#################################################################### # DELTA # # Database for Extended Ligand-Target Analyses # # 2025 # #################################################################### @MOLECULE 7e32.1.E_min 4601 4664 285 0 0 SMALL USER_CHARGES File created by VEGA ZZ 3.2.4 @ATOM 1 N 72.0450 119.2010 131.2870 N.4 1 ILE1 -0.0638 2 H1 71.9500 118.3138 130.7547 H 1 ILE1 0.2751 3 H2 71.2388 119.8141 131.0350 H 1 ILE1 0.2751 4 H3 72.0274 118.9998 132.3070 H 1 ILE1 0.2751 5 CA 73.3430 119.8800 130.9080 C.3 1 ILE1 0.1955 6 HA 73.1875 120.3088 129.9153 H 1 ILE1 0.0693 7 C 74.4990 118.9060 130.7410 C.2 1 ILE1 0.2318 8 O 75.1800 118.9270 129.7260 O.2 1 ILE1 -0.2773 9 CB 73.7095 121.0290 131.8773 C.3 1 ILE1 -0.0077 10 HB 73.9018 120.5977 132.8615 H 1 ILE1 0.0322 11 CG1 72.5358 122.0209 132.0213 C.3 1 ILE1 -0.0510 12 HG11 71.6174 121.4847 132.2587 H 1 ILE1 0.0266 13 HG12 72.3561 122.5256 131.0707 H 1 ILE1 0.0266 14 CG2 74.9894 121.7650 131.4319 C.3 1 ILE1 -0.0601 15 HG21 75.2670 122.5508 132.1339 H 1 ILE1 0.0233 16 HG22 74.8602 122.2277 130.4527 H 1 ILE1 0.0233 17 HG23 75.8477 121.0955 131.3697 H 1 ILE1 0.0233 18 CD1 72.7480 123.0702 133.1196 C.3 1 ILE1 -0.0650 19 HD11 71.8565 123.6861 133.2425 H 1 ILE1 0.0230 20 HD12 73.5716 123.7440 132.8841 H 1 ILE1 0.0230 21 HD13 72.9603 122.6019 134.0811 H 1 ILE1 0.0230 22 N 74.6970 117.9550 131.6840 N.am 2 SER2 -0.2432 23 H 74.0140 117.8830 132.4380 H 2 SER2 0.1313 24 CA 75.8200 117.0270 131.6950 C.3 2 SER2 0.1109 25 HA 76.7361 117.6118 131.5963 H 2 SER2 0.0580 26 C 75.7890 116.0040 130.5560 C.2 2 SER2 0.2209 27 O 76.8070 115.4090 130.2200 O.2 2 SER2 -0.2777 28 CB 75.8014 116.2873 133.0391 C.3 2 SER2 0.0681 29 HB1 76.1036 116.9779 133.8329 H 2 SER2 0.0577 30 HB2 76.5230 115.4596 133.0331 H 2 SER2 0.0577 31 OG 74.4758 115.8282 133.2930 O.3 2 SER2 -0.3930 32 HG 74.4536 115.2605 134.0631 H 2 SER2 0.2095 33 N 74.6170 115.8350 129.8930 N.am 3 TYR3 -0.2453 34 H 73.8110 116.3520 130.2450 H 3 TYR3 0.1312 35 CA 74.3960 114.9900 128.7310 C.3 3 TYR3 0.0917 36 HA 74.7706 114.0146 129.0342 H 3 TYR3 0.0560 37 C 75.2220 115.3870 127.5160 C.2 3 TYR3 0.2190 38 O 75.6420 114.5310 126.7490 O.2 3 TYR3 -0.2778 39 CB 72.9058 114.7930 128.3801 C.3 3 TYR3 -0.0036 40 HB1 72.4976 114.0234 129.0365 H 3 TYR3 0.0333 41 HB2 72.7894 114.3959 127.3699 H 3 TYR3 0.0333 42 CG 72.0672 116.0352 128.5242 C.ar 3 TYR3 -0.0453 43 CD1 71.0745 116.0896 129.4979 C.ar 3 TYR3 -0.0561 44 HD1 70.8830 115.2313 130.1275 H 3 TYR3 0.0621 45 CD2 72.2547 117.1319 127.6880 C.ar 3 TYR3 -0.0561 46 HD2 72.9785 117.0886 126.8876 H 3 TYR3 0.0621 47 CE1 70.3357 117.2470 129.6854 C.ar 3 TYR3 -0.0317 48 HE1 69.5944 117.2945 130.4702 H 3 TYR3 0.0643 49 CE2 71.5456 118.3063 127.8987 C.ar 3 TYR3 -0.0317 50 HE2 71.7579 119.1788 127.2970 H 3 TYR3 0.0643 51 CZ 70.6110 118.3707 128.9210 C.ar 3 TYR3 0.0726 52 OH 70.0957 119.5880 129.3103 O.3 3 TYR3 -0.3598 53 HH 69.7000 120.0153 128.5549 H 3 TYR3 0.2173 54 N 75.5410 116.6910 127.3280 N.am 4 ILE4 -0.2454 55 H 75.1440 117.3890 127.9570 H 4 ILE4 0.1312 56 CA 76.4340 117.1350 126.2570 C.3 4 ILE4 0.0903 57 HA 75.9875 116.8207 125.3125 H 4 ILE4 0.0560 58 C 77.7900 116.4550 126.4000 C.2 4 ILE4 0.2189 59 O 78.3720 115.9670 125.4360 O.2 4 ILE4 -0.2778 60 CB 76.5751 118.6753 126.3093 C.3 4 ILE4 -0.0201 61 HB 77.0288 118.9353 127.2678 H 4 ILE4 0.0318 62 CG1 75.2009 119.3777 126.2446 C.3 4 ILE4 -0.0514 63 HG11 74.5220 118.9532 126.9815 H 4 ILE4 0.0266 64 HG12 74.7416 119.2008 125.2713 H 4 ILE4 0.0266 65 CG2 77.5053 119.1896 125.1932 C.3 4 ILE4 -0.0605 66 HG21 77.6497 120.2675 125.2527 H 4 ILE4 0.0233 67 HG22 77.1003 118.9610 124.2071 H 4 ILE4 0.0233 68 HG23 78.4976 118.7423 125.2534 H 4 ILE4 0.0233 69 CD1 75.2678 120.8845 126.5206 C.3 4 ILE4 -0.0650 70 HD11 74.2675 121.3169 126.5466 H 4 ILE4 0.0230 71 HD12 75.8276 121.4122 125.7489 H 4 ILE4 0.0230 72 HD13 75.7431 121.0866 127.4809 H 4 ILE4 0.0230 73 N 78.2820 116.3580 127.6480 N.am 5 ASN5 -0.2452 74 H 77.7040 116.6660 128.4300 H 5 ASN5 0.1312 75 CA 79.6110 115.8290 127.9230 C.3 5 ASN5 0.0957 76 HA 80.2935 116.2992 127.2121 H 5 ASN5 0.0562 77 C 79.7680 114.3100 127.7840 C.2 5 ASN5 0.2191 78 O 80.8180 113.7750 127.9020 O.2 5 ASN5 -0.2778 79 CB 80.0092 116.2147 129.3590 C.3 5 ASN5 0.0446 80 HB1 81.0549 115.9715 129.5537 H 5 ASN5 0.0375 81 HB2 79.4126 115.6620 130.0850 H 5 ASN5 0.0375 82 CG 79.7842 117.7099 129.6234 C.2 5 ASN5 0.2000 83 OD1 78.7088 118.1345 130.0286 O.2 5 ASN5 -0.2797 84 ND2 80.8570 118.4745 129.3715 N.am 5 ASN5 -0.2723 85 HD21 80.8030 119.4626 129.5110 H 5 ASN5 0.1266 86 HD22 81.7176 118.0811 129.0482 H 5 ASN5 0.1266 87 N 78.6660 113.5550 127.6480 N.am 6 ILE6 -0.2454 88 H 77.7490 113.9610 127.8310 H 6 ILE6 0.1312 89 CA 78.7710 112.1630 127.2420 C.3 6 ILE6 0.0903 90 HA 79.7906 111.8074 127.3915 H 6 ILE6 0.0560 91 C 78.4850 111.9890 125.7480 C.2 6 ILE6 0.2189 92 O 79.0450 111.0830 125.1380 O.2 6 ILE6 -0.2778 93 CB 77.8476 111.2827 128.1107 C.3 6 ILE6 -0.0201 94 HB 77.9177 110.2596 127.7371 H 6 ILE6 0.0318 95 CG1 76.3731 111.7167 128.0310 C.3 6 ILE6 -0.0514 96 HG11 76.0608 111.7989 126.9905 H 6 ILE6 0.0266 97 HG12 76.2805 112.7093 128.4612 H 6 ILE6 0.0266 98 CG2 78.3471 111.2702 129.5650 C.3 6 ILE6 -0.0605 99 HG21 77.8035 110.5446 130.1691 H 6 ILE6 0.0233 100 HG22 78.2329 112.2477 130.0347 H 6 ILE6 0.0233 101 HG23 79.4025 111.0010 129.6133 H 6 ILE6 0.0233 102 CD1 75.4058 110.7627 128.7398 C.3 6 ILE6 -0.0650 103 HD11 74.3742 111.0849 128.5967 H 6 ILE6 0.0230 104 HD12 75.5906 110.7261 129.8130 H 6 ILE6 0.0230 105 HD13 75.4953 109.7500 128.3461 H 6 ILE6 0.0230 106 N 77.6510 112.8690 125.1150 N.am 7 ILE7 -0.2454 107 H 77.1940 113.5720 125.6960 H 7 ILE7 0.1312 108 CA 77.3520 112.8970 123.6790 C.3 7 ILE7 0.0903 109 HA 77.0241 111.8931 123.4132 H 7 ILE7 0.0560 110 C 78.5990 113.1910 122.8560 C.2 7 ILE7 0.2189 111 O 78.8930 112.5190 121.8720 O.2 7 ILE7 -0.2778 112 CB 76.2073 113.9039 123.4138 C.3 7 ILE7 -0.0201 113 HB 76.4714 114.8375 123.9124 H 7 ILE7 0.0318 114 CG1 74.8829 113.3908 124.0173 C.3 7 ILE7 -0.0514 115 HG11 75.0566 112.9641 125.0040 H 7 ILE7 0.0266 116 HG12 74.5003 112.5678 123.4127 H 7 ILE7 0.0266 117 CG2 76.0218 114.2101 121.9146 C.3 7 ILE7 -0.0605 118 HG21 75.1982 114.9024 121.7458 H 7 ILE7 0.0233 119 HG22 75.8126 113.2999 121.3519 H 7 ILE7 0.0233 120 HG23 76.9091 114.6724 121.4819 H 7 ILE7 0.0233 121 CD1 73.8071 114.4771 124.1483 C.3 7 ILE7 -0.0650 122 HD11 72.9251 114.0858 124.6552 H 7 ILE7 0.0230 123 HD12 73.4880 114.8459 123.1741 H 7 ILE7 0.0230 124 HD13 74.1708 115.3268 124.7252 H 7 ILE7 0.0230 125 N 79.3940 114.1980 123.2730 N.am 8 MET8 -0.2456 126 H 79.0790 114.7600 124.0640 H 8 MET8 0.1312 127 CA 80.6740 114.5320 122.6640 C.3 8 MET8 0.0888 128 HA 80.4510 114.7155 121.6151 H 8 MET8 0.0557 129 C 81.7690 113.4190 122.6940 C.2 8 MET8 0.2214 130 O 82.4070 113.2020 121.6710 O.2 8 MET8 -0.2776 131 CB 81.1884 115.8597 123.2489 C.3 8 MET8 -0.0199 132 HB1 82.2275 116.0079 122.9550 H 8 MET8 0.0293 133 HB2 81.1724 115.8377 124.3363 H 8 MET8 0.0293 134 CG 80.3661 117.0717 122.7949 C.3 8 MET8 -0.0047 135 HG1 79.3213 116.9785 123.0932 H 8 MET8 0.0377 136 HG2 80.3676 117.1411 121.7066 H 8 MET8 0.0377 137 SD 81.0310 118.6029 123.4777 S.3 8 MET8 -0.1641 138 CE 82.4166 118.8345 122.3474 C.3 8 MET8 -0.0181 139 HE1 82.9690 119.7402 122.5942 H 8 MET8 0.0340 140 HE2 82.0584 118.9026 121.3200 H 8 MET8 0.0340 141 HE3 83.0979 117.9878 122.4062 H 8 MET8 0.0340 142 N 82.0430 112.6750 123.7720 N.am 9 PRO9 -0.2316 143 CA 82.9410 111.5070 123.7890 C.3 9 PRO9 0.0907 144 HA 83.9195 111.8435 123.4438 H 9 PRO9 0.0559 145 C 82.4650 110.3640 122.9620 C.2 9 PRO9 0.2190 146 O 83.2770 109.6920 122.3440 O.2 9 PRO9 -0.2778 147 CB 82.9724 111.0477 125.2521 C.3 9 PRO9 -0.0276 148 HB1 83.9588 110.6919 125.5512 H 9 PRO9 0.0285 149 HB2 82.2651 110.2399 125.4531 H 9 PRO9 0.0285 150 CG 82.5269 112.2517 126.0500 C.3 9 PRO9 -0.0379 151 HG1 83.4197 112.8089 126.3201 H 9 PRO9 0.0278 152 HG2 82.0299 111.9597 126.9728 H 9 PRO9 0.0278 153 CD 81.6454 113.0847 125.1105 C.3 9 PRO9 0.0071 154 HD1 80.5949 112.9133 125.2157 H 9 PRO9 0.0431 155 HD2 81.8561 114.1405 125.2556 H 9 PRO9 0.0431 156 N 81.1580 110.0640 123.0070 N.am 10 SER10 -0.2436 157 H 80.5360 110.6210 123.5930 H 10 SER10 0.1312 158 CA 80.6140 108.9620 122.2370 C.3 10 SER10 0.1109 159 HA 81.2434 108.0968 122.4505 H 10 SER10 0.0580 160 C 80.6920 109.2230 120.7460 C.2 10 SER10 0.2209 161 O 81.1400 108.3530 120.0050 O.2 10 SER10 -0.2777 162 CB 79.1773 108.6445 122.6785 C.3 10 SER10 0.0681 163 HB1 79.1718 108.4865 123.7622 H 10 SER10 0.0577 164 HB2 78.8632 107.7074 122.2047 H 10 SER10 0.0577 165 OG 78.2734 109.6890 122.3404 O.3 10 SER10 -0.3930 166 HG 77.3792 109.4659 122.5855 H 10 SER10 0.2095 167 N 80.3300 110.4490 120.2840 N.am 11 VAL11 -0.2453 168 H 79.9300 111.1160 120.9430 H 11 VAL11 0.1312 169 CA 80.4850 110.8590 118.8910 C.3 11 VAL11 0.0901 170 HA 80.0246 110.0473 118.3291 H 11 VAL11 0.0560 171 C 81.9410 110.8920 118.4450 C.2 11 VAL11 0.2189 172 O 82.2970 110.3870 117.3860 O.2 11 VAL11 -0.2778 173 CB 79.6889 112.1375 118.5630 C.3 11 VAL11 -0.0227 174 HB 78.7195 112.0424 119.0543 H 11 VAL11 0.0315 175 CG1 80.3494 113.4084 119.0958 C.3 11 VAL11 -0.0608 176 HG11 79.6805 114.2658 119.0236 H 11 VAL11 0.0233 177 HG12 81.2631 113.6478 118.5529 H 11 VAL11 0.0233 178 HG13 80.6060 113.2662 120.1371 H 11 VAL11 0.0233 179 CG2 79.4237 112.2626 117.0566 C.3 11 VAL11 -0.0608 180 HG21 78.8132 113.1386 116.8365 H 11 VAL11 0.0233 181 HG22 78.8979 111.3870 116.6754 H 11 VAL11 0.0233 182 HG23 80.3559 112.3573 116.5014 H 11 VAL11 0.0233 183 N 82.8590 111.4440 119.2650 N.am 12 PHE12 -0.2453 184 H 82.5400 111.8760 120.1330 H 12 PHE12 0.1312 185 CA 84.2800 111.4510 118.9680 C.3 12 PHE12 0.0917 186 HA 84.3845 111.8004 117.9408 H 12 PHE12 0.0560 187 C 84.8980 110.0690 118.9940 C.2 12 PHE12 0.2188 188 O 85.7150 109.7200 118.1470 O.2 12 PHE12 -0.2778 189 CB 85.0632 112.3731 119.9176 C.3 12 PHE12 -0.0036 190 HB1 86.1153 112.3144 119.6496 H 12 PHE12 0.0333 191 HB2 84.9721 112.0098 120.9429 H 12 PHE12 0.0333 192 CG 84.7049 113.8410 119.8852 C.ar 12 PHE12 -0.0454 193 CD1 84.0682 114.4402 118.7981 C.ar 12 PHE12 -0.0585 194 HD1 83.7767 113.8640 117.9340 H 12 PHE12 0.0620 195 CD2 85.0683 114.6407 120.9662 C.ar 12 PHE12 -0.0585 196 HD2 85.5721 114.1998 121.8143 H 12 PHE12 0.0620 197 CE1 83.7807 115.7990 118.8062 C.ar 12 PHE12 -0.0615 198 HE1 83.2773 116.2475 117.9622 H 12 PHE12 0.0618 199 CE2 84.7873 116.0001 120.9748 C.ar 12 PHE12 -0.0615 200 HE2 85.0731 116.6036 121.8238 H 12 PHE12 0.0618 201 CZ 84.1397 116.5808 119.8944 C.ar 12 PHE12 -0.0617 202 HZ 83.9173 117.6377 119.8985 H 12 PHE12 0.0618 203 N 84.4850 109.2150 119.9450 N.am 13 GLY13 -0.2485 204 H 83.8640 109.5660 120.6740 H 13 GLY13 0.1309 205 CA 84.8770 107.8200 119.9880 C.3 13 GLY13 0.0765 206 HA1 84.4085 107.3840 120.8695 H 13 GLY13 0.0521 207 HA2 85.9604 107.7787 120.1035 H 13 GLY13 0.0521 208 C 84.4620 107.0480 118.7610 C.2 13 GLY13 0.2156 209 O 85.2910 106.3820 118.1520 O.2 13 GLY13 -0.2781 210 N 83.1890 107.1520 118.3180 N.am 14 THR14 -0.2436 211 H 82.5210 107.6890 118.8700 H 14 THR14 0.1312 212 CA 82.7300 106.5230 117.0750 C.3 14 THR14 0.1135 213 HA 83.0025 105.4711 117.1652 H 14 THR14 0.0583 214 C 83.4520 107.0360 115.8450 C.2 14 THR14 0.2212 215 O 83.8500 106.2370 115.0010 O.2 14 THR14 -0.2777 216 CB 81.2027 106.6081 116.8924 C.3 14 THR14 0.0763 217 HB 80.9668 106.1466 115.9252 H 14 THR14 0.0611 218 OG1 80.7942 107.9651 116.8687 O.3 14 THR14 -0.3900 219 HG1 79.8565 108.0324 116.7219 H 14 THR14 0.2098 220 CG2 80.4605 105.8191 117.9836 C.3 14 THR14 -0.0370 221 HG21 79.3836 105.8087 117.8158 H 14 THR14 0.0255 222 HG22 80.6382 106.2350 118.9731 H 14 THR14 0.0255 223 HG23 80.7935 104.7815 118.0018 H 14 THR14 0.0255 224 N 83.6930 108.3640 115.7250 N.am 15 ILE15 -0.2453 225 H 83.3330 108.9840 116.4500 H 15 ILE15 0.1312 226 CA 84.4410 108.9620 114.6150 C.3 15 ILE15 0.0903 227 HA 83.9150 108.6724 113.7044 H 15 ILE15 0.0560 228 C 85.8450 108.4150 114.4950 C.2 15 ILE15 0.2190 229 O 86.2930 108.0230 113.4160 O.2 15 ILE15 -0.2778 230 CB 84.4194 110.5050 114.7541 C.3 15 ILE15 -0.0201 231 HB 84.6833 110.7419 115.7860 H 15 ILE15 0.0318 232 CG1 83.0039 111.0535 114.4792 C.3 15 ILE15 -0.0514 233 HG11 82.2539 110.4230 114.9559 H 15 ILE15 0.0266 234 HG12 82.7924 110.9970 113.4110 H 15 ILE15 0.0266 235 CG2 85.4434 111.2072 113.8373 C.3 15 ILE15 -0.0605 236 HG21 85.3937 112.2907 113.9338 H 15 ILE15 0.0233 237 HG22 85.2685 110.9582 112.7904 H 15 ILE15 0.0233 238 HG23 86.4678 110.9256 114.0813 