2962 O 78.7790 107.6800 60.0010 O.2 189 ARG189 -0.2778 2963 CB 81.3570 107.8060 58.0830 C.3 189 ARG189 -0.0258 2964 CG 82.8050 107.5630 57.6080 C.3 189 ARG189 -0.0154 2965 CD 83.2710 106.0990 57.5620 C.3 189 ARG189 0.1045 2966 NE 82.3860 105.3140 56.6980 N.pl3 189 ARG189 -0.4450 2967 CZ 82.7280 104.1720 56.1050 C.cat 189 ARG189 0.5062 2968 NH1 81.8510 103.5480 55.3670 N.pl3 189 ARG189 -0.4573 2969 NH2 83.9190 103.6560 56.2430 N.pl3 189 ARG189 -0.4573 2970 H 80.6130 105.5140 59.1380 H 189 ARG189 0.1312 2971 HA 81.9880 107.9420 60.1430 H 189 ARG189 0.0557 2972 HB1 81.1300 108.8530 57.8770 H 189 ARG189 0.0286 2973 HB2 80.6440 107.2320 57.4910 H 189 ARG189 0.0286 2974 HG1 83.4890 108.1330 58.2380 H 189 ARG189 0.0299 2975 HG2 82.9100 107.9820 56.6070 H 189 ARG189 0.0299 2976 HD1 83.2870 105.6380 58.5510 H 189 ARG189 0.0711 2977 HD2 84.2880 106.0650 57.1640 H 189 ARG189 0.0711 2978 HE 81.4580 105.6460 56.5440 H 189 ARG189 0.3153 2979 HH11 82.0970 102.6870 54.9290 H 189 ARG189 0.3114 2980 HH12 80.9380 103.9270 55.2450 H 189 ARG189 0.3114 2981 HH21 84.1750 102.8150 55.7760 H 189 ARG189 0.3114 2982 HH22 84.5810 104.1100 56.8380 H 189 ARG189 0.3114 2983 N 80.0720 109.4240 60.6640 N.am 190 ASP190 -0.2451 2984 CA 79.0460 110.3530 61.1400 C.3 190 ASP190 0.0974 2985 H3 79.6014 111.2037 61.5335 H 190 ASP190 0.0563 2986 C 78.2060 109.8040 62.2870 C.2 190 ASP190 0.2192 2987 O 77.1190 110.3320 62.5510 O.2 190 ASP190 -0.2778 2988 CB 78.2284 110.8267 59.9232 C.3 190 ASP190 0.0576 2989 H2 77.6036 111.6827 60.1732 H 190 ASP190 0.0394 2990 H1 77.5751 110.0355 59.5562 H 190 ASP190 0.0394 2991 CG 79.2033 111.2347 58.7967 C.2 190 ASP190 0.1780 2992 OD1 79.2072 110.5946 57.7442 O.co2 190 ASP190 -0.6478 2993 OD2 79.9620 112.1821 58.9952 O.co2 190 ASP190 -0.6478 2994 H 81.0410 109.7190 60.7830 H 190 ASP190 0.1312 2995 N 78.6720 108.7650 62.9830 N.am 191 GLU191 -0.2456 2996 CA 77.9190 108.1890 64.0840 C.3 191 GLU191 0.0885 2997 C 78.9110 107.6260 65.0970 C.2 191 GLU191 0.2214 2998 O 79.8210 106.8690 64.7130 O.2 191 GLU191 -0.2776 2999 CB 76.8840 107.1120 63.6700 C.3 191 GLU191 -0.0192 3000 CG 75.5520 107.1200 64.4830 C.3 191 GLU191 0.0356 3001 CD 75.5360 106.4800 65.9020 C.2 191 GLU191 0.1760 3002 OE1 76.0050 105.3630 66.0790 O.co2 191 GLU191 -0.6478 3003 OE2 75.0340 107.0910 66.8480 O.co2 191 GLU191 -0.6478 3004 H 79.5780 108.3660 62.7360 H 191 GLU191 0.1312 3005 HA 77.3770 109.0200 64.5310 H 191 GLU191 0.0557 3006 HB1 77.3220 106.1130 63.6650 H 191 GLU191 0.0290 3007 HB2 76.6150 107.3080 62.6320 H 191 GLU191 0.0290 3008 HG1 74.8020 106.5760 63.9110 H 191 GLU191 0.0374 3009 HG2 75.1780 108.1400 64.5620 H 191 GLU191 0.0374 3010 N 78.7810 107.9760 66.3780 N.am 192 PRO192 -0.2316 3011 CA 79.6970 107.4340 67.3940 C.3 192 PRO192 0.0907 3012 C 79.3900 105.9710 67.6780 C.2 192 PRO192 0.2190 3013 O 78.2530 105.6090 67.9860 O.2 192 PRO192 -0.2778 3014 CB 79.4740 108.3440 68.6050 C.3 192 PRO192 -0.0276 3015 CG 78.0710 108.9120 68.4150 C.3 192 PRO192 -0.0379 3016 CD 77.8330 108.9530 66.9050 C.3 192 PRO192 0.0071 3017 HA 80.7180 107.5250 67.0210 H 192 PRO192 0.0559 3018 HB1 80.1950 109.1600 68.5730 H 192 PRO192 0.0285 3019 HB2 79.5990 107.8350 69.5620 H 192 PRO192 0.0285 3020 HG1 77.9340 109.8820 68.8920 H 192 PRO192 0.0278 3021 HG2 77.3670 108.2210 68.8610 H 192 PRO192 0.0278 3022 HD1 76.8170 108.6940 66.6250 H 192 PRO192 0.0431 3023 HD2 78.1000 109.9220 66.4830 H 192 PRO192 0.0431 3024 N 80.4150 105.1310 67.5620 N.am 193 SER193 -0.2436 3025 CA 80.2610 103.6920 67.7060 C.3 193 SER193 0.1109 3026 C 79.9190 103.3210 69.1450 C.2 193 SER193 0.2209 3027 O 80.1440 104.0870 70.0850 O.2 193 SER193 -0.2777 3028 CB 81.6000 103.0230 67.3430 C.3 193 SER193 0.0681 3029 OG 81.4970 101.6040 67.4220 O.3 193 SER193 -0.3930 3030 H 81.3410 105.5090 67.3650 H 193 SER193 0.1312 3031 HA 79.4630 103.3700 67.0350 H 193 SER193 0.0580 3032 HB1 82.3870 103.3960 68.0140 H 193 SER193 0.0577 3033 HB2 81.8810 103.3100 66.3250 H 193 SER193 0.0577 3034 HG 82.3620 101.2020 67.3500 H 193 SER193 0.2095 3035 N 79.3540 102.1200 69.3050 N.am 194 ALA194 -0.2459 3036 CA 78.9410 101.6410 70.6200 C.3 194 ALA194 0.0850 3037 C 80.1210 101.3980 71.5500 C.2 194 ALA194 0.2184 3038 O 79.9440 101.4170 72.7720 O.2 194 ALA194 -0.2778 3039 CB 78.1340 100.3510 70.4390 C.3 194 ALA194 -0.0411 3040 H 79.2080 101.5250 68.4890 H 194 ALA194 0.1312 3041 HA 78.3140 102.4160 71.0620 H 194 ALA194 0.0554 3042 HB1 77.7630 99.9750 71.3940 H 194 ALA194 0.0249 3043 HB2 78.7390 99.5670 69.9810 H 194 ALA194 0.0249 3044 HB3 77.2730 100.5210 69.7940 H 194 ALA194 0.0249 3045 N 81.3160 101.1680 71.0060 N.am 195 LEU195 -0.2457 3046 CA 82.5040 101.1130 71.8470 C.3 195 LEU195 0.0880 3047 C 82.9850 102.5090 72.2120 C.2 195 LEU195 0.2187 3048 O 83.3360 102.7620 73.3710 O.2 195 LEU195 -0.2778 3049 CB 83.5760 100.3260 71.0710 C.3 195 LEU195 -0.0266 3050 CG 84.9680 100.2900 71.7270 C.3 195 LEU195 -0.0449 3051 CD1 84.9330 99.6560 73.1250 C.3 195 LEU195 -0.0626 3052 CD2 85.9760 99.5700 70.8240 C.3 195 LEU195 -0.0626 3053 H 81.3990 101.0300 69.9990 H 195 LEU195 0.1312 3054 HA 82.2540 100.5820 72.7660 H 195 LEU195 0.0557 3055 HB1 83.6710 100.7530 70.0720 H 195 LEU195 0.0287 3056 HB2 83.2240 99.3070 70.9170 H 195 LEU195 0.0287 3057 HG 85.3200 101.3160 71.8190 H 195 LEU195 0.0296 3058 HD11 85.9310 99.6220 73.5610 H 195 LEU195 0.0232 3059 HD12 84.5520 98.6360 73.0820 H 195 LEU195 0.0232 3060 HD13 84.3000 100.2260 73.8030 H 195 LEU195 0.0232 3061 HD21 86.9750 99.5870 71.2590 H 195 LEU195 0.0232 3062 HD22 86.0350 100.0560 69.8490 H 195 LEU195 0.0232 3063 HD23 85.6930 98.5290 70.6630 H 195 LEU195 0.0232 3064 N 82.9870 103.4250 71.2380 N.am 196 ALA196 -0.2459 3065 CA 83.5120 104.7680 71.4620 C.3 196 ALA196 0.0850 3066 C 82.6400 105.5590 72.4270 C.2 196 ALA196 0.2184 3067 O 83.1550 106.3580 73.2150 O.2 196 ALA196 -0.2778 3068 CB 83.3960 105.5390 70.1310 C.3 196 ALA196 -0.0411 3069 H 82.6140 103.1800 70.3210 H 196 ALA196 0.1312 3070 HA 84.5450 104.6860 71.8030 H 196 ALA196 0.0554 3071 HB1 84.0330 106.4240 70.1310 H 196 ALA196 0.0249 3072 HB2 82.3740 105.8590 69.9170 H 196 ALA196 0.0249 3073 HB3 83.6680 104.9310 69.2780 H 196 ALA196 0.0249 3074 N 81.3240 105.3240 72.4030 N.am 197 ARG197 -0.2457 3075 CA 80.4180 106.0050 73.3240 C.3 197 ARG197 0.0879 3076 C 80.6680 105.5810 74.7690 C.2 197 ARG197 0.2187 3077 O 80.7690 106.4320 75.6640 O.2 197 ARG197 -0.2778 3078 CB 79.0440 105.6270 72.6930 C.3 197 ARG197 -0.0258 3079 CG 77.7690 106.3790 73.1210 C.3 197 ARG197 -0.0154 3080 CD 76.8580 106.8410 71.9440 C.3 197 ARG197 0.1045 3081 NE 76.6170 105.8190 70.9070 N.pl3 197 ARG197 -0.4450 3082 CZ 75.9150 106.0420 69.7790 C.cat 197 ARG197 0.5062 3083 NH1 75.2810 107.1560 69.5600 N.pl3 197 ARG197 -0.4573 3084 NH2 75.8500 105.1500 68.8360 N.pl3 197 ARG197 -0.4573 3085 H 80.9460 104.6570 71.7300 H 197 ARG197 0.1312 3086 HA 80.5970 107.0760 73.2230 H 197 ARG197 0.0557 3087 HB1 78.8810 104.5510 72.7810 H 197 ARG197 0.0286 3088 HB2 79.1510 105.8010 71.6210 H 197 ARG197 0.0286 3089 HG1 78.0480 107.2560 73.7070 H 197 ARG197 0.0299 3090 HG2 77.1970 105.7430 73.7970 H 197 ARG197 0.0299 3091 HD1 77.3290 107.6870 71.4370 H 197 ARG197 0.0711 3092 HD2 75.8880 107.1750 72.3200 H 197 ARG197 0.0711 3093 HE 77.0030 104.9000 70.9510 H 197 ARG197 0.3153 3094 HH11 74.9060 107.2520 68.6260 H 197 ARG197 0.3114 3095 HH12 75.1780 107.8730 70.2340 H 197 ARG197 0.3114 3096 HH21 75.4840 105.4410 67.9320 H 197 ARG197 0.3114 3097 HH22 76.1790 104.2210 68.9200 H 197 ARG197 0.3114 3098 N 80.8160 104.2750 75.0050 N.am 198 ALA198 -0.2459 3099 CA 81.0870 103.7820 76.3520 C.3 198 ALA198 0.0850 3100 C 82.4730 104.1950 76.8280 C.2 198 ALA198 0.2184 3101 O 82.6560 104.5260 78.0060 O.2 198 ALA198 -0.2778 3102 CB 80.9650 102.2540 76.3320 C.3 198 ALA198 -0.0411 3103 H 80.7390 103.6130 74.2330 H 198 ALA198 0.1312 3104 HA 80.3410 104.2170 77.0190 H 198 ALA198 0.0554 3105 HB1 81.1290 101.8270 77.3210 H 198 ALA198 0.0249 3106 HB2 81.6840 101.8080 75.6420 H 198 ALA198 0.0249 3107 HB3 79.9700 101.9530 76.0020 H 198 ALA198 0.0249 3108 N 83.4560 104.2070 75.9220 N.am 199 LEU199 -0.2457 3109 CA 84.8040 104.6030 76.3150 C.3 199 LEU199 0.0880 3110 C 84.8850 106.0920 76.6280 C.2 199 LEU199 0.2187 3111 O 85.5670 106.4850 77.5810 O.2 199 LEU199 -0.2778 3112 CB 85.7850 104.3240 75.1590 C.3 199 LEU199 -0.0266 3113 CG 86.1200 102.8470 74.9010 C.3 199 LEU199 -0.0449 3114 CD1 86.8670 102.7230 73.5650 C.3 199 LEU199 -0.0626 3115 CD2 86.9680 102.2430 76.0280 C.3 199 LEU199 -0.0626 3116 H 83.2640 103.9390 74.9570 H 199 LEU199 0.1312 3117 HA 85.0900 104.0580 77.2080 H 199 LEU199 0.0557 3118 HB1 86.7310 104.8330 75.3420 H 199 LEU199 0.0287 3119 HB2 85.3810 104.7660 74.2450 H 199 LEU199 0.0287 3120 HG 85.1960 102.2760 74.8250 H 199 LEU199 0.0296 3121 HD11 87.1050 101.6850 73.3330 H 199 LEU199 0.0232 3122 HD12 87.8050 103.2800 73.5820 H 199 LEU199 0.0232 3123 HD13 86.2710 103.1190 72.7410 H 199 LEU199 0.0232 3124 HD21 87.1990 101.1980 75.8200 H 199 LEU199 0.0232 3125 HD22 86.4560 102.2820 76.9860 H 199 LEU199 0.0232 3126 HD23 87.9140 102.7760 76.1320 H 199 LEU199 0.0232 3127 N 84.1710 106.9380 75.8750 N.am 200 THR200 -0.2434 3128 CA 84.2250 108.3610 76.1890 C.3 200 THR200 0.1135 3129 C 83.3880 108.6910 77.4190 C.2 200 THR200 0.2212 3130 O 83.7240 109.6310 78.1470 O.2 200 THR200 -0.2777 3131 CB 83.8540 109.2100 74.9590 C.3 200 THR200 0.0763 3132 OG1 84.2850 110.5400 75.1990 O.3 200 THR200 -0.3900 3133 CG2 82.3560 109.1770 74.6180 C.3 200 THR200 -0.0370 3134 H 83.6030 106.5950 75.1000 H 200 THR200 0.1313 3135 HA 85.2630 108.6000 76.4280 H 200 THR200 0.0583 3136 HB 84.4210 108.8010 74.1140 H 200 THR200 0.0611 3137 HG1 84.0850 111.1000 74.4560 H 200 THR200 0.2098 3138 HG21 82.1460 109.6690 73.6680 H 200 THR200 0.0255 3139 HG22 81.7590 109.6660 75.3880 H 200 THR200 0.0255 3140 HG23 82.0110 108.1530 74.5300 H 200 THR200 0.0255 3141 N 82.3530 107.8960 77.7210 N.am 201 TRP201 -0.2453 3142 CA 81.6530 108.0970 78.9850 C.3 201 TRP201 0.0918 3143 C 82.5110 107.6700 80.1680 C.2 201 TRP201 0.2190 3144 O 82.4930 108.3250 81.2160 O.2 201 TRP201 -0.2778 3145 CB 80.3230 107.3190 78.9330 C.3 201 TRP201 -0.0021 3146 CG 79.6600 107.1910 80.2960 C.ar 201 TRP201 -0.0260 3147 CD1 79.2260 105.9910 80.8650 C.ar 201 TRP201 -0.0136 3148 CD2 79.3830 108.2260 81.2680 C.ar 201 TRP201 -0.0028 3149 NE1 78.7370 106.2300 82.1060 N.ar 201 TRP201 -0.2641 3150 CE2 78.8220 107.5840 82.3980 C.ar 201 TRP201 0.0269 3151 CE3 79.5750 109.5840 81.2830 C.ar 201 TRP201 -0.0528 3152 CZ2 78.4730 108.3160 83.5010 C.ar 201 TRP201 -0.0430 3153 CZ3 79.2330 110.3300 82.4110 C.ar 201 TRP201 -0.0611 3154 CH2 78.6800 109.6950 83.5220 C.ar 201 TRP201 -0.0602 3155 H 82.0590 107.1620 77.0770 H 201 TRP201 0.1312 3156 HA 81.4540 109.1650 79.0800 H 201 TRP201 0.0560 3157 HB1 80.5040 106.3160 78.5450 H 201 TRP201 0.0334 3158 HB2 79.6320 107.7980 78.2390 H 201 TRP201 0.0334 3159 HD1 79.2800 105.0220 80.3900 H 201 TRP201 0.0748 3160 HE1 78.3620 105.5520 82.7060 H 201 TRP201 0.1331 3161 HE3 79.9940 110.0860 80.4260 H 201 TRP201 0.0624 3162 HZ2 78.0320 107.8220 84.3540 H 201 TRP201 0.0633 3163 HZ3 79.3880 111.3990 82.4180 H 201 TRP201 0.0618 3164 HH2 78.4010 110.2730 84.3910 H 201 TRP201 0.0618 3165 N 83.2720 106.5820 80.0200 N.am 202 ARG202 -0.2456 3166 CA 84.1610 106.1500 81.0950 C.3 202 ARG202 0.0879 3167 C 85.2920 107.1500 81.3180 C.2 202 ARG202 0.2187 3168 O 85.6450 107.4510 82.4670 O.2 202 ARG202 -0.2778 3169 CB 84.6880 104.7810 80.6290 C.3 202 ARG202 -0.0258 3170 CG 85.6540 104.0720 81.5860 C.3 202 ARG202 -0.0154 3171 CD 86.2060 102.7580 81.0030 C.3 202 ARG202 0.1045 3172 NE 85.1800 101.7060 80.9400 N.pl3 202 ARG202 -0.4450 3173 CZ 84.4220 101.4150 79.8810 C.cat 202 ARG202 0.5062 3174 NH1 83.5780 100.4200 79.9500 N.pl3 202 ARG202 -0.4573 3175 NH2 84.4990 102.0970 78.7730 N.pl3 202 ARG202 -0.4573 3176 H 83.2320 106.0500 79.1510 H 202 ARG202 0.1312 3177 HA 83.5700 106.0630 82.0080 H 202 ARG202 0.0557 3178 HB1 85.1730 104.9020 79.6590 H 202 ARG202 0.0286 3179 HB2 83.8250 104.1390 80.4540 H 202 ARG202 0.0286 3180 HG1 85.1620 103.8820 82.5410 H 202 ARG202 0.0299 3181 HG2 86.4950 104.7320 81.8010 H 202 ARG202 0.0299 3182 HD1 86.9970 102.3720 81.6510 H 202 ARG202 0.0711 3183 HD2 86.6590 102.9040 