H 15 ILE15 0.0233 239 CD1 82.7990 112.4932 114.9685 C.3 15 ILE15 -0.0650 240 HD11 81.7815 112.8260 114.7655 H 15 ILE15 0.0230 241 HD12 83.4714 113.1919 114.4729 H 15 ILE15 0.0230 242 HD13 82.9654 112.5701 116.0428 H 15 ILE15 0.0230 243 N 86.5700 108.3420 115.6230 N.am 16 CYS16 -0.2449 244 H 86.1520 108.6700 116.4940 H 16 CYS16 0.1312 245 CA 87.9160 107.8190 115.6570 C.3 16 CYS16 0.0965 246 HA 88.4610 108.3221 114.8560 H 16 CYS16 0.0565 247 C 87.9830 106.3440 115.3630 C.2 16 CYS16 0.2195 248 O 88.8120 105.9100 114.5700 O.2 16 CYS16 -0.2778 249 CB 88.5693 108.1936 116.9890 C.3 16 CYS16 0.0147 250 HB1 89.5481 107.7217 117.0829 H 16 CYS16 0.0394 251 HB2 87.9596 107.8484 117.8255 H 16 CYS16 0.0394 252 SG 88.7886 109.9900 117.1071 S.3 16 CYS16 -0.1762 253 HG 89.3827 110.2953 118.2636 H 16 CYS16 0.1017 254 N 87.0550 105.5400 115.9230 N.am 17 LEU17 -0.2456 255 H 86.4100 105.9370 116.6060 H 17 LEU17 0.1312 256 CA 86.9410 104.1330 115.5900 C.3 17 LEU17 0.0880 257 HA 87.9050 103.6776 115.8168 H 17 LEU17 0.0557 258 C 86.6710 103.8920 114.1130 C.2 17 LEU17 0.2187 259 O 87.3490 103.0820 113.4890 O.2 17 LEU17 -0.2778 260 CB 85.8257 103.5024 116.4420 C.3 17 LEU17 -0.0266 261 HB1 85.5737 102.5092 116.0662 H 17 LEU17 0.0287 262 HB2 84.9227 104.1040 116.3264 H 17 LEU17 0.0287 263 CG 86.1792 103.3855 117.9365 C.3 17 LEU17 -0.0449 264 HG 86.6086 104.3283 118.2744 H 17 LEU17 0.0296 265 CD1 84.9179 103.1316 118.7720 C.3 17 LEU17 -0.0626 266 HD11 85.1555 103.0771 119.8345 H 17 LEU17 0.0232 267 HD12 84.4387 102.1946 118.4871 H 17 LEU17 0.0232 268 HD13 84.1905 103.9326 118.6390 H 17 LEU17 0.0232 269 CD2 87.2196 102.2853 118.1891 C.3 17 LEU17 -0.0626 270 HD21 87.4491 102.2029 119.2517 H 17 LEU17 0.0232 271 HD22 88.1559 102.4894 117.6707 H 17 LEU17 0.0232 272 HD23 86.8557 101.3145 117.8518 H 17 LEU17 0.0232 273 N 85.7340 104.6440 113.4930 N.am 18 LEU18 -0.2456 274 H 85.1880 105.2990 114.0520 H 18 LEU18 0.1312 275 CA 85.4690 104.5620 112.0650 C.3 18 LEU18 0.0880 276 HA 85.2233 103.5218 111.8528 H 18 LEU18 0.0557 277 C 86.6650 104.9150 111.2100 C.2 18 LEU18 0.2185 278 O 86.9590 104.2390 110.2250 O.2 18 LEU18 -0.2778 279 CB 84.2761 105.4760 111.7347 C.3 18 LEU18 -0.0266 280 HB1 84.1734 105.5981 110.6553 H 18 LEU18 0.0287 281 HB2 84.4857 106.4713 112.1304 H 18 LEU18 0.0287 282 CG 82.9368 104.9683 112.3035 C.3 18 LEU18 -0.0449 283 HG 83.0864 104.6458 113.3333 H 18 LEU18 0.0296 284 CD1 81.8952 106.0945 112.3276 C.3 18 LEU18 -0.0626 285 HD11 80.9554 105.7507 112.7599 H 18 LEU18 0.0232 286 HD12 81.6880 106.4615 111.3221 H 18 LEU18 0.0232 287 HD13 82.2423 106.9374 112.9261 H 18 LEU18 0.0232 288 CD2 82.4082 103.7608 111.5167 C.3 18 LEU18 -0.0626 289 HD21 81.4567 103.4174 111.9233 H 18 LEU18 0.0232 290 HD22 83.1005 102.9203 111.5575 H 18 LEU18 0.0232 291 HD23 82.2498 104.0129 110.4679 H 18 LEU18 0.0232 292 N 87.4090 105.9750 111.5930 N.am 19 GLY19 -0.2485 293 H 87.0410 106.5830 112.3250 H 19 GLY19 0.1309 294 CA 88.7080 106.2990 111.0190 C.3 19 GLY19 0.0765 295 HA1 89.1139 107.1273 111.5988 H 19 GLY19 0.0521 296 HA2 88.5448 106.6334 109.9941 H 19 GLY19 0.0521 297 C 89.6860 105.1650 111.0320 C.2 19 GLY19 0.2155 298 O 90.1950 104.7590 109.9940 O.2 19 GLY19 -0.2781 299 N 89.9490 104.5890 112.2150 N.am 20 ILE20 -0.2456 300 H 89.4910 104.9630 113.0460 H 20 ILE20 0.1312 301 CA 90.8530 103.4600 112.3760 C.3 20 ILE20 0.0903 302 HA 91.8010 103.7884 111.9528 H 20 ILE20 0.0560 303 C 90.4650 102.2580 111.5480 C.2 20 ILE20 0.2189 304 O 91.3100 101.6950 110.8530 O.2 20 ILE20 -0.2778 305 CB 91.0532 103.1382 113.8713 C.3 20 ILE20 -0.0201 306 HB 90.0677 102.9490 114.3008 H 20 ILE20 0.0318 307 CG1 91.6620 104.3310 114.6362 C.3 20 ILE20 -0.0514 308 HG11 91.7882 104.0474 115.6794 H 20 ILE20 0.0266 309 HG12 90.9707 105.1666 114.6480 H 20 ILE20 0.0266 310 CG2 91.8959 101.8713 114.1070 C.3 20 ILE20 -0.0605 311 HG21 92.0630 101.7048 115.1714 H 20 ILE20 0.0233 312 HG22 92.8701 101.9456 113.6257 H 20 ILE20 0.0233 313 HG23 91.4011 100.9816 113.7172 H 20 ILE20 0.0233 314 CD1 92.9942 104.8471 114.0762 C.3 20 ILE20 -0.0650 315 HD11 93.3749 105.6549 114.7007 H 20 ILE20 0.0230 316 HD12 92.8841 105.2602 113.0741 H 20 ILE20 0.0230 317 HD13 93.7463 104.0599 114.0356 H 20 ILE20 0.0230 318 N 89.1640 101.8960 111.5610 N.am 21 ILE21 -0.2454 319 H 88.5370 102.4110 112.1800 H 21 ILE21 0.1312 320 CA 88.5880 100.8270 110.7590 C.3 21 ILE21 0.0903 321 HA 89.1397 99.9215 111.0069 H 21 ILE21 0.0560 322 C 88.7610 101.0660 109.2710 C.2 21 ILE21 0.2187 323 O 89.1660 100.1800 108.5250 O.2 21 ILE21 -0.2778 324 CB 87.1009 100.6516 111.1520 C.3 21 ILE21 -0.0201 325 HB 86.6289 101.6329 111.0801 H 21 ILE21 0.0318 326 CG1 86.9676 100.1626 112.6103 C.3 21 ILE21 -0.0514 327 HG11 87.6802 100.6767 113.2537 H 21 ILE21 0.0266 328 HG12 87.2354 99.1073 112.6696 H 21 ILE21 0.0266 329 CG2 86.3473 99.6967 110.2050 C.3 21 ILE21 -0.0605 330 HG21 85.3102 99.5656 110.5107 H 21 ILE21 0.0233 331 HG22 86.8163 98.7125 110.1869 H 21 ILE21 0.0233 332 HG23 86.3244 100.0732 109.1824 H 21 ILE21 0.0233 333 CD1 85.5661 100.3759 113.1969 C.3 21 ILE21 -0.0650 334 HD11 85.5397 100.0852 114.2472 H 21 ILE21 0.0230 335 HD12 84.8154 99.7848 112.6737 H 21 ILE21 0.0230 336 HD13 85.2693 101.4231 113.1375 H 21 ILE21 0.0230 337 N 88.4900 102.2900 108.7730 N.am 22 GLY22 -0.2485 338 H 88.2030 103.0400 109.4030 H 22 GLY22 0.1309 339 CA 88.6030 102.5510 107.3450 C.3 22 GLY22 0.0765 340 HA1 88.1592 103.5301 107.1683 H 22 GLY22 0.0521 341 HA2 88.0184 101.8017 106.8098 H 22 GLY22 0.0521 342 C 90.0170 102.5540 106.8410 C.2 22 GLY22 0.2155 343 O 90.3080 101.9880 105.7930 O.2 22 GLY22 -0.2781 344 N 90.9460 103.1430 107.6100 N.am 23 ASN23 -0.2454 345 H 90.6390 103.6340 108.4500 H 23 ASN23 0.1312 346 CA 92.3660 103.1160 107.3060 C.3 23 ASN23 0.0957 347 HA 92.4404 103.3963 106.2515 H 23 ASN23 0.0562 348 C 92.9740 101.7200 107.3430 C.2 23 ASN23 0.2192 349 O 93.7420 101.3490 106.4560 O.2 23 ASN23 -0.2778 350 CB 93.1038 104.1575 108.1498 C.3 23 ASN23 0.0446 351 HB1 94.1833 104.0259 108.0937 H 23 ASN23 0.0375 352 HB2 92.7984 104.1123 109.1937 H 23 ASN23 0.0375 353 CG 92.7857 105.5321 107.5574 C.2 23 ASN23 0.2000 354 OD1 93.1386 105.8109 106.4211 O.2 23 ASN23 -0.2797 355 ND2 92.1070 106.3604 108.3638 N.am 23 ASN23 -0.2723 356 HD21 91.9161 107.2828 108.0230 H 23 ASN23 0.1266 357 HD22 91.7985 106.0890 109.2740 H 23 ASN23 0.1266 358 N 92.6240 100.8970 108.3610 N.am 24 SER24 -0.2436 359 H 91.9880 101.2580 109.0720 H 24 SER24 0.1312 360 CA 93.1020 99.5230 108.5030 C.3 24 SER24 0.1109 361 HA 94.1869 99.5853 108.4178 H 24 SER24 0.0580 362 C 92.6210 98.6320 107.3700 C.2 24 SER24 0.2210 363 O 93.4010 97.8750 106.7920 O.2 24 SER24 -0.2777 364 CB 92.7522 98.9518 109.8850 C.3 24 SER24 0.0681 365 HB1 93.0282 99.6879 110.6485 H 24 SER24 0.0577 366 HB2 93.3568 98.0556 110.0577 H 24 SER24 0.0577 367 OG 91.3738 98.6216 109.9893 O.3 24 SER24 -0.3930 368 HG 91.1553 98.3087 110.8635 H 24 SER24 0.2095 369 N 91.3300 98.7740 106.9830 N.am 25 THR25 -0.2433 370 H 90.7420 99.3930 107.5420 H 25 THR25 0.1313 371 CA 90.7040 98.1170 105.8320 C.3 25 THR25 0.1135 372 HA 90.8065 97.0452 105.9996 H 25 THR25 0.0583 373 C 91.3960 98.4430 104.5340 C.2 25 THR25 0.2212 374 O 91.6780 97.5530 103.7310 O.2 25 THR25 -0.2777 375 CB 89.2098 98.4917 105.8037 C.3 25 THR25 0.0763 376 HB 89.1387 99.5854 105.8694 H 25 THR25 0.0611 377 OG1 88.6198 97.8842 106.9430 O.3 25 THR25 -0.3900 378 HG1 87.7488 98.2341 107.1066 H 25 THR25 0.2098 379 CG2 88.4695 98.0032 104.5457 C.3 25 THR25 -0.0370 380 HG21 87.4097 98.2559 104.5814 H 25 THR25 0.0255 381 HG22 88.5510 96.9213 104.4421 H 25 THR25 0.0255 382 HG23 88.8722 98.4585 103.6410 H 25 THR25 0.0255 383 N 91.7320 99.7300 104.3070 N.am 26 VAL26 -0.2453 384 H 91.4220 100.4390 104.9720 H 26 VAL26 0.1312 385 CA 92.5180 100.1520 103.1550 C.3 26 VAL26 0.0901 386 HA 91.9930 99.7650 102.2798 H 26 VAL26 0.0560 387 C 93.8830 99.5440 103.1150 C.2 26 VAL26 0.2189 388 O 94.2780 98.9770 102.1020 O.2 26 VAL26 -0.2778 389 CB 92.5766 101.6898 103.0501 C.3 26 VAL26 -0.0227 390 HB 92.8722 102.1020 104.0164 H 26 VAL26 0.0315 391 CG1 93.5842 102.1869 101.9937 C.3 26 VAL26 -0.0608 392 HG11 93.5049 103.2643 101.8497 H 26 VAL26 0.0233 393 HG12 93.4065 101.7165 101.0267 H 26 VAL26 0.0233 394 HG13 94.6139 101.9771 102.2845 H 26 VAL26 0.0233 395 CG2 91.1938 102.2311 102.6922 C.3 26 VAL26 -0.0608 396 HG21 91.2293 103.3118 102.5857 H 26 VAL26 0.0233 397 HG22 90.4390 101.9850 103.4347 H 26 VAL26 0.0233 398 HG23 90.8652 101.8113 101.7435 H 26 VAL26 0.0233 399 N 94.6250 99.5900 104.2310 N.am 27 ILE27 -0.2454 400 H 94.2400 100.0320 105.0660 H 27 ILE27 0.1312 401 CA 95.9630 99.0270 104.2830 C.3 27 ILE27 0.0903 402 HA 96.5294 99.4999 103.4781 H 27 ILE27 0.0560 403 C 95.9820 97.5610 104.0370 C.2 27 ILE27 0.2189 404 O 96.7200 97.0740 103.1900 O.2 27 ILE27 -0.2778 405 CB 96.6252 99.3572 105.6386 C.3 27 ILE27 -0.0201 406 HB 95.9431 99.0210 106.4219 H 27 ILE27 0.0318 407 CG1 96.8197 100.8730 105.7953 C.3 27 ILE27 -0.0514 408 HG11 95.9633 101.4004 105.3849 H 27 ILE27 0.0266 409 HG12 97.6828 101.2102 105.2198 H 27 ILE27 0.0266 410 CG2 97.9754 98.6368 105.8407 C.3 27 ILE27 -0.0605 411 HG21 98.4433 98.9198 106.7826 H 27 ILE27 0.0233 412 HG22 98.6727 98.8821 105.0390 H 27 ILE27 0.0233 413 HG23 97.8622 97.5530 105.8631 H 27 ILE27 0.0233 414 CD1 96.9643 101.2820 107.2582 C.3 27 ILE27 -0.0650 415 HD11 97.0390 102.3586 107.3635 H 27 ILE27 0.0230 416 HD12 97.8492 100.8442 107.7177 H 27 ILE27 0.0230 417 HD13 96.0867 100.9636 107.8165 H 27 ILE27 0.0230 418 N 95.1020 96.8160 104.7160 N.am 28 PHE28 -0.2453 419 H 94.4720 97.2680 105.3790 H 28 PHE28 0.1312 420 CA 95.0260 95.3920 104.5300 C.3 28 PHE28 0.0917 421 HA 96.0334 94.9989 104.6599 H 28 PHE28 0.0560 422 C 94.5830 94.9820 103.1470 C.2 28 PHE28 0.2190 423 O 95.0950 94.0080 102.6010 O.2 28 PHE28 -0.2778 424 CB 94.0298 94.7917 105.5404 C.3 28 PHE28 -0.0036 425 HB1 93.8094 93.7561 105.2863 H 28 PHE28 0.0333 426 HB2 93.0828 95.3303 105.4598 H 28 PHE28 0.0333 427 CG 94.4846 94.8122 106.9798 C.ar 28 PHE28 -0.0454 428 CD1 95.7973 94.5127 107.3444 C.ar 28 PHE28 -0.0585 429 HD1 96.5487 94.2933 106.6016 H 28 PHE28 0.0620 430 CD2 93.5615 95.0918 107.9847 C.ar 28 PHE28 -0.0585 431 HD2 92.5402 95.3423 107.7320 H 28 PHE28 0.0620 432 CE1 96.1793 94.5148 108.6796 C.ar 28 PHE28 -0.0615 433 HE1 97.2046 94.3065 108.9512 H 28 PHE28 0.0618 434 CE2 93.9414 95.0972 109.3194 C.ar 28 PHE28 -0.0615 435 HE2 93.2187 95.3435 110.0848 H 28 PHE28 0.0618 436 CZ 95.2519 94.8081 109.6686 C.ar 28 PHE28 -0.0617 437 HZ 95.5519 94.8267 110.7069 H 28 PHE28 0.0618 438 N 93.6630 95.7380 102.5190 N.am 29 ALA29 -0.2459 439 H 93.1740 96.4630 103.0440 H 29 ALA29 0.1312 440 CA 93.3510 95.5500 101.1240 C.3 29 ALA29 0.0850 441 HA 93.0311 94.5144 101.0035 H 29 ALA29 0.0554 442 C 94.5450 95.7880 100.2020 C.2 29 ALA29 0.2184 443 O 94.8030 94.9730 99.3270 O.2 29 ALA29 -0.2778 444 CB 92.2047 96.4962 100.7453 C.3 29 ALA29 -0.0411 445 HB1 91.9082 96.3669 99.7035 H 29 ALA29 0.0249 446 HB2 92.4859 97.5408 100.8846 H 29 ALA29 0.0249 447 HB3 91.3265 96.3093 101.3633 H 29 ALA29 0.0249 448 N 95.3380 96.8620 100.4030 N.am 30 VAL30 -0.2454 449 H 95.0690 97.5310 101.1240 H 30 VAL30 0.1312 450 CA 96.5590 97.1180 99.6450 C.3 30 VAL30 0.0901 451 HA 96.2740 97.1268 98.5922 H 30 VAL30 0.0560 452 C 97.6170 96.0340 99.8060 C.2 30 VAL30 0.2189 453 O 98.1810 95.5510 98.8260 O.2 30 VAL30 -0.2778 454 CB 97.1427 98.4991 100.0347 C.3 30 VAL30 -0.0227 455 HB 97.2153 98.5488 101.1219 H 30 VAL30 0.0315 456 CG1 98.5505 98.7485 99.4647 C.3 30 VAL30 -0.0608 457 HG11 98.8790 99.7718 99.6505 H 30 VAL30 0.0233 458 HG12 98.5596 98.5851 98.3887 H 30 VAL30 0.0233 459 HG13 99.2952 98.0881 99.9096 H 30 VAL30 0.0233 460 CG2 96.2208 99.6309 99.5769 C.3 30 VAL30 -0.0608 461 HG21 96.6037 100.6049 99.8839 H 30 VAL30 0.0233 462 HG22 95.2272 99.5228 100.0001 H 30 VAL30 0.0233 463 HG23 96.1268 99.6335 98.4907 H 30 VAL30 0.0233 464 N 97.8810 95.6080 101.0590 N.am 31 VAL31 -0.2454 465 H 97.3660 96.0450 101.8240 H 31 VAL31 0.1312 466 CA 98.8460 94.5700 101.4040 C.3 31 VAL31 0.0901 467 HA 99.7907 94.8659 100.9443 H 31 VAL31 0.0560 468 C 98.4910 93.1990 100.8430 C.2 31 VAL31 0.2189 469 O 99.3360 92.5050 100.2790 O.2 31 VAL31 -0.2778 470 CB 99.0022 94.5478 102.9426 C.3 31 VAL31 -0.0227 471 HB 98.0039 94.4781 103.3766 H 31 VAL31 0.0315 472 CG1 99.8155 93.3465 103.4563 C.3 31 VAL31 -0.0608 473 HG11 99.9508 93.3999 104.5367 H 31 VAL31 0.0233 474 HG12 100.8052 93.3205 102.9991 H 31 VAL31 0.0233 475 HG13 99.3221 92.3987 103.2408 H 31 VAL31 0.0233 476 CG2 99.6443 