80.0190 H 202 ARG202 0.0711 3184 HE 85.0300 101.1440 81.7520 H 202 ARG202 0.3153 3185 HH11 83.0070 100.1980 79.1620 H 202 ARG202 0.3114 3186 HH12 83.4990 99.8760 80.7820 H 202 ARG202 0.3114 3187 HH21 83.9360 101.8670 77.9830 H 202 ARG202 0.3114 3188 HH22 85.1310 102.8650 78.7150 H 202 ARG202 0.3114 3189 N 85.8420 107.7080 80.2310 N.am 203 GLN203 -0.2456 3190 CA 86.8460 108.7640 80.3530 C.3 203 GLN203 0.0882 3191 C 86.2720 110.0190 81.0020 C.2 203 GLN203 0.2187 3192 O 86.9330 110.6430 81.8390 O.2 203 GLN203 -0.2778 3193 CB 87.4120 109.0850 78.9570 C.3 203 GLN203 -0.0210 3194 CG 88.3800 108.0050 78.4450 C.3 203 GLN203 0.0225 3195 CD 89.6550 107.9710 79.2950 C.2 203 GLN203 0.1981 3196 OE1 89.8870 107.0540 80.0710 O.2 203 GLN203 -0.2798 3197 NE2 90.4550 109.0310 79.1010 N.am 203 GLN203 -0.2724 3198 H 85.5560 107.3910 79.3050 H 203 GLN203 0.1312 3199 HA 87.6310 108.3940 81.0140 H 203 GLN203 0.0557 3200 HB1 87.9240 110.0490 78.9650 H 203 GLN203 0.0289 3201 HB2 86.5870 109.2000 78.2530 H 203 GLN203 0.0289 3202 HG1 88.6690 108.1920 77.4130 H 203 GLN203 0.0356 3203 HG2 87.9180 107.0190 78.4690 H 203 GLN203 0.0356 3204 HE21 91.3080 109.1090 79.6150 H 203 GLN203 0.1266 3205 HE22 90.2140 109.7480 78.4480 H 203 GLN203 0.1266 3206 N 85.0410 110.4000 80.6380 N.am 204 ALA204 -0.2459 3207 CA 84.4390 111.6030 81.2040 C.3 204 ALA204 0.0850 3208 C 84.1210 111.4270 82.6820 C.2 204 ALA204 0.2184 3209 O 84.3220 112.3520 83.4760 O.2 204 ALA204 -0.2778 3210 CB 83.1600 111.9140 80.4190 C.3 204 ALA204 -0.0411 3211 H 84.5200 109.8450 79.9600 H 204 ALA204 0.1312 3212 HA 85.1580 112.4180 81.0930 H 204 ALA204 0.0554 3213 HB1 82.6760 112.8190 80.7880 H 204 ALA204 0.0249 3214 HB2 82.4420 111.0950 80.4870 H 204 ALA204 0.0249 3215 HB3 83.3840 112.0670 79.3630 H 204 ALA204 0.0249 3216 N 83.6420 110.2410 83.0700 N.am 205 ARG205 -0.2457 3217 CA 83.3780 109.9650 84.4790 C.3 205 ARG205 0.0879 3218 C 84.6660 109.9420 85.2900 C.2 205 ARG205 0.2187 3219 O 84.7000 110.4550 86.4140 O.2 205 ARG205 -0.2778 3220 CB 82.6600 108.6120 84.6560 C.3 205 ARG205 -0.0258 3221 CG 82.0140 108.4640 86.0540 C.3 205 ARG205 -0.0154 3222 CD 82.1510 107.0750 86.7040 C.3 205 ARG205 0.1045 3223 NE 83.4960 106.9000 87.2690 N.pl3 205 ARG205 -0.4450 3224 CZ 83.8280 105.9840 88.1880 C.cat 205 ARG205 0.5062 3225 NH1 85.0550 105.9110 88.6240 N.pl3 205 ARG205 -0.4573 3226 NH2 82.9580 105.1430 88.6820 N.pl3 205 ARG205 -0.4573 3227 H 83.4590 109.5200 82.3730 H 205 ARG205 0.1312 3228 HA 82.7470 110.7790 84.8420 H 205 ARG205 0.0557 3229 HB1 83.3540 107.7940 84.4550 H 205 ARG205 0.0286 3230 HB2 81.8810 108.5180 83.8970 H 205 ARG205 0.0286 3231 HG1 80.9550 108.7110 85.9610 H 205 ARG205 0.0299 3232 HG2 82.4130 109.2070 86.7460 H 205 ARG205 0.0299 3233 HD1 81.9650 106.2750 85.9840 H 205 ARG205 0.0711 3234 HD2 81.4250 106.9880 87.5170 H 205 ARG205 0.0711 3235 HE 84.2220 107.5110 86.9550 H 205 ARG205 0.3153 3236 HH11 85.2830 105.2160 89.3090 H 205 ARG205 0.3114 3237 HH12 85.7590 106.5300 88.2890 H 205 ARG205 0.3114 3238 HH21 83.2600 104.4810 89.3720 H 205 ARG205 0.3114 3239 HH22 82.0090 105.1580 88.3840 H 205 ARG205 0.3114 3240 N 85.7470 109.3950 84.7240 N.am 206 ALA206 -0.2459 3241 CA 87.0220 109.3810 85.4370 C.3 206 ALA206 0.0850 3242 C 87.6060 110.7830 85.5820 C.2 206 ALA206 0.2184 3243 O 88.1230 111.1320 86.6500 O.2 206 ALA206 -0.2778 3244 CB 87.9940 108.4900 84.6540 C.3 206 ALA206 -0.0411 3245 H 85.6810 108.9860 83.7920 H 206 ALA206 0.1312 3246 HA 86.8470 108.9730 86.4330 H 206 ALA206 0.0554 3247 HB1 88.9630 108.4220 85.1520 H 206 ALA206 0.0249 3248 HB2 88.1610 108.8740 83.6460 H 206 ALA206 0.0249 3249 HB3 87.6000 107.4790 84.5560 H 206 ALA206 0.0249 3250 N 87.5090 111.6070 84.5320 N.am 207 GLN207 -0.2456 3251 CA 88.0110 112.9780 84.6070 C.3 207 GLN207 0.0882 3252 C 87.1910 113.8260 85.5730 C.2 207 GLN207 0.2187 3253 O 87.7550 114.6150 86.3400 O.2 207 GLN207 -0.2778 3254 CB 87.9780 113.5740 83.1900 C.3 207 GLN207 -0.0210 3255 CG 89.0120 112.9170 82.2570 C.3 207 GLN207 0.0225 3256 CD 88.8050 113.3250 80.7910 C.2 207 GLN207 0.1981 3257 OE1 88.0440 114.2280 80.4720 O.2 207 GLN207 -0.2798 3258 NE2 89.5290 112.6020 79.9230 N.am 207 GLN207 -0.2724 3259 H 87.0800 111.2740 83.6690 H 207 GLN207 0.1312 3260 HA 89.0370 112.9390 84.9780 H 207 GLN207 0.0557 3261 HB1 88.1690 114.6480 83.2250 H 207 GLN207 0.0289 3262 HB2 86.9730 113.4530 82.7800 H 207 GLN207 0.0289 3263 HG1 88.9540 111.8320 82.3130 H 207 GLN207 0.0356 3264 HG2 90.0220 113.1970 82.5550 H 207 GLN207 0.0356 3265 HE21 89.4580 112.8060 78.9470 H 207 GLN207 0.1266 3266 HE22 90.1350 111.8690 80.2290 H 207 GLN207 0.1266 3267 N 85.8660 113.6610 85.5750 N.am 208 ALA208 -0.2459 3268 CA 85.0330 114.4280 86.4950 C.3 208 ALA208 0.0850 3269 C 85.2240 113.9700 87.9360 C.2 208 ALA208 0.2182 3270 O 85.2280 114.7970 88.8530 O.2 208 ALA208 -0.2778 3271 CB 83.5700 114.2570 86.0720 C.3 208 ALA208 -0.0411 3272 H 85.4350 112.9970 84.9320 H 208 ALA208 0.1312 3273 HA 85.3260 115.4770 86.4190 H 208 ALA208 0.0554 3274 HB1 82.9000 114.8300 86.7140 H 208 ALA208 0.0249 3275 HB2 83.2650 113.2100 86.1100 H 208 ALA208 0.0249 3276 HB3 83.4230 114.6030 85.0480 H 208 ALA208 0.0249 3277 N 85.4170 112.6670 88.1560 N.am 209 GLY209 -0.2485 3278 CA 85.6660 112.1860 89.5050 C.3 209 GLY209 0.0765 3279 C 87.0250 112.5960 90.0390 C.2 209 GLY209 0.2155 3280 O 87.1710 112.8730 91.2320 O.2 209 GLY209 -0.2781 3281 H 85.3900 112.0090 87.3770 H 209 GLY209 0.1309 3282 HA1 85.6030 111.1000 89.4740 H 209 GLY209 0.0521 3283 HA2 84.8810 112.5640 90.1620 H 209 GLY209 0.0521 3284 N 88.0340 112.6570 89.1660 N.am 210 ALA210 -0.2462 3285 CA 89.3440 113.1300 89.5990 C.3 210 ALA210 0.0850 3286 C 89.3400 114.6340 89.8360 C.2 210 ALA210 0.2184 3287 O 90.0420 115.1230 90.7270 O.2 210 ALA210 -0.2778 3288 CB 90.3670 112.7700 88.5140 C.3 210 ALA210 -0.0411 3289 H 87.8890 112.3730 88.1970 H 210 ALA210 0.1311 3290 HA 89.5950 112.6300 90.5360 H 210 ALA210 0.0554 3291 HB1 91.3720 113.0880 88.7940 H 210 ALA210 0.0249 3292 HB2 90.1160 113.2410 87.5620 H 210 ALA210 0.0249 3293 HB3 90.3920 111.6930 88.3490 H 210 ALA210 0.0249 3294 N 88.5750 115.3840 89.0340 N.am 211 MET211 -0.2456 3295 CA 88.4270 116.8190 89.2620 C.3 211 MET211 0.0885 3296 C 87.7040 117.1000 90.5720 C.2 211 MET211 0.2187 3297 O 88.0880 118.0030 91.3220 O.2 211 MET211 -0.2778 3298 CB 87.6550 117.4110 88.0720 C.3 211 MET211 -0.0199 3299 CG 87.5470 118.9420 88.1030 C.3 211 MET211 -0.0047 3300 SD 89.1670 119.7370 88.0770 S.3 211 MET211 -0.1641 3301 CE 89.6390 119.3750 86.3760 C.3 211 MET211 -0.0181 3302 H 88.0880 114.9470 88.2520 H 211 MET211 0.1312 3303 HA 89.4310 117.2430 89.3180 H 211 MET211 0.0557 3304 HB1 86.6550 116.9770 88.0280 H 211 MET211 0.0293 3305 HB2 88.1460 117.1100 87.1460 H 211 MET211 0.0293 3306 HG1 86.9950 119.2860 88.9780 H 211 MET211 0.0377 3307 HG2 86.9800 119.2800 87.2350 H 211 MET211 0.0377 3308 HE1 90.4240 120.0570 86.0510 H 211 MET211 0.0340 3309 HE2 88.7870 119.5090 85.7100 H 211 MET211 0.0340 3310 HE3 89.9890 118.3460 86.2860 H 211 MET211 0.0340 3311 N 86.6580 116.3300 90.8650 N.am 212 LEU212 -0.2456 3312 CA 85.8570 116.5630 92.0560 C.3 212 LEU212 0.0880 3313 C 86.5300 116.0310 93.3150 C.2 212 LEU212 0.2187 3314 O 86.2670 116.5380 94.4090 O.2 212 LEU212 -0.2778 3315 CB 84.5070 115.8540 91.8350 C.3 212 LEU212 -0.0266 3316 CG 83.4180 116.1930 92.8720 C.3 212 LEU212 -0.0449 3317 CD1 82.8640 117.6080 92.6600 C.3 212 LEU212 -0.0626 3318 CD2 82.2810 115.1660 92.8190 C.3 212 LEU212 -0.0626 3319 H 86.4130 115.5610 90.2410 H 212 LEU212 0.1312 3320 HA 85.7170 117.6400 92.1570 H 212 LEU212 0.0557 3321 HB1 84.6770 114.7760 91.8180 H 212 LEU212 0.0287 3322 HB2 84.1280 116.1030 90.8430 H 212 LEU212 0.0287 3323 HG 83.8490 116.1430 93.8720 H 212 LEU212 0.0296 3324 HD11 82.1500 117.8710 93.4410 H 212 LEU212 0.0232 3325 HD12 82.3520 117.6880 91.7000 H 212 LEU212 0.0232 3326 HD13 83.6540 118.3550 92.6710 H 212 LEU212 0.0232 3327 HD21 81.5160 115.3890 93.5630 H 212 LEU212 0.0232 3328 HD22 82.6510 114.1600 93.0170 H 212 LEU212 0.0232 3329 HD23 81.8020 115.1600 91.8390 H 212 LEU212 0.0232 3330 N 87.4080 115.0310 93.1860 N.am 213 LEU213 -0.2456 3331 CA 88.0230 114.4250 94.3630 C.3 213 LEU213 0.0880 3332 C 89.1220 115.3010 94.9490 C.2 213 LEU213 0.2187 3333 O 89.2610 115.3780 96.1720 O.2 213 LEU213 -0.2778 3334 CB 88.5570 113.0240 93.9990 C.3 213 LEU213 -0.0266 3335 CG 89.2160 112.2460 95.1650 C.3 213 LEU213 -0.0449 3336 CD1 88.9280 110.7390 95.0660 C.3 213 LEU213 -0.0626 3337 CD2 90.7370 112.4730 95.2360 C.3 213 LEU213 -0.0626 3338 H 87.6500 114.6880 92.2560 H 213 LEU213 0.1312 3339 HA 87.2450 114.3200 95.1220 H 213 LEU213 0.0557 3340 HB1 89.2420 113.0870 93.1520 H 213 LEU213 0.0287 3341 HB2 87.7030 112.4490 93.6380 H 213 LEU213 0.0287 3342 HG 88.7750 112.5900 96.1020 H 213 LEU213 0.0296 3343 HD11 89.3670 110.1980 95.9060 H 213 LEU213 0.0232 3344 HD12 89.3360 110.3180 94.1470 H 213 LEU213 0.0232 3345 HD13 87.8550 110.5420 95.0780 H 213 LEU213 0.0232 3346 HD21 91.1770 111.9060 96.0560 H 213 LEU213 0.0232 3347 HD22 90.9960 113.5180 95.3980 H 213 LEU213 0.0232 3348 HD23 91.2240 112.1520 94.3150 H 213 LEU213 0.0232 3349 N 89.9300 115.9420 94.1070 N.am 214 PHE214 -0.2453 3350 CA 90.9710 116.8180 94.6340 C.3 214 PHE214 0.0917 3351 C 90.3890 118.1180 95.1680 C.2 214 PHE214 0.2188 3352 O 90.7590 118.5610 96.2610 O.2 214 PHE214 -0.2778 3353 CB 92.0230 117.0830 93.5420 C.3 214 PHE214 -0.0036 3354 CG 93.0340 115.9670 93.4510 C.ar 214 PHE214 -0.0454 3355 CD1 94.3180 116.1420 93.9620 C.ar 214 PHE214 -0.0585 3356 CD2 92.7060 114.7480 92.8650 C.ar 214 PHE214 -0.0585 3357 CE1 95.2570 115.1220 93.8810 C.ar 214 PHE214 -0.0615 3358 CE2 93.6420 113.7250 92.7850 C.ar 214 PHE214 -0.0615 3359 CZ 94.9210 113.9130 93.2900 C.ar 214 PHE214 -0.0617 3360 H 89.8220 115.8210 93.1000 H 214 PHE214 0.1312 3361 HA 91.4390 116.3150 95.4780 H 214 PHE214 0.0560 3362 HB1 92.5610 118.0110 93.7430 H 214 PHE214 0.0333 3363 HB2 91.5390 117.2180 92.5740 H 214 PHE214 0.0333 3364 HD1 94.5950 117.0770 94.4250 H 214 PHE214 0.0620 3365 HD2 91.7130 114.5880 92.4730 H 214 PHE214 0.0620 3366 HE1 96.2510 115.2790 94.2740 H 214 PHE214 0.0618 3367 HE2 93.3710 112.7840 92.3310 H 214 PHE214 0.0618 3368 HZ 95.6540 113.1220 93.2240 H 214 PHE214 0.0618 3369 N 89.4410 118.7100 94.4420 N.am 215 GLY215 -0.2485 3370 CA 88.9600 120.0340 94.8030 C.3 215 GLY215 0.0765 3371 C 88.0720 120.0480 96.0340 C.2 215 GLY215 0.2155 3372 O 88.0780 121.0160 96.7980 O.2 215 GLY215 -0.2781 3373 H 89.0510 118.2320 93.6300 H 215 GLY215 0.1309 3374 HA1 88.3910 120.4050 93.9510 H 215 GLY215 0.0521 3375 HA2 89.8180 120.6900 94.9560 H 215 GLY215 0.0521 3376 N 87.2970 118.9900 96.2430 N.am 216 LEU216 -0.2459 3377 CA 86.3520 118.9510 97.3520 C.3 216 LEU216 0.0880 3378 C 86.8630 118.1670 98.5530 C.2 216 LEU216 0.2187 3379 O 86.1850 118.1350 99.5810 O.2 216 LEU216 -0.2778 3380 CB 85.0140 118.3500 96.8690 C.3 216 LEU216 -0.0266 3381 CG 84.1490 119.2650 95.9750 C.3 216 LEU216 -0.0449 3382 CD1 83.5690 120.4490 96.7600 C.3 216 LEU216 -0.0626 3383 CD2 84.8530 119.7480 94.6990 C.3 216 LEU216 -0.0626 3384 H 87.3640 118.1890 95.6150 H 216 LEU216 0.1312 3385 HA 86.1710 119.9660 97.7070 H 216 LEU216 0.0557 3386 HB1 84.4010 118.0780 97.7300 H 216 LEU216 0.0287 3387 HB2 85.2060 117.4100 96.3560 H 216 LEU216 0.0287 3388 HG 83.3030 118.6570 95.6510 H 216 LEU216 0.0296 3389 HD11 82.8650 121.0140 96.1480 H 216 LEU216 0.0232 3390 HD12 84.3500 121.1380 97.0810 H 216 LEU216 0.0232 3391 HD13 83.0360 120.1090 97.6480 H 216 LEU216 0.0232 3392 HD21 84.1370 120.1990 94.0120 H 216 LEU216 0.0232 3393 HD22 85.3430 118.9260 94.1780 H 216 LEU216 0.0232 3394 HD23 85.6010 120.5090 94.9170 H 216 LEU216 0.0232 3395 N 88.0250 117.5220 98.4500 N.am 217 CYS217 -0.2449 3396 CA 88.6330 116.8660 99.6030 C.3 217 CYS217 0.0965 3397 C 90.0000 117.4410 99.9530 C.2 217 CYS217 0.2195 3398 O 90.2240 117.7980 101.1120 O.2 217 CYS217 -0.2778 3399 CB 88.7400 115.3540 99.3610 C.3 217 CYS217 0.0147 3400 SG 87.1630 114.5800 98.9190 S.3 217 CYS217 -0.1762 3401 H 88.4990 117.4860 97.5470 H 217 CYS217 0.1312 3402 HA 88.0040 117.0230 100.4800 H 217 CYS217 0.0565 3403 HB1 89.1130 114.8680 100.2630 H 217 CYS217 0.0394 3404 HB2 89.4630 115.1410 98.5740 H 217 CYS217 0.0394 3405 HG 87.3420 113.2690 98.7410 H 217 CYS217 0.1017 3406 N 90.9320 117.5320 99.0010 N.am 218 TRP218 -0.2453 3407 CA 92.2750 117.9890 99.3470 C.3 218 TRP218 0.0918 3408 C 92.3260 119.4980 99.5320 C.2 218 TRP218 0.2188 3409 O 93.2000 120.0080 100.2420 O.2 218 TRP218 -0.2778 3410 CB 93.3050 117.5300 98.2960 C.3 218 TRP218 -0.0021 3411 CG 93.6310 116.0550 98.4530 C.ar 218 TRP218 -0.0260 3412 CD1 93.3390 115.0380 97.5380 C.ar 218 TRP218 -0.0136 3413 CD2 94.3570 115.4270 99.5330 C.ar 218 TRP218 -0.0028 3414 NE1 93.8300 113.8620 97.9960 N.ar 218 TRP218 -0.2641 3415 CE2 94.4660 114.0530 99.2150 C.ar 218 TRP218 0.0269 3416 CE3 94.9060 115.9000 100.6960 C.ar 218 TRP218 -0.0528 3417 CZ2 95.1020 113.1970 100.0730 C.ar 218 TRP218 -0.0430 3418 CZ3 95.5600 115.0290 101.5690 C.ar 218 TRP218 -0.0611 3419 CH2 95.6510 113.6730 101.2610 C.ar 218 TRP218 -0.0602 3420 H 90.7070 117.2840 98.0380 H 218 TRP218 0.1312 3421 HA 92.5340 117.5530 100.3140 H 218 TRP218 0.0560 3422 HB1 94.2400 118.0820 98.4060 H 218 TRP218 0.0334 3423 HB2 92.9450 117.7240 97.2850 H 218 TRP218 0.0334 3424 HD1 92.8180 115.1590 96.6020 H 218 TRP218 0.0748 3425 HE1 93.7490 113.0000 97.5370 H 218 TRP218 0.1331 3426 HE3 94.8320 116.9510 100.9330 H 218 TRP218 0.0624 3427 HZ2 95.1710 112.1490 99.8320 H 218 TRP218 0.0633 3428 HZ3 95.9980 115.3950 102.4850 H 218 TRP218 0.0618 3429 HH2 96.1480 112.9940 101.9390 H 218 TRP218 0.0618 3430 N 91.4290 120.2270 98.8770 N.am 219 GLY219 -0.2484 3431 CA 91.3140 121.6630 99.0450 C.3 219 GLY219 0.0767 3432 C 91.0460 122.1360 100.4670 C.2 219 GLY219 0.2182 3433 O 91.8150 122.9430 101.0100 O.2 219 GLY219 -0.2779 3434 H 90.7960 119.7580 98.2300 H 219 GLY219 0.1309 3435 HA1 90.5010 121.9910 98.3980 H 219 GLY219 0.0521 3436 HA2 92.2400 122.1110 98.6840 H 219 GLY219 0.0521 3437 N 89.9610 121.6520 101.1030 N.am 220 PRO220 -0.2318 3438 CA 89.7640 121.9870 102.5190 C.3 220 PRO220 0.0907 3439 C 90.8400 121.4410 103.4370 C.2 220 PRO220 0.2189 3440 O 91.1100 122.0560 104.4720 O.2 220 PRO220 -0.2778 3441 CB 88.3810 121.3950 102.8310 C.3 220 PRO220 -0.0276 3442 CG 88.1440 120.3290 101.7620 C.3 220 PRO220 -0.0379 3443 CD 88.8990 120.8260 100.5290 C.3 220 PRO220 0.0071 3444 HA 89.7480 123.0740 102.6100 H 220 PRO220 0.0559 3445 HB1 87.6280 122.1760 102.7210 H 220 PRO220 0.0285 3446 HB2 88.2860 120.9990 103.8440 H 220 PRO220 0.0285 3447 HG1 87.0860 120.1520 101.5630 H 220 PRO220 0.0278 3448 HG2 88.5770 119.3870 102.0980 H 220 PRO220 0.0278 3449 HD1 89.2870 120.0040 99.9390 H 220 PRO220 0.0431 3450 HD2 88.2860 121.4750 99.9020 H 220 PRO220 0.0431 3451 N 91.4730 120.3140 103.0990 N.am 221 TYR221 -0.2453 3452 CA 92.5770 119.8270 103.9240 C.3 221 TYR221 0.0917 3453 C 93.7870 120.7500 103.8620 C.2 221 TYR221 0.2190 3454 O 94.4150 121.0100 104.8910 O.2 221 TYR221 -0.2778 3455 CB 93.0200 118.4030 103.5780 C.3 221 TYR221 -0.0036 3456 CG 94.1180 117.9380 104.5130 C.ar 221 TYR221 -0.0453 3457 CD1 93.8680 117.7960 105.8770 C.ar 221 TYR221 -0.0561 3458 CD2 95.3930 117.6420 104.0380 C.ar 221 TYR221 -0.0561 3459 CE1 94.8280 117.2620 106.7260 C.ar 221 TYR221 -0.0317 3460 CE2 96.3630 117.1200 104.8870 C.ar 221 TYR221 -0.0317 3461 CZ 96.0660 116.8980 106.2240 C.ar 221 TYR221 0.0726 3462 OH 96.9860 116.2940 107.0550 O.3 221 TYR221 -0.3598 3463 H 91.1870 119.7960 102.2690 H 221 TYR221 0.1312 3464 HA 92.2060 119.8370 104.9500 H 221 TYR221 0.0560 3465 HB1 93.3590 118.3480 102.5430 H 221 TYR221 0.0333 3466 HB2 92.1730 117.7220 103.6660 H 221 TYR221 0.0333 3467 HD1 92.9060 118.0610 106.2820 H 221 TYR221 0.0621 3468 HD2 95.6280 117.7900 102.9940 H 221 TYR221 0.0621 3469 HE1 94.6080 117.1080 107.7720 H 221 TYR221 0.0643 3470 HE2 97.3360 116.8520 104.5050 H 221 TYR221 0.0643 3471 HH 97.8070 116.7710 107.0300 H 221 TYR221 0.2173 3472 N 94.1230 121.2610 102.6730 N.am 222 VAL222 -0.2454 3473 CA 95.2060 122.2390 102.5560 C.3 222 VAL222 0.0901 3474 C 94.8460 123.5290 103.2890 C.2 222 VAL222 0.2189 3475 O 95.6860 124.1190 103.9860 O.2 222 VAL222 -0.2778 3476 CB 95.5600 122.4630 101.0710 C.3 222 VAL222 -0.0227 3477 CG1 96.4980 123.6640 100.8630 C.3 222 VAL222 -0.0608 3478 CG2 96.2070 121.2030 100.4700 C.3 222 VAL222 -0.0608 3479 H 93.6180 120.9660 101.8370 H 222 VAL222 0.1312 3480 HA 96.0720 121.8160 103.0700 H 222 VAL222 0.0560 3481 HB 94.6350 122.6620 100.5280 H 222 VAL222 0.0315 3482 HG11 96.8050 123.7470 99.8200 H 222 VAL222 0.0233 3483 HG12 97.3980 123.5640 101.4710 H 222 VAL222 0.0233 3484 HG13 96.0180 124.6040 101.1330 H 222 VAL222 0.0233 3485 HG21 96.3720 121.3230 99.3990 H 222 VAL222 0.0233 3486 HG22 95.5890 120.3170 100.6100 H 222 VAL222 0.0233 3487 HG23 97.1730 121.0010 100.9330 H 222 VAL222 0.0233 3488 N 93.5750 123.9420 103.2080 N.am 223 ALA223 -0.2459 3489 CA 93.1370 125.1640 103.8830 C.3 223 ALA223 0.0850 3490 C 93.2070 125.0300 105.4040 C.2 223 ALA223 0.2185 3491 O 93.7220 125.9210 106.0910 O.2 223 ALA223 -0.2778 3492 CB 91.7030 125.4770 103.4420 C.3 223 ALA223 -0.0411 3493 H 92.9030 123.3970 102.6680 H 223 ALA223 0.1312 3494 HA 93.8110 125.9650 103.5740 H 223 ALA223 0.0554 3495 HB1 91.3500 126.4130 103.8760 H 223 ALA223 0.0249 3496 HB2 91.0150 124.6870 103.7410 H 223 ALA223 0.0249 3497 HB3 91.6450 125.5710 102.3570 H 223 ALA223 0.0249 3498 N 92.7260 123.9090 105.9470 N.am 224 THR224 -0.2434 3499 CA 92.7990 123.7000 107.3890 C.3 224 THR224 0.1135 3500 C 94.2210 123.4310 107.8550 C.2 224 THR224 0.2212 3501 O 94.5680 123.7730 108.9840 O.2 224 THR224 -0.2777 3502 CB 91.9160 122.5050 107.7840 C.3 224 THR224 0.0763 3503 OG1 92.2320 121.3430 107.0380 O.3 224 THR224 -0.3900 3504 CG2 90.4350 122.8380 107.5810 C.3 224 THR224 -0.0370 3505 H 92.3060 123.1960 105.3510 H 224 THR224 0.1313 3506 HA 92.4440 124.6060 107.8800 H 224 THR224 0.0583 3507 HB 92.0500 122.2760 108.8460 H 224 THR224 0.0611 3508 HG1 93.1750 121.2010 107.0380 H 224 THR224 0.2098 3509 HG21 89.7980 122.0530 107.9750 H 224 THR224 0.0255 3510 HG22 90.1880 122.9730 106.5300 H 224 THR224 0.0255 3511 HG23 90.1710 123.7550 108.1000 H 224 THR224 0.0255 3512 N 95.0380 122.8580 106.9690 N.am 225 LEU225 -0.2456 3513 CA 96.4500 122.6050 107.2540 C.3 225 LEU225 0.0880 3514 C 97.2010 123.9280 107.4440 C.2 225 LEU225 0.2187 3515 O 98.0110 124.0620 108.3620 O.2 225 LEU225 -0.2778 3516 CB 97.1060 121.7700 106.1370 C.3 225 LEU225 -0.0266 3517 CG 98.2920 120.8830 106.5500 C.3 225 LEU225 -0.0449 3518 CD1 98.8980 120.2290 105.3010 C.3 225 LEU225 -0.0626 3519 CD2 99.3600 121.6210 107.3560 C.3 225 LEU225 -0.0626 3520 H 94.6640 122.5870 106.0600 H 225 LEU225 0.1312 3521 HA 96.4780 122.0510 108.1940 H 225 LEU225 0.0557 3522 HB1 97.3680 122.4020 105.2870 H 225 LEU225 0.0287 3523 HB2 96.3890 121.0540 105.7670 H 225 LEU225 0.0287 3524 HG 97.9090 120.0830 107.1850 H 225 LEU225 0.0296 3525 HD11 99.6600 119.5030 105.5720 H 225 LEU225 0.0232 3526 HD12 99.3600 120.9720 104.6500 H 225 LEU225 0.0232 3527 HD13 98.1390 119.7020 104.7240 H 225 LEU225 0.0232 3528 HD21 100.2550 121.0100 107.4510 H 225 LEU225 0.0232 3529 HD22 99.0170 121.8380 108.3670 H 225 LEU225 0.0232 3530 HD23 99.6320 122.5580 106.8740 H 225 LEU225 0.0232 3531 N 96.9270 124.9000 106.5730 N.am 226 LEU226 -0.2456 3532 CA 97.5240 126.2300 106.6880 C.3 226 LEU226 0.0880 3533 C 96.9480 127.0170 107.8650 C.2 226 LEU226 0.2187 3534 O 97.6880 127.7390 108.5500 O.2 226 LEU226 -0.2778 3535 CB 97.3870 126.9660 105.3430 C.3 226 LEU226 -0.0266 3536 CG 98.5820 126.7290 104.3950 C.3 226 LEU226 -0.0449 3537 CD1 98.8620 125.2440 104.1080 C.3 226 LEU226 -0.0626 3538 CD2 98.3860 127.4940 103.0810 C.3 226 LEU226 -0.0626 3539 H 96.2830 124.7100 105.8050 H 226 LEU226 0.1312 3540 HA 98.5840 126.0890 106.9120 H 226 LEU226 0.0557 3541 HB1 97.3140 128.0410 105.5160 H 226 LEU226 0.0287 3542 HB2 96.4520 126.6790 104.8590 H 226 LEU226 0.0287 3543 HG 99.4710 127.1350 104.8800 H 226 LEU226 0.0296 3544 HD11 99.7180 125.1370 103.4420 H 226 LEU226 0.0232 3545 HD12 98.0110 124.7640 103.6280 H 226 LEU226 0.0232 3546 HD13 99.0960 124.6910 105.0170 H 226 LEU226 0.0232 3547 HD21 99.2540 127.3840 102.4290 H 226 LEU226 0.0232 3548 HD22 98.2430 128.5600 103.2640 H 226 LEU226 0.0232 3549 HD23 97.5130 127.1270 102.5400 H 226 LEU226 0.0232 3550 N 95.6380 126.8940 108.1270 N.am 227 LEU227 -0.2456 3551 CA 95.0640 127.5440 109.3070 C.3 227 LEU227 0.0880 3552 C 95.6080 126.9470 110.6010 C.2 227 LEU227 0.2187 3553 O 95.7270 127.6450 111.6130 O.2 227 LEU227 -0.2778 3554 CB 93.5340 127.3950 109.2760 C.3 227 LEU227 -0.0266 3555 CG 92.8510 128.2570 108.2010 C.3 227 LEU227 -0.0449 3556 CD1 91.4160 127.7760 107.9550 C.3 227 LEU227 -0.0626 3557 CD2 92.8580 129.7440 108.5850 C.3 227 LEU227 -0.0626 3558 H 95.0420 126.3480 107.5050 H 227 LEU227 0.1312 3559 HA 95.3550 128.5940 109.2800 H 227 LEU227 0.0557 3560 HB1 93.1040 127.6500 110.2470 H 227 LEU227 0.0287 3561 HB2 93.2950 126.3440 109.1110 H 227 LEU227 0.0287 3562 HG 93.3960 128.1480 107.2620 H 227 LEU227 0.0296 3563 HD11 90.9290 128.3710 107.1830 H 227 LEU227 0.0232 3564 HD12 90.8170 127.8500 108.8630 H 227 LEU227 0.0232 3565 HD13 91.4040 126.7370 107.6250 H 227 LEU227 0.0232 3566 HD21 92.3600 130.3460 107.8250 H 227 LEU227 0.0232 3567 HD22 93.8720 130.1300 108.6900 H 227 LEU227 0.0232 3568 HD23 92.3400 129.9080 109.5310 H 227 LEU227 0.0232 3569 N 95.9370 125.6560 110.5870 N.am 228 SER228 -0.2436 3570 CA 96.5600 125.0320 111.7440 C.3 228 SER228 0.1109 3571 C 98.0000 125.4880 111.9200 C.2 228 SER228 0.2209 3572 O 98.4920 125.5460 113.0510 O.2 228 SER228 -0.2777 3573 CB 96.4800 123.5070 111.5690 C.3 228 SER228 0.0681 3574 OG 96.8270 122.8390 112.7760 O.3 228 SER228 -0.3930 3575 H 95.7500 125.0980 109.7540 H 228 SER228 0.1312 3576 HA 95.9900 125.3240 112.6260 H 228 SER228 0.0580 3577 HB1 97.1360 123.1880 110.7500 H 228 SER228 0.0577 3578 HB2 95.4550 123.2450 111.2890 H 228 SER228 0.0577 3579 HG 96.7450 121.8920 112.6870 H 228 SER228 0.2095 3580 N 98.6980 125.7830 110.8200 N.am 229 VAL229 -0.2453 3581 CA 100.0100 126.4190 110.9370 C.3 229 VAL229 0.0901 3582 C 99.8810 127.8170 111.5340 C.2 229 VAL229 0.2189 3583 O 100.6940 128.2130 112.3800 O.2 229 VAL229 -0.2778 3584 CB 100.7890 126.4380 109.6070 C.3 229 VAL229 -0.0227 3585 CG1 102.0540 127.3140 109.6940 C.3 229 VAL229 -0.0608 3586 CG2 101.2060 125.0200 109.2070 C.3 229 VAL229 -0.0608 3587 H 98.3160 125.5650 109.8990 H 229 VAL229 0.1312 3588 HA 100.5800 125.8300 111.6600 H 229 VAL229 0.0560 3589 HB 100.1490 126.8470 108.8240 H 229 VAL229 0.0315 3590 HG11 102.6590 127.2330 108.7950 H 229 VAL229 0.0233 3591 HG12 102.6760 127.0100 110.5350 H 229 VAL229 0.0233 3592 HG13 101.8120 128.3700 109.8200 H 229 VAL229 0.0233 3593 HG21 101.8460 125.0560 108.3280 H 229 VAL229 0.0233 3594 HG22 100.3490 124.3880 108.9820 H 229 VAL229 0.0233 3595 HG23 101.7760 124.5410 110.0040 H 229 VAL229 0.0233 3596 N 98.8420 128.5660 111.1490 N.am 230 LEU230 -0.2456 3597 CA 98.5940 129.8630 111.7800 C.3 230 LEU230 0.0880 3598 C 98.1880 129.7100 113.2430 C.2 230 LEU230 0.2187 3599 O 98.6240 130.4880 114.0990 O.2 230 LEU230 -0.2778 3600 CB 97.5170 130.6440 111.0010 C.3 230 LEU230 -0.0266 3601 CG 98.0840 131.5320 109.8770 C.3 230 LEU230 -0.0449 3602 CD1 98.7070 130.7230 108.7320 C.3 230 LEU230 -0.0626 3603 CD2 96.9960 132.4670 109.3320 C.3 230 LEU230 -0.0626 3604 H 98.2200 128.2320 110.4130 H 230 LEU230 0.1312 3605 HA 99.5370 130.4170 111.7710 H 230 LEU230 0.0557 3606 HB1 96.9810 131.3040 111.6870 H 230 LEU230 0.0287 3607 HB2 96.7660 129.9580 110.6080 H 230 LEU230 0.0287 3608 HG 98.8680 132.1550 110.3090 H 230 LEU230 0.0296 3609 HD11 99.1500 131.3840 107.9880 H 230 LEU230 0.0232 3610 HD12 97.9560 130.1190 108.2260 H 230 LEU230 0.0232 3611 HD13 99.4990 130.0620 109.0860 H 230 LEU230 0.0232 3612 HD21 97.3960 133.1270 108.5620 H 230 LEU230 0.0232 3613 HD22 96.5840 133.0940 110.1230 H 230 LEU230 0.0232 3614 HD23 96.1750 131.9000 108.8930 H 230 LEU230 0.0232 3615 N 97.3600 128.7100 113.5520 N.am 231 ALA231 -0.2459 3616 CA 96.9270 128.5080 114.9300 C.3 231 ALA231 0.0850 3617 C 98.0300 127.9450 115.8190 C.2 231 ALA231 0.2184 3618 O 97.9210 128.0420 117.0440 O.2 231 ALA231 -0.2778 3619 CB 95.7200 127.5630 114.9260 C.3 231 ALA231 -0.0411 3620 H 97.0280 128.0830 112.8190 H 231 ALA231 0.1312 3621 HA 96.6350 129.4810 115.3300 H 231 ALA231 0.0554 3622 HB1 95.3160 127.4320 115.9300 H 231 ALA231 0.0249 3623 HB2 95.9920 