95.8505 103.4496 C.3 31 VAL31 -0.0608 477 HG21 99.6603 95.8821 104.5391 H 31 VAL31 0.0233 478 HG22 99.1137 96.7374 103.1067 H 31 VAL31 0.0233 479 HG23 100.6736 95.9379 103.1004 H 31 VAL31 0.0233 480 N 97.2140 92.7790 100.9540 N.am 32 LYS32 -0.2456 481 H 96.5150 93.4290 101.3120 H 32 LYS32 0.1312 482 CA 96.7950 91.4390 100.5840 C.3 32 LYS32 0.0878 483 HA 97.6402 90.7644 100.7345 H 32 LYS32 0.0557 484 C 96.3690 91.3160 99.1380 C.2 32 LYS32 0.2187 485 O 96.1080 90.2170 98.6540 O.2 32 LYS32 -0.2778 486 CB 95.6553 91.0504 101.5458 C.3 32 LYS32 -0.0289 487 HB1 95.2836 90.0525 101.3087 H 32 LYS32 0.0285 488 HB2 94.8184 91.7335 101.3931 H 32 LYS32 0.0285 489 CG 96.0948 91.0937 103.0250 C.3 32 LYS32 -0.0496 490 HG1 96.6483 92.0107 103.2274 H 32 LYS32 0.0266 491 HG2 96.7950 90.2796 103.2172 H 32 LYS32 0.0266 492 CD 94.9278 91.0334 104.0208 C.3 32 LYS32 -0.0278 493 HD1 94.4199 90.0718 103.9373 H 32 LYS32 0.0282 494 HD2 94.1955 91.7976 103.7568 H 32 LYS32 0.0282 495 CE 95.4102 91.2656 105.4612 C.3 32 LYS32 0.1103 496 HE1 95.9766 92.1978 105.5122 H 32 LYS32 0.0559 497 HE2 96.0895 90.4655 105.7636 H 32 LYS32 0.0559 498 NZ 94.3279 91.3464 106.4464 N.4 32 LYS32 -0.0749 499 HZ1 94.7225 91.5285 107.3927 H 32 LYS32 0.2742 500 HZ2 93.7953 90.4523 106.4620 H 32 LYS32 0.2742 501 HZ3 93.6825 92.1248 106.2007 H 32 LYS32 0.2742 502 N 96.3110 92.4290 98.3900 N.am 33 LYS33 -0.2457 503 H 96.5100 93.3300 98.8250 H 33 LYS33 0.1312 504 CA 95.9760 92.3850 96.9920 C.3 33 LYS33 0.0878 505 HA 95.7283 91.3643 96.6954 H 33 LYS33 0.0557 506 C 97.1920 92.8010 96.2180 C.2 33 LYS33 0.2187 507 O 97.5630 93.9680 96.1180 O.2 33 LYS33 -0.2778 508 CB 94.7787 93.2912 96.6556 C.3 33 LYS33 -0.0289 509 HB1 94.6920 93.3750 95.5711 H 33 LYS33 0.0285 510 HB2 94.9648 94.2993 97.0173 H 33 LYS33 0.0285 511 CG 93.4458 92.7520 97.2022 C.3 33 LYS33 -0.0496 512 HG1 93.4376 92.8189 98.2909 H 33 LYS33 0.0266 513 HG2 93.3766 91.6907 96.9607 H 33 LYS33 0.0266 514 CD 92.2151 93.4706 96.6176 C.3 33 LYS33 -0.0278 515 HD1 92.3046 93.5125 95.5313 H 33 LYS33 0.0282 516 HD2 92.1921 94.5060 96.9613 H 33 LYS33 0.0282 517 CE 90.8989 92.7611 96.9772 C.3 33 LYS33 0.1103 518 HE1 90.7401 92.7820 98.0562 H 33 LYS33 0.0559 519 HE2 90.9456 91.7135 96.6750 H 33 LYS33 0.0559 520 NZ 89.7222 93.3420 96.3395 N.4 33 LYS33 -0.0749 521 HZ1 89.8053 93.3809 95.2987 H 33 LYS33 0.2742 522 HZ2 89.5873 94.3489 96.5774 H 33 LYS33 0.2742 523 HZ3 88.8431 92.8320 96.5357 H 33 LYS33 0.2742 524 N 97.8380 91.8250 95.5680 N.am 34 SER34 -0.2436 525 H 97.4680 90.8760 95.6200 H 34 SER34 0.1312 526 CA 99.0390 92.0580 94.7940 C.3 34 SER34 0.1109 527 HA 99.7439 92.5393 95.4739 H 34 SER34 0.0580 528 C 98.8230 92.9970 93.6130 C.2 34 SER34 0.2209 529 O 99.7060 93.7680 93.2600 O.2 34 SER34 -0.2777 530 CB 99.6085 90.7042 94.3481 C.3 34 SER34 0.0681 531 HB1 99.6822 90.0535 95.2287 H 34 SER34 0.0577 532 HB2 100.6242 90.8371 93.9640 H 34 SER34 0.0577 533 OG 98.7852 90.1157 93.3440 O.3 34 SER34 -0.3930 534 HG 99.0377 89.2076 93.1826 H 34 SER34 0.2095 535 N 97.6110 93.0060 93.0150 N.am 35 LYS35 -0.2456 536 H 96.9290 92.3180 93.3330 H 35 LYS35 0.1312 537 CA 97.1970 93.9140 91.9560 C.3 35 LYS35 0.0878 538 HA 97.9489 93.7646 91.1829 H 35 LYS35 0.0557 539 C 97.3180 95.3860 92.3330 C.2 35 LYS35 0.2187 540 O 97.5910 96.2260 91.4780 O.2 35 LYS35 -0.2778 541 CB 95.8177 93.5305 91.3983 C.3 35 LYS35 -0.0289 542 HB1 95.0504 94.1550 91.8605 H 35 LYS35 0.0285 543 HB2 95.5638 92.5106 91.6903 H 35 LYS35 0.0285 544 CG 95.7423 93.6533 89.8618 C.3 35 LYS35 -0.0496 545 HG1 96.4013 94.4439 89.5002 H 35 LYS35 0.0266 546 HG2 94.7335 93.9824 89.6081 H 35 LYS35 0.0266 547 CD 95.9945 92.3286 89.1106 C.3 35 LYS35 -0.0278 548 HD1 95.6918 92.4424 88.0687 H 35 LYS35 0.0282 549 HD2 95.3222 91.5746 89.5232 H 35 LYS35 0.0282 550 CE 97.4346 91.7828 89.1593 C.3 35 LYS35 0.1103 551 HE1 97.4191 90.7254 88.8854 H 35 LYS35 0.0559 552 HE2 97.8459 91.8242 90.1690 H 35 LYS35 0.0559 553 NZ 98.3638 92.4442 88.2374 N.4 35 LYS35 -0.0749 554 HZ1 99.3095 92.0108 88.3019 H 35 LYS35 0.2742 555 HZ2 98.4746 93.4516 88.4776 H 35 LYS35 0.2742 556 HZ3 98.0252 92.3620 87.2576 H 35 LYS35 0.2742 557 N 97.1160 95.6880 93.6330 N.am 36 LEU36 -0.2456 558 H 96.7920 94.9390 94.2450 H 36 LEU36 0.1312 559 CA 97.3220 96.9840 94.2230 C.3 36 LEU36 0.0880 560 HA 97.0155 97.7315 93.4918 H 36 LEU36 0.0557 561 C 98.7850 97.2520 94.5290 C.2 36 LEU36 0.2187 562 O 99.2730 98.3060 94.1770 O.2 36 LEU36 -0.2778 563 CB 96.4464 97.0696 95.5012 C.3 36 LEU36 -0.0266 564 HB1 96.8574 97.7619 96.2330 H 36 LEU36 0.0287 565 HB2 96.4742 96.1094 96.0136 H 36 LEU36 0.0287 566 CG 94.9734 97.4497 95.2379 C.3 36 LEU36 -0.0449 567 HG 94.5742 96.7742 94.4805 H 36 LEU36 0.0296 568 CD1 94.1242 97.2865 96.5075 C.3 36 LEU36 -0.0626 569 HD11 93.0762 97.5139 96.3095 H 36 LEU36 0.0232 570 HD12 94.4630 97.9578 97.2971 H 36 LEU36 0.0232 571 HD13 94.1680 96.2724 96.8964 H 36 LEU36 0.0232 572 CD2 94.8261 98.8917 94.7303 C.3 36 LEU36 -0.0626 573 HD21 93.7806 99.1301 94.5336 H 36 LEU36 0.0232 574 HD22 95.3763 99.0710 93.8082 H 36 LEU36 0.0232 575 HD23 95.1848 99.5968 95.4794 H 36 LEU36 0.0232 576 N 99.5460 96.3320 95.1590 N.am 37 HIS37 -0.2453 577 H 99.1920 95.3830 95.2830 H 37 HIS37 0.1312 578 CA 100.8700 96.6800 95.6650 C.3 37 HIS37 0.0932 579 HA 101.0837 97.7303 95.4544 H 37 HIS37 0.0561 580 C 101.9970 95.8870 95.0310 C.2 37 HIS37 0.2190 581 O 102.8800 96.4070 94.3520 O.2 37 HIS37 -0.2778 582 CB 100.8465 96.4978 97.1939 C.3 37 HIS37 0.0146 583 HB1 100.6174 95.4682 97.4708 H 37 HIS37 0.0348 584 HB2 100.0629 97.1166 97.6267 H 37 HIS37 0.0348 585 CG 102.1694 96.9074 97.8021 C.ar 37 HIS37 0.0551 586 ND1 102.6800 98.1541 97.7220 N.ar 37 HIS37 -0.2469 587 CD2 103.1009 96.0900 98.4629 C.ar 37 HIS37 0.0047 588 HD2 102.9899 95.0351 98.6659 H 37 HIS37 0.0764 589 CE1 103.8866 98.0978 98.3093 C.ar 37 HIS37 0.0737 590 HE1 104.5543 98.9441 98.3882 H 37 HIS37 0.0963 591 NE2 104.1652 96.8654 98.7736 N.ar 37 HIS37 -0.2539 592 HE2 104.9843 96.5862 99.2330 H 37 HIS37 0.1339 593 N 101.9880 94.5700 95.2890 N.am 38 TRP38 -0.2453 594 H 101.1440 94.1740 95.7030 H 38 TRP38 0.1312 595 CA 103.0880 93.6740 95.0220 C.3 38 TRP38 0.0918 596 HA 103.9875 94.2087 95.3350 H 38 TRP38 0.0560 597 C 103.3020 93.2690 93.5560 C.2 38 TRP38 0.2190 598 O 104.4210 93.3140 93.0660 O.2 38 TRP38 -0.2778 599 CB 102.9069 92.4368 95.9170 C.3 38 TRP38 -0.0021 600 HB1 102.0446 91.8483 95.6062 H 38 TRP38 0.0334 601 HB2 102.7200 92.7461 96.9463 H 38 TRP38 0.0334 602 CG 104.1477 91.5706 95.8941 C.ar 38 TRP38 -0.0260 603 CD1 104.2894 90.3463 95.2345 C.ar 38 TRP38 -0.0136 604 HD1 103.5227 89.8553 94.6538 H 38 TRP38 0.0748 605 CD2 105.4130 91.8463 96.5278 C.ar 38 TRP38 -0.0028 606 NE1 105.5445 89.8758 95.4347 N.ar 38 TRP38 -0.2641 607 HE1 105.8993 89.0360 95.0751 H 38 TRP38 0.1331 608 CE2 106.2700 90.7648 96.2180 C.ar 38 TRP38 0.0269 609 CE3 105.8679 92.8863 97.2943 C.ar 38 TRP38 -0.0528 610 HE3 105.2133 93.7141 97.5244 H 38 TRP38 0.0624 611 CZ2 107.5562 90.7566 96.6854 C.ar 38 TRP38 -0.0430 612 HZ2 108.2084 89.9307 96.4439 H 38 TRP38 0.0633 613 CZ3 107.1789 92.8811 97.7711 C.ar 38 TRP38 -0.0611 614 HZ3 107.5400 93.7036 98.3711 H 38 TRP38 0.0618 615 CH2 108.0247 91.8142 97.4663 C.ar 38 TRP38 -0.0602 616 HH2 109.0416 91.8085 97.8307 H 38 TRP38 0.0618 617 N 102.2320 92.8860 92.8110 N.am 39 CYS39 -0.2449 618 H 101.3050 93.1000 93.1800 H 39 CYS39 0.1312 619 CA 102.2970 92.1880 91.5150 C.3 39 CYS39 0.0965 620 HA 102.8800 91.2794 91.6730 H 39 CYS39 0.0565 621 C 102.9860 93.0140 90.4580 C.2 39 CYS39 0.2195 622 O 103.8390 92.5380 89.7170 O.2 39 CYS39 -0.2778 623 CB 100.8739 91.8553 91.0431 C.3 39 CYS39 0.0147 624 HB1 100.2723 92.7641 91.0119 H 39 CYS39 0.0394 625 HB2 100.4018 91.2018 91.7711 H 39 CYS39 0.0394 626 SG 100.7709 91.0503 89.4202 S.3 39 CYS39 -0.1762 627 HG 101.7036 90.0926 89.3445 H 39 CYS39 0.1017 628 N 102.6250 94.3080 90.4190 N.am 40 ASN40 -0.2452 629 H 102.0000 94.6630 91.1430 H 40 ASN40 0.1312 630 CA 103.0840 95.2150 89.3970 C.3 40 ASN40 0.0957 631 HA 103.6710 94.6487 88.6713 H 40 ASN40 0.0562 632 C 104.0160 96.2690 89.9620 C.2 40 ASN40 0.2191 633 O 104.3480 97.2240 89.2660 O.2 40 ASN40 -0.2778 634 CB 101.9050 95.8824 88.6467 C.3 40 ASN40 0.0446 635 HB1 102.1192 95.9113 87.5785 H 40 ASN40 0.0375 636 HB2 101.7767 96.9230 88.9430 H 40 ASN40 0.0375 637 CG 100.5543 95.1663 88.8463 C.2 40 ASN40 0.2000 638 OD1 100.2898 94.0921 88.3200 O.2 40 ASN40 -0.2797 639 ND2 99.7121 95.8324 89.6454 N.am 40 ASN40 -0.2723 640 HD21 98.8005 95.5043 89.8850 H 40 ASN40 0.1266 641 HD22 99.9820 96.7106 90.0410 H 40 ASN40 0.1266 642 N 104.4500 96.1380 91.2370 N.am 41 ASN41 -0.2452 643 H 104.1210 95.3350 91.7730 H 41 ASN41 0.1312 644 CA 105.3590 97.0730 91.8940 C.3 41 ASN41 0.0957 645 HA 105.4600 96.6964 92.9132 H 41 ASN41 0.0562 646 C 104.8320 98.4880 92.0280 C.2 41 ASN41 0.2191 647 O 105.5750 99.4610 91.9390 O.2 41 ASN41 -0.2778 648 CB 106.7380 97.0591 91.2026 C.3 41 ASN41 0.0446 649 HB1 107.4091 97.7880 91.6492 H 41 ASN41 0.0375 650 HB2 106.6650 97.3144 90.1461 H 41 ASN41 0.0375 651 CG 107.4172 95.6941 91.3511 C.2 41 ASN41 0.2000 652 OD1 108.1589 95.4544 92.2926 O.2 41 ASN41 -0.2797 653 ND2 107.1288 94.8212 90.3740 N.am 41 ASN41 -0.2723 654 HD21 107.5356 93.9089 90.4067 H 41 ASN41 0.1266 655 HD22 106.5179 95.0628 89.6219 H 41 ASN41 0.1266 656 N 103.5260 98.6120 92.2370 N.am 42 VAL42 -0.2454 657 H 103.0170 97.7700 92.5060 H 42 VAL42 0.1312 658 CA 102.7690 99.8210 92.1180 C.3 42 VAL42 0.0903 659 HA 102.9421 100.1438 91.0943 H 42 VAL42 0.0560 660 C 103.1380 100.9460 93.1190 C.2 42 VAL42 0.2216 661 O 102.9270 100.8030 94.3220 O.2 42 VAL42 -0.2776 662 CB 101.2705 99.5098 92.2378 C.3 42 VAL42 -0.0227 663 HB 101.0606 99.3557 93.2926 H 42 VAL42 0.0315 664 CG1 100.4368 100.6951 91.7398 C.3 42 VAL42 -0.0608 665 HG11 99.3777 100.4454 91.7203 H 42 VAL42 0.0233 666 HG12 100.7180 100.9839 90.7270 H 42 VAL42 0.0233 667 HG13 100.5721 101.5653 92.3807 H 42 VAL42 0.0233 668 CG2 100.8483 98.2421 91.4824 C.3 42 VAL42 -0.0608 669 HG21 99.7711 98.0909 91.5584 H 42 VAL42 0.0233 670 HG22 101.3196 97.3410 91.8747 H 42 VAL42 0.0233 671 HG23 101.0961 98.3353 90.4271 H 42 VAL42 0.0233 672 N 103.6510 102.0930 92.7140 N.am 43 PRO43 -0.2316 673 CA 104.1350 103.1050 93.6430 C.3 43 PRO43 0.0907 674 HA 104.5663 102.6342 94.5260 H 43 PRO43 0.0559 675 C 103.0600 104.1030 94.0350 C.2 43 PRO43 0.2189 676 O 103.1650 104.6520 95.1250 O.2 43 PRO43 -0.2778 677 CB 105.2028 103.7965 92.7886 C.3 43 PRO43 -0.0276 678 HB1 106.1429 103.2527 92.8874 H 43 PRO43 0.0285 679 HB2 105.3934 104.8333 93.0640 H 43 PRO43 0.0285 680 CG 104.7003 103.6784 91.3508 C.3 43 PRO43 -0.0379 681 HG1 105.5238 103.6243 90.6400 H 43 PRO43 0.0278 682 HG2 104.0717 104.5361 91.1087 H 43 PRO43 0.0278 683 CD 103.8645 102.4074 91.3075 C.3 43 PRO43 0.0071 684 HD1 102.8964 102.5367 90.8193 H 43 PRO43 0.0431 685 HD2 104.4350 101.5969 90.8513 H 43 PRO43 0.0431 686 N 102.0420 104.3760 93.1970 N.am 44 ASP44 -0.2451 687 H 102.0570 103.9290 92.2810 H 44 ASP44 0.1312 688 CA 100.9230 105.2560 93.4910 C.3 44 ASP44 0.0974 689 HA 101.4036 106.1060 93.9779 H 44 ASP44 0.0563 690 C 100.0430 104.7060 94.5960 C.2 44 ASP44 0.2192 691 O 99.6540 105.3830 95.5460 O.2 44 ASP44 -0.2778 692 CB 100.2606 105.8795 92.2831 C.3 44 ASP44 0.0576 693 HB1 101.0727 106.3997 91.7956 H 44 ASP44 0.0394 694 HB2 99.5551 106.6385 92.6054 H 44 ASP44 0.0394 695 CG 99.6031 104.9579 91.2447 C.2 44 ASP44 0.1780 696 OD1 98.8453 105.4613 90.4154 O.co2 44 ASP44 -0.6478 697 OD2 99.8488 103.7641 91.2321 O.co2 44 ASP44 -0.6478 698 N 99.7790 103.3980 94.5170 N.am 45 ILE45 -0.2454 699 H 100.0140 102.9200 93.6470 H 45 ILE45 0.1312 700 CA 99.1860 102.6140 95.5710 C.3 45 ILE45 0.0903 701 HA 98.3018 103.1634 95.8843 H 45 ILE45 0.0560 702 C 100.0890 102.5150 96.7810 C.2 45 ILE45 0.2189 703 O 99.6290 102.5720 97.9170 O.2 45 ILE45 -0.2778 704 CB 98.7395 101.2590 95.0122 C.3 45 ILE45 -0.0201 705 HB 99.6376 100.7113 94.7236 H 45 ILE45 0.0318 706 CG1 97.8684 101.3968 93.7426 C.3 45 ILE45 -0.0514 707 HG11 97.6837 100.4037 93.3317 H 45 ILE45 0.0266 708 HG12 98.4024 101.9452 92.9687 H 45 ILE45 0.0266 709 CG2 98.0096 100.4464 96.0832 C.3 45 ILE45 -0.0605 710 HG21 97.5680 99.5675 95.6319 H 45 ILE45 0.0233 711 HG22 97.2084 101.0185 96.5515 H 45 ILE45 0.0233 712 HG23 98.6954 100.1239 96.8640 H 45 ILE45 0.0233 713 CD1 96.5249 102.0956 93.9585 C.3 45 ILE45 -0.0650 714 HD11 95.9776 102.1741 93.0193 H 45 ILE45 0.0230 715 HD12 96.6529 103.1036 94.3517 H 45 ILE45 0.0230 716 HD13 95.9070 101.5298 94.6488 H 45 ILE45 0.0230 717 N 101.4200 102.4130 