126.5790 114.5420 H 231 ALA231 0.0249 3624 HB3 94.9230 127.9570 114.2950 H 231 ALA231 0.0249 3625 N 99.0680 127.3370 115.2330 N.am 232 TYR232 -0.2453 3626 CA 100.2350 126.9180 116.0090 C.3 232 TYR232 0.0917 3627 C 100.9590 128.1120 116.6120 C.2 232 TYR232 0.2190 3628 O 101.4960 128.0280 117.7220 O.2 232 TYR232 -0.2778 3629 CB 101.1730 126.1120 115.0880 C.3 232 TYR232 -0.0036 3630 CG 102.5720 125.9310 115.6300 C.ar 232 TYR232 -0.0453 3631 CD1 102.8490 124.9670 116.5950 C.ar 232 TYR232 -0.0561 3632 CD2 103.6130 126.7290 115.1590 C.ar 232 TYR232 -0.0561 3633 CE1 104.1500 124.7690 117.0440 C.ar 232 TYR232 -0.0317 3634 CE2 104.9110 126.5410 115.6140 C.ar 232 TYR232 -0.0317 3635 CZ 105.1830 125.5540 116.5490 C.ar 232 TYR232 0.0726 3636 OH 106.4790 125.3600 116.9830 O.3 232 TYR232 -0.3598 3637 H 99.0450 127.1630 114.2280 H 232 TYR232 0.1312 3638 HA 99.8810 126.2920 116.8290 H 232 TYR232 0.0560 3639 HB1 101.2460 126.6040 114.1190 H 232 TYR232 0.0333 3640 HB2 100.7370 125.1330 114.8860 H 232 TYR232 0.0333 3641 HD1 102.0490 124.3620 116.9940 H 232 TYR232 0.0621 3642 HD2 103.4150 127.4930 114.4210 H 232 TYR232 0.0621 3643 HE1 104.3590 124.0040 117.7760 H 232 TYR232 0.0643 3644 HE2 105.7140 127.1550 115.2320 H 232 TYR232 0.0643 3645 HH 106.5220 124.5760 117.5180 H 232 TYR232 0.2173 3646 N 100.9810 129.2340 115.8990 N.am 233 GLU233 -0.2456 3647 CA 101.6190 130.4390 116.3980 C.3 233 GLU233 0.0883 3648 C 100.7600 131.0910 117.4810 C.2 233 GLU233 0.2187 3649 O 99.7200 130.5720 117.8990 O.2 233 GLU233 -0.2778 3650 CB 101.7170 131.4620 115.2420 C.3 233 GLU233 -0.0193 3651 CG 102.5130 131.0480 113.9930 C.3 233 GLU233 0.0356 3652 CD 102.4870 132.2250 112.9910 C.2 233 GLU233 0.1760 3653 OE1 102.9060 133.3270 113.3390 O.co2 233 GLU233 -0.6478 3654 OE2 102.0300 132.0670 111.8640 O.co2 233 GLU233 -0.6478 3655 H 100.5390 129.2490 114.9800 H 233 GLU233 0.1312 3656 HA 102.6010 130.1790 116.7960 H 233 GLU233 0.0557 3657 HB1 102.1590 132.3880 115.6120 H 233 GLU233 0.0290 3658 HB2 100.7080 131.7160 114.9200 H 233 GLU233 0.0290 3659 HG1 102.0790 130.1650 113.5240 H 233 GLU233 0.0374 3660 HG2 103.5490 130.8210 114.2410 H 233 GLU233 0.0374 3661 N 101.2240 132.2540 117.9460 N.am 234 GLN234 -0.2456 3662 CA 100.5220 132.9750 119.0020 C.3 234 GLN234 0.0882 3663 C 99.1690 133.4860 118.5260 C.2 234 GLN234 0.2187 3664 O 98.2040 133.5160 119.2980 O.2 234 GLN234 -0.2778 3665 CB 101.3980 134.1420 119.4890 C.3 234 GLN234 -0.0210 3666 CG 102.7400 133.6970 120.1000 C.3 234 GLN234 0.0225 3667 CD 102.5560 132.8420 121.3620 C.2 234 GLN234 0.1981 3668 OE1 102.9540 131.6880 121.4220 O.2 234 GLN234 -0.2798 3669 NE2 101.9320 133.4770 122.3660 N.am 234 GLN234 -0.2724 3670 H 102.0820 132.6440 117.5570 H 234 GLN234 0.1312 3671 HA 100.3410 132.2660 119.8120 H 234 GLN234 0.0557 3672 HB1 100.8470 134.7400 120.2160 H 234 GLN234 0.0289 3673 HB2 101.6020 134.8080 118.6500 H 234 GLN234 0.0289 3674 HG1 103.3390 134.5680 120.3660 H 234 GLN234 0.0356 3675 HG2 103.3240 133.1230 119.3800 H 234 GLN234 0.0356 3676 HE21 101.7750 132.9870 123.2220 H 234 GLN234 0.1266 3677 HE22 101.6200 134.4210 122.2740 H 234 GLN234 0.1266 3678 N 99.0780 133.8810 117.2640 N.am 235 ARG235 -0.2456 3679 CA 97.8590 134.4860 116.7440 C.3 235 ARG235 0.0881 3680 C 96.8160 133.4220 116.4090 C.2 235 ARG235 0.2213 3681 O 97.1220 132.4730 115.6780 O.2 235 ARG235 -0.2776 3682 CB 98.3400 135.1340 115.4110 C.3 235 ARG235 -0.0258 3683 CG 98.8070 134.0930 114.3510 C.3 235 ARG235 -0.0154 3684 CD 100.0550 134.3840 113.5210 C.3 235 ARG235 0.1045 3685 NE 99.8480 135.4140 112.5070 N.pl3 235 ARG235 -0.4450 3686 CZ 100.6780 135.5170 111.4670 C.cat 235 ARG235 0.5062 3687 NH1 100.4730 136.4510 110.5800 N.pl3 235 ARG235 -0.4573 3688 NH2 101.6930 134.7190 111.2940 N.pl3 235 ARG235 -0.4573 3689 H 99.8780 133.7590 116.6440 H 235 ARG235 0.1312 3690 HA 97.5130 135.2350 117.4540 H 235 ARG235 0.0557 3691 HB1 99.1620 135.8140 115.6350 H 235 ARG235 0.0286 3692 HB2 97.5480 135.7530 114.9880 H 235 ARG235 0.0286 3693 HG1 97.9780 133.8300 113.6940 H 235 ARG235 0.0299 3694 HG2 99.0840 133.1680 114.8510 H 235 ARG235 0.0299 3695 HD1 100.2830 133.4540 113.0010 H 235 ARG235 0.0711 3696 HD2 100.9120 134.6560 114.1430 H 235 ARG235 0.0711 3697 HE 99.0760 136.0330 112.6010 H 235 ARG235 0.3153 3698 HH11 101.0990 136.5150 109.8080 H 235 ARG235 0.3114 3699 HH12 99.7060 137.0750 110.6810 H 235 ARG235 0.3114 3700 HH21 102.3250 134.7810 110.5350 H 235 ARG235 0.3114 3701 HH22 101.8760 133.9690 111.9550 H 235 ARG235 0.3114 3702 N 95.6110 133.5010 116.9670 N.am 236 PRO236 -0.2316 3703 CA 94.5280 132.6210 116.5240 C.3 236 PRO236 0.0909 3704 C 93.8680 133.1800 115.2780 C.2 236 PRO236 0.2216 3705 O 93.8840 134.4010 115.0560 O.2 236 PRO236 -0.2776 3706 CB 93.5660 132.6890 117.7140 C.3 236 PRO236 -0.0275 3707 CG 93.7560 134.0930 118.2860 C.3 236 PRO236 -0.0379 3708 CD 95.2280 134.4310 118.0260 C.3 236 PRO236 0.0071 3709 HA 94.9380 131.6220 116.4000 H 236 PRO236 0.0560 3710 HB1 93.8740 131.9560 118.4600 H 236 PRO236 0.0285 3711 HB2 92.5300 132.4710 117.4530 H 236 PRO236 0.0285 3712 HG1 93.4910 134.1560 119.3410 H 236 PRO236 0.0278 3713 HG2 93.1210 134.7930 117.7420 H 236 PRO236 0.0278 3714 HD1 95.3590 135.4560 117.6780 H 236 PRO236 0.0431 3715 HD2 95.8550 134.2270 118.8940 H 236 PRO236 0.0431 3716 N 93.3020 132.3220 114.4200 N.am 237 PRO237 -0.2316 3717 CA 92.6100 132.8280 113.2260 C.3 237 PRO237 0.0907 3718 C 91.3170 133.5540 113.5640 C.2 237 PRO237 0.2189 3719 O 91.0690 134.6660 113.0860 O.2 237 PRO237 -0.2778 3720 CB 92.3590 131.5580 112.3890 C.3 237 PRO237 -0.0276 3721 CG 93.2160 130.4650 113.0260 C.3 237 PRO237 -0.0379 3722 CD 93.3480 130.8630 114.4950 C.3 237 PRO237 0.0071 3723 HA 93.2920 133.5080 112.7130 H 237 PRO237 0.0559 3724 HB1 92.6060 131.7070 111.3380 H 237 PRO237 0.0285 3725 HB2 91.3160 131.2470 112.4260 H 237 PRO237 0.0285 3726 HG1 94.2060 130.4750 112.5670 H 237 PRO237 0.0278 3727 HG2 92.8110 129.4630 112.8930 H 237 PRO237 0.0278 3728 HD1 92.5070 130.5370 115.1080 H 237 PRO237 0.0431 3729 HD2 94.2920 130.4960 114.8930 H 237 PRO237 0.0431 3730 N 90.4970 132.9290 114.4000 N.am 238 LEU238 -0.2456 3731 CA 89.2080 133.4740 114.8180 C.3 238 LEU238 0.0880 3732 C 89.0640 133.1800 116.3080 C.2 238 LEU238 0.2185 3733 O 90.0390 132.8530 116.9940 O.2 238 LEU238 -0.2778 3734 CB 88.0230 132.8570 114.0180 C.3 238 LEU238 -0.0266 3735 CG 87.8790 133.1910 112.5180 C.3 238 LEU238 -0.0449 3736 CD1 87.8450 134.6990 112.2420 C.3 238 LEU238 -0.0626 3737 CD2 88.8500 132.4440 111.5940 C.3 238 LEU238 -0.0626 3738 H 90.7820 132.0220 114.7690 H 238 LEU238 0.1312 3739 HA 89.2320 134.5590 114.7060 H 238 LEU238 0.0557 3740 HB1 87.0840 133.1890 114.4590 H 238 LEU238 0.0287 3741 HB2 88.0160 131.7780 114.1420 H 238 LEU238 0.0287 3742 HG 86.8920 132.8150 112.2430 H 238 LEU238 0.0296 3743 HD11 87.6100 134.8980 111.1960 H 238 LEU238 0.0232 3744 HD12 88.8000 135.1740 112.4570 H 238 LEU238 0.0232 3745 HD13 87.0860 135.1910 112.8500 H 238 LEU238 0.0232 3746 HD21 88.4950 132.4800 110.5640 H 238 LEU238 0.0232 3747 HD22 88.9370 131.3940 111.8720 H 238 LEU238 0.0232 3748 HD23 89.8420 132.8850 111.5910 H 238 LEU238 0.0232 3749 N 87.8440 133.3160 116.8230 N.am 239 GLY239 -0.2485 3750 CA 87.5480 133.0130 118.2040 C.3 239 GLY239 0.0767 3751 C 87.6960 131.5400 118.5370 C.2 239 GLY239 0.2182 3752 O 87.7140 130.6800 117.6490 O.2 239 GLY239 -0.2779 3753 H 87.0900 133.6460 116.2200 H 239 GLY239 0.1309 3754 HA1 86.5210 133.3250 118.3890 H 239 GLY239 0.0521 3755 HA2 88.2190 133.6410 118.7850 H 239 GLY239 0.0521 3756 N 87.8410 131.2280 119.8290 N.am 240 PRO240 -0.2318 3757 CA 87.9660 129.8250 120.2460 C.3 240 PRO240 0.0907 3758 C 86.6880 129.0390 119.9920 C.2 240 PRO240 0.2187 3759 O 85.5830 129.5880 120.0110 O.2 240 PRO240 -0.2778 3760 CB 88.2320 129.9160 121.7600 C.3 240 PRO240 -0.0276 3761 CG 88.6150 131.3690 122.0290 C.3 240 PRO240 -0.0379 3762 CD 87.9190 132.1780 120.9370 C.3 240 PRO240 0.0071 3763 HA 88.8110 129.3950 119.7060 H 240 PRO240 0.0559 3764 HB1 89.0070 129.2210 122.0840 H 240 PRO240 0.0285 3765 HB2 87.3360 129.6900 122.3410 H 240 PRO240 0.0285 3766 HG1 89.6950 131.4800 121.9230 H 240 PRO240 0.0278 3767 HG2 88.3460 131.6990 123.0320 H 240 PRO240 0.0278 3768 HD1 86.8980 132.4560 121.2020 H 240 PRO240 0.0431 3769 HD2 88.5090 133.0580 120.6860 H 240 PRO240 0.0431 3770 N 86.8720 127.7440 119.7000 N.am 241 GLY241 -0.2485 3771 CA 85.8650 126.7440 119.3310 C.3 241 GLY241 0.0765 3772 C 85.1500 127.0520 118.0180 C.2 241 GLY241 0.2156 3773 O 84.1830 126.3610 117.6740 O.2 241 GLY241 -0.2781 3774 H 87.8360 127.4110 119.7390 H 241 GLY241 0.1309 3775 HA1 85.1330 126.7050 120.1380 H 241 GLY241 0.0521 3776 HA2 86.3660 125.7810 119.2690 H 241 GLY241 0.0521 3777 N 85.5930 128.0650 117.2720 N.am 242 THR242 -0.2436 3778 CA 85.1400 128.3030 115.9120 C.3 242 THR242 0.1135 3779 C 86.1170 127.7600 114.8820 C.2 242 THR242 0.2212 3780 O 85.7540 127.6290 113.7090 O.2 242 THR242 -0.2777 3781 CB 84.8860 129.8070 115.6540 C.3 242 THR242 0.0763 3782 OG1 86.0660 130.5380 115.3900 O.3 242 THR242 -0.3900 3783 CG2 84.0840 130.4860 116.7760 C.3 242 THR242 -0.0370 3784 H 86.2810 128.7020 117.6740 H 242 THR242 0.1312 3785 HA 84.1950 127.7770 115.7700 H 242 THR242 0.0583 3786 HB 84.2910 129.8810 114.7410 H 242 THR242 0.0611 3787 HG1 86.6480 130.4590 116.1350 H 242 THR242 0.2098 3788 HG21 83.8550 131.5180 116.5130 H 242 THR242 0.0255 3789 HG22 84.6270 130.5030 117.7210 H 242 THR242 0.0255 3790 HG23 83.1400 129.9690 116.9470 H 242 THR242 0.0255 3791 N 87.3400 127.4420 115.2990 N.am 243 LEU243 -0.2456 3792 CA 88.2770 126.6970 114.4750 C.3 243 LEU243 0.0880 3793 C 88.1770 125.2000 114.6980 C.2 243 LEU243 0.2187 3794 O 88.6540 124.4380 113.8560 O.2 243 LEU243 -0.2778 3795 CB 89.7290 127.1290 114.7800 C.3 243 LEU243 -0.0266 3796 CG 90.2130 128.3680 114.0130 C.3 243 LEU243 -0.0449 3797 CD1 90.2980 128.1200 112.4980 C.3 243 LEU243 -0.0626 3798 CD2 89.3800 129.6080 114.3330 C.3 243 LEU243 -0.0626 3799 H 87.6310 127.7320 116.2330 H 243 LEU243 0.1312 3800 HA 88.0400 126.8740 113.4260 H 243 LEU243 0.0557 3801 HB1 90.4270 126.3260 114.5370 H 243 LEU243 0.0287 3802 HB2 89.8400 127.2920 115.8530 H 243 LEU243 0.0287 3803 HG 91.2270 128.5690 114.3590 H 243 LEU243 0.0296 3804 HD11 90.7520 128.9670 111.9850 H 243 LEU243 0.0232 3805 HD12 89.3130 127.9750 112.0560 H 243 LEU243 0.0232 3806 HD13 90.8990 127.2390 112.2750 H 243 LEU243 0.0232 3807 HD21 89.8250 130.4830 113.8680 H 243 LEU243 0.0232 3808 HD22 89.3270 129.7920 115.4060 H 243 LEU243 0.0232 3809 HD23 88.3640 129.5160 113.9490 H 243 LEU243 0.0232 3810 N 87.5560 124.7830 115.8040 N.am 244 LEU244 -0.2456 3811 CA 87.5620 123.3880 116.2390 C.3 244 LEU244 0.0880 3812 C 86.8880 122.4770 115.2120 C.2 244 LEU244 0.2187 3813 O 87.5090 121.5370 114.6880 O.2 244 LEU244 -0.2778 3814 CB 86.8780 123.3440 117.6180 C.3 244 LEU244 -0.0266 3815 CG 87.0070 122.0360 118.4210 C.3 244 LEU244 -0.0449 3816 CD1 86.2270 120.8600 117.8180 C.3 244 LEU244 -0.0626 3817 CD2 88.4710 121.6710 118.6980 C.3 244 LEU244 -0.0626 3818 H 87.0550 125.4680 116.3700 H 244 LEU244 0.1312 3819 HA 88.6110 123.0970 116.3200 H 244 LEU244 0.0557 3820 HB1 85.8260 123.6190 117.5240 H 244 LEU244 0.0287 3821 HB2 87.3290 124.1300 118.2220 H 244 LEU244 0.0287 3822 HG 86.5500 122.2410 119.3910 H 244 LEU244 0.0296 3823 HD11 86.1350 120.0510 118.5430 H 244 LEU244 0.0232 3824 HD12 86.7260 120.4510 116.9400 H 244 LEU244 0.0232 3825 HD13 85.2190 121.1610 117.5300 H 244 LEU244 0.0232 3826 HD21 88.5350 120.8830 119.4470 H 244 LEU244 0.0232 3827 HD22 89.0270 122.5260 119.0820 H 244 LEU244 0.0232 3828 HD23 88.9760 121.3220 117.7970 H 244 LEU244 0.0232 3829 N 85.6340 122.7910 114.8680 N.am 245 SER245 -0.2436 3830 CA 84.8760 121.9900 113.9110 C.3 245 SER245 0.1109 3831 C 85.4650 122.0810 112.5100 C.2 245 SER245 0.2209 3832 O 85.4670 121.0920 111.7720 O.2 245 SER245 -0.2777 3833 CB 83.3980 122.4100 113.9280 C.3 245 SER245 0.0681 3834 OG 82.5790 121.2900 113.6020 O.3 245 SER245 -0.3930 3835 H 85.1960 123.6120 115.2850 H 245 SER245 0.1312 3836 HA 84.9610 120.9550 114.2430 H 245 SER245 0.0580 3837 HB1 83.2350 123.2600 113.2520 H 245 SER245 0.0577 3838 HB2 83.1300 122.7470 114.9340 H 245 SER245 0.0577 3839 HG 81.7010 121.5690 113.3460 H 245 SER245 0.2095 3840 N 