96.5970 N.am 46 PHE46 -0.2453 718 H 101.7940 102.2510 95.6620 H 46 PHE46 0.1312 719 CA 102.3220 102.5330 97.7270 C.3 46 PHE46 0.0917 720 HA 101.9480 101.7954 98.4365 H 46 PHE46 0.0560 721 C 102.2090 103.9070 98.4210 C.2 46 PHE46 0.2190 722 O 102.2220 103.9880 99.6400 O.2 46 PHE46 -0.2778 723 CB 103.7704 102.1699 97.3626 C.3 46 PHE46 -0.0036 724 HB1 104.1591 102.9062 96.6616 H 46 PHE46 0.0333 725 HB2 103.7922 101.2071 96.8516 H 46 PHE46 0.0333 726 CG 104.6928 102.0964 98.5621 C.ar 46 PHE46 -0.0454 727 CD1 104.2984 101.4991 99.7602 C.ar 46 PHE46 -0.0585 728 HD1 103.3233 101.0480 99.8607 H 46 PHE46 0.0620 729 CD2 105.9757 102.6276 98.4830 C.ar 46 PHE46 -0.0585 730 HD2 106.3185 103.0668 97.5624 H 46 PHE46 0.0620 731 CE1 105.1471 101.4781 100.8593 C.ar 46 PHE46 -0.0615 732 HE1 104.8200 101.0275 101.7849 H 46 PHE46 0.0618 733 CE2 106.8289 102.6051 99.5770 C.ar 46 PHE46 -0.0615 734 HE2 107.8130 103.0407 99.4997 H 46 PHE46 0.0618 735 CZ 106.4123 102.0385 100.7713 C.ar 46 PHE46 -0.0617 736 HZ 107.0731 102.0280 101.6255 H 46 PHE46 0.0618 737 N 102.0100 105.0230 97.6810 N.am 47 ILE47 -0.2454 738 H 102.0840 104.9350 96.6680 H 47 ILE47 0.1312 739 CA 101.6960 106.3490 98.2230 C.3 47 ILE47 0.0903 740 HA 102.4929 106.5466 98.9412 H 47 ILE47 0.0560 741 C 100.3950 106.3880 99.0580 C.2 47 ILE47 0.2189 742 O 100.2110 107.2450 99.9170 O.2 47 ILE47 -0.2778 743 CB 101.7852 107.4479 97.1314 C.3 47 ILE47 -0.0201 744 HB 101.1208 107.1680 96.3151 H 47 ILE47 0.0318 745 CG1 103.2211 107.5598 96.5725 C.3 47 ILE47 -0.0514 746 HG11 103.6403 106.5726 96.3958 H 47 ILE47 0.0266 747 HG12 103.8714 108.0142 97.3210 H 47 ILE47 0.0266 748 CG2 101.3413 108.8292 97.6527 C.3 47 ILE47 -0.0605 749 HG21 101.4260 109.5937 96.8833 H 47 ILE47 0.0233 750 HG22 101.9502 109.1456 98.4999 H 47 ILE47 0.0233 751 HG23 100.3024 108.8287 97.9741 H 47 ILE47 0.0233 752 CD1 103.3135 108.3565 95.2627 C.3 47 ILE47 -0.0650 753 HD11 104.3323 108.3434 94.8754 H 47 ILE47 0.0230 754 HD12 103.0317 109.4003 95.3984 H 47 ILE47 0.0230 755 HD13 102.6664 107.9344 94.4939 H 47 ILE47 0.0230 756 N 99.5230 105.3490 98.9670 N.am 48 ILE48 -0.2454 757 H 99.6370 104.7110 98.1790 H 48 ILE48 0.1312 758 CA 98.4340 105.0690 99.9040 C.3 48 ILE48 0.0903 759 HA 97.9543 106.0302 100.0715 H 48 ILE48 0.0560 760 C 98.9760 104.5820 101.2700 C.2 48 ILE48 0.2189 761 O 98.2660 104.1670 102.1790 O.2 48 ILE48 -0.2778 762 CB 97.3725 104.1050 99.3188 C.3 48 ILE48 -0.0201 763 HB 97.8202 103.1146 99.2621 H 48 ILE48 0.0318 764 CG1 96.9530 104.4911 97.8849 C.3 48 ILE48 -0.0514 765 HG11 96.5735 103.6022 97.3905 H 48 ILE48 0.0266 766 HG12 97.8131 104.7870 97.2882 H 48 ILE48 0.0266 767 CG2 96.1352 103.9628 100.2311 C.3 48 ILE48 -0.0605 768 HG21 95.3070 103.4762 99.7204 H 48 ILE48 0.0233 769 HG22 95.7794 104.9352 100.5733 H 48 ILE48 0.0233 770 HG23 96.3438 103.3563 101.1107 H 48 ILE48 0.0233 771 CD1 95.8937 105.5966 97.8111 C.3 48 ILE48 -0.0650 772 HD11 95.6916 105.8685 96.7754 H 48 ILE48 0.0230 773 HD12 96.2312 106.4874 98.3361 H 48 ILE48 0.0230 774 HD13 94.9479 105.2840 98.2537 H 48 ILE48 0.0230 775 N 100.2840 104.8230 101.5220 N.am 49 ASN49 -0.2452 776 H 100.8750 104.9690 100.7040 H 49 ASN49 0.1312 777 CA 100.9470 104.8990 102.7970 C.3 49 ASN49 0.0957 778 HA 100.6962 103.9844 103.3355 H 49 ASN49 0.0562 779 C 100.4460 106.0850 103.6140 C.2 49 ASN49 0.2191 780 O 100.6730 106.1550 104.8120 O.2 49 ASN49 -0.2778 781 CB 102.4669 104.9872 102.5600 C.3 49 ASN49 0.0446 782 HB1 102.7165 105.8652 101.9628 H 49 ASN49 0.0375 783 HB2 102.8038 104.1175 101.9981 H 49 ASN49 0.0375 784 CG 103.2702 105.0093 103.8706 C.2 49 ASN49 0.2000 785 OD1 103.4305 103.9994 104.5411 O.2 49 ASN49 -0.2797 786 ND2 103.7621 106.2164 104.1928 N.am 49 ASN49 -0.2723 787 HD21 104.2960 106.3149 105.0314 H 49 ASN49 0.1266 788 HD22 103.6023 107.0178 103.6180 H 49 ASN49 0.1266 789 N 99.6280 106.9780 102.9930 N.am 50 LEU50 -0.2456 790 H 99.6350 106.9960 101.9730 H 50 LEU50 0.1312 791 CA 98.7450 107.9080 103.6770 C.3 50 LEU50 0.0880 792 HA 99.4017 108.6063 104.1976 H 50 LEU50 0.0557 793 C 97.9400 107.2030 104.7190 C.2 50 LEU50 0.2187 794 O 97.8930 107.6150 105.8460 O.2 50 LEU50 -0.2778 795 CB 97.8529 108.6965 102.6912 C.3 50 LEU50 -0.0266 796 HB1 98.5069 109.1720 101.9676 H 50 LEU50 0.0287 797 HB2 97.3762 109.5236 103.2209 H 50 LEU50 0.0287 798 CG 96.7762 107.9014 101.9168 C.3 50 LEU50 -0.0449 799 HG 97.0862 106.8612 101.8396 H 50 LEU50 0.0296 800 CD1 95.4138 107.9351 102.6230 C.3 50 LEU50 -0.0626 801 HD11 94.6559 107.3947 102.0559 H 50 LEU50 0.0232 802 HD12 95.0696 108.9601 102.7459 H 50 LEU50 0.0232 803 HD13 95.4541 107.4951 103.6155 H 50 LEU50 0.0232 804 CD2 96.6149 108.4573 100.4946 C.3 50 LEU50 -0.0626 805 HD21 95.8296 107.9291 99.9555 H 50 LEU50 0.0232 806 HD22 97.5403 108.3604 99.9268 H 50 LEU50 0.0232 807 HD23 96.3444 109.5137 100.5164 H 50 LEU50 0.0232 808 N 97.4410 106.0050 104.3780 N.am 51 SER51 -0.2436 809 H 97.6430 105.6350 103.4490 H 51 SER51 0.1312 810 CA 96.6350 105.2250 105.2710 C.3 51 SER51 0.1109 811 HA 95.8230 105.8875 105.5772 H 51 SER51 0.0580 812 C 97.3630 104.8300 106.5400 C.2 51 SER51 0.2209 813 O 96.7830 104.8070 107.6180 O.2 51 SER51 -0.2777 814 CB 96.0362 104.0100 104.5468 C.3 51 SER51 0.0681 815 HB1 95.3576 103.4686 105.2138 H 51 SER51 0.0577 816 HB2 96.8325 103.3184 104.2690 H 51 SER51 0.0577 817 OG 95.3455 104.3439 103.3538 O.3 51 SER51 -0.3930 818 HG 94.6936 105.0155 103.5352 H 51 SER51 0.2095 819 N 98.6790 104.5000 106.4410 N.am 52 VAL52 -0.2453 820 H 99.0840 104.4170 105.5090 H 52 VAL52 0.1312 821 CA 99.5470 104.2570 107.5920 C.3 52 VAL52 0.0901 822 HA 99.0515 103.4961 108.1964 H 52 VAL52 0.0560 823 C 99.6870 105.5000 108.4410 C.2 52 VAL52 0.2189 824 O 99.5630 105.4500 109.6620 O.2 52 VAL52 -0.2778 825 CB 100.9170 103.7343 107.1074 C.3 52 VAL52 -0.0227 826 HB 101.3936 104.5117 106.5094 H 52 VAL52 0.0315 827 CG1 101.8600 103.4157 108.2793 C.3 52 VAL52 -0.0608 828 HG11 102.8154 103.0348 107.9177 H 52 VAL52 0.0233 829 HG12 101.4272 102.6626 108.9381 H 52 VAL52 0.0233 830 HG13 102.0720 104.3017 108.8784 H 52 VAL52 0.0233 831 CG2 100.7603 102.4980 106.2066 C.3 52 VAL52 -0.0608 832 HG21 101.7332 102.1275 105.8828 H 52 VAL52 0.0233 833 HG22 100.1880 102.7194 105.3058 H 52 VAL52 0.0233 834 HG23 100.2526 101.6891 106.7329 H 52 VAL52 0.0233 835 N 99.8830 106.6690 107.8030 N.am 53 VAL53 -0.2454 836 H 100.0270 106.6450 106.7930 H 53 VAL53 0.1312 837 CA 99.9020 107.9630 108.4650 C.3 53 VAL53 0.0901 838 HA 100.6629 107.8889 109.2413 H 53 VAL53 0.0560 839 C 98.5860 108.2600 109.1610 C.2 53 VAL53 0.2189 840 O 98.5590 108.6610 110.3200 O.2 53 VAL53 -0.2778 841 CB 100.2999 109.0768 107.4791 C.3 53 VAL53 -0.0227 842 HB 99.5184 109.1785 106.7261 H 53 VAL53 0.0315 843 CG1 100.4399 110.4262 108.1948 C.3 53 VAL53 -0.0608 844 HG11 100.7651 111.1860 107.4914 H 53 VAL53 0.0233 845 HG12 101.1765 110.3769 108.9969 H 53 VAL53 0.0233 846 HG13 99.4960 110.7576 108.6279 H 53 VAL53 0.0233 847 CG2 101.6100 108.7490 106.7495 C.3 53 VAL53 -0.0608 848 HG21 101.8263 109.4981 105.9922 H 53 VAL53 0.0233 849 HG22 101.5789 107.7912 106.2391 H 53 VAL53 0.0233 850 HG23 102.4438 108.7202 107.4470 H 53 VAL53 0.0233 851 N 97.4640 107.9790 108.4710 N.am 54 ASP54 -0.2451 852 H 97.5730 107.6630 107.5070 H 54 ASP54 0.1312 853 CA 96.1250 108.0880 108.9830 C.3 54 ASP54 0.0974 854 HA 96.0776 109.1087 109.3289 H 54 ASP54 0.0563 855 C 95.8650 107.1970 110.2040 C.2 54 ASP54 0.2192 856 O 95.2770 107.6190 111.2010 O.2 54 ASP54 -0.2778 857 CB 95.0768 107.9520 107.8669 C.3 54 ASP54 0.0576 858 HB1 94.0796 107.9824 108.2962 H 54 ASP54 0.0394 859 HB2 95.1937 107.0042 107.3490 H 54 ASP54 0.0394 860 CG 95.1239 109.1075 106.8435 C.2 54 ASP54 0.1780 861 OD1 95.3490 110.2491 107.2400 O.co2 54 ASP54 -0.6478 862 OD2 94.9272 108.8611 105.6566 O.co2 54 ASP54 -0.6478 863 N 96.3670 105.9460 110.1990 N.am 55 LEU55 -0.2456 864 H 96.7410 105.5770 109.3240 H 55 LEU55 0.1312 865 CA 96.4020 105.0950 111.3800 C.3 55 LEU55 0.0880 866 HA 95.3862 105.0922 111.7707 H 55 LEU55 0.0557 867 C 97.2430 105.6030 112.5280 C.2 55 LEU55 0.2187 868 O 96.8830 105.4430 113.6860 O.2 55 LEU55 -0.2778 869 CB 96.8605 103.6561 111.0589 C.3 55 LEU55 -0.0266 870 HB1 97.1687 103.1646 111.9844 H 55 LEU55 0.0287 871 HB2 97.7558 103.6910 110.4367 H 55 LEU55 0.0287 872 CG 95.8156 102.7305 110.4100 C.3 55 LEU55 -0.0449 873 HG 95.6838 103.0339 109.3720 H 55 LEU55 0.0296 874 CD1 96.3359 101.2865 110.4362 C.3 55 LEU55 -0.0626 875 HD11 95.6406 100.6049 109.9478 H 55 LEU55 0.0232 876 HD12 96.4643 100.9368 111.4609 H 55 LEU55 0.0232 877 HD13 97.3032 101.2055 109.9419 H 55 LEU55 0.0232 878 CD2 94.4500 102.7770 111.1097 C.3 55 LEU55 -0.0626 879 HD21 93.7732 102.0399 110.6809 H 55 LEU55 0.0232 880 HD22 93.9682 103.7470 111.0064 H 55 LEU55 0.0232 881 HD23 94.5475 102.5620 112.1733 H 55 LEU55 0.0232 882 N 98.4050 106.2170 112.2550 N.am 56 LEU56 -0.2456 883 H 98.7240 106.2390 111.2870 H 56 LEU56 0.1312 884 CA 99.2310 106.8520 113.2660 C.3 56 LEU56 0.0880 885 HA 99.3629 106.1060 114.0490 H 56 LEU56 0.0557 886 C 98.5750 108.0410 113.9660 C.2 56 LEU56 0.2187 887 O 99.0780 108.5230 114.9780 O.2 56 LEU56 -0.2778 888 CB 100.6049 107.1851 112.6623 C.3 56 LEU56 -0.0266 889 HB1 101.1840 107.8071 113.3466 H 56 LEU56 0.0287 890 HB2 100.4564 107.7835 111.7631 H 56 LEU56 0.0287 891 CG 101.4203 105.9185 112.3220 C.3 56 LEU56 -0.0449 892 HG 100.7727 105.2061 111.8115 H 56 LEU56 0.0296 893 CD1 102.5713 106.2365 111.3647 C.3 56 LEU56 -0.0626 894 HD11 103.1051 105.3302 111.0780 H 56 LEU56 0.0232 895 HD12 103.2873 106.9089 111.8364 H 56 LEU56 0.0232 896 HD13 102.2062 106.7036 110.4504 H 56 LEU56 0.0232 897 CD2 101.9672 105.2345 113.5833 C.3 56 LEU56 -0.0626 898 HD21 102.5339 104.3396 113.3255 H 56 LEU56 0.0232 899 HD22 101.1722 104.9286 114.2621 H 56 LEU56 0.0232 900 HD23 102.6350 105.9018 114.1281 H 56 LEU56 0.0232 901 N 97.3660 108.4790 113.5390 N.am 57 PHE57 -0.2453 902 H 97.0090 108.1560 112.6400 H 57 PHE57 0.1312 903 CA 96.5680 109.3960 114.3290 C.3 57 PHE57 0.0917 904 HA 97.2404 110.1174 114.7954 H 57 PHE57 0.0560 905 C 95.8630 108.6400 115.4470 C.2 57 PHE57 0.2190 906 O 95.2060 109.2460 116.2760 O.2 57 PHE57 -0.2778 907 CB 95.4924 110.1218 113.5143 C.3 57 PHE57 -0.0036 908 HB1 94.8422 110.7028 114.1666 H 57 PHE57 0.0333 909 HB2 94.8533 109.4040 112.9984 H 57 PHE57 0.0333 910 CG 96.0914 111.0835 112.5397 C.ar 57 PHE57 -0.0454 911 CD1 96.8582 112.1568 112.9709 C.ar 57 PHE57 -0.0585 912 HD1 97.0117 112.3264 114.0257 H 57 PHE57 0.0620 913 CD2 95.8756 110.9082 111.1868 C.ar 57 PHE57 -0.0585 914 HD2 95.2356 110.1030 110.8696 H 57 PHE57 0.0620 915 CE1 97.4461 113.0055 112.0480 C.ar 57 PHE57 -0.0615 916 HE1 98.0596 113.8205 112.3939 H 57 PHE57 0.0618 917 CE2 96.4823 111.7353 110.2559 C.ar 57 PHE57 -0.0615 918 HE2 96.3352 111.5645 109.1983 H 57 PHE57 0.0618 919 CZ 97.2844 112.7747 110.6904 C.ar 57 PHE57 -0.0617 920 HZ 97.7870 113.3876 109.9644 H 57 PHE57 0.0618 921 N 96.0540 107.3080 115.5800 N.am 58 LEU58 -0.2456 922 H 96.4820 106.8090 114.8000 H 58 LEU58 0.1312 923 CA 95.6900 106.5390 116.7590 C.3 58 LEU58 0.0880 924 HA 94.6644 106.8168 117.0035 H 58 LEU58 0.0557 925 C 96.5710 106.8340 117.9540 C.2 58 LEU58 0.2187 926 O 96.1930 106.6430 119.1030 O.2 58 LEU58 -0.2778 927 CB 95.7852 105.0405 116.4221 C.3 58 LEU58 -0.0266 928 HB1 96.8161 104.7941 116.1625 H 58 LEU58 0.0287 929 HB2 95.2121 104.8482 115.5206 H 58 LEU58 0.0287 930 CG 95.3074 104.0787 117.5283 C.3 58 LEU58 -0.0449 931 HG 96.0108 104.1328 118.3602 H 58 LEU58 0.0296 932 CD1 93.9184 104.4444 118.0699 C.3 58 LEU58 -0.0626 933 HD11 93.5720 103.7047 118.7919 H 58 LEU58 0.0232 934 HD12 93.1857 104.4985 117.2681 H 58 LEU58 0.0232 935 HD13 93.9262 105.4074 118.5779 H 58 LEU58 0.0232 936 CD2 95.3184 102.6341 117.0126 C.3 58 LEU58 -0.0626 937 HD21 95.0340 101.9340 117.7985 H 58 LEU58 0.0232 938 HD22 96.3105 102.3511 116.6600 H 58 LEU58 0.0232 939 HD23 94.6205 102.5074 116.1839 H 58 LEU58 0.0232 940 N 97.7730 107.3730 117.7070 N.am 59 LEU59 -0.2456 941 H 98.0760 107.4670 116.7380 H 59 LEU59 0.1312 942 CA 98.6580 107.8260 118.7560 C.3 59 LEU59 0.0880 943 HA 98.6062 107.1168 119.5832 H 59 LEU59 0.0557 944 C 98.2520 109.2030 119.2750 C.2 59 LEU59 0.2185 945 O 98.7330 109.6720 120.3020 O.2 59 LEU59 -0.2778 946 CB 100.0887 107.8999 118.1906 C.3 59 LEU59 -0.0266 947 HB1 100.7790 108.1790 118.9879 H 59 LEU59 0.0287 948 HB2 100.1414 108.7031 117.4532 H 59 LEU59 0.0287 949 CG 100.5812 106.6000 117.5255 C.3 59 LEU59 -0.0449 950 HG 99.9118 106.3446 116.7030 H 59 LEU59 0.0296 951 CD1 101.9722 106.8067 116.9148 C.3 59 LEU59 -0.0626 952 HD11 102.3343 105.8911 116.4478 H 59 LEU59 0.0232 953 HD12 102.6968 107.1007 117.6746 H 59 LEU59 0.0232 954 HD13 101.9528 107.5848 116.1508 H 59 LEU59 0.0232 955 CD2 100.5929 105.4222 118.5089 C.3 59 LEU59 -0.0626 956 HD21 100.9797 104.5208 118.0329 H 59 LEU59 0.0232 957 HD22 99.5901 105.1922 118.8686 H 59 LEU59 0.0232 958 HD23 101.2204 105.6379 119.3740 H 59 LEU59 0.0232 959 N 97.3290 109.8650 118.5410 N.am 60 GLY60 -0.2485 960 H 96.9410 109.3770 117.7330 H 60 GLY60 0.1309 961 CA 96.8390 111.2100 118.8000 C.3 60 GLY60 0.0765 962 HA1 96.9566 111.7785 117.8776 H 60 GLY60 0.0521 963 HA2 97.4494 111.6776 119.5745 H 60 GLY60 0.0521 964 C 95.3920 111.2270 119.2180 C.2 60 GLY60 0.2155 965 O 95.0610 111.7150 120.2920 O.2 60 GLY60 -0.2781 966 N 94.4790 110.6780 118.3880 N.am 61 MET61 -0.2459 967 H 94.8350 110.1960 117.5630 H 61 MET61 0.1312 968 CA 93.0320 110.7090 118.5610 C.3 61 MET61 0.0888 969 HA 92.7767 111.7648 118.4645 H 61 MET61 0.0557 970 C 92.5030 110.3010 119.9450 C.2 61 MET61 0.2214 971 O 91.7510 111.1040 120.4920 O.2 61 MET61 -0.2776 972 CB 92.3462 109.9583 117.4048 C.3 61 MET61 -0.0199 973 HB1 91.3076 109.7521 117.6573 H 61 MET61 0.0293 974 HB2 92.8169 108.9901 117.2446 H 61 MET61 0.0293 975 CG 92.3829 110.7479 116.0888 C.3 61 MET61 -0.0047 976 HG1 93.4075 111.0175 115.8370 H 61 MET61 0.0377 977 HG2 91.8396 111.6891 116.1797 H 61 MET61 0.0377 978 SD 91.6789 109.7944 114.7289 S.3 61 MET61 -0.1641 979 CE 92.0471 110.9092 113.3564 C.3 61 MET61 -0.0181 980 HE1 92.5279 110.3524 112.5517 H 61 MET61 0.0340 981 HE2 92.7194 111.7104 113.6597 H 61 MET61 0.0340 982 HE3 91.1280 111.3370 112.9553 H 61 MET61 0.0340 983 N 92.8300 109.1790 120.6030 N.am 62 PRO62 -0.2316 984 CA 92.4260 108.8820 121.9800 C.3 62 PRO62 0.0907 985 HA 91.3423 108.7597 121.9665 H 62 PRO62 0.0559 986 C 92.8040 109.9500 122.9940 C.2 62 PRO62 0.2189 987 O 91.9890 110.3010 123.8450 O.2 62 PRO62 -0.2778 988 CB 93.1381 107.5533 122.2834 C.3 62 PRO62 -0.0276 989 HB1 92.5395 106.8955 122.9138 H 62 PRO62 0.0285 990 HB2 94.0872 107.7200 122.7966 H 62 PRO62 0.0285 991 CG 93.4372 106.9417 120.9185 C.3 62 PRO62 -0.0379 992 HG1 92.5698 106.3770 120.5751 H 62 PRO62 0.0278 993 HG2 94.2905 106.2632 120.9365 H 62 PRO62 0.0278 994 CD 93.6577 108.1401 119.9993 C.3 62 PRO62 0.0071 995 HD1 94.6905 108.4912 120.0262 H 62 PRO62 0.0431 996 HD2 93.3488 107.9322 118.9775 H 62 PRO62 0.0431 997 N 94.0470 110.4680 122.9160 N.am 63 PHE63 -0.2453 998 H 94.6630 110.0960 122.1930 H 63 PHE63 0.1312 999 CA 94.5840 111.5110 123.7740 C.3 63 PHE63 0.0917 1000 HA 94.3769 111.2062 124.8010 H 63 PHE63 0.0560 1001 C 93.8930 112.8360 123.5460 C.2 63 PHE63 0.2190 1002 O 93.5580 113.5410 124.4940 O.2 63 PHE63 -0.2778 1003 CB 96.0983 111.6352 123.5606 C.3 63 PHE63 -0.0036 1004 HB1 96.5058 112.4423 124.1714 H 63 PHE63 0.0333 1005 HB2 96.3244 111.8905 122.5244 H 63 PHE63 0.0333 1006 CG 96.7997 110.3545 123.9231 C.ar 63 PHE63 -0.0454 1007 CD1 97.0512 109.3888 122.9532 C.ar 63 PHE63 -0.0585 1008 HD1 96.7410 109.5575 121.9318 H 63 PHE63 0.0620 1009 CD2 97.2025 110.1185 125.2341 C.ar 63 PHE63 -0.0585 1010 HD2 97.0117 110.8570 125.9996 H 63 PHE63 0.0620 1011 CE1 97.7036 108.2092 123.2837 C.ar 63 PHE63 -0.0615 1012 HE1 97.8992 107.4715 122.5190 H 63 PHE63 0.0618 1013 CE2 97.8541 108.9385 125.5685 C.ar 63 PHE63 -0.0615 1014 HE2 98.1656 108.7645 126.5880 H 63 PHE63 0.0618 1015 CZ 98.1068 107.9838 124.5926 C.ar 63 PHE63 -0.0617 1016 HZ 98.6160 107.0669 124.8509 H 63 PHE63 0.0618 1017 N 93.6080 113.1740 122.2730 N.am 64 MET64 -0.2456 1018 H 93.9940 112.5990 121.5240 H 64 MET64 0.1312 1019 CA 92.7840 114.3080 121.9090 C.3 64 MET64 0.0885 1020 HA 93.2566 115.1840 122.3563 H 64 MET64 0.0557 1021 C 91.3910 114.2290 122.4760 C.2 64 MET64 0.2187 1022 O 90.9250 115.1800 123.0870 O.2 64 MET64 -0.2778 1023 CB 92.7549 114.4526 120.3815 C.3 64 MET64 -0.0199 1024 HB1 91.9845 115.1640 120.0806 H 64 MET64 0.0293 1025 HB2 92.4870 113.5002 119.9263 H 64 MET64 0.0293 1026 CG 94.0969 114.9367 119.8262 C.3 64 MET64 -0.0047 1027 HG1 94.0962 114.8832 118.7395 H 64 MET64 0.0377 1028 HG2 94.9202 114.3023 120.1541 H 64 MET64 0.0377 1029 SD 94.4194 116.6388 120.3279 S.3 64 MET64 -0.1641 1030 CE 95.9692 116.9022 119.4466 C.3 64 MET64 -0.0181 1031 HE1 96.6217 117.5603 120.0205 H 64 MET64 0.0340 1032 HE2 95.7793 117.3597 118.4763 H 64 MET64 0.0340 1033 HE3 96.5043 115.9633 119.3036 H 64 MET64 0.0340 1034 N 90.7100 113.0750 122.3750 N.am 65 ILE65 -0.2454 1035 H 91.1310 112.2960 121.8690 H 65 ILE65 0.1312 1036 CA 89.3870 112.9000 122.9660 C.3 65 ILE65 0.0903 1037 HA 88.7609 113.6910 122.5497 H 65 ILE65 0.0560 1038 C 89.3840 113.0880 124.4760 C.2 65 ILE65 0.2189 1039 O 88.5410 113.8030 125.0210 O.2 65 ILE65 -0.2778 1040 CB 88.7894 111.5236 122.5830 C.3 65 ILE65 -0.0201 1041 HB 89.5096 110.7527 122.8622 H 65 ILE65 0.0318 1042 CG1 88.5624 111.4434 121.0638 C.3 65 ILE65 -0.0514 1043 HG11 89.4734 111.6935 120.5261 H 65 ILE65 0.0266 1044 HG12 87.8484 112.2122 120.7817 H 65 ILE65 0.0266 1045 CG2 87.4658 111.2329 123.3282 C.3 65 ILE65 -0.0605 1046 HG21 87.0703 110.2476 123.0878 H 65 ILE65 0.0233 1047 HG22 86.7020 111.9690 123.0750 H 65 ILE65 0.0233 1048 HG23 87.5904 111.2416 124.4106 H 65 ILE65 0.0233 1049 CD1 88.0788 110.0698 120.5824 C.3 65 ILE65 -0.0650 1050 HD11 87.9467 110.0658 119.5043 H 65 ILE65 0.0230 1051 HD12 87.1139 109.8022 121.0091 H 65 ILE65 0.0230 1052 HD13 88.7946 109.2879 120.8367 H 65 ILE65 0.0230 1053 N 90.3830 112.4850 125.1630 N.am 66 HIS66 -0.2453 1054 H 91.0400 111.9110 124.6350 H 66 HIS66 0.1312 1055 CA 90.5870 112.5960 126.5980 C.3 66 HIS66 0.0932 1056 HA 89.6542 112.2639 127.0566 H 66 HIS66 0.0561 1057 C 90.8410 114.0230 127.0330 C.2 66 HIS66 0.2190 1058 O 90.2780 114.5120 128.0080 O.2 66 HIS66 -0.2778 1059 CB 91.7397 111.6747 127.0271 C.3 66 HIS66 0.0146 1060 HB1 92.7094 112.0800 126.7355 H 66 HIS66 0.0348 1061 HB2 91.6447 110.7067 126.5341 H 66 HIS66 0.0348 1062 CG 91.6990 111.4525 128.5251 C.ar 66 HIS66 0.0551 1063 ND1 91.2891 110.3009 129.0986 N.ar 66 HIS66 -0.2469 1064 CD2 92.0278 112.3576 129.5495 C.ar 66 HIS66 0.0047 1065 HD2 92.3788 113.3707 129.4173 H 66 HIS66 0.0764 1066 CE1 91.3670 110.4970 130.4257 C.ar 66 HIS66 0.0737 1067 HE1 91.0994 109.7500 131.1597 H 66 HIS66 0.0963 1068 NE2 91.8172 111.7281 130.7280 N.ar 66 HIS66 -0.2539 1069 HE2 91.9525 112.0985 131.6250 H 66 HIS66 0.1339 1070 N 91.6950 114.7400 126.2840 N.am 67 GLN67 -0.2456 1071 H 92.1390 114.2950 125.4810 H 67 GLN67 0.1312 1072 CA 92.0030 116.1100 126.5760 C.3 67 GLN67 0.0882 1073 HA 92.2433 116.1755 127.6391 H 67 GLN67 0.0557 1074 C 90.8550 117.0820 126.2830 C.2 67 GLN67 0.2187 1075 O 90.4270 117.8180 127.1650 O.2 67 GLN67 -0.2778 1076 CB 93.2435 116.4548 125.7325 C.3 67 GLN67 -0.0210 1077 HB1 93.0442 116.2434 124.6800 H 67 GLN67 0.0289 1078 HB2 94.0429 115.7763 126.0263 H 67 GLN67 0.0289 1079 CG 93.7152 117.9084 125.8783 C.3 67 GLN67 0.0225 1080 HG1 93.8217 118.1698 126.9310 H 67 GLN67 0.0356 1081 HG2 92.9846 118.5751 125.4258 H 67 GLN67 0.0356 1082 CD 95.0476 118.1691 125.1697 C.2 67 GLN67 0.1981 1083 OE1 95.5381 117.3675 124.3886 O.2 67 GLN67 -0.2798 1084 NE2 95.5973 119.3485 125.4939 N.am 67 GLN67 -0.2724 1085 HE21 96.4567 119.6117 125.0562 H 67 GLN67 0.1266 1086 HE22 95.1639 119.9560 126.1590 H 67 GLN67 0.1266 1087 N 90.2830 117.0860 125.0550 N.am 68 LEU68 -0.2456 1088 H 90.5310 116.3370 124.4090 H 68 LEU68 0.1312 1089 CA 89.3340 118.0970 124.6010 C.3 68 LEU68 0.0880 1090 HA 89.8393 119.0562 124.7149 H 68 LEU68 0.0557 1091 C 88.0580 118.1840 125.4120 C.2 68 LEU68 0.2187 1092 O 87.5770 119.2750 125.7080 O.2 68 LEU68 -0.2778 1093 CB 89.0202 117.8436 123.1125 C.3 68 LEU68 -0.0266 1094 HB1 88.2124 118.4958 122.7765 H 68 LEU68 0.0287 1095 HB2 88.6435 116.8241 123.0132 H 68 LEU68 0.0287 1096 CG 90.2307 118.0325 122.1714 C.3 68 LEU68 -0.0449 1097 HG 91.1047 117.5518 122.6100 H 68 LEU68 0.0296 1098 CD1 89.9776 117.3631 120.8134 C.3 68 LEU68 -0.0626 1099 HD11 90.8464 117.4595 120.1613 H 68 LEU68 0.0232 1100 HD12 89.1258 117.8141 120.3035 H 68 LEU68 0.0232 1101 HD13 89.7715 116.2989 120.9309 H 68 LEU68 0.0232 1102 CD2 90.5773 119.5126 121.9678 C.3 68 LEU68 -0.0626 1103 HD21 91.4638 119.6228 121.3424 H 68 LEU68 0.0232 1104 HD22 90.7774 120.0179 122.9120 H 68 LEU68 0.0232 1105 HD23 89.7612 120.0336 121.4710 H 68 LEU68 0.0232 1106 N 87.4870 117.0220 125.7870 N.am 69 MET69 -0.2456 1107 H 87.8980 116.1510 125.4510 H 69 MET69 0.1312 1108 CA 86.3200 116.9460 126.6430 C.3 69 MET69 0.0885 1109 HA 85.6065 117.6388 126.1931 H 69 MET69 0.0557 1110 C 86.5770 117.4720 128.0470 C.2 69 MET69 0.2185 1111 O 85.7880 118.2350 128.5950 O.2 69 MET69 -0.2778 1112 CB 85.6767 115.5540 126.6307 C.3 69 MET69 -0.0199 1113 HB1 86.3158 114.8196 127.1228 H 69 MET69 0.0293 1114 HB2 85.5887 115.2304 125.5930 H 69 MET69 0.0293 1115 CG 84.2696 115.5715 127.2572 C.3 69 MET69 -0.0047 1116 HG1 83.6508 114.7804 126.8475 H 69 MET69 0.0377 1117 HG2 83.7395 116.4897 127.0021 H 69 MET69 0.0377 1118 SD 84.3032 115.4016 129.0516 S.3 69 MET69 -0.1641 1119 CE 84.2101 113.6055 129.1559 C.3 69 MET69 -0.0181 1120 HE1 84.4482 113.2707 130.1653 H 69 MET69 0.0340 1121 HE2 84.9271 113.1538 128.4700 H 69 MET69 0.0340 1122 HE3 83.2146 113.2594 128.8784 H 69 MET69 0.0340 1123 N 87.7320 117.1240 128.6520 N.am 70 GLY70 -0.2485 1124 H 88.3870 116.5340 128.1390 H 70 GLY70 0.1309 1125 CA 88.0940 117.5460 130.0000 C.3 70 GLY70 0.0765 1126 HA1 88.7911 116.8006 130.3820 H 70 GLY70 0.0521 1127 HA2 87.1998 117.5316 130.6245 H 70 GLY70 0.0521 1128 C 88.7460 118.9090 130.0690 C.2 70 GLY70 0.2155 1129 O 89.7270 119.1080 130.7810 O.2 70 GLY70 -0.2781 1130 N 88.2310 119.8820 129.2920 N.am 71 ASN71 -0.2454 1131 H 87.4820 119.6080 128.6560 H 71 ASN71 0.1312 1132 CA 88.6300 121.2880 129.2620 C.3 71 ASN71 0.0957 1133 HA 87.9403 121.7476 128.5531 H 71 ASN71 0.0562 1134 C 90.0170 121.5530 128.7000 C.2 71 ASN71 0.2189 1135 O 90.5720 122.6390 128.8440 O.2 71 ASN71 -0.2778 1136 CB 88.4360 121.9487 130.6396 C.3 71 ASN71 0.0446 1137 HB1 88.7237 122.9997 130.6132 H 71 ASN71 0.0375 1138 HB2 89.0421 121.4680 131.4045 H 71 ASN71 0.0375 1139 CG 86.9636 121.8862 131.0618 C.2 71 ASN71 0.2000 1140 OD1 86.1339 122.6556 130.5986 O.2 71 ASN71 -0.2797 1141 ND2 86.6904 120.9312 131.9638 N.am 71 ASN71 -0.2723 1142 HD21 85.7528 120.8290 132.2937 H 71 ASN71 0.1266 1143 HD22 87.4046 120.3222 132.3063 H 71 ASN71 0.1266 1144 N 90.6210 120.5520 128.0440 N.am 72 GLY72 -0.2485 1145 H 90.0870 119.7000 127.8730 H 72 GLY72 0.1309 1146 CA 91.9870 120.6060 127.5630 C.3 72 GLY72 0.0765 1147 HA1 92.1495 121.5768 127.0937 H 72 GLY72 0.0521 1148 HA2 92.0631 119.8431 126.7979 H 72 GLY72 0.0521 1149 C 93.0390 120.3720 128.6230 C.2 72 GLY72 0.2155 1150 O 94.2350 120.4670 128.3370 O.2 72 GLY72 -0.2781 1151 N 92.6060 120.0490 129.8640 N.am 73 VAL73 -0.2456 1152 H 91.6060 119.8820 129.9790 H 73 VAL73 0.1312 1153 CA 93.4420 119.9190 131.0500 C.3 73 VAL73 0.0901 1154 HA 94.0840 120.8021 131.0648 H 73 VAL73 0.0560 1155 C 94.3130 118.7000 130.9870 C.2 73 VAL73 0.2189 1156 O 93.8740 117.5590 130.8420 O.2 73 VAL73 -0.2778 1157 CB 92.5592 119.9194 132.3160 C.3 73 VAL73 -0.0227 1158 HB 91.8483 119.0958 132.2339 H 73 VAL73 0.0315 1159 CG1 93.3712 119.7081 133.6065 C.3 73 VAL73 -0.0608 1160 HG11 92.7247 119.7409 134.4836 H 73 VAL73 0.0233 1161 HG12 94.1313 120.4810 133.7239 H 73 VAL73 0.0233 1162 HG13 93.8757 118.7416 133.6166 H 73 VAL73 0.0233 1163 CG2 91.7607 121.2270 132.4219 C.3 73 VAL73 -0.0608 1164 HG21 91.0578 121.1913 133.2544 H 73 VAL73 0.0233 1165 HG22 91.1904 121.4250 131.5167 H 73 VAL73 0.0233 1166 HG23 92.4232 122.0782 132.5805 H 73 VAL73 0.0233 1167 N 95.6270 118.9270 131.0980 N.am 74 TRP74 -0.2453 1168 H 95.9680 119.8760 131.2540 H 74 TRP74 0.1312 1169 CA 96.5500 117.8470 130.9990 C.3 74 TRP74 0.0918 1170 HA 96.1117 117.1027 130.3309 H 74 TRP74 0.0560 1171 C 96.8350 117.1480 132.3250 C.2 74 TRP74 0.2190 1172 O 97.7480 117.4920 133.0720 O.2 74 TRP74 -0.2778 1173 CB 97.8229 118.3652 130.3330 C.3 74 TRP74 -0.0021 1174 HB1 98.4527 118.9224 131.0289 H 74 TRP74 0.0334 1175 HB2 97.5600 119.0545 129.5297 H 74 TRP74 0.0334 1176 CG 98.5844 117.2059 129.7316 C.ar 74 TRP74 -0.0260 1177 CD1 99.8426 116.7623 130.1321 C.ar 74 TRP74 -0.0136 1178 HD1 100.4110 117.1874 130.9465 H 74 TRP74 0.0748 1179 CD2 98.2220 116.4276 128.5717 C.ar 74 TRP74 -0.0028 1180 NE1 100.2396 115.7525 129.3199 N.ar 74 TRP74 -0.2641 1181 HE1 101.0897 115.2696 129.4077 H 74 TRP74 0.1331 1182 CE2 99.2846 115.5250 128.3378 C.ar 74 TRP74 0.0269 1183 CE3 97.1339 116.4372 127.7404 C.ar 74 TRP74 -0.0528 1184 HE3 96.3305 117.1405 127.9051 H 74 TRP74 0.0624 1185 CZ2 99.2142 114.6385 127.2975 C.ar 74 TRP74 -0.0430 1186 HZ2 100.0242 113.9442 127.1293 H 74 TRP74 0.0633 1187 CZ3 97.0598 115.5329 126.6818 C.ar 74 TRP74 -0.0611 1188 HZ3 96.2073 115.5276 126.0213 H 74 TRP74 0.0618 1189 CH2 98.0948 114.6277 126.4660 C.ar 74 TRP74 -0.0602 1190 HH2 98.0170 113.9231 125.6528 H 74 TRP74 0.0618 1191 N 96.0850 116.0590 132.5860 N.am 75 HIS75 -0.2453 1192 H 95.3140 115.8440 131.9540 H 75 HIS75 0.1312 1193 CA 96.3110 115.1730 133.7170 C.3 75 HIS75 0.0932 1194 HA 96.4757 115.8031 134.5932 H 75 HIS75 0.0561 1195 C 97.5300 114.2670 133.5480 C.2 75 HIS75 0.2190 1196 O 97.9710 113.6110 134.4850 O.2 75 HIS75 -0.2778 1197 CB 95.0540 114.3127 133.9237 C.3 75 HIS75 0.0146 1198 HB1 95.1582 113.6803 134.8062 H 75 HIS75 0.0348 1199 HB2 94.8881 113.6541 133.0701 H 75 HIS75 0.0348 1200 CG 93.8426 115.2021 134.1011 C.ar 75 HIS75 0.0551 1201 ND1 93.5106 115.7971 135.2664 N.ar 75 HIS75 -0.2469 1202 CD2 92.9049 115.5878 133.1278 C.ar 75 HIS75 0.0047 1203 HD2 92.9047 115.2946 132.0880 H 75 HIS75 0.0764 1204 CE1 92.4108 116.5258 135.0102 C.ar 75 HIS75 0.0737 1205 HE1 91.9080 117.1338 135.7490 H 75 HIS75 0.0963 1206 NE2 92.0253 116.4234 133.7252 N.ar 75 HIS75 -0.2539 1207 HE2 91.2653 116.8747 133.3017 H 75 HIS75 0.1339 1208 N 98.1130 114.1950 132.3320 N.am 76 PHE76 -0.2453 1209 H 97.7980 114.8360 131.6030 H 76 PHE76 0.1312 1210 CA 99.1660 113.2490 132.0130 C.3 76 PHE76 0.0917 1211 HA 99.1037 112.4260 132.7270 H 76 PHE76 0.0560 1212 C 100.5680 113.8220 132.1330 C.2 76 PHE76 0.2188 1213 O 101.5540 113.1340 131.8920 O.2 76 PHE76 -0.2778 1214 CB 98.9839 112.6698 130.6029 C.3 76 PHE76 -0.0036 1215 HB1 99.7408 111.9090 130.4093 H 76 PHE76 0.0333 1216 HB2 99.1421 113.4394 129.8574 H 76 PHE76 0.0333 1217 CG 97.6362 112.0415 130.3813 C.ar 76 PHE76 -0.0454 1218 CD1 97.3296 110.8146 130.9608 C.ar 76 PHE76 -0.0585 1219 HD1 98.0449 110.3301 131.6096 H 76 PHE76 0.0620 1220 CD2 96.7051 112.6454 129.5418 C.ar 76 PHE76 -0.0585 1221 HD2 96.9271 113.5954 129.0798 H 76 PHE76 0.0620 1222 CE1 96.1153 110.1952 130.6976 C.ar 76 PHE76 -0.0615 1223 HE1 95.8868 109.2396 131.1465 H 76 PHE76 0.0618 1224 CE2 95.4963 112.0224 129.2660 C.ar 76 PHE76 -0.0615 1225 HE2 94.7907 112.4898 128.5950 H 76 PHE76 0.0618 1226 CZ 95.2022 110.7945 129.8421 C.ar 76 PHE76 -0.0617 1227 HZ 94.2657 110.3028 129.6242 H 76 PHE76 0.0618 1228 N 100.7000 115.0960 132.5620 N.am 77 GLY77 -0.2485 1229 H 99.8600 115.6640 132.6690 H 77 GLY77 0.1309 1230 CA 101.9910 115.6940 132.8780 C.3 77 GLY77 0.0765 1231 HA1 102.4848 115.0632 133.6175 H 77 GLY77 0.0521 1232 HA2 101.7405 116.6411 133.3337 H 77 GLY77 0.0521 1233 C 102.9100 115.9150 131.6860 C.2 77 GLY77 0.2155 1234 O 102.8380 115.2530 130.6890 O.2 77 GLY77 -0.2781 1235 N 103.8110 116.9240 131.7770 N.am 78 GLU78 -0.2459 1236 H 104.0070 117.2720 132.7150 H 78 GLU78 0.1312 1237 CA 104.5300 117.5660 130.6860 C.3 78 GLU78 0.0883 1238 HA 103.7625 118.0353 130.0708 H 78 GLU78 0.0557 1239 C 105.2680 116.6380 129.7870 C.2 78 GLU78 0.2188 1240 O 105.3370 116.8270 128.5790 O.2 78 GLU78 -0.2778 1241 CB 105.4511 118.6479 131.2890 C.3 78 GLU78 -0.0193 1242 HB1 106.3957 118.7183 130.7621 H 78 GLU78 0.0290 1243 HB2 105.7116 118.3859 132.3160 H 78 GLU78 0.0290 1244 CG 104.7661 120.0172 131.2398 C.3 78 GLU78 0.0356 1245 HG1 103.7717 119.9008 131.6489 H 78 GLU78 0.0374 1246 HG2 104.6507 120.3380 130.2049 H 78 GLU78 0.0374 1247 CD 105.4645 121.1378 132.0286 C.2 78 GLU78 0.1760 1248 OE1 105.9710 120.8667 133.1100 O.co2 78 GLU78 -0.6478 1249 OE2 105.4877 122.2747 131.5501 O.co2 78 GLU78 -0.6478 1250 N 105.8250 115.5900 130.4000 N.am 79 THR79 -0.2434 1251 H 105.7150 115.5230 131.4120 H 79 THR79 0.1313 1252 CA 106.5720 114.5430 129.7400 C.3 79 THR79 0.1135 1253 HA 107.4342 115.0313 129.2841 H 79 THR79 0.0583 1254 C 105.7860 113.8550 128.6510 C.2 79 THR79 0.2212 1255 O 106.2620 113.6990 127.5300 O.2 79 THR79 -0.2777 1256 CB 107.0439 113.5191 130.7940 C.3 79 THR79 0.0763 1257 HB 106.1549 113.0345 131.2157 H 79 THR79 0.0611 1258 OG1 107.7147 114.2285 131.8241 O.3 79 THR79 -0.3900 1259 HG1 108.0029 113.6412 132.5154 H 79 THR79 0.2098 1260 CG2 107.9797 112.4519 130.1953 C.3 79 THR79 -0.0370 1261 HG21 108.2858 111.7156 130.9386 H 79 THR79 0.0255 1262 HG22 108.8809 112.9115 129.7889 H 79 THR79 0.0255 1263 HG23 107.4953 111.9022 129.3883 H 79 THR79 0.0255 1264 N 104.5220 113.4850 128.9390 N.am 80 MET80 -0.2456 1265 H 104.1880 113.5870 129.8970 H 80 MET80 0.1312 1266 CA 103.6220 112.9500 127.9430 C.3 80 MET80 0.0886 1267 HA 104.1553 112.1673 127.4019 H 80 MET80 0.0557 1268 C 103.1750 113.9910 126.9390 C.2 80 MET80 0.2187 1269 O 103.0980 113.7120 125.7520 O.2 80 MET80 -0.2778 1270 CB 102.3834 112.3748 128.6522 C.3 80 MET80 -0.0199 1271 HB1 101.6590 112.0312 127.9128 H 80 MET80 0.0293 1272 HB2 101.8814 113.1628 129.2163 H 80 MET80 0.0293 1273 CG 102.7149 111.2171 129.6035 C.3 80 MET80 -0.0047 1274 HG1 101.7897 110.8288 130.0291 H 80 MET80 0.0377 1275 HG2 103.3237 111.5603 130.4406 H 80 MET80 0.0377 1276 SD 103.5719 109.8693 128.7631 S.3 80 MET80 -0.1641 1277 CE 102.3088 109.4235 127.5557 C.3 80 MET80 -0.0181 1278 HE1 102.4449 108.3903 127.2367 H 80 MET80 0.0340 1279 HE2 102.3596 110.0805 126.6869 H 80 MET80 0.0340 1280 HE3 101.3155 109.5023 127.9980 H 80 MET80 0.0340 1281 N 102.9170 115.2370 127.3880 N.am 81 CYS81 -0.2449 1282 H 103.0940 115.4300 128.3740 H 81 CYS81 0.1312 1283 CA 102.4040 116.3270 126.5690 C.3 81 CYS81 0.0965 1284 HA 101.4048 116.0642 126.2248 H 81 CYS81 0.0565 1285 C 103.2730 116.6280 125.3830 C.2 81 CYS81 0.2195 1286 O 102.8050 116.7090 124.2560 O.2 81 CYS81 -0.2778 1287 CB 102.4116 117.6197 127.3992 C.3 81 CYS81 0.0147 1288 HB1 103.3851 117.7625 127.8548 H 81 CYS81 0.0394 1289 HB2 101.7255 117.5446 128.2349 H 81 CYS81 0.0394 1290 SG 102.0806 119.1246 126.4408 S.3 81 CYS81 -0.1762 1291 HG 102.2948 120.1978 127.2074 H 81 CYS81 0.1017 1292 N 104.5830 116.7110 125.6350 N.am 82 THR82 -0.2434 1293 H 104.8850 116.6340 126.6060 H 82 THR82 0.1313 1294 CA 105.6040 116.9030 124.6270 C.3 82 THR82 0.1135 1295 HA 105.4521 117.8810 124.1731 H 82 THR82 0.0583 1296 C 105.6390 115.8250 123.5730 C.2 82 THR82 0.2212 1297 O 105.7970 116.0850 122.3840 O.2 82 THR82 -0.2777 1298 CB 106.9671 116.8025 125.3360 C.3 82 THR82 0.0763 1299 HB 107.0741 115.7706 125.7051 H 82 THR82 0.0611 1300 OG1 106.9692 117.6939 126.4296 O.3 82 THR82 -0.3900 1301 HG1 107.6952 117.4878 127.0039 H 82 THR82 0.2098 1302 CG2 108.1632 117.1369 124.4296 C.3 82 THR82 -0.0370 1303 HG21 109.1008 117.0015 124.9674 H 82 THR82 0.0255 1304 HG22 108.1141 118.1701 124.0849 H 82 THR82 0.0255 1305 HG23 108.2079 116.4929 123.5518 H 82 THR82 0.0255 1306 N 105.5110 114.5530 123.9930 N.am 83 LEU83 -0.2456 1307 H 105.4970 114.3570 124.9940 H 83 LEU83 0.1312 1308 CA 105.3930 113.4590 123.0570 C.3 83 LEU83 0.0880 1309 HA 106.2306 113.5337 122.3627 H 83 LEU83 0.0557 1310 C 104.1110 113.5250 122.2400 C.2 83 LEU83 0.2187 1311 O 104.1520 113.3890 121.0220 O.2 83 LEU83 -0.2778 1312 CB 105.4510 112.1297 123.8322 C.3 83 LEU83 -0.0266 1313 HB1 105.3400 111.2929 123.1407 H 83 LEU83 0.0287 1314 HB2 104.5955 112.0755 124.5068 H 83 LEU83 0.0287 1315 CG 106.7395 111.9343 124.6539 C.3 83 LEU83 -0.0449 1316 HG 106.8881 112.8036 125.2934 H 83 LEU83 0.0296 1317 CD1 106.6092 110.7184 125.5797 C.3 83 LEU83 -0.0626 1318 HD11 107.5025 110.5943 126.1923 H 83 LEU83 0.0232 1319 HD12 106.4641 109.8012 125.0085 H 83 LEU83 0.0232 1320 HD13 105.7611 110.8289 126.2557 H 83 LEU83 0.0232 1321 CD2 107.9763 111.7996 123.7555 C.3 83 LEU83 -0.0626 1322 HD21 108.8735 111.6294 124.3510 H 83 LEU83 0.0232 1323 HD22 108.1448 112.7019 123.1683 H 83 LEU83 0.0232 1324 HD23 107.8718 110.9629 123.0643 H 83 LEU83 0.0232 1325 N 102.9530 113.7950 122.8850 N.am 84 ILE84 -0.2454 1326 H 102.9860 113.9110 123.8980 H 84 ILE84 0.1312 1327 CA 101.6570 113.9310 122.2220 C.3 84 ILE84 0.0903 1328 HA 101.5291 113.0171 121.6434 H 84 ILE84 0.0560 1329 C 101.6320 115.0450 121.1940 C.2 84 ILE84 0.2190 1330 O 101.2220 114.8270 120.0550 O.2 84 ILE84 -0.2778 1331 CB 100.5320 114.0177 123.2759 C.3 84 ILE84 -0.0201 1332 HB 100.7911 114.8255 123.9625 H 84 ILE84 0.0318 1333 CG1 100.4455 112.7195 124.1103 C.3 84 ILE84 -0.0514 1334 HG11 99.7518 112.8620 124.9339 H 84 ILE84 0.0266 1335 HG12 101.4038 112.5017 124.5768 H 84 ILE84 0.0266 1336 CG2 99.1625 114.3699 122.6637 C.3 84 ILE84 -0.0605 1337 HG21 98.3707 114.3316 123.4107 H 84 ILE84 0.0233 1338 HG22 98.8952 113.6832 121.8603 H 84 ILE84 0.0233 1339 HG23 99.1601 115.3773 122.2467 H 84 ILE84 0.0233 1340 CD1 100.0035 111.4833 123.3190 C.3 84 ILE84 -0.0650 1341 HD11 99.9054 110.6207 123.9772 H 84 ILE84 0.0230 1342 HD12 100.7266 111.2187 122.5534 H 84 ILE84 0.0230 1343 HD13 99.0442 111.6400 122.8287 H 84 ILE84 0.0230 1344 N 102.1340 116.2490 121.5420 N.am 85 THR85 -0.2434 1345 H 102.4760 116.3720 122.4950 H 85 THR85 0.1313 1346 CA 102.2130 117.3860 120.6260 C.3 85 THR85 0.1135 1347 HA 101.2071 117.5070 120.2208 H 85 THR85 0.0583 1348 C 103.1100 117.0960 119.4350 C.2 85 THR85 0.2212 1349 O 102.7820 117.4230 118.2950 O.2 85 THR85 -0.2777 1350 CB 102.5899 118.6796 121.3730 C.3 85 THR85 0.0763 1351 HB 102.6829 119.4769 120.6263 H 85 THR85 0.0611 1352 OG1 103.8306 118.5021 122.0390 O.3 85 THR85 -0.3900 1353 HG1 104.0800 119.3053 122.4869 H 85 THR85 0.2098 1354 CG2 101.4887 119.0966 122.3651 C.3 85 THR85 -0.0370 1355 HG21 101.7037 120.0585 122.8314 H 85 THR85 0.0255 1356 HG22 101.3622 118.3641 123.1606 H 85 THR85 0.0255 1357 HG23 100.5295 119.1968 121.8571 H 85 THR85 0.0255 1358 N 104.2840 116.4590 119.6710 N.am 86 ALA86 -0.2458 1359 H 104.5150 116.2200 120.6350 H 86 ALA86 0.1312 1360 CA 105.2290 116.0980 118.6330 C.3 86 ALA86 0.0850 1361 HA 105.4427 117.0118 118.0756 H 86 ALA86 0.0554 1362 C 104.6940 115.0730 117.6530 C.2 86 ALA86 0.2184 1363 O 104.8720 115.1960 116.4410 O.2 86 ALA86 -0.2778 1364 CB 106.5161 115.5917 119.2931 C.3 86 ALA86 -0.0411 1365 HB1 107.2802 115.3624 118.5495 H 86 ALA86 0.0249 1366 HB2 106.3340 114.6935 119.8845 H 86 ALA86 0.0249 1367 HB3 106.9270 116.3475 119.9622 H 86 ALA86 0.0249 1368 N 104.0090 114.0360 118.1800 N.am 87 MET87 -0.2456 1369 H 103.9710 113.9540 119.1960 H 87 MET87 0.1312 1370 CA 103.3250 113.0340 117.3920 C.3 87 MET87 0.0885 1371 HA 104.0664 112.6490 116.6897 H 87 MET87 0.0557 1372 C 102.2030 113.5980 116.5500 C.2 87 MET87 0.2187 1373 O 102.1660 113.2960 115.3630 O.2 87 MET87 -0.2778 1374 CB 102.8300 111.8801 118.2781 C.3 87 MET87 -0.0199 1375 HB1 102.1527 111.2445 117.7050 H 87 MET87 0.0293 1376 HB2 102.2498 112.2763 119.1126 H 87 MET87 0.0293 1377 CG 103.9819 110.9998 118.7867 C.3 87 MET87 -0.0047 1378 HG1 104.5696 111.5404 119.5266 H 87 MET87 0.0377 1379 HG2 104.6555 110.7479 117.9674 H 87 MET87 0.0377 1380 SD 103.3891 109.4586 119.5132 S.3 87 MET87 -0.1641 1381 CE 102.3494 110.1333 120.8181 C.3 87 MET87 -0.0181 1382 HE1 102.1697 109.3808 121.5854 H 87 MET87 0.0340 1383 HE2 101.3966 110.4717 120.4100 H 87 MET87 0.0340 1384 HE3 102.8445 110.9807 121.2925 H 87 MET87 0.0340 1385 N 101.3200 114.4590 117.1240 N.am 88 ASP88 -0.2451 1386 H 101.4090 114.6360 118.1250 H 88 ASP88 0.1312 1387 CA 100.2590 115.1430 116.4060 C.3 88 ASP88 0.0974 1388 HA 99.5993 114.3873 115.9820 H 88 ASP88 0.0563 1389 C 100.8120 115.9900 115.2670 C.2 88 ASP88 0.2192 1390 O 100.4900 115.7920 114.0990 O.2 88 ASP88 -0.2778 1391 CB 99.5055 115.9855 117.4604 C.3 88 ASP88 0.0576 1392 HB1 100.2278 116.5201 118.0780 H 88 ASP88 0.0394 1393 HB2 98.9555 115.3312 118.1351 H 88 ASP88 0.0394 1394 CG 98.5205 117.0348 116.9143 C.2 88 ASP88 0.1780 1395 OD1 98.0717 116.9499 115.7755 O.co2 88 ASP88 -0.6478 1396 OD2 98.1983 117.9792 117.6273 O.co2 88 ASP88 -0.6478 1397 N 101.7540 116.9050 115.5650 N.am 89 ALA89 -0.2459 1398 H 102.1110 116.9700 116.5180 H 89 ALA89 0.1312 1399 CA 102.2630 117.7950 114.5490 C.3 89 ALA89 0.0850 1400 HA 101.4084 118.3258 114.1298 H 89 ALA89 0.0554 1401 C 102.9600 117.0680 113.4070 C.2 89 ALA89 0.2184 1402 O 102.7350 117.3540 112.2370 O.2 89 ALA89 -0.2778 1403 CB 103.2125 118.7766 115.2503 C.3 89 ALA89 -0.0411 1404 HB1 103.6767 119.4729 114.5549 H 89 ALA89 0.0249 1405 HB2 104.0045 118.2480 115.7790 H 89 ALA89 0.0249 1406 HB3 102.6792 119.3646 115.9973 H 89 ALA89 0.0249 1407 N 103.7900 116.0520 113.7290 N.am 90 ASN90 -0.2452 1408 H 103.9570 115.8550 114.7160 H 90 ASN90 0.1312 1409 CA 104.4520 115.2320 112.7420 C.3 90 ASN90 0.0957 1410 HA 105.0729 115.8797 112.1219 H 90 ASN90 0.0562 1411 C 103.4530 114.4760 111.8940 C.2 