85.9930 123.2480 112.1360 N.am 246 LEU246 -0.2456 3841 CA 86.5090 123.4280 110.7820 C.3 246 LEU246 0.0880 3842 C 87.8100 122.6530 110.5700 C.2 246 LEU246 0.2187 3843 O 87.9840 121.9940 109.5340 O.2 246 LEU246 -0.2778 3844 CB 86.7050 124.9460 110.5980 C.3 246 LEU246 -0.0266 3845 CG 87.4140 125.3770 109.2970 C.3 246 LEU246 -0.0449 3846 CD1 86.7660 126.6350 108.7040 C.3 246 LEU246 -0.0626 3847 CD2 88.9100 125.6340 109.5350 C.3 246 LEU246 -0.0626 3848 H 86.0360 124.0200 112.8010 H 246 LEU246 0.1312 3849 HA 85.7650 123.0530 110.0770 H 246 LEU246 0.0557 3850 HB1 87.2410 125.3580 111.4550 H 246 LEU246 0.0287 3851 HB2 85.7160 125.4040 110.6410 H 246 LEU246 0.0287 3852 HG 87.3100 124.5810 108.5580 H 246 LEU246 0.0296 3853 HD11 87.2590 126.9310 107.7770 H 246 LEU246 0.0232 3854 HD12 86.8270 127.4740 109.3970 H 246 LEU246 0.0232 3855 HD13 85.7130 126.4650 108.4770 H 246 LEU246 0.0232 3856 HD21 89.4120 125.8770 108.6000 H 246 LEU246 0.0232 3857 HD22 89.4090 124.7680 109.9640 H 246 LEU246 0.0232 3858 HD23 89.0620 126.4680 110.2190 H 246 LEU246 0.0232 3859 N 88.7180 122.6830 111.5550 N.am 247 LEU247 -0.2456 3860 CA 89.9590 121.9180 111.4600 C.3 247 LEU247 0.0880 3861 C 89.6950 120.4180 111.5350 C.2 247 LEU247 0.2187 3862 O 90.3390 119.6310 110.8200 O.2 247 LEU247 -0.2778 3863 CB 90.9430 122.3810 112.5500 C.3 247 LEU247 -0.0266 3864 CG 91.4100 123.8470 112.4070 C.3 247 LEU247 -0.0449 3865 CD1 92.2290 124.2710 113.6330 C.3 247 LEU247 -0.0626 3866 CD2 92.2240 124.0820 111.1270 C.3 247 LEU247 -0.0626 3867 H 88.5400 123.2490 112.3850 H 247 LEU247 0.1312 3868 HA 90.3810 122.1140 110.4750 H 247 LEU247 0.0557 3869 HB1 91.8220 121.7340 112.5500 H 247 LEU247 0.0287 3870 HB2 90.4710 122.2500 113.5250 H 247 LEU247 0.0287 3871 HG 90.5380 124.4980 112.3580 H 247 LEU247 0.0296 3872 HD11 92.5170 125.3210 113.5700 H 247 LEU247 0.0232 3873 HD12 93.1420 123.6820 113.7160 H 247 LEU247 0.0232 3874 HD13 91.6590 124.1380 114.5530 H 247 LEU247 0.0232 3875 HD21 92.6420 125.0890 111.1060 H 247 LEU247 0.0232 3876 HD22 91.6050 123.9780 110.2380 H 247 LEU247 0.0232 3877 HD23 93.0510 123.3770 111.0510 H 247 LEU247 0.0232 3878 N 88.7420 120.0050 112.3840 N.am 248 SER248 -0.2436 3879 CA 88.3550 118.5980 112.4210 C.3 248 SER248 0.1109 3880 C 87.7260 118.1590 111.1020 C.2 248 SER248 0.2209 3881 O 87.9450 117.0300 110.6530 O.2 248 SER248 -0.2777 3882 CB 87.3540 118.4410 113.5730 C.3 248 SER248 0.0681 3883 OG 86.9230 117.0930 113.7260 O.3 248 SER248 -0.3930 3884 H 88.2870 120.6750 113.0040 H 248 SER248 0.1312 3885 HA 89.2520 118.0040 112.6020 H 248 SER248 0.0580 3886 HB1 86.4960 119.0990 113.3850 H 248 SER248 0.0577 3887 HB2 87.8360 118.7850 114.4940 H 248 SER248 0.0577 3888 HG 86.2790 117.0150 114.4190 H 248 SER248 0.2095 3889 N 86.9820 119.0560 110.4470 N.am 249 LEU249 -0.2456 3890 CA 86.3740 118.7440 109.1560 C.3 249 LEU249 0.0880 3891 C 87.4260 118.5910 108.0640 C.2 249 LEU249 0.2185 3892 O 87.3070 117.7100 107.2040 O.2 249 LEU249 -0.2778 3893 CB 85.3540 119.8470 108.8210 C.3 249 LEU249 -0.0266 3894 CG 84.5550 119.6290 107.5170 C.3 249 LEU249 -0.0449 3895 CD1 83.1440 120.2190 107.6450 C.3 249 LEU249 -0.0626 3896 CD2 85.2540 120.2340 106.2880 C.3 249 LEU249 -0.0626 3897 H 86.8360 119.9780 110.8580 H 249 LEU249 0.1312 3898 HA 85.8590 117.7880 109.2630 H 249 LEU249 0.0557 3899 HB1 85.8370 120.8240 108.8010 H 249 LEU249 0.0287 3900 HB2 84.6540 119.8900 109.6550 H 249 LEU249 0.0287 3901 HG 84.4420 118.5550 107.3540 H 249 LEU249 0.0296 3902 HD11 82.5630 120.0490 106.7380 H 249 LEU249 0.0232 3903 HD12 83.1820 121.2950 107.8200 H 249 LEU249 0.0232 3904 HD13 82.6000 119.7650 108.4730 H 249 LEU249 0.0232 3905 HD21 84.6520 120.0920 105.3910 H 249 LEU249 0.0232 3906 HD22 86.2230 119.7810 106.0910 H 249 LEU249 0.0232 3907 HD23 85.4110 121.3050 106.4150 H 249 LEU249 0.0232 3908 N 88.4530 119.4460 108.0750 N.am 250 GLY250 -0.2485 3909 CA 89.5300 119.3020 107.1040 C.3 250 GLY250 0.0765 3910 C 90.3150 118.0130 107.2750 C.2 250 GLY250 0.2156 3911 O 90.6030 117.3060 106.2940 O.2 250 GLY250 -0.2781 3912 H 88.4830 120.1990 108.7630 H 250 GLY250 0.1309 3913 HA1 90.2070 120.1360 107.2330 H 250 GLY250 0.0521 3914 HA2 89.1030 119.3500 106.1010 H 250 GLY250 0.0521 3915 N 90.6450 117.6710 108.5260 N.am 251 SER251 -0.2439 3916 CA 91.3350 116.4090 108.7800 C.3 251 SER251 0.1109 3917 C 90.4500 115.2070 108.4590 C.2 251 SER251 0.2209 3918 O 90.9480 114.1710 107.9960 O.2 251 SER251 -0.2777 3919 CB 91.7700 116.3730 110.2500 C.3 251 SER251 0.0681 3920 OG 92.7180 117.4090 110.4780 O.3 251 SER251 -0.3930 3921 H 90.4150 118.2920 109.3020 H 251 SER251 0.1312 3922 HA 92.2130 116.3740 108.1340 H 251 SER251 0.0580 3923 HB1 92.2260 115.4060 110.4850 H 251 SER251 0.0577 3924 HB2 90.8890 116.5020 110.8920 H 251 SER251 0.0577 3925 HG 92.9210 117.4970 111.4050 H 251 SER251 0.2095 3926 N 89.1330 115.3450 108.6440 N.am 252 ALA252 -0.2459 3927 CA 88.2060 114.2800 108.2770 C.3 252 ALA252 0.0850 3928 C 88.1210 114.1070 106.7680 C.2 252 ALA252 0.2185 3929 O 87.9680 112.9840 106.2830 O.2 252 ALA252 -0.2778 3930 CB 86.8220 114.6120 108.8480 C.3 252 ALA252 -0.0411 3931 H 88.7710 116.2090 109.0480 H 252 ALA252 0.1312 3932 HA 88.5810 113.3520 108.7120 H 252 ALA252 0.0554 3933 HB1 86.1090 113.8110 108.6490 H 252 ALA252 0.0249 3934 HB2 86.4240 115.5310 108.4180 H 252 ALA252 0.0249 3935 HB3 86.8690 114.7520 109.9270 H 252 ALA252 0.0249 3936 N 88.2010 115.2080 106.0120 N.am 253 SER253 -0.2436 3937 CA 88.2410 115.1160 104.5530 C.3 253 SER253 0.1109 3938 C 89.4890 114.3850 104.0800 C.2 253 SER253 0.2209 3939 O 89.4230 113.5510 103.1620 O.2 253 SER253 -0.2777 3940 CB 88.1970 116.5250 103.9390 C.3 253 SER253 0.0681 3941 OG 86.9550 117.1440 104.2490 O.3 253 SER253 -0.3930 3942 H 88.2350 116.1240 106.4590 H 253 SER253 0.1312 3943 HA 87.3640 114.5490 104.2390 H 253 SER253 0.0580 3944 HB1 88.3100 116.4570 102.8510 H 253 SER253 0.0577 3945 HB2 89.0290 117.1240 104.3250 H 253 SER253 0.0577 3946 HG 86.9140 118.0360 103.9140 H 253 SER253 0.2095 3947 N 90.6360 114.6850 104.7010 N.am 254 ALA254 -0.2459 3948 CA 91.8660 113.9620 104.3710 C.3 254 ALA254 0.0850 3949 C 91.7570 112.4810 104.7000 C.2 254 ALA254 0.2184 3950 O 92.2280 111.6340 103.9330 O.2 254 ALA254 -0.2778 3951 CB 93.0500 114.5630 105.1190 C.3 254 ALA254 -0.0411 3952 H 90.6530 115.4210 105.4070 H 254 ALA254 0.1312 3953 HA 92.0200 114.0560 103.2940 H 254 ALA254 0.0554 3954 HB1 93.9560 113.9660 105.0070 H 254 ALA254 0.0249 3955 HB2 92.8420 114.6830 106.1820 H 254 ALA254 0.0249 3956 HB3 93.2550 115.5360 104.6970 H 254 ALA254 0.0249 3957 N 91.1330 112.1470 105.8310 N.am 255 ALA255 -0.2459 3958 CA 90.9290 110.7390 106.1630 C.3 255 ALA255 0.0850 3959 C 89.9090 110.0770 105.2420 C.2 255 ALA255 0.2184 3960 O 89.9510 108.8590 105.0490 O.2 255 ALA255 -0.2778 3961 CB 90.5130 110.6220 107.6340 C.3 255 ALA255 -0.0411 3962 H 90.7990 112.8740 106.4630 H 255 ALA255 0.1312 3963 HA 91.8770 110.2350 106.0020 H 255 ALA255 0.0554 3964 HB1 90.4300 109.5780 107.9390 H 255 ALA255 0.0249 3965 HB2 89.5540 111.1080 107.8170 H 255 ALA255 0.0249 3966 HB3 91.2530 111.0920 108.2820 H 255 ALA255 0.0249 3967 N 88.9840 110.8580 104.6810 N.am 256 ALA256 -0.2459 3968 CA 87.9240 110.3500 103.8220 C.3 256 ALA256 0.0850 3969 C 88.3280 110.2210 102.3620 C.2 256 ALA256 0.2184 3970 O 87.5280 109.7010 101.5760 O.2 256 ALA256 -0.2778 3971 CB 86.7250 111.2980 103.9400 C.3 256 ALA256 -0.0411 3972 H 89.0210 111.8610 104.8630 H 256 ALA256 0.1312 3973 HA 87.6510 109.3580 104.1800 H 256 ALA256 0.0554 3974 HB1 85.8670 110.9300 103.3780 H 256 ALA256 0.0249 3975 HB2 86.9700 112.2940 103.5700 H 256 ALA256 0.0249 3976 HB3 86.4160 111.4040 104.9800 H 256 ALA256 0.0249 3977 N 89.4960 110.7530 101.9760 N.am 257 VAL257 -0.2454 3978 CA 90.0040 110.5640 100.6040 C.3 257 VAL257 0.0903 3979 C 90.0680 109.0940 100.1400 C.2 257 VAL257 0.2216 3980 O 89.5440 108.8000 99.0570 O.2 257 VAL257 -0.2776 3981 CB 91.3460 111.3130 100.3940 C.3 257 VAL257 -0.0227 3982 CG1 92.1030 110.8660 99.1280 C.3 257 VAL257 -0.0608 3983 CG2 91.1210 112.8290 100.3300 C.3 257 VAL257 -0.0608 3984 H 90.0430 111.2980 102.6420 H 257 VAL257 0.1312 3985 HA 89.2560 111.0320 99.9610 H 257 VAL257 0.0560 3986 HB 91.9950 111.1210 101.2470 H 257 VAL257 0.0315 3987 HG11 92.9960 111.4690 98.9700 H 257 VAL257 0.0233 3988 HG12 91.4770 110.9640 98.2420 H 257 VAL257 0.0233 3989 HG13 92.4320 109.8290 99.1980 H 257 VAL257 0.0233 3990 HG21 92.0640 113.3680 100.2940 H 257 VAL257 0.0233 3991 HG22 90.5850 113.1890 101.2010 H 257 VAL257 0.0233 3992 HG23 90.5460 113.1020 99.4460 H 257 VAL257 0.0233 3993 N 90.6800 108.1410 100.8850 N.am 258 PRO258 -0.2316 3994 CA 90.7940 106.7790 100.3160 C.3 258 PRO258 0.0907 3995 C 89.4760 106.0280 100.1970 C.2 258 PRO258 0.2189 3996 O 89.3440 105.1890 99.2970 O.2 258 PRO258 -0.2778 3997 CB 91.7260 106.0800 101.3270 C.3 258 PRO258 -0.0276 3998 CG 92.3720 107.2050 102.1390 C.3 258 PRO258 -0.0379 3999 CD 91.3150 108.3060 102.1800 C.3 258 PRO258 0.0071 4000 HA 91.2670 106.8660 99.3370 H 258 PRO258 0.0559 4001 HB1 92.4640 105.4450 100.8380 H 258 PRO258 0.0285 4002 HB2 91.1630 105.4460 102.0150 H 258 PRO258 0.0285 4003 HG1 93.2540 107.5710 101.6120 H 258 PRO258 0.0278 4004 HG2 92.6890 106.8890 103.1320 H 258 PRO258 0.0278 4005 HD1 90.5460 108.1100 102.9240 H 258 PRO258 0.0431 4006 HD2 91.7360 109.3010 102.3080 H 258 PRO258 0.0431 4007 N 88.5010 106.3100 101.0640 N.am 259 VAL259 -0.2454 4008 CA 87.1730 105.7110 100.9360 C.3 259 VAL259 0.0901 4009 C 86.5060 106.1620 99.6420 C.2 259 VAL259 0.2189 4010 O 85.9610 105.3480 98.8850 O.2 259 VAL259 -0.2778 4011 CB 86.3330 106.0840 102.1790 C.3 259 VAL259 -0.0227 4012 CG1 84.8950 105.5470 102.0850 C.3 259 VAL259 -0.0608 4013 CG2 86.9930 105.5920 103.4790 C.3 259 VAL259 -0.0608 4014 H 88.6860 106.9560 101.8310 H 259 VAL259 0.1312 4015 HA 87.3090 104.6290 100.8880 H 259 VAL259 0.0560 4016 HB 86.2750 107.1730 102.2380 H 259 VAL259 0.0315 4017 HG11 84.3320 105.7750 102.9910 H 259 VAL259 0.0233 4018 HG12 84.8910 104.4660 101.9480 H 259 VAL259 0.0233 4019 HG13 84.3520 105.9890 101.2490 H 259 VAL259 0.0233 4020 HG21 86.3960 105.8660 104.3490 H 259 VAL259 0.0233 4021 HG22 87.9830 106.0250 103.6240 H 259 VAL259 0.0233 4022 HG23 87.0990 104.5070 103.4820 H 259 VAL259 0.0233 4023 N 86.5520 107.4670 99.3650 N.am 260 ALA260 -0.2459 4024 CA 85.9800 107.9950 98.1320 C.3 260 ALA260 0.0850 4025 C 86.7640 107.5520 96.9040 C.2 260 ALA260 0.2184 4026 O 86.2020 107.4870 95.8060 O.2 260 ALA260 -0.2778 4027 CB 85.9810 109.5250 98.2270 C.3 260 ALA260 -0.0411 4028 H 86.9940 108.1050 100.0260 H 260 ALA260 0.1312 4029 HA 84.9590 107.6180 98.0510 H 260 ALA260 0.0554 4030 HB1 85.5350 109.9810 97.3410 H 260 ALA260 0.0249 4031 HB2 86.9940 109.9150 98.3330 H 260 ALA260 0.0249 4032 HB3 85.4100 109.8580 99.0930 H 260 ALA260 0.0249 4033 N 88.0560 107.2600 97.0610 N.am 261 MET261 -0.2456 4034 CA 88.8180 106.6760 95.9610 C.3 261 MET261 0.0885 4035 C 88.3830 105.2410 95.6910 C.2 261 MET261 0.2185 4036 O 88.2690 104.8270 94.5320 O.2 261 MET261 -0.2778 4037 CB 90.3080 106.7910 96.3160 C.3 261 MET261 -0.0199 4038 CG 91.2340 106.6320 95.1040 C.3 261 MET261 -0.0047 4039 SD 92.9120 107.1870 95.4730 S.3 261 MET261 -0.1641 4040 CE 92.5970 108.9510 95.6980 C.3 261 MET261 -0.0181 4041 H 88.5140 107.4460 97.9530 H 261 MET261 0.1312 4042 HA 88.6030 107.2740 95.0740 H 261 MET261 0.0557 4043 HB1 90.5780 106.0790 97.0960 H 261 MET261 0.0293 4044 HB2 90.4680 107.7780 96.7490 H 261 MET261 0.0293 4045 HG1 90.8540 107.2330 94.2770 H 261 MET261 0.0377 4046 HG2 91.2560 105.5990 94.7570 H 261 MET261 0.0377 4047 HE1 93.4720 109.5280 95.4020 H 261 MET261 0.0340 4048 HE2 92.3670 109.1680 96.7410 H 261 MET261 0.0340 4049 HE3 91.7650 109.2790 95.0750 H 261 MET261 0.0340 4050 N 88.1280 104.4700 96.7500 N.am 262 GLY262 -0.2485 4051 CA 87.7780 103.0710 96.5810 C.3 262 GLY262 0.0765 4052 C 86.3550 102.8220 96.1350 C.2 262 GLY262 0.2155 4053 O 86.0990 101.8610 95.4030 O.2 262 GLY262 -0.2781 4054 H 88.1800 104.8680 97.6880 H 262 GLY262 0.1309 4055 HA1 87.9210 102.5990 97.5520 H 262 GLY262 0.0521 4056 HA2 88.4730 102.6140 95.8740 H 262 GLY262 0.0521 4057 N 85.4100 103.6550 96.5760 N.am 263 LEU263 -0.2459 4058 CA 84.0260 103.4980 96.1350 C.3 263 LEU263 0.0880 4059 C 83.8550 103.8540 94.6640 C.2 