90 ASN90 0.2192 1412 O 103.4720 114.5600 110.6750 O.2 90 ASN90 -0.2778 1413 CB 105.2665 114.1757 113.5235 C.3 90 ASN90 0.0446 1414 HB1 104.6114 113.5122 114.0889 H 90 ASN90 0.0375 1415 HB2 105.9033 114.6287 114.2731 H 90 ASN90 0.0375 1416 CG 106.1414 113.3127 112.6122 C.2 90 ASN90 0.2000 1417 OD1 105.9137 112.1249 112.4379 O.2 90 ASN90 -0.2797 1418 ND2 107.1462 113.9839 112.0447 N.am 90 ASN90 -0.2723 1419 HD21 107.7555 113.5283 111.3949 H 90 ASN90 0.1266 1420 HD22 107.2987 114.9507 112.2514 H 90 ASN90 0.1266 1421 N 102.5020 113.7690 112.5250 N.am 91 SER91 -0.2436 1422 H 102.4390 113.8230 113.5420 H 91 SER91 0.1312 1423 CA 101.5630 112.9330 111.8080 C.3 91 SER91 0.1109 1424 HA 102.1653 112.2751 111.1799 H 91 SER91 0.0580 1425 C 100.6760 113.7420 110.8660 C.2 91 SER91 0.2209 1426 O 100.5010 113.3670 109.7080 O.2 91 SER91 -0.2777 1427 CB 100.7525 112.0629 112.7781 C.3 91 SER91 0.0681 1428 HB1 101.4523 111.4100 113.3125 H 91 SER91 0.0577 1429 HB2 100.0670 111.4207 112.2131 H 91 SER91 0.0577 1430 OG 100.0208 112.8584 113.7006 O.3 91 SER91 -0.3930 1431 HG 99.6056 112.3155 114.3652 H 91 SER91 0.2095 1432 N 100.1690 114.9170 111.3190 N.am 92 GLN92 -0.2456 1433 H 100.3410 115.1570 112.2950 H 92 GLN92 0.1312 1434 CA 99.3990 115.8620 110.5230 C.3 92 GLN92 0.0882 1435 HA 98.5599 115.3220 110.0930 H 92 GLN92 0.0557 1436 C 100.1790 116.4450 109.3630 C.2 92 GLN92 0.2187 1437 O 99.6860 116.5820 108.2470 O.2 92 GLN92 -0.2778 1438 CB 98.8778 117.0166 111.3993 C.3 92 GLN92 -0.0210 1439 HB1 98.4579 117.7858 110.7469 H 92 GLN92 0.0289 1440 HB2 99.7076 117.4853 111.9318 H 92 GLN92 0.0289 1441 CG 97.7894 116.5879 112.3965 C.3 92 GLN92 0.0225 1442 HG1 98.2055 115.9860 113.2031 H 92 GLN92 0.0356 1443 HG2 97.0395 115.9784 111.8929 H 92 GLN92 0.0356 1444 CD 97.0859 117.8112 113.0079 C.2 92 GLN92 0.1981 1445 OE1 97.6027 118.9222 113.0250 O.2 92 GLN92 -0.2798 1446 NE2 95.8713 117.5412 113.5062 N.am 92 GLN92 -0.2724 1447 HE21 95.3081 118.2569 113.9150 H 92 GLN92 0.1266 1448 HE22 95.5138 116.6080 113.4803 H 92 GLN92 0.1266 1449 N 101.4540 116.7990 109.5800 N.am 93 PHE93 -0.2453 1450 H 101.8400 116.7140 110.5200 H 93 PHE93 0.1312 1451 CA 102.2980 117.3000 108.5130 C.3 93 PHE93 0.0917 1452 HA 101.7343 118.0740 107.9893 H 93 PHE93 0.0560 1453 C 102.6100 116.2290 107.5080 C.2 93 PHE93 0.2191 1454 O 102.5230 116.4500 106.3040 O.2 93 PHE93 -0.2778 1455 CB 103.6267 117.8806 109.0360 C.3 93 PHE93 -0.0036 1456 HB1 104.2277 118.2529 108.2051 H 93 PHE93 0.0333 1457 HB2 104.1986 117.0809 109.5025 H 93 PHE93 0.0333 1458 CG 103.5118 118.9868 110.0534 C.ar 93 PHE93 -0.0454 1459 CD1 102.3251 119.6835 110.2745 C.ar 93 PHE93 -0.0585 1460 HD1 101.4491 119.5074 109.6690 H 93 PHE93 0.0620 1461 CD2 104.6069 119.2570 110.8693 C.ar 93 PHE93 -0.0585 1462 HD2 105.5298 118.7123 110.7326 H 93 PHE93 0.0620 1463 CE1 102.2232 120.5876 111.3211 C.ar 93 PHE93 -0.0615 1464 HE1 101.2888 121.0977 111.4902 H 93 PHE93 0.0618 1465 CE2 104.5068 120.1650 111.9121 C.ar 93 PHE93 -0.0615 1466 HE2 105.3506 120.3161 112.5665 H 93 PHE93 0.0618 1467 CZ 103.3121 120.8310 112.1417 C.ar 93 PHE93 -0.0617 1468 HZ 103.2196 121.5202 112.9679 H 93 PHE93 0.0618 1469 N 102.9010 115.0040 107.9910 N.am 94 THR94 -0.2434 1470 H 102.9920 114.8910 109.0010 H 94 THR94 0.1313 1471 CA 103.0920 113.8380 107.1490 C.3 94 THR94 0.1135 1472 HA 103.9367 114.0710 106.4996 H 94 THR94 0.0583 1473 C 101.8820 113.5930 106.2840 C.2 94 THR94 0.2213 1474 O 102.0230 113.4580 105.0770 O.2 94 THR94 -0.2777 1475 CB 103.4154 112.5878 107.9846 C.3 94 THR94 0.0763 1476 HB 102.5237 112.3284 108.5672 H 94 THR94 0.0611 1477 OG1 104.4860 112.8800 108.8626 O.3 94 THR94 -0.3900 1478 HG1 104.6479 112.1539 109.4571 H 94 THR94 0.2098 1479 CG2 103.8369 111.4132 107.0895 C.3 94 THR94 -0.0370 1480 HG21 103.9145 110.4932 107.6599 H 94 THR94 0.0255 1481 HG22 104.8022 111.6044 106.6194 H 94 THR94 0.0255 1482 HG23 103.1167 111.2340 106.2967 H 94 THR94 0.0255 1483 N 100.6510 113.6150 106.8490 N.am 95 SER95 -0.2435 1484 H 100.5760 113.8220 107.8450 H 95 SER95 0.1312 1485 CA 99.4270 113.3560 106.0950 C.3 95 SER95 0.1109 1486 HA 99.5712 112.3806 105.6282 H 95 SER95 0.0580 1487 C 99.2300 114.3590 104.9760 C.2 95 SER95 0.2210 1488 O 99.0770 113.9840 103.8170 O.2 95 SER95 -0.2777 1489 CB 98.1825 113.2749 106.9930 C.3 95 SER95 0.0681 1490 HB1 98.3571 112.5522 107.7935 H 95 SER95 0.0577 1491 HB2 97.3447 112.8870 106.3960 H 95 SER95 0.0577 1492 OG 97.8748 114.5409 107.5662 O.3 95 SER95 -0.3930 1493 HG 96.9750 114.5610 107.8816 H 95 SER95 0.2095 1494 N 99.3770 115.6620 105.2950 N.am 96 THR96 -0.2433 1495 H 99.5630 115.8910 106.2710 H 96 THR96 0.1313 1496 CA 99.2890 116.7680 104.3450 C.3 96 THR96 0.1135 1497 HA 98.3012 116.6992 103.8902 H 96 THR96 0.0583 1498 C 100.3000 116.6930 103.2240 C.2 96 THR96 0.2212 1499 O 99.9700 116.8320 102.0470 O.2 96 THR96 -0.2777 1500 CB 99.4106 118.1090 105.1002 C.3 96 THR96 0.0763 1501 HB 100.2516 118.0248 105.8005 H 96 THR96 0.0611 1502 OG1 98.2032 118.2992 105.8216 O.3 96 THR96 -0.3900 1503 HG1 98.2700 119.0374 106.4183 H 96 THR96 0.2098 1504 CG2 99.6585 119.3036 104.1559 C.3 96 THR96 -0.0370 1505 HG21 99.3773 120.2582 104.5922 H 96 THR96 0.0255 1506 HG22 99.0959 119.2006 103.2297 H 96 THR96 0.0255 1507 HG23 100.7124 119.3629 103.8852 H 96 THR96 0.0255 1508 N 101.5730 116.4250 103.5580 N.am 97 TYR97 -0.2453 1509 H 101.8070 116.3450 104.5480 H 97 TYR97 0.1312 1510 CA 102.6280 116.2440 102.5880 C.3 97 TYR97 0.0918 1511 HA 102.5366 117.0727 101.8891 H 97 TYR97 0.0560 1512 C 102.4780 114.9830 101.7440 C.2 97 TYR97 0.2190 1513 O 102.8080 114.9820 100.5600 O.2 97 TYR97 -0.2778 1514 CB 104.0073 116.3064 103.2766 C.3 97 TYR97 -0.0036 1515 HB1 104.7568 115.7903 102.6846 H 97 TYR97 0.0333 1516 HB2 103.9840 115.8040 104.2448 H 97 TYR97 0.0333 1517 CG 104.5470 117.7071 103.4032 C.ar 97 TYR97 -0.0453 1518 CD1 104.8883 118.4194 102.2555 C.ar 97 TYR97 -0.0561 1519 HD1 104.7093 117.9894 101.2807 H 97 TYR97 0.0621 1520 CD2 104.8172 118.2675 104.6483 C.ar 97 TYR97 -0.0561 1521 HD2 104.5878 117.7215 105.5515 H 97 TYR97 0.0621 1522 CE1 105.4828 119.6701 102.3470 C.ar 97 TYR97 -0.0317 1523 HE1 105.7499 120.2163 101.4549 H 97 TYR97 0.0643 1524 CE2 105.4166 119.5181 104.7414 C.ar 97 TYR97 -0.0317 1525 HE2 105.6323 119.9448 105.7097 H 97 TYR97 0.0643 1526 CZ 105.7553 120.2166 103.5898 C.ar 97 TYR97 0.0726 1527 OH 106.3661 121.4508 103.6735 O.3 97 TYR97 -0.3598 1528 HH 106.2197 121.8065 104.5408 H 97 TYR97 0.2173 1529 N 101.9450 113.8830 102.3110 N.am 98 ILE98 -0.2454 1530 H 101.8000 113.8860 103.3210 H 98 ILE98 0.1312 1531 CA 101.5630 112.6900 101.5670 C.3 98 ILE98 0.0903 1532 HA 102.4548 112.4242 101.0015 H 98 ILE98 0.0560 1533 C 100.4930 112.9910 100.5110 C.2 98 ILE98 0.2189 1534 O 100.6160 112.5630 99.3620 O.2 98 ILE98 -0.2778 1535 CB 101.2119 111.4613 102.4401 C.3 98 ILE98 -0.0201 1536 HB 100.3115 111.7141 103.0034 H 98 ILE98 0.0318 1537 CG1 102.3185 111.1184 103.4734 C.3 98 ILE98 -0.0514 1538 HG11 101.8625 111.1379 104.4616 H 98 ILE98 0.0266 1539 HG12 103.0873 111.8906 103.4849 H 98 ILE98 0.0266 1540 CG2 100.8726 110.2484 101.5488 C.3 98 ILE98 -0.0605 1541 HG21 100.6605 109.3636 102.1442 H 98 ILE98 0.0233 1542 HG22 101.6964 110.0051 100.8777 H 98 ILE98 0.0233 1543 HG23 99.9966 110.4333 100.9277 H 98 ILE98 0.0233 1544 CD1 103.0188 109.7561 103.3240 C.3 98 ILE98 -0.0650 1545 HD11 103.8219 109.6597 104.0554 H 98 ILE98 0.0230 1546 HD12 103.4599 109.6310 102.3357 H 98 ILE98 0.0230 1547 HD13 102.3305 108.9286 103.4982 H 98 ILE98 0.0230 1548 N 99.4490 113.7920 100.8400 N.am 99 LEU99 -0.2456 1549 H 99.3570 114.0900 101.8110 H 99 LEU99 0.1312 1550 CA 98.4490 114.2510 99.8780 C.3 99 LEU99 0.0880 1551 HA 98.0153 113.3568 99.4313 H 99 LEU99 0.0557 1552 C 99.0550 115.0640 98.7480 C.2 99 LEU99 0.2187 1553 O 98.7160 114.8790 97.5760 O.2 99 LEU99 -0.2778 1554 CB 97.3709 115.0608 100.6234 C.3 99 LEU99 -0.0266 1555 HB1 96.6701 115.4971 99.9101 H 99 LEU99 0.0287 1556 HB2 97.8452 115.9031 101.1276 H 99 LEU99 0.0287 1557 CG 96.5781 114.2367 101.6577 C.3 99 LEU99 -0.0449 1558 HG 97.2705 113.7078 102.3085 H 99 LEU99 0.0296 1559 CD1 95.7233 115.1470 102.5478 C.3 99 LEU99 -0.0626 1560 HD11 95.2070 114.5710 103.3161 H 99 LEU99 0.0232 1561 HD12 94.9664 115.6684 101.9621 H 99 LEU99 0.0232 1562 HD13 96.3338 115.8930 103.0552 H 99 LEU99 0.0232 1563 CD2 95.6921 113.1889 100.9813 C.3 99 LEU99 -0.0626 1564 HD21 95.1006 112.6398 101.7141 H 99 LEU99 0.0232 1565 HD22 96.2733 112.4575 100.4212 H 99 LEU99 0.0232 1566 HD23 95.0082 113.6827 100.2955 H 99 LEU99 0.0232 1567 N 100.0100 115.9470 99.1110 N.am 100 THR100 -0.2434 1568 H 100.1510 116.0910 100.1110 H 100 THR100 0.1313 1569 CA 100.8590 116.7150 98.2050 C.3 100 THR100 0.1135 1570 HA 100.1721 117.3053 97.6011 H 100 THR100 0.0583 1571 C 101.6440 115.8470 97.2590 C.2 100 THR100 0.2212 1572 O 101.6080 116.0430 96.0490 O.2 100 THR100 -0.2777 1573 CB 101.7964 117.6585 98.9598 C.3 100 THR100 0.0763 1574 HB 102.5658 117.0690 99.4686 H 100 THR100 0.0611 1575 OG1 100.9896 118.3181 99.9055 O.3 100 THR100 -0.3900 1576 HG1 101.5226 118.8819 100.4386 H 100 THR100 0.2098 1577 CG2 102.4598 118.6954 98.0368 C.3 100 THR100 -0.0370 1578 HG21 103.1526 119.3398 98.5786 H 100 THR100 0.0255 1579 HG22 101.7068 119.3336 97.5753 H 100 THR100 0.0255 1580 HG23 103.0244 118.2155 97.2387 H 100 THR100 0.0255 1581 N 102.3320 114.8130 97.7650 N.am 101 ALA101 -0.2458 1582 H 102.3480 114.6810 98.7760 H 101 ALA101 0.1312 1583 CA 103.0520 113.8790 96.9300 C.3 101 ALA101 0.0850 1584 HA 103.7359 114.4594 96.3126 H 101 ALA101 0.0554 1585 C 102.2080 113.0190 96.0180 C.2 101 ALA101 0.2184 1586 O 102.5760 112.7590 94.8760 O.2 101 ALA101 -0.2778 1587 CB 103.8486 112.9619 97.8517 C.3 101 ALA101 -0.0411 1588 HB1 104.3815 112.2006 97.2873 H 101 ALA101 0.0249 1589 HB2 103.1911 112.4512 98.5562 H 101 ALA101 0.0249 1590 HB3 104.5807 113.5365 98.4171 H 101 ALA101 0.0249 1591 N 101.0390 112.5640 96.4940 N.am 102 MET102 -0.2456 1592 H 100.8160 112.7130 97.4780 H 102 MET102 0.1312 1593 CA 100.0850 111.8700 95.6590 C.3 102 MET102 0.0885 1594 HA 100.5804 110.9896 95.2464 H 102 MET102 0.0557 1595 C 99.5690 112.7330 94.5070 C.2 102 MET102 0.2187 1596 O 99.3960 112.2710 93.3810 O.2 102 MET102 -0.2778 1597 CB 98.9232 111.4779 96.5900 C.3 102 MET102 -0.0199 1598 HB1 98.5106 112.3769 97.0493 H 102 MET102 0.0293 1599 HB2 99.3111 110.8839 97.4175 H 102 MET102 0.0293 1600 CG 97.7821 110.7090 95.9173 C.3 102 MET102 -0.0047 1601 HG1 97.3522 111.2856 95.0987 H 102 MET102 0.0377 1602 HG2 96.9719 110.5585 96.6294 H 102 MET102 0.0377 1603 SD 98.3174 109.1059 95.2976 S.3 102 MET102 -0.1641 1604 CE 97.8109 108.1060 96.7066 C.3 102 MET102 -0.0181 1605 HE1 98.1160 108.5817 97.6378 H 102 MET102 0.0340 1606 HE2 98.2713 107.1201 96.6679 H 102 MET102 0.0340 1607 HE3 96.7261 108.0151 96.7226 H 102 MET102 0.0340 1608 N 99.3260 114.0380 94.7650 N.am 103 ALA103 -0.2459 1609 H 99.3560 114.3470 95.7370 H 103 ALA103 0.1312 1610 CA 99.0250 115.0260 93.7440 C.3 103 ALA103 0.0850 1611 HA 98.1576 114.6535 93.1977 H 103 ALA103 0.0554 1612 C 100.1700 115.2370 92.7460 C.2 103 ALA103 0.2184 1613 O 99.9350 115.2970 91.5400 O.2 103 ALA103 -0.2778 1614 CB 98.6838 116.3542 94.4332 C.3 103 ALA103 -0.0411 1615 HB1 98.2914 117.0812 93.7210 H 103 ALA103 0.0249 1616 HB2 99.5543 116.7985 94.9145 H 103 ALA103 0.0249 1617 HB3 97.9339 116.2050 95.2089 H 103 ALA103 0.0249 1618 N 101.4360 115.3030 93.2310 N.am 104 ILE104 -0.2454 1619 H 101.5500 115.3270 94.2440 H 104 ILE104 0.1312 1620 CA 102.6510 115.3420 92.4140 C.3 104 ILE104 0.0903 1621 HA 102.5247 116.1961 91.7475 H 104 ILE104 0.0560 1622 C 102.7910 114.1190 91.5040 C.2 104 ILE104 0.2189 1623 O 103.0030 114.2820 90.3030 O.2 104 ILE104 -0.2778 1624 CB 103.8817 115.5973 93.3132 C.3 104 ILE104 -0.0201 1625 HB 103.8505 114.8713 94.1242 H 104 ILE104 0.0318 1626 CG1 103.8148 117.0161 93.9210 C.3 104 ILE104 -0.0514 1627 HG11 102.8048 117.2353 94.2649 H 104 ILE104 0.0266 1628 HG12 104.0221 117.7533 93.1448 H 104 ILE104 0.0266 1629 CG2 105.2113 115.3981 92.5599 C.3 104 ILE104 -0.0605 1630 HG21 106.0695 115.6122 93.1950 H 104 ILE104 0.0233 1631 HG22 105.2706 116.0482 91.6866 H 104 ILE104 0.0233 1632 HG23 105.3281 114.3698 92.2183 H 104 ILE104 0.0233 1633 CD1 104.7676 117.2342 95.1023 C.3 104 ILE104 -0.0650 1634 HD11 104.6665 118.2466 95.4936 H 104 ILE104 0.0230 1635 HD12 105.8093 117.0989 94.8145 H 104 ILE104 0.0230 1636 HD13 104.5491 116.5441 95.9165 H 104 ILE104 0.0230 1637 N 102.6200 112.8750 92.0320 N.am 105 ASP105 -0.2451 1638 H 102.4430 112.8070 93.0340 H 105 ASP105 