263 LEU263 0.2185 4060 O 82.9490 103.3340 94.0060 O.2 263 LEU263 -0.2778 4061 CB 83.0860 104.3150 97.0460 C.3 263 LEU263 -0.0266 4062 CG 82.5570 103.5540 98.2820 C.3 263 LEU263 -0.0449 4063 CD1 81.6420 102.3820 97.8970 C.3 263 LEU263 -0.0626 4064 CD2 83.6620 103.0850 99.2390 C.3 263 LEU263 -0.0626 4065 H 85.6550 104.4040 97.2230 H 263 LEU263 0.1312 4066 HA 83.7890 102.4380 96.2190 H 263 LEU263 0.0557 4067 HB1 82.2150 104.6480 96.4780 H 263 LEU263 0.0287 4068 HB2 83.5920 105.2290 97.3610 H 263 LEU263 0.0287 4069 HG 81.9390 104.2610 98.8370 H 263 LEU263 0.0296 4070 HD11 81.1210 101.9940 98.7730 H 263 LEU263 0.0232 4071 HD12 82.2070 101.5550 97.4700 H 263 LEU263 0.0232 4072 HD13 80.8870 102.6880 97.1720 H 263 LEU263 0.0232 4073 HD21 83.2350 102.5750 100.1020 H 263 LEU263 0.0232 4074 HD22 84.2330 103.9270 99.6210 H 263 LEU263 0.0232 4075 HD23 84.3500 102.3920 98.7560 H 263 LEU263 0.0232 4076 N 84.7030 104.7390 94.1350 N.am 264 GLY264 -0.2485 4077 CA 84.6310 105.0780 92.7240 C.3 264 GLY264 0.0765 4078 C 85.1030 103.9650 91.8090 C.2 264 GLY264 0.2155 4079 O 84.7010 103.9050 90.6440 O.2 264 GLY264 -0.2781 4080 H 85.4070 105.1810 94.7260 H 264 GLY264 0.1309 4081 HA1 85.2650 105.9520 92.5840 H 264 GLY264 0.0521 4082 HA2 83.6020 105.3490 92.4870 H 264 GLY264 0.0521 4083 N 85.9640 103.0840 92.3090 N.am 265 ASP265 -0.2454 4084 CA 86.3780 101.9200 91.5360 C.3 265 ASP265 0.0974 4085 C 85.2520 100.8950 91.4940 C.2 265 ASP265 0.2192 4086 O 84.6460 100.5810 92.5220 O.2 265 ASP265 -0.2778 4087 CB 87.6800 101.3200 92.0890 C.3 265 ASP265 0.0576 4088 CG 88.4070 100.4520 91.0410 C.2 265 ASP265 0.1780 4089 OD1 88.0750 100.4940 89.8550 O.co2 265 ASP265 -0.6478 4090 OD2 89.3210 99.7220 91.4050 O.co2 265 ASP265 -0.6478 4091 H 86.3400 103.2250 93.2460 H 265 ASP265 0.1312 4092 HA 86.5570 102.2850 90.5230 H 265 ASP265 0.0563 4093 HB1 87.4930 100.7290 92.9850 H 265 ASP265 0.0394 4094 HB2 88.3660 102.1170 92.3730 H 265 ASP265 0.0394 4095 N 84.9700 100.3750 90.2980 N.am 266 GLN266 -0.2456 4096 CA 83.8640 99.4350 90.1490 C.3 266 GLN266 0.0882 4097 C 84.2310 98.0540 90.6790 C.2 266 GLN266 0.2187 4098 O 83.3740 97.3500 91.2260 O.2 266 GLN266 -0.2778 4099 CB 83.4710 99.3980 88.6620 C.3 266 GLN266 -0.0210 4100 CG 82.4170 98.3360 88.2880 C.3 266 GLN266 0.0225 4101 CD 83.0730 97.0110 87.8660 C.2 266 GLN266 0.1981 4102 OE1 83.8220 96.9530 86.8990 O.2 266 GLN266 -0.2798 4103 NE2 82.7490 95.9610 88.6330 N.am 266 GLN266 -0.2724 4104 H 85.5290 100.6350 89.4860 H 266 GLN266 0.1312 4105 HA 83.0240 99.8040 90.7420 H 266 GLN266 0.0557 4106 HB1 84.3640 99.2840 88.0430 H 266 GLN266 0.0289 4107 HB2 83.0720 100.3810 88.4090 H 266 GLN266 0.0289 4108 HG1 81.8330 98.6810 87.4360 H 266 GLN266 0.0356 4109 HG2 81.7140 98.1690 89.1050 H 266 GLN266 0.0356 4110 HE21 83.0970 95.0540 88.4040 H 266 GLN266 0.1266 4111 HE22 82.1640 96.0710 89.4370 H 266 GLN266 0.1266 4112 N 85.4930 97.6440 90.5280 N.am 267 ARG267 -0.2457 4113 CA 85.8780 96.2900 90.9090 C.3 267 ARG267 0.0879 4114 C 86.0040 96.1080 92.4140 C.2 267 ARG267 0.2187 4115 O 86.0160 94.9660 92.8830 O.2 267 ARG267 -0.2778 4116 CB 87.2600 96.0080 90.2760 C.3 267 ARG267 -0.0258 4117 CG 88.2700 97.1310 90.5840 C.3 267 ARG267 -0.0154 4118 CD 89.7520 96.7900 90.4000 C.3 267 ARG267 0.1045 4119 NE 90.1640 96.8230 88.9940 N.pl3 267 ARG267 -0.4450 4120 CZ 90.4450 97.9610 88.3570 C.cat 267 ARG267 0.5062 4121 NH1 90.9490 97.9120 87.1560 N.pl3 267 ARG267 -0.4573 4122 NH2 90.2370 99.1280 88.8870 N.pl3 267 ARG267 -0.4573 4123 H 86.1910 98.2810 90.1440 H 267 ARG267 0.1312 4124 HA 85.1270 95.5950 90.5300 H 267 ARG267 0.0557 4125 HB1 87.1530 95.9130 89.1960 H 267 ARG267 0.0286 4126 HB2 87.6410 95.0480 90.6280 H 267 ARG267 0.0286 4127 HG1 88.1570 97.4510 91.6180 H 267 ARG267 0.0299 4128 HG2 88.0240 97.9960 89.9740 H 267 ARG267 0.0299 4129 HD1 89.9740 95.7970 90.7910 H 267 ARG267 0.0711 4130 HD2 90.3820 97.4890 90.9580 H 267 ARG267 0.0711 4131 HE 90.2560 95.9780 88.4790 H 267 ARG267 0.3153 4132 HH11 91.1560 98.7710 86.6960 H 267 ARG267 0.3114 4133 HH12 91.1230 97.0400 86.7130 H 267 ARG267 0.3114 4134 HH21 90.5060 99.9810 88.4610 H 267 ARG267 0.3114 4135 HH22 89.7590 99.2170 89.7740 H 267 ARG267 0.3114 4136 N 86.1020 97.1940 93.1780 N.am 268 TYR268 -0.2453 4137 CA 86.2770 97.0940 94.6210 C.3 268 TYR268 0.0917 4138 C 84.9590 97.0670 95.3810 C.2 268 TYR268 0.2191 4139 O 84.9450 96.6630 96.5480 O.2 268 TYR268 -0.2778 4140 CB 87.2440 98.1790 95.1320 C.3 268 TYR268 -0.0036 4141 CG 88.6840 98.0010 94.6850 C.ar 268 TYR268 -0.0453 4142 CD1 89.2460 96.7450 94.4370 C.ar 268 TYR268 -0.0561 4143 CD2 89.5080 99.1190 94.5800 C.ar 268 TYR268 -0.0561 4144 CE1 90.5820 96.6170 94.0850 C.ar 268 TYR268 -0.0317 4145 CE2 90.8480 98.9920 94.2300 C.ar 268 TYR268 -0.0317 4146 CZ 91.3870 97.7370 93.9860 C.ar 268 TYR268 0.0726 4147 OH 92.7200 97.5860 93.6620 O.3 268 TYR268 -0.3598 4148 H 86.0540 98.1160 92.7440 H 268 TYR268 0.1312 4149 HA 86.6880 96.1140 94.8490 H 268 TYR268 0.0560 4150 HB1 87.2460 98.1950 96.2230 H 268 TYR268 0.0333 4151 HB2 86.8860 99.1600 94.8150 H 268 TYR268 0.0333 4152 HD1 88.6730 95.8380 94.5260 H 268 TYR268 0.0621 4153 HD2 89.1080 100.1050 94.7700 H 268 TYR268 0.0621 4154 HE1 91.0090 95.6430 93.9060 H 268 TYR268 0.0643 4155 HE2 91.4690 99.8720 94.1500 H 268 TYR268 0.0643 4156 HH 93.1330 98.4410 93.6320 H 268 TYR268 0.2173 4157 N 83.8580 97.4790 94.7520 N.am 269 THR269 -0.2434 4158 CA 82.5250 97.3240 95.3190 C.3 269 THR269 0.1135 4159 C 81.7940 96.1470 94.6650 C.2 269 THR269 0.2212 4160 O 80.5710 96.1680 94.4790 O.2 269 THR269 -0.2777 4161 CB 81.7640 98.6500 95.0910 C.3 269 THR269 0.0763 4162 OG1 82.6370 99.7200 95.4230 O.3 269 THR269 -0.3900 4163 CG2 80.5080 98.7870 95.9690 C.3 269 THR269 -0.0370 4164 H 83.9530 97.9200 93.8370 H 269 THR269 0.1313 4165 HA 82.6130 97.1350 96.3890 H 269 THR269 0.0583 4166 HB 81.4920 98.7020 94.0270 H 269 THR269 0.0611 4167 HG1 82.3280 100.5470 95.0630 H 269 THR269 0.2098 4168 HG21 79.9850 99.7220 95.7680 H 269 THR269 0.0255 4169 HG22 80.7760 98.7800 97.0250 H 269 THR269 0.0255 4170 HG23 79.7980 97.9810 95.8030 H 269 THR269 0.0255 4171 N 82.5430 95.1180 94.2810 N.am 270 ALA270 -0.2458 4172 CA 82.0170 93.9290 93.6140 C.3 270 ALA270 0.0852 4173 C 81.3750 92.8810 94.5350 C.2 270 ALA270 0.2211 4174 O 80.3620 92.3020 94.1230 O.2 270 ALA270 -0.2776 4175 CB 83.1240 93.3120 92.7500 C.3 270 ALA270 -0.0411 4176 H 83.5460 95.1610 94.4630 H 270 ALA270 0.1312 4177 HA 81.2290 94.2770 92.9430 H 270 ALA270 0.0554 4178 HB1 82.7480 92.4690 92.1690 H 270 ALA270 0.0249 4179 HB2 83.9640 92.9580 93.3460 H 270 ALA270 0.0249 4180 HB3 83.5130 94.0480 92.0460 H 270 ALA270 0.0249 4181 N 81.9050 92.5510 95.7360 N.am 271 PRO271 -0.2316 4182 CA 81.1460 91.6110 96.5910 C.3 271 PRO271 0.0907 4183 C 79.8180 92.1540 97.1000 C.2 271 PRO271 0.2189 4184 O 78.8080 91.4410 97.0480 O.2 271 PRO271 -0.2778 4185 CB 82.1210 91.3780 97.7650 C.3 271 PRO271 -0.0276 4186 CG 83.4820 91.9150 97.3070 C.3 271 PRO271 -0.0379 4187 CD 83.1670 93.0120 96.2920 C.3 271 PRO271 0.0071 4188 HA 80.9850 90.6950 96.0200 H 271 PRO271 0.0559 4189 HB1 82.1730 90.3260 98.0480 H 271 PRO271 0.0285 4190 HB2 81.8210 91.9290 98.6570 H 271 PRO271 0.0285 4191 HG1 84.0330 91.1160 96.8100 H 271 PRO271 0.0278 4192 HG2 84.0940 92.2730 98.1360 H 271 PRO271 0.0278 4193 HD1 82.9840 93.9790 96.7630 H 271 PRO271 0.0431 4194 HD2 83.9260 93.1000 95.5160 H 271 PRO271 0.0431 4195 N 79.7830 93.3940 97.5930 N.am 272 TRP272 -0.2453 4196 CA 78.5440 93.9240 98.1560 C.3 272 TRP272 0.0918 4197 C 77.5490 94.2930 97.0630 C.2 272 TRP272 0.2189 4198 O 76.4770 93.6880 96.9520 O.2 272 TRP272 -0.2778 4199 CB 78.8500 95.1590 99.0220 C.3 272 TRP272 -0.0021 4200 CG 79.5410 94.7320 100.2970 C.ar 272 TRP272 -0.0260 4201 CD1 78.9060 94.3670 101.4880 C.ar 272 TRP272 -0.0136 4202 CD2 80.9580 94.6050 100.5290 C.ar 272 TRP272 -0.0028 4203 NE1 79.8420 94.0310 102.4070 N.ar 272 TRP272 -0.2641 4204 CE2 81.1130 94.1540 101.8610 C.ar 272 TRP272 0.0269 4205 CE3 82.0590 94.8230 99.7450 C.ar 272 TRP272 -0.0528 4206 CZ2 82.3630 93.9240 102.3650 C.ar 272 TRP272 -0.0430 4207 CZ3 83.3350 94.5860 100.2540 C.ar 272 TRP272 -0.0611 4208 CH2 83.4840 94.1290 101.5640 C.ar 272 TRP272 -0.0602 4209 H 80.6230 93.9720 97.5770 H 272 TRP272 0.1312 4210 HA 78.0930 93.1410 98.7700 H 272 TRP272 0.0560 4211 HB1 77.9310 95.6780 99.2990 H 272 TRP272 0.0334 4212 HB2 79.4710 95.8750 98.4830 H 272 TRP272 0.0334 4213 HD1 77.8390 94.3490 101.6500 H 272 TRP272 0.0748 4214 HE1 79.6560 93.7340 103.3220 H 272 TRP272 0.1331 4215 HE3 81.9420 95.1740 98.7300 H 272 TRP272 0.0624 4216 HZ2 82.4780 93.5790 103.3810 H 272 TRP272 0.0633 4217 HZ3 84.2020 94.7600 99.6340 H 272 TRP272 0.0618 4218 HH2 84.4650 93.9380 101.9710 H 272 TRP272 0.0618 4219 N 77.8880 95.2770 96.2410 N.am 273 ARG273 -0.2473 4220 CA 76.9480 95.7640 95.2440 C.3 273 ARG273 0.0700 4221 C 77.4970 95.5690 93.8350 C.2 273 ARG273 0.1375 4222 O 77.8750 96.5300 93.1670 O.2 273 ARG273 -0.2994 4223 CB 76.6360 97.2460 95.5190 C.3 273 ARG273 -0.0274 4224 CG 76.1250 97.5470 96.9400 C.3 273 ARG273 -0.0154 4225 CD 74.9630 96.6640 97.4320 C.3 273 ARG273 0.1045 4226 NE 73.8790 96.5920 96.4450 N.pl3 273 ARG273 -0.4450 4227 CZ 73.3400 95.4720 95.9570 C.cat 273 ARG273 0.5062 4228 NH1 72.3340 95.5630 95.1290 N.pl3 273 ARG273 -0.4573 4229 NH2 73.7830 94.2820 96.2750 N.pl3 273 ARG273 -0.4573 4230 H 78.8160 95.6960 96.3090 H 273 ARG273 0.1311 4231 HA 76.0270 95.1890 95.2760 H 273 ARG273 0.0540 4232 H 77.5560 94.5530 93.4090 H 273 ARG273 0.1043 4233 HB1 75.9000 97.5950 94.7940 H 273 ARG273 0.0285 4234 HB2 77.5280 97.8490 95.3430 H 273 ARG273 0.0285 4235 HG1 75.8160 98.5920 96.9770 H 273 ARG273 0.0299 4236 HG2 76.9510 97.4620 97.6470 H 273 ARG273 0.0299 4237 HD1 74.5340 97.0880 98.3440 H 273 ARG273 0.0711 4238 HD2 75.3130 95.6700 97.6990 H 273 ARG273 0.0711 4239 HE 73.5040 97.4550 96.1100 H 273 ARG273 0.3153 4240 HH11 71.9240 94.7370 94.7490 H 273 ARG273 0.3114 4241 HH12 71.9730 96.4560 94.8710 H 273 ARG273 0.3114 4242 HH21 73.3320 93.4600 95.9360 H 273 ARG273 0.3114 4243 HH22 74.5900 94.1840 96.8590 H 273 ARG273 0.3114 @BOND 1 1 2 1 2 1 9 1 3 1 10 1 4 1 11 1 5 2 5 1 6 2 3 1 7 2 12 1 8 3 4 2 9 3 22 am 10 5 6 1 11 5 13 1 12 5 14 1 13 6 7 1 14 6 8 1 15 6 15 1 16 7 16 1 17 7 17 1 18 7 18 1 19 8 19 1 20 8 20 1 21 8 21 1 22 22 23 1 23 22 28 1 24 23 26 1 25 23 24 1 26 23 29 1 27 24 25 2 28 24 33 am 29 26 27 1 30 26 30 1 31 26 31 1 32 27 32 1 33 33 34 1 34 33 41 1 35 34 37 1 36 34 35 1 37 34 42 1 38 35 36 2 39 35 52 am 40 37 38 1 41 37 43 1 42 37 44 1 43 38 39 1 44 38 40 1 45 38 45 1 46 39 46 1 47 39 47 1 48 39 48 1 49 40 49 1 50 40 50 1 51 40 51 1 52 52 53 1 53 52 57 1 54 53 56 1 55 53 54 1 56 53 58 1 57 54 55 2 58 54 62 am 59 56 59 1 60 56 60 1 61 56 61 1 62 62 63 1 63 62 70 1 64 63 66 1 65 63 64 1 66 63 71 1 67 64 65 2 68 64 81 am 69 66 67 1 70 66 72 1 71 66 73 1 72 67 68 1 73 67 69 1 74 67 74 1 75 68 75 1 76 68 76 1 77 68 77 1 78 69 78 1 79 69 79 1 80 69 80 1 81 81 82 1 82 81 86 1 83 82 85 1 84 82 83 1 85 82 87 1 86 83 84 2 87 83 91 am 88 85 88 1 89 85 89 1 90 85 90 1 91 91 92 1 92 91 97 1 93 92 95 1 94 92 93 1 95 92 98 1 96 93 94 2 97 93 102 am 98 95 96 1 99 95 99 1 100 95 100 1 101 96 101 1 102 102 103 1 103 102 110 1 104 103 106 1 105 103 104 1 106 103 111 1 107 104 105 2 108 104 121 am 109 106 107 1 110 106 112 1 111 106 113 1 112 107 108 1 113 107 109 1 114 107 114 1 115 108 115 1 116 108 116 1 117 108 117 1 118 109 118 1 119 109 119 1 120 109 120 1 121 121 122 1 122 121 129 1 123 122 125 1 124 122 123 1 125 122 130 1 126 123 124 2 127 123 140 am 128 125 127 1 129 125 126 1 130 125 131 1 131 126 128 1 132 126 132 1 133 126 133 1 134 127 134 1 135 127 135 1 136 127 136 1 137 128 137 1 138 128 138 1 139 128 139 1 140 140 141 1 141 140 148 1 142 141 144 1 143 141 142 1 144 141 149 1 145 142 143 2 146 142 159 am 147 144 146 1 148 144 145 1 149 144 150 1 150 145 147 1 151 145 151 1 152 145 152 1 153 146 153 1 154 146 154 1 155 146 155 1 156 147 156 1 157 147 157 1 158 147 158 1 159 159 160 1 160 159 166 1 161 160 163 1 162 160 161 1 163 160 167 1 164 161 162 2 165 161 173 am 166 163 165 1 167 163 164 1 168 163 168 1 169 164 169 1 170 165 170 1 171 165 171 1 172 165 172 1 173 173 174 1 174 173 178 1 175 174 177 1 176 174 175 1 177 174 179 1 178 175 176 2 179 175 183 am 180 177 180 1 181 177 181 1 182 177 182 1 183 183 184 1 184 183 191 1 185 184 187 1 186 184 185 1 187 184 192 1 188 185 186 2 189 185 197 am 190 187 188 1 191 187 193 1 192 187 194 1 193 188 189 2 194 188 190 am 195 190 195 1 196 190 196 1 197 197 198 1 198 197 205 1 199 198 201 1 200 198 199 1 201 198 206 1 202 199 200 2 203 199 216 am 204 201 202 1 205 201 207 1 206 201 208 1 207 202 203 1 208 202 204 1 209 202 209 1 210 203 210 1 211 203 211 1 212 203 212 1 213 204 213 1 214 204 214 1 215 204 215 1 216 216 217 1 217 216 224 1 218 217 220 1 219 217 218 1 220 217 225 1 221 218 219 2 222 218 235 am 223 220 221 1 224 220 226 1 225 220 227 1 226 221 222 1 227 221 223 1 228 221 228 1 229 222 229 1 230 222 230 1 231 222 231 1 232 223 232 1 233 223 233 1 234 223 234 1 235 235 236 1 236 235 243 1 237 236 239 1 238 236 237 1 239 236 244 1 240 237 238 2 241 237 254 am 242 239 240 1 243 239 245 1 244 239 246 1 245 240 241 1 246 240 242 1 247 240 247 1 248 241 248 1 249 241 249 1 250 241 250 1 251 242 251 1 252 242 252 1 253 242 253 1 254 254 255 1 255 254 259 1 256 255 258 1 257 255 256 1 258 255 260 1 259 256 257 2 260 256 264 am 261 258 261 1 262 258 262 1 263 258 263 1 264 264 265 1 265 264 272 1 266 265 268 1 267 265 266 1 268 265 273 1 269 266 267 2 270 266 283 am 271 268 269 1 272 268 274 1 273 268 275 1 274 269 270 1 275 269 271 1 276 269 276 1 277 270 277 1 278 270 278 1 279 270 279 1 280 271 280 1 281 271 281 1 282 271 282 1 283 283 284 1 284 283 287 1 285 284 285 1 286 284 288 1 287 284 289 1 288 285 286 2 289 285 290 am 290 290 291 1 291 290 298 1 292 291 294 1 293 291 292 1 294 291 299 1 295 292 293 2 296 292 309 am 297 294 296 1 298 294 295 1 299 294 300 1 300 295 297 1 301 295 301 1 302 295 302 1 303 296 303 1 304 296 304 1 305 296 305 1 306 297 306 1 307 297 307 1 308 297 308 1 309 309 310 1 310 309 314 1 311 310 313 1 312 310 311 1 313 310 315 1 314 311 312 2 315 311 319 am 316 313 316 1 317 313 317 1 318 313 318 1 319 319 320 1 320 319 333 1 321 320 323 1 322 320 321 1 323 320 334 1 324 321 322 2 325 321 343 am 326 323 324 1 327 323 335 1 328 323 336 1 329 324 325 ar 330 324 326 ar 331 325 327 ar 332 325 337 1 333 326 328 ar 334 326 329 ar 335 327 328 ar 336 327 338 1 337 328 330 ar 338 329 331 ar 339 329 339 1 340 330 332 ar 341 330 340 1 342 331 332 ar 343 331 341 1 344 332 342 1 345 343 344 1 346 343 351 1 347 344 347 1 348 344 345 1 349 344 352 1 350 345 355 am 351 345 346 2 352 347 348 1 353 347 353 1 354 347 354 1 355 348 349 ar 356 348 350 ar 357 355 356 1 358 355 378 1 359 356 358 1 360 356 360 1 361 356 357 1 362 358 359 2 363 358 379 am 364 360 363 1 365 360 362 1 366 360 361 1 367 363 366 1 368 363 365 1 369 363 364 1 370 366 369 1 371 366 368 1 372 366 367 1 373 369 371 ar 374 369 370 1 375 371 372 ar 376 371 375 ar 377 372 374 1 378 372 373 1 379 375 377 1 380 375 376 1 381 379 380 1 382 379 390 1 383 380 383 1 384 380 381 1 385 380 391 1 386 381 382 2 387 381 403 am 388 383 384 1 389 383 392 1 390 383 393 1 391 384 385 1 392 384 394 1 393 384 395 1 394 385 386 1 395 385 396 1 396 385 397 1 397 386 387 ar 398 386 398 1 399 387 388 ar 400 387 389 ar 401 388 399 1 402 388 400 1 403 389 401 1 404 389 402 1 405 403 404 1 406 403 411 1 407 404 407 1 408 404 405 1 409 404 412 1 410 405 406 2 411 405 422 am 412 407 408 1 413 407 413 1 414 407 414 1 415 408 409 1 416 408 410 1 417 408 415 1 418 409 416 1 419 409 417 1 420 409 418 1 421 410 419 1 422 410 420 1 423 410 421 1 424 422 423 1 425 422 433 1 426 423 426 1 427 423 424 1 428 423 434 1 429 424 425 2 430 424 446 am 431 426 427 1 432 426 435 1 433 426 436 1 434 427 428 1 435 427 437 1 436 427 438 1 437 428 429 1 438 428 439 1 439 428 440 1 440 429 430 ar 441 429 441 1 442 430 431 ar 443 430 432 ar 444 431 442 1 445 431 443 1 446 432 444 1 447 432 445 1 448 446 447 1 449 446 452 1 450 447 450 1 451 447 448 1 452 447 453 1 453 448 449 2 454 448 457 am 455 450 451 1 456 450 454 1 457 450 455 1 458 451 456 1 459 457 463 1 460 457 458 1 461 458 461 1 462 458 459 1 463 458 464 1 464 459 460 2 465 459 471 am 466 461 462 1 467 461 465 1 468 461 466 1 469 462 463 1 470 462 467 1 471 462 468 1 472 463 469 1 473 463 470 1 474 471 477 1 475 471 472 1 476 472 475 1 477 472 473 1 478 472 478 1 479 473 474 2 480 473 485 am 481 475 476 1 482 475 479 1 483 475 480 1 484 476 477 1 485 476 481 1 486 476 482 1 487 477 483 1 488 477 484 1 489 485 486 1 490 485 490 1 491 486 489 1 492 486 487 1 493 486 491 1 494 487 488 2 495 487 495 am 496 489 492 1 497 489 493 1 498 489 494 1 499 495 496 1 500 495 499 1 501 496 497 1 502 496 500 1 503 496 501 1 504 497 498 2 505 497 502 am 506 502 503 1 507 502 508 1 508 503 506 1 509 503 504 1 510 503 509 1 511 504 505 2 512 504 513 am 513 506 507 1 514 506 510 1 515 506 511 1 516 507 512 1 517 513 514 1 518 513 524 1 519 514 517 1 520 514 515 1 521 514 525 1 522 515 516 2 523 515 533 am 524 517 518 1 525 517 526 1 526 517 527 1 527 518 519 ar 528 518 520 ar 529 519 521 ar 530 519 528 1 531 520 522 ar 532 520 529 1 533 521 523 ar 534 521 530 1 535 522 523 ar 536 522 531 1 537 523 532 1 538 533 534 1 539 533 544 1 540 534 537 1 541 534 535 1 542 534 545 1 543 535 536 2 544 535 553 am 545 537 538 1 546 537 546 1 547 537 547 1 548 538 539 ar 549 538 540 ar 550 539 541 ar 551 539 548 1 552 540 542 ar 553 540 549 1 554 541 543 ar 555 541 550 1 556 542 543 ar 557 542 551 1 558 543 552 1 559 553 554 1 560 553 561 1 561 554 557 1 562 554 555 1 563 554 562 1 564 555 556 2 565 555 572 am 566 557 558 1 567 557 563 1 568 557 564 1 569 558 559 1 570 558 560 1 571 558 565 1 572 559 566 1 573 559 567 1 574 559 568 1 575 560 569 1 576 560 570 1 577 560 571 1 578 572 573 1 579 572 578 1 580 573 576 1 581 573 574 1 582 573 579 1 583 574 575 2 584 574 583 am 585 576 577 1 586 576 580 1 587 576 581 1 588 577 582 1 589 583 584 1 590 583 591 1 591 584 587 1 592 584 585 1 593 584 592 1 594 585 586 2 595 585 602 am 596 587 588 1 597 587 593 1 598 587 594 1 599 588 589 1 600 588 590 1 601 588 595 1 602 589 596 1 603 589 597 1 604 589 598 1 605 590 599 1 606 590 600 1 607 590 601 1 608 602 603 1 609 602 610 1 610 603 606 1 611 603 604 1 612 603 611 1 613 604 605 2 614 604 621 am 615 606 607 1 616 606 612 1 617 606 613 1 618 607 608 1 619 607 609 1 620 607 614 1 621 608 615 1 622 608 616 1 623 608 617 1 624 609 618 1 625 609 619 1 626 609 620 1 627 621 622 1 628 621 629 1 629 622 625 1 630 622 623 1 631 622 630 1 632 623 624 2 633 623 640 am 634 625 626 1 635 625 631 1 636 625 632 1 637 626 627 1 638 626 628 1 639 626 633 1 640 627 634 1 641 627 635 1 642 627 636 1 643 628 637 1 644 628 638 1 645 628 639 1 646 640 641 1 647 640 645 1 648 641 644 1 649 641 642 1 650 641 646 1 651 642 643 2 652 642 650 am 653 644 647 1 654 644 648 1 655 644 649 1 656 650 651 1 657 650 654 1 658 651 652 1 659 651 655 1 660 651 656 1 661 652 653 2 662 652 657 am 663 657 658 1 664 657 665 1 665 658 661 1 666 658 659 1 667 658 666 1 668 659 660 2 669 659 676 am 670 661 662 1 671 661 667 1 672 661 668 1 673 662 663 1 674 662 664 1 675 662 669 1 676 663 670 1 677 663 671 1 678 663 672 1 679 664 673 1 680 664 674 1 681 664 675 1 682 676 677 1 683 676 684 1 684 677 680 1 685 677 678 1 686 677 685 1 687 678 679 2 688 678 695 am 689 680 681 1 690 680 686 1 691 680 687 1 692 681 682 1 693 681 683 1 694 681 688 1 695 682 689 1 696 682 690 1 697 682 691 1 698 683 692 1 699 683 693 1 700 683 694 1 701 695 696 1 702 695 702 1 703 696 699 1 704 696 697 1 705 696 703 1 706 697 698 2 707 697 709 am 708 699 701 1 709 699 700 1 710 699 704 1 711 700 705 1 712 701 706 1 713 701 707 1 714 701 708 1 715 709 710 1 716 709 713 1 717 710 711 1 718 710 714 1 719 710 715 1 720 711 712 2 721 711 716 am 722 716 717 1 723 716 724 1 724 717 720 1 725 717 718 1 726 717 725 1 727 718 719 2 728 718 735 am 729 720 721 1 730 720 726 1 731 720 727 1 732 721 722 1 733 721 723 1 734 721 728 1 735 722 729 1 736 722 730 1 737 722 731 1 738 723 732 1 739 723 733 1 740 723 734 1 741 735 736 1 742 735 740 1 743 736 739 1 744 736 737 1 745 736 741 1 746 737 738 2 747 737 745 am 748 739 742 1 749 739 743 1 750 739 744 1 751 745 746 1 752 745 753 1 753 746 749 1 754 746 747 1 755 746 754 1 756 747 748 2 757 747 764 am 758 749 750 1 759 749 755 1 760 749 756 1 761 750 751 1 762 750 752 1 763 750 757 1 764 751 758 1 765 751 759 1 766 751 760 1 767 752 761 1 768 752 762 1 769 752 763 1 770 764 770 1 771 764 765 1 772 765 768 1 773 765 766 1 774 765 771 1 775 766 767 2 776 766 778 am 777 768 769 1 778 768 772 1 779 768 773 1 780 769 770 1 781 769 774 1 782 769 775 1 783 770 776 1 784 770 777 1 785 778 779 1 786 778 785 1 787 779 782 1 788 779 780 1 789 779 786 1 790 780 781 2 791 780 792 am 792 782 784 1 793 782 783 1 794 782 787 1 795 783 788 1 796 784 789 1 797 784 790 1 798 784 791 1 799 792 793 1 800 792 800 1 801 793 796 1 802 793 794 1 803 793 801 1 804 794 795 2 805 794 811 am 806 796 797 1 807 796 802 1 808 796 803 1 809 797 798 1 810 797 799 1 811 797 804 1 812 798 805 1 813 798 806 1 814 798 807 1 815 799 808 1 816 799 809 1 817 799 810 1 818 811 817 1 819 811 812 1 820 812 815 1 821 812 813 1 822 812 818 1 823 813 814 2 824 813 825 am 825 815 816 1 826 815 819 1 827 815 820 1 828 816 817 1 829 816 821 1 830 816 822 1 831 817 823 1 832 817 824 1 833 825 826 1 834 825 829 1 835 826 827 1 836 826 830 1 837 826 831 1 838 827 828 2 839 827 832 am 840 832 833 1 841 832 840 1 842 833 836 1 843 833 834 1 844 833 841 1 845 834 835 2 846 834 851 am 847 836 837 1 848 836 842 1 849 836 843 1 850 837 838 1 851 837 839 1 852 837 844 1 853 838 845 1 854 838 846 1 855 838 847 1 856 839 848 1 857 839 849 1 858 839 850 1 859 851 852 1 860 851 865 1 861 852 855 1 862 852 853 1 863 852 866 1 864 853 854 2 865 853 875 am 866 855 856 1 867 855 867 1 868 855 868 1 869 856 857 ar 870 856 858 ar 871 857 859 ar 872 857 869 1 873 858 860 ar 874 858 861 ar 875 859 860 ar 876 859 870 1 877 860 862 ar 878 861 863 ar 879 861 871 1 880 862 864 ar 881 862 872 1 882 863 864 ar 883 863 873 1 884 864 874 1 885 875 876 1 886 875 883 1 887 876 879 1 888 876 877 1 889 876 884 1 890 877 878 2 891 877 889 am 892 879 880 1 893 879 885 1 894 879 886 1 895 880 881 2 896 880 882 am 897 882 887 1 898 882 888 1 899 889 890 1 900 889 898 1 901 890 893 1 902 890 891 1 903 890 899 1 904 891 892 2 905 891 906 am 906 893 894 1 907 893 900 1 908 893 901 1 909 894 895 1 910 894 902 1 911 894 903 1 912 895 896 2 913 895 897 am 914 897 904 1 915 897 905 1 916 906 907 1 917 906 912 1 918 907 910 1 919 907 908 1 920 907 913 1 921 908 909 2 922 908 917 am 923 910 911 1 924 910 914 1 925 910 915 1 926 911 916 1 927 917 918 1 928 917 928 1 929 918 921 1 930 918 919 1 931 918 929 1 932 919 920 2 933 919 941 am 934 921 922 1 935 921 930 1 936 921 931 1 937 922 923 1 938 922 932 1 939 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4042 3982 3987 1 4043 3982 3988 1 4044 3982 3989 1 4045 3983 3990 1 4046 3983 3991 1 4047 3983 3992 1 4048 3993 3999 1 4049 3993 3994 1 4050 3994 3997 1 4051 3994 3995 1 4052 3994 4000 1 4053 3995 3996 2 4054 3995 4007 am 4055 3997 3998 1 4056 3997 4001 1 4057 3997 4002 1 4058 3998 3999 1 4059 3998 4003 1 4060 3998 4004 1 4061 3999 4005 1 4062 3999 4006 1 4063 4007 4008 1 4064 4007 4014 1 4065 4008 4011 1 4066 4008 4009 1 4067 4008 4015 1 4068 4009 4010 2 4069 4009 4023 am 4070 4011 4012 1 4071 4011 4013 1 4072 4011 4016 1 4073 4012 4017 1 4074 4012 4018 1 4075 4012 4019 1 4076 4013 4020 1 4077 4013 4021 1 4078 4013 4022 1 4079 4023 4024 1 4080 4023 4028 1 4081 4024 4027 1 4082 4024 4025 1 4083 4024 4029 1 4084 4025 4026 2 4085 4025 4033 am 4086 4027 4030 1 4087 4027 4031 1 4088 4027 4032 1 4089 4033 4034 1 4090 4033 4041 1 4091 4034 4037 1 4092 4034 4035 1 4093 4034 4042 1 4094 4035 4036 2 4095 4035 4050 am 4096 4037 4038 1 4097 4037 4043 1 4098 4037 4044 1 4099 4038 4039 1 4100 4038 4045 1 4101 4038 4046 1 4102 4039 4040 1 4103 4040 4047 1 4104 4040 4048 1 4105 4040 4049 1 4106 4050 4051 1 4107 4050 4054 1 4108 4051 4052 1 4109 4051 4055 1 4110 4051 4056 1 4111 4052 4053 2 4112 4052 4057 am 4113 4057 4058 1 4114 4057 4065 1 4115 4058 4061 1 4116 4058 4059 1 4117 4058 4066 1 4118 4059 4060 2 4119 4059 4076 am 4120 4061 4062 1 4121 4061 4067 1 4122 4061 4068 1 4123 4062 4063 1 4124 4062 4064 1 4125 4062 4069 1 4126 4063 4070 1 4127 4063 4071 1 4128 4063 4072 1 4129 4064 4073 1 4130 4064 4074 1 4131 4064 4075 1 4132 4076 4077 1 4133 4076 4080 1 4134 4077 4078 1 4135 4077 4081 1 4136 4077 4082 1 4137 4078 4079 2 4138 4078 4083 am 4139 4083 4084 1 4140 4083 4091 1 4141 4084 4087 1 4142 4084 4085 1 4143 4084 4092 1 4144 4085 4086 2 4145 4085 4095 am 4146 4087 4088 1 4147 4087 4093 1 4148 4087 4094 1 4149 4088 4089 ar 4150 4088 4090 ar 4151 4095 4096 1 4152 4095 4104 1 4153 4096 4099 1 4154 4096 4097 1 4155 4096 4105 1 4156 4097 4098 2 4157 4097 4112 am 4158 4099 4100 1 4159 4099 4106 1 4160 4099 4107 1 4161 4100 4101 1 4162 4100 4108 1 4163 4100 4109 1 4164 4101 4102 2 4165 4101 4103 am 4166 4103 4110 1 4167 4103 4111 1 4168 4112 4113 1 4169 4112 4123 1 4170 4113 4116 1 4171 4113 4114 1 4172 4113 4124 1 4173 4114 4115 2 4174 4114 4136 am 4175 4116 4117 1 4176 4116 4125 1 4177 4116 4126 1 4178 4117 4118 1 4179 4117 4127 1 4180 4117 4128 1 4181 4118 4119 1 4182 4118 4129 1 4183 4118 4130 1 4184 4119 4120 ar 4185 4119 4131 1 4186 4120 4121 ar 4187 4120 4122 ar 4188 4121 4132 1 4189 4121 4133 1 4190 4122 4134 1 4191 4122 4135 1 4192 4136 4137 1 4193 4136 4148 1 4194 4137 4140 1 4195 4137 4138 1 4196 4137 4149 1 4197 4138 4139 2 4198 4138 4157 am 4199 4140 4141 1 4200 4140 4150 1 4201 4140 4151 1 4202 4141 4142 ar 4203 4141 4143 ar 4204 4142 4144 ar 4205 4142 4152 1 4206 4143 4145 ar 4207 4143 4153 1 4208 4144 4146 ar 4209 4144 4154 1 4210 4145 4146 ar 4211 4145 4155 1 4212 4146 4147 1 4213 4147 4156 1 4214 4157 4158 1 4215 4157 4164 1 4216 4158 4161 1 4217 4158 4159 1 4218 4158 4165 1 4219 4159 4160 2 4220 4159 4171 am 4221 4161 4163 1 4222 4161 4162 1 4223 4161 4166 1 4224 4162 4167 1 4225 4163 4168 1 4226 4163 4169 1 4227 4163 4170 1 4228 4171 4172 1 4229 4171 4176 1 4230 4172 4175 1 4231 4172 4173 1 4232 4172 4177 1 4233 4173 4174 2 4234 4173 4181 am 4235 4175 4178 1 4236 4175 4179 1 4237 4175 4180 1 4238 4181 4187 1 4239 4181 4182 1 4240 4182 4185 1 4241 4182 4183 1 4242 4182 4188 1 4243 4183 4184 2 4244 4183 4195 am 4245 4185 4186 1 4246 4185 4189 1 4247 4185 4190 1 4248 4186 4187 1 4249 4186 4191 1 4250 4186 4192 1 4251 4187 4193 1 4252 4187 4194 1 4253 4195 4196 1 4254 4195 4209 1 4255 4196 4199 1 4256 4196 4197 1 4257 4196 4210 1 4258 4197 4219 am 4259 4197 4198 2 4260 4199 4200 1 4261 4199 4211 1 4262 4199 4212 1 4263 4200 4201 ar 4264 4200 4202 ar 4265 4201 4203 ar 4266 4201 4213 1 4267 4202 4204 ar 4268 4202 4205 ar 4269 4203 4204 ar 4270 4203 4214 1 4271 4204 4206 ar 4272 4205 4207 ar 4273 4205 4215 1 4274 4206 4208 ar 4275 4206 4216 1 4276 4207 4208 ar 4277 4207 4217 1 4278 4208 4218 1 4279 4219 4220 1 4280 4219 4230 1 4281 4220 4223 1 4282 4220 4221 1 4283 4220 4231 1 4284 4221 4222 2 4285 4221 4232 1 4286 4223 4224 1 4287 4223 4233 1 4288 4223 4234 1 4289 4224 4225 1 4290 4224 4235 1 4291 4224 4236 1 4292 4225 4226 1 4293 4225 4237 1 4294 4225 4238 1 4295 4226 4227 ar 4296 4226 4239 1 4297 4227 4228 ar 4298 4227 4229 ar 4299 4228 4240 1 4300 4228 4241 1 4301 4229 4242 1 4302 4229 4243 1 @SUBSTRUCTURE 1 LEU1 2 RESIDUE 1 R LEU 1 ROOT 2 SER2 23 RESIDUE 1 R SER 2 3 LEU3 34 RESIDUE 1 R LEU 2 4 ALA4 53 RESIDUE 1 R ALA 2 5 LEU5 63 RESIDUE 1 R LEU 2 6 ALA6 82 RESIDUE 1 R ALA 2 7 SER7 92 RESIDUE 1 R SER 2 8 LEU8 103 RESIDUE 1 R LEU 2 9 ILE9 122 RESIDUE 1 R ILE 2 10 ILE10 141 RESIDUE 1 R ILE 2 11 THR11 160 RESIDUE 1 R THR 2 12 ALA12 174 RESIDUE 1 R ALA 2 13 ASN13 184 RESIDUE 1 R ASN 2 14 LEU14 198 RESIDUE 1 R LEU 2 15 LEU15 217 RESIDUE 1 R LEU 2 16 LEU16 236 RESIDUE 1 R LEU 2 17 ALA17 255 RESIDUE 1 R ALA 2 18 LEU18 265 RESIDUE 1 R LEU 2 19 GLY19 284 RESIDUE 1 R GLY 2 20 ILE20 291 RESIDUE 1 R ILE 2 21 ALA21 310 RESIDUE 1 R ALA 2 22 TRP22 320 RESIDUE 1 R TRP 2 23 ASP23 344 RESIDUE 1 R ASP 2 24 ARG24 356 RESIDUE 1 R ARG 2 25 ARG25 380 RESIDUE 1 R ARG 2 26 LEU26 404 RESIDUE 1 R LEU 2 27 ARG27 423 RESIDUE 1 R ARG 2 28 SER28 447 RESIDUE 1 R SER 2 29 PRO29 458 RESIDUE 1 R PRO 2 30 PRO30 472 RESIDUE 1 R PRO 2 31 ALA31 486 RESIDUE 1 R ALA 2 32 GLY32 496 RESIDUE 1 R GLY 2 33 CYS33 503 RESIDUE 1 R CYS 2 34 PHE34 514 RESIDUE 1 R PHE 2 35 PHE35 534 RESIDUE 1 R PHE 2 36 LEU36 554 RESIDUE 1 R LEU 2 37 SER37 573 RESIDUE 1 R SER 2 38 LEU38 584 RESIDUE 1 R LEU 2 39 LEU39 603 RESIDUE 1 R LEU 2 40 LEU40 622 RESIDUE 1 R LEU 2 41 ALA41 641 RESIDUE 1 R ALA 2 42 GLY42 651 RESIDUE 1 R GLY 2 43 LEU43 658 RESIDUE 1 R LEU 2 44 LEU44 677 RESIDUE 1 R LEU 2 45 THR45 696 RESIDUE 1 R THR 2 46 GLY46 710 RESIDUE 1 R GLY 2 47 LEU47 717 RESIDUE 1 R LEU 2 48 ALA48 736 RESIDUE 1 R ALA 2 49 LEU49 746 RESIDUE 1 R LEU 2 50 PRO50 765 RESIDUE 1 R PRO 2 51 THR51 779 RESIDUE 1 R THR 2 52 LEU52 793 RESIDUE 1 R LEU 2 53 PRO53 812 RESIDUE 1 R PRO 2 54 GLY54 826 RESIDUE 1 R GLY 2 55 LEU55 833 RESIDUE 1 R LEU 2 56 TRP56 852 RESIDUE 1 R TRP 2 57 ASN57 876 RESIDUE 1 R ASN 2 58 GLN58 890 RESIDUE 1 R GLN 2 59 SER59 907 RESIDUE 1 R SER 2 60 ARG60 918 RESIDUE 1 R ARG 2 61 ARG61 942 RESIDUE 1 R ARG 2 62 GLY62 966 RESIDUE 1 R GLY 2 63 TYR63 973 RESIDUE 1 R TYR 2 64 TRP64 994 RESIDUE 1 R TRP 2 65 SER65 1018 RESIDUE 1 R SER 2 66 CYS66 1029 RESIDUE 1 R CYS 3 67 LEU67 1039 RESIDUE 1 R LEU 2 68 LEU68 1058 RESIDUE 1 R LEU 2 69 VAL69 1077 RESIDUE 1 R VAL 2 70 TYR70 1093 RESIDUE 1 R TYR 2 71 LEU71 1114 RESIDUE 1 R LEU 2 72 ALA72 1133 RESIDUE 1 R ALA 2 73 PRO73 1143 RESIDUE 1 R PRO 2 74 ASN74 1157 RESIDUE 1 R ASN 2 75 PHE75 1171 RESIDUE 1 R PHE 2 76 SER76 1191 RESIDUE 1 R SER 2 77 PHE77 1202 RESIDUE 1 R PHE 2 78 LEU78 1222 RESIDUE 1 R LEU 2 79 SER79 1241 RESIDUE 1 R SER 2 80 LEU80 1252 RESIDUE 1 R LEU 2 81 LEU81 1271 RESIDUE 1 R LEU 2 82 ALA82 1290 RESIDUE 1 R ALA 2 83 ASN83 1300 RESIDUE 1 R ASN 2 84 LEU84 1314 RESIDUE 1 R LEU 2 85 LEU85 1333 RESIDUE 1 R LEU 2 86 LEU86 1352 RESIDUE 1 R LEU 2 87 VAL87 1371 RESIDUE 1 R VAL 2 88 HIS88 1387 RESIDUE 1 R HIS 2 89 GLY89 1404 RESIDUE 1 R GLY 2 90 GLU90 1411 RESIDUE 1 R GLU 2 91 ARG91 1426 RESIDUE 1 R ARG 2 92 TYR92 1450 RESIDUE 1 R TYR 2 93 MET93 1471 RESIDUE 1 R MET 2 94 ALA94 1488 RESIDUE 1 R ALA 2 95 VAL95 1498 RESIDUE 1 R VAL 2 96 LEU96 1514 RESIDUE 1 R LEU 2 97 ARG97 1533 RESIDUE 1 R ARG 2 98 PRO98 1557 RESIDUE 1 R PRO 2 99 LEU99 1571 RESIDUE 1 R LEU 2 100 GLN100 1590 RESIDUE 1 R GLN 2 101 PRO101 1607 RESIDUE 1 R PRO 2 102 PRO102 1621 RESIDUE 1 R PRO 2 103 GLY103 1635 RESIDUE 1 R GLY 2 104 SER104 1642 RESIDUE 1 R SER 2 105 ILE105 1653 RESIDUE 1 R ILE 2 106 ARG106 1672 RESIDUE 1 R ARG 2 107 LEU107 1696 RESIDUE 1 R LEU 2 108 ALA108 1715 RESIDUE 1 R ALA 2 109 LEU109 1725 RESIDUE 1 R LEU 2 110 LEU110 1744 RESIDUE 1 R LEU 2 111 LEU111 1763 RESIDUE 1 R LEU 2 112 THR112 1782 RESIDUE 1 R THR 2 113 TRP113 1796 RESIDUE 1 R TRP 2 114 ALA114 1820 RESIDUE 1 R ALA 2 115 GLY115 1830 RESIDUE 1 R GLY 2 116 PRO116 1837 RESIDUE 1 R PRO 2 117 LEU117 1851 RESIDUE 1 R LEU 2 118 LEU118 1870 RESIDUE 1 R LEU 2 119 PHE119 1889 RESIDUE 1 R PHE 2 120 ALA120 1909 RESIDUE 1 R ALA 2 121 SER121 1919 RESIDUE 1 R SER 2 122 LEU122 1930 RESIDUE 1 R LEU 2 123 PRO123 1949 RESIDUE 1 R PRO 2 124 ALA124 1963 RESIDUE 1 R ALA 2 125 LEU125 1973 RESIDUE 1 R LEU 2 126 GLY126 1992 RESIDUE 1 R GLY 2 127 TRP127 1999 RESIDUE 1 R TRP 2 128 ASN128 2023 RESIDUE 1 R ASN 2 129 HIS129 2037 RESIDUE 1 R HIS 2 130 TRP130 2054 RESIDUE 1 R TRP 2 131 THR131 2078 RESIDUE 1 R THR 2 132 PRO132 2092 RESIDUE 1 R PRO 2 133 GLY133 2106 RESIDUE 1 R GLY 2 134 ALA134 2113 RESIDUE 1 R ALA 2 135 ASN135 2123 RESIDUE 1 R ASN 2 136 CYS136 2137 RESIDUE 1 R CYS 3 137 SER137 2147 RESIDUE 1 R SER 2 138 SER138 2158 RESIDUE 1 R SER 2 139 GLN139 2169 RESIDUE 1 R GLN 2 140 ALA140 2186 RESIDUE 1 R ALA 2 141 ILE141 2196 RESIDUE 1 R ILE 2 142 PHE142 2215 RESIDUE 1 R PHE 2 143 PRO143 2235 RESIDUE 1 R PRO 2 144 ALA144 2249 RESIDUE 1 R ALA 2 145 PRO145 2259 RESIDUE 1 R PRO 2 146 TYR146 2273 RESIDUE 1 R TYR 2 147 LEU147 2294 RESIDUE 1 R LEU 2 148 TYR148 2313 RESIDUE 1 R TYR 2 149 LEU149 2334 RESIDUE 1 R LEU 2 150 GLU150 2353 RESIDUE 1 R GLU 2 151 VAL151 2368 RESIDUE 1 R VAL 2 152 TYR152 2384 RESIDUE 1 R TYR 2 153 GLY153 2405 RESIDUE 1 R GLY 2 154 LEU154 2412 RESIDUE 1 R LEU 2 155 LEU155 2431 RESIDUE 1 R LEU 2 156 LEU156 2450 RESIDUE 1 R LEU 2 157 PRO157 2469 RESIDUE 1 R PRO 2 158 ALA158 2483 RESIDUE 1 R ALA 2 159 VAL159 2493 RESIDUE 1 R VAL 2 160 GLY160 2509 RESIDUE 1 R GLY 2 161 ALA161 2516 RESIDUE 1 R ALA 2 162 ALA162 2526 RESIDUE 1 R ALA 2 163 ALA163 2536 RESIDUE 1 R ALA 2 164 PHE164 2546 RESIDUE 1 R PHE 2 165 LEU165 2566 RESIDUE 1 R LEU 2 166 SER166 2585 RESIDUE 1 R SER 2 167 VAL167 2596 RESIDUE 1 R VAL 2 168 ARG168 2612 RESIDUE 1 R ARG 2 169 VAL169 2636 RESIDUE 1 R VAL 2 170 LEU170 2652 RESIDUE 1 R LEU 2 171 ALA171 2671 RESIDUE 1 R ALA 2 172 THR172 2681 RESIDUE 1 R THR 2 173 ALA173 2695 RESIDUE 1 R ALA 2 174 HIS174 2705 RESIDUE 1 R HIS 2 175 ARG175 2722 RESIDUE 1 R ARG 2 176 GLN176 2746 RESIDUE 1 R GLN 2 177 LEU177 2763 RESIDUE 1 R LEU 2 178 GLN178 2782 RESIDUE 1 R GLN 2 179 ASP179 2799 RESIDUE 1 R ASP 2 180 ILE180 2811 RESIDUE 1 R ILE 2 181 CYS181 2830 RESIDUE 1 R CYS 2 182 ARG182 2841 RESIDUE 1 R ARG 2 183 LEU183 2865 RESIDUE 1 R LEU 2 184 GLU184 2884 RESIDUE 1 R GLU 2 185 ARG185 2899 RESIDUE 1 R ARG 2 186 ALA186 2923 RESIDUE 1 R ALA 2 187 VAL187 2933 RESIDUE 1 R VAL 2 188 CYS188 2949 RESIDUE 1 R CYS 2 189 ARG189 2960 RESIDUE 1 R ARG 2 190 ASP190 2984 RESIDUE 1 R ASP 2 191 GLU191 2996 RESIDUE 1 R GLU 2 192 PRO192 3011 RESIDUE 1 R PRO 2 193 SER193 3025 RESIDUE 1 R SER 2 194 ALA194 3036 RESIDUE 1 R ALA 2 195 LEU195 3046 RESIDUE 1 R LEU 2 196 ALA196 3065 RESIDUE 1 R ALA 2 197 ARG197 3075 RESIDUE 1 R ARG 2 198 ALA198 3099 RESIDUE 1 R ALA 2 199 LEU199 3109 RESIDUE 1 R LEU 2 200 THR200 3128 RESIDUE 1 R THR 2 201 TRP201 3142 RESIDUE 1 R TRP 2 202 ARG202 3166 RESIDUE 1 R ARG 2 203 GLN203 3190 RESIDUE 1 R GLN 2 204 ALA204 3207 RESIDUE 1 R ALA 2 205 ARG205 3217 RESIDUE 1 R ARG 2 206 ALA206 3241 RESIDUE 1 R ALA 2 207 GLN207 3251 RESIDUE 1 R GLN 2 208 ALA208 3268 RESIDUE 1 R ALA 2 209 GLY209 3278 RESIDUE 1 R GLY 2 210 ALA210 3285 RESIDUE 1 R ALA 2 211 MET211 3295 RESIDUE 1 R MET 2 212 LEU212 3312 RESIDUE 1 R LEU 2 213 LEU213 3331 RESIDUE 1 R LEU 2 214 PHE214 3350 RESIDUE 1 R PHE 2 215 GLY215 3370 RESIDUE 1 R GLY 2 216 LEU216 3377 RESIDUE 1 R LEU 2 217 CYS217 3396 RESIDUE 1 R CYS 2 218 TRP218 3407 RESIDUE 1 R TRP 2 219 GLY219 3431 RESIDUE 1 R GLY 2 220 PRO220 3438 RESIDUE 1 R PRO 2 221 TYR221 3452 RESIDUE 1 R TYR 2 222 VAL222 3473 RESIDUE 1 R VAL 2 223 ALA223 3489 RESIDUE 1 R ALA 2 224 THR224 3499 RESIDUE 1 R THR 2 225 LEU225 3513 RESIDUE 1 R LEU 2 226 LEU226 3532 RESIDUE 1 R LEU 2 227 LEU227 3551 RESIDUE 1 R LEU 2 228 SER228 3570 RESIDUE 1 R SER 2 229 VAL229 3581 RESIDUE 1 R VAL 2 230 LEU230 3597 RESIDUE 1 R LEU 2 231 ALA231 3616 RESIDUE 1 R ALA 2 232 TYR232 3626 RESIDUE 1 R TYR 2 233 GLU233 3647 RESIDUE 1 R GLU 2 234 GLN234 3662 RESIDUE 1 R GLN 2 235 ARG235 3679 RESIDUE 1 R ARG 2 236 PRO236 3703 RESIDUE 1 R PRO 2 237 PRO237 3717 RESIDUE 1 R PRO 2 238 LEU238 3731 RESIDUE 1 R LEU 2 239 GLY239 3750 RESIDUE 1 R GLY 2 240 PRO240 3757 RESIDUE 1 R PRO 2 241 GLY241 3771 RESIDUE 1 R GLY 2 242 THR242 3778 RESIDUE 1 R THR 2 243 LEU243 3792 RESIDUE 1 R LEU 2 244 LEU244 3811 RESIDUE 1 R LEU 2 245 SER245 3830 RESIDUE 1 R SER 2 246 LEU246 3841 RESIDUE 1 R LEU 2 247 LEU247 3860 RESIDUE 1 R LEU 2 248 SER248 3879 RESIDUE 1 R SER 2 249 LEU249 3890 RESIDUE 1 R LEU 2 250 GLY250 3909 RESIDUE 1 R GLY 2 251 SER251 3916 RESIDUE 1 R SER 2 252 ALA252 3927 RESIDUE 1 R ALA 2 253 SER253 3937 RESIDUE 1 R SER 2 254 ALA254 3948 RESIDUE 1 R ALA 2 255 ALA255 3958 RESIDUE 1 R ALA 2 256 ALA256 3968 RESIDUE 1 R ALA 2 257 VAL257 3978 RESIDUE 1 R VAL 2 258 PRO258 3994 RESIDUE 1 R PRO 2 259 VAL259 4008 RESIDUE 1 R VAL 2 260 ALA260 4024 RESIDUE 1 R ALA 2 261 MET261 4034 RESIDUE 1 R MET 2 262 GLY262 4051 RESIDUE 1 R GLY 2 263 LEU263 4058 RESIDUE 1 R LEU 2 264 GLY264 4077 RESIDUE 1 R GLY 2 265 ASP265 4084 RESIDUE 1 R ASP 2 266 GLN266 4096 RESIDUE 1 R GLN 2 267 ARG267 4113 RESIDUE 1 R ARG 2 268 TYR268 4137 RESIDUE 1 R TYR 2 269 THR269 4158 RESIDUE 1 R THR 2 270 ALA270 4172 RESIDUE 1 R ALA 2 271 PRO271 4182 RESIDUE 1 R PRO 2 272 TRP272 4196 RESIDUE 1 R TRP 2 273 ARG273 4220 RESIDUE 1 R ARG 1