0.1312 1639 CA 102.6720 111.6280 91.2660 C.3 105 ASP105 0.0974 1640 HA 103.6518 111.5632 90.7923 H 105 ASP105 0.0563 1641 C 101.6080 111.6220 90.1790 C.2 105 ASP105 0.2192 1642 O 101.9020 111.3730 89.0110 O.2 105 ASP105 -0.2778 1643 CB 102.4420 110.4446 92.2332 C.3 105 ASP105 0.0576 1644 HB1 101.6432 110.6838 92.9360 H 105 ASP105 0.0394 1645 HB2 103.3342 110.2559 92.8282 H 105 ASP105 0.0394 1646 CG 102.0512 109.1500 91.4935 C.2 105 ASP105 0.1780 1647 OD1 102.9092 108.5115 90.8980 O.co2 105 ASP105 -0.6478 1648 OD2 100.8770 108.7926 91.4989 O.co2 105 ASP105 -0.6478 1649 N 100.3570 111.9860 90.5330 N.am 106 ARG106 -0.2456 1650 H 100.1670 112.2090 91.5100 H 106 ARG106 0.1312 1651 CA 99.2760 112.0700 89.5730 C.3 106 ARG106 0.0879 1652 HA 99.2845 111.1068 89.0592 H 106 ARG106 0.0557 1653 C 99.5310 113.0830 88.4740 C.2 106 ARG106 0.2187 1654 O 99.3620 112.7590 87.3080 O.2 106 ARG106 -0.2778 1655 CB 97.9239 112.2090 90.2984 C.3 106 ARG106 -0.0258 1656 HB1 97.1983 112.6558 89.6172 H 106 ARG106 0.0286 1657 HB2 98.0093 112.8962 91.1412 H 106 ARG106 0.0286 1658 CG 97.3608 110.8402 90.7471 C.3 106 ARG106 -0.0154 1659 HG1 97.3786 110.1642 89.8913 H 106 ARG106 0.0299 1660 HG2 96.3092 110.9507 91.0099 H 106 ARG106 0.0299 1661 CD 98.0972 110.1814 91.9283 C.3 106 ARG106 0.1045 1662 HD1 97.7268 110.5257 92.8941 H 106 ARG106 0.0711 1663 HD2 99.1594 110.4006 91.9160 H 106 ARG106 0.0711 1664 NE 98.0288 108.7237 91.8531 N.pl3 106 ARG106 -0.4450 1665 HE 98.8509 108.2845 91.4672 H 106 ARG106 0.3153 1666 CZ 97.0156 107.9759 92.2653 C.cat 106 ARG106 0.5062 1667 NH1 95.9991 108.5155 92.8798 N.pl3 106 ARG106 -0.4573 1668 HH11 95.2376 107.9517 93.1803 H 106 ARG106 0.3114 1669 HH12 96.0217 109.4972 93.0384 H 106 ARG106 0.3114 1670 NH2 97.0211 106.6897 92.0639 N.pl3 106 ARG106 -0.4573 1671 HH21 96.3043 106.0918 92.3987 H 106 ARG106 0.3114 1672 HH22 97.7831 106.2809 91.5474 H 106 ARG106 0.3114 1673 N 100.0130 114.3000 88.8040 N.am 107 TYR107 -0.2453 1674 H 100.0910 114.5310 89.7940 H 107 TYR107 0.1312 1675 CA 100.4280 115.3020 87.8350 C.3 107 TYR107 0.0917 1676 HA 99.5629 115.5546 87.2246 H 107 TYR107 0.0560 1677 C 101.5450 114.7880 86.9180 C.2 107 TYR107 0.2190 1678 O 101.4870 114.9240 85.7020 O.2 107 TYR107 -0.2778 1679 CB 100.8777 116.5091 88.6794 C.3 107 TYR107 -0.0036 1680 HB1 101.5072 116.1649 89.5003 H 107 TYR107 0.0333 1681 HB2 100.0074 116.9665 89.1517 H 107 TYR107 0.0333 1682 CG 101.6275 117.5671 87.9167 C.ar 107 TYR107 -0.0453 1683 CD1 100.9736 118.3684 86.9891 C.ar 107 TYR107 -0.0561 1684 HD1 99.9225 118.2136 86.7863 H 107 TYR107 0.0621 1685 CD2 102.9870 117.7630 88.1460 C.ar 107 TYR107 -0.0561 1686 HD2 103.5098 117.1334 88.8529 H 107 TYR107 0.0621 1687 CE1 101.6684 119.3623 86.3142 C.ar 107 TYR107 -0.0317 1688 HE1 101.1648 119.9580 85.5710 H 107 TYR107 0.0643 1689 CE2 103.6775 118.7678 87.4820 C.ar 107 TYR107 -0.0317 1690 HE2 104.7285 118.9181 87.6780 H 107 TYR107 0.0643 1691 CZ 103.0114 119.5820 86.5783 C.ar 107 TYR107 0.0726 1692 OH 103.6813 120.6088 85.9431 O.3 107 TYR107 -0.3598 1693 HH 104.5121 120.2686 85.6282 H 107 TYR107 0.2173 1694 N 102.5930 114.1380 87.4530 N.am 108 LEU108 -0.2456 1695 H 102.6510 114.0330 88.4660 H 108 LEU108 0.1312 1696 CA 103.6440 113.5820 86.6190 C.3 108 LEU108 0.0880 1697 HA 104.0091 114.3926 85.9884 H 108 LEU108 0.0557 1698 C 103.1950 112.4650 85.6850 C.2 108 LEU108 0.2187 1699 O 103.6130 112.3950 84.5310 O.2 108 LEU108 -0.2778 1700 CB 104.7692 113.0759 87.5379 C.3 108 LEU108 -0.0266 1701 HB1 105.5043 112.5076 86.9655 H 108 LEU108 0.0287 1702 HB2 104.3376 112.3728 88.2529 H 108 LEU108 0.0287 1703 CG 105.4968 114.1997 88.3013 C.3 108 LEU108 -0.0449 1704 HG 104.7592 114.8782 88.7278 H 108 LEU108 0.0296 1705 CD1 106.3036 113.6216 89.4703 C.3 108 LEU108 -0.0626 1706 HD11 106.7934 114.4119 90.0393 H 108 LEU108 0.0232 1707 HD12 107.0729 112.9345 89.1173 H 108 LEU108 0.0232 1708 HD13 105.6564 113.0745 90.1569 H 108 LEU108 0.0232 1709 CD2 106.4003 115.0247 87.3742 C.3 108 LEU108 -0.0626 1710 HD21 106.9220 115.8030 87.9314 H 108 LEU108 0.0232 1711 HD22 105.8274 115.5165 86.5887 H 108 LEU108 0.0232 1712 HD23 107.1523 114.3961 86.8966 H 108 LEU108 0.0232 1713 N 102.3190 111.5710 86.1790 N.am 109 ALA109 -0.2459 1714 H 102.0580 111.6640 87.1610 H 109 ALA109 0.1312 1715 CA 101.7190 110.4910 85.4310 C.3 109 ALA109 0.0850 1716 HA 102.5226 110.0096 84.8714 H 109 ALA109 0.0554 1717 C 100.6480 110.9310 84.4320 C.2 109 ALA109 0.2185 1718 O 100.3270 110.1830 83.5150 O.2 109 ALA109 -0.2778 1719 CB 101.1237 109.5010 86.4396 C.3 109 ALA109 -0.0411 1720 HB1 100.7072 108.6244 85.9427 H 109 ALA109 0.0249 1721 HB2 100.3318 109.9661 87.0285 H 109 ALA109 0.0249 1722 HB3 101.8869 109.1539 87.1371 H 109 ALA109 0.0249 1723 N 100.0730 112.1460 84.5570 N.am 110 THR110 -0.2434 1724 H 100.3050 112.7150 85.3710 H 110 THR110 0.1313 1725 CA 99.1300 112.6800 83.5730 C.3 110 THR110 0.1135 1726 HA 98.7192 111.8353 83.0193 H 110 THR110 0.0583 1727 C 99.7980 113.5740 82.5380 C.2 110 THR110 0.2212 1728 O 99.3250 113.6650 81.4060 O.2 110 THR110 -0.2777 1729 CB 97.9523 113.4056 84.2522 C.3 110 THR110 0.0763 1730 HB 97.3130 113.8083 83.4607 H 110 THR110 0.0611 1731 OG1 98.4407 114.4941 85.0152 O.3 110 THR110 -0.3900 1732 HG1 97.7431 114.8940 85.5240 H 110 THR110 0.2098 1733 CG2 97.0972 112.4290 85.0813 C.3 110 THR110 -0.0370 1734 HG21 96.2294 112.9164 85.5259 H 110 THR110 0.0255 1735 HG22 97.6663 111.9655 85.8839 H 110 THR110 0.0255 1736 HG23 96.7227 111.6215 84.4524 H 110 THR110 0.0255 1737 N 100.9210 114.2420 82.8910 N.am 111 VAL111 -0.2453 1738 H 101.3200 114.0580 83.8110 H 111 VAL111 0.1312 1739 CA 101.5960 115.2120 82.0310 C.3 111 VAL111 0.0901 1740 HA 100.8713 115.5232 81.2773 H 111 VAL111 0.0560 1741 C 102.7570 114.6490 81.2520 C.2 111 VAL111 0.2189 1742 O 102.8040 114.7350 80.0270 O.2 111 VAL111 -0.2778 1743 CB 101.9554 116.4727 82.8453 C.3 111 VAL111 -0.0227 1744 HB 102.6560 116.1896 83.6326 H 111 VAL111 0.0315 1745 CG1 102.6173 117.5549 81.9755 C.3 111 VAL111 -0.0608 1746 HG11 102.9122 118.4144 82.5776 H 111 VAL111 0.0233 1747 HG12 101.9343 117.9076 81.2024 H 111 VAL111 0.0233 1748 HG13 103.5100 117.1864 81.4743 H 111 VAL111 0.0233 1749 CG2 100.7008 117.0706 83.5060 C.3 111 VAL111 -0.0608 1750 HG21 100.9432 117.9864 84.0401 H 111 VAL111 0.0233 1751 HG22 100.2384 116.3907 84.2201 H 111 VAL111 0.0233 1752 HG23 99.9473 117.3208 82.7590 H 111 VAL111 0.0233 1753 N 103.7330 114.0380 81.9500 N.am 112 HIS112 -0.2453 1754 H 103.6490 113.9830 82.9650 H 112 HIS112 0.1312 1755 CA 104.8980 113.4560 81.3160 C.3 112 HIS112 0.0934 1756 HA 104.8730 113.6368 80.2405 H 112 HIS112 0.0561 1757 C 104.9280 111.9390 81.5540 C.2 112 HIS112 0.2217 1758 O 105.9150 111.4570 82.1100 O.2 112 HIS112 -0.2776 1759 CB 106.1630 114.0867 81.9216 C.3 112 HIS112 0.0146 1760 HB1 107.0497 113.6935 81.4281 H 112 HIS112 0.0348 1761 HB2 106.2481 113.8540 82.9842 H 112 HIS112 0.0348 1762 CG 106.1567 115.5870 81.7530 C.ar 112 HIS112 0.0551 1763 ND1 106.4042 116.2145 80.5843 N.ar 112 HIS112 -0.2469 1764 CD2 105.9641 116.5606 82.7468 C.ar 112 HIS112 0.0047 1765 HD2 105.7566 116.3675 83.7890 H 112 HIS112 0.0764 1766 CE1 106.3477 117.5296 80.8524 C.ar 112 HIS112 0.0737 1767 HE1 106.4975 118.2977 80.1066 H 112 HIS112 0.0963 1768 NE2 106.0832 117.7700 82.1507 N.ar 112 HIS112 -0.2539 1769 HE2 105.9975 118.6480 82.5749 H 112 HIS112 0.1339 1770 N 103.9330 111.1010 81.1800 N.am 113 PRO113 -0.2316 1771 CA 103.8900 109.6960 81.5760 C.3 113 PRO113 0.0907 1772 HA 103.9182 109.6507 82.6591 H 113 PRO113 0.0559 1773 C 105.0070 108.8920 80.9720 C.2 113 PRO113 0.2189 1774 O 105.4310 107.8920 81.5350 O.2 113 PRO113 -0.2778 1775 CB 102.5329 109.2240 81.0358 C.3 113 PRO113 -0.0276 1776 HB1 101.7907 109.3099 81.8265 H 113 PRO113 0.0285 1777 HB2 102.5206 108.1844 80.7052 H 113 PRO113 0.0285 1778 CG 102.1850 110.2037 79.9168 C.3 113 PRO113 -0.0379 1779 HG1 101.1120 110.2784 79.7404 H 113 PRO113 0.0278 1780 HG2 102.6565 109.8799 78.9887 H 113 PRO113 0.0278 1781 CD 102.7995 111.5259 80.3684 C.3 113 PRO113 0.0071 1782 HD1 103.1345 112.1540 79.5415 H 113 PRO113 0.0431 1783 HD2 102.1171 112.0677 81.0238 H 113 PRO113 0.0431 1784 N 105.4990 109.3060 79.7980 N.am 114 ILE114 -0.2454 1785 H 105.1040 110.1520 79.3860 H 114 ILE114 0.1312 1786 CA 106.5570 108.6290 79.0750 C.3 114 ILE114 0.0903 1787 HA 106.1926 107.6136 78.9138 H 114 ILE114 0.0560 1788 C 107.8670 108.5250 79.8420 C.2 114 ILE114 0.2190 1789 O 108.5000 107.4650 79.8750 O.2 114 ILE114 -0.2778 1790 CB 106.7574 109.3214 77.7034 C.3 114 ILE114 -0.0201 1791 HB 107.0692 110.3504 77.8925 H 114 ILE114 0.0318 1792 CG1 105.4359 109.3807 76.9038 C.3 114 ILE114 -0.0514 1793 HG11 104.6475 109.8338 77.5045 H 114 ILE114 0.0266 1794 HG12 105.0945 108.3709 76.6740 H 114 ILE114 0.0266 1795 CG2 107.8627 108.6391 76.8720 C.3 114 ILE114 -0.0605 1796 HG21 108.0289 109.1583 75.9287 H 114 ILE114 0.0233 1797 HG22 107.5987 107.6071 76.6414 H 114 ILE114 0.0233 1798 HG23 108.8211 108.6382 77.3900 H 114 ILE114 0.0233 1799 CD1 105.5315 110.1960 75.6081 C.3 114 ILE114 -0.0650 1800 HD11 104.5500 110.2951 75.1437 H 114 ILE114 0.0230 1801 HD12 106.1865 109.7244 74.8764 H 114 ILE114 0.0230 1802 HD13 105.9066 111.2012 75.8022 H 114 ILE114 0.0230 1803 N 108.3040 109.6580 80.4400 N.am 115 SER115 -0.2436 1804 H 107.7570 110.5080 80.3000 H 115 SER115 0.1312 1805 CA 109.4940 109.7520 81.2660 C.3 115 SER115 0.1109 1806 HA 110.2402 109.0736 80.8536 H 115 SER115 0.0580 1807 C 109.1580 109.2900 82.6610 C.2 115 SER115 0.2210 1808 O 109.9390 108.5700 83.2790 O.2 115 SER115 -0.2777 1809 CB 110.0474 111.1842 81.2550 C.3 115 SER115 0.0681 1810 HB1 110.2702 111.4728 80.2225 H 115 SER115 0.0577 1811 HB2 110.9893 111.2122 81.8128 H 115 SER115 0.0577 1812 OG 109.1092 112.0935 81.8112 O.3 115 SER115 -0.3930 1813 HG 109.4694 112.9771 81.8651 H 115 SER115 0.2095 1814 N 107.9430 109.6410 83.1660 N.am 116 SER116 -0.2435 1815 H 107.3300 110.2300 82.6030 H 116 SER116 0.1312 1816 CA 107.4850 109.2060 84.4820 C.3 116 SER116 0.1109 1817 HA 108.2481 109.5625 85.1711 H 116 SER116 0.0580 1818 C 107.4250 107.7170 84.6040 C.2 116 SER116 0.2210 1819 O 107.7990 107.2220 85.6490 O.2 116 SER116 -0.2777 1820 CB 106.1418 109.8373 84.9029 C.3 116 SER116 0.0681 1821 HB1 106.0313 110.8294 84.4639 H 116 SER116 0.0577 1822 HB2 106.1233 110.0041 85.9856 H 116 SER116 0.0577 1823 OG 105.0065 109.0706 84.5411 O.3 116 SER116 -0.3930 1824 HG 105.0779 108.1889 84.8934 H 116 SER116 0.2095 1825 N 107.0550 106.9160 83.6010 N.am 117 THR117 -0.2433 1826 H 106.7350 107.3430 82.7320 H 117 THR117 0.1313 1827 CA 107.0860 105.4530 83.6890 C.3 117 THR117 0.1135 1828 HA 106.4071 105.2003 84.5054 H 117 THR117 0.0583 1829 C 108.4370 104.8630 84.0540 C.2 117 THR117 0.2212 1830 O 108.5380 103.9290 84.8380 O.2 117 THR117 -0.2777 1831 CB 106.5265 104.8334 82.3919 C.3 117 THR117 0.0763 1832 HB 107.1210 105.2084 81.5527 H 117 THR117 0.0611 1833 OG1 105.1936 105.2920 82.2641 O.3 117 THR117 -0.3900 1834 HG1 104.7812 104.9737 81.4676 H 117 THR117 0.2098 1835 CG2 106.5347 103.2915 82.4010 C.3 117 THR117 -0.0370 1836 HG21 106.1173 102.8744 81.4843 H 117 THR117 0.0255 1837 HG22 105.9484 102.9074 83.2364 H 117 THR117 0.0255 1838 HG23 107.5444 102.8926 82.4938 H 117 THR117 0.0255 1839 N 109.5230 105.4240 83.4880 N.am 118 LYS118 -0.2456 1840 H 109.3730 106.1230 82.7600 H 118 LYS118 0.1312 1841 CA 110.8940 105.1000 83.8460 C.3 118 LYS118 0.0878 1842 HA 110.9600 104.0111 83.8674 H 118 LYS118 0.0557 1843 C 111.2710 105.6030 85.2190 C.2 118 LYS118 0.2187 1844 O 111.9820 104.9330 85.9610 O.2 118 LYS118 -0.2778 1845 CB 111.8708 105.6591 82.7924 C.3 118 LYS118 -0.0289 1846 HB1 112.8903 105.4867 83.1417 H 118 LYS118 0.0285 1847 HB2 111.7675 106.7430 82.7169 H 118 LYS118 0.0285 1848 CG 111.7517 105.0181 81.3956 C.3 118 LYS118 -0.0496 1849 HG1 111.6665 103.9342 81.4829 H 118 LYS118 0.0266 1850 HG2 112.6849 105.2038 80.8618 H 118 LYS118 0.0266 1851 CD 110.6005 105.5819 80.5510 C.3 118 LYS118 -0.0278 1852 HD1 110.6549 106.6702 80.5851 H 118 LYS118 0.0282 1853 HD2 109.6424 105.2990 80.9842 H 118 LYS118 0.0282 1854 CE 110.6320 105.1181 79.0881 C.3 118 LYS118 0.1103 1855 HE1 110.6315 104.0274 79.0300 H 118 LYS118 0.0559 1856 HE2 111.5438 105.4698 78.6000 H 118 LYS118 0.0559 1857 NZ 109.4832 105.6168 78.3279 N.4 118 LYS118 -0.0749 1858 HZ1 109.5708 105.3563 77.3241 H 118 LYS118 0.2742 1859 HZ2 109.4262 106.6534 78.4215 H 118 LYS118 0.2742 1860 HZ3 108.6037 105.2195 78.7167 H 118 LYS118 0.2742 1861 N 110.8310 106.8190 85.5780 N.am 119 PHE119 -0.2453 1862 H 110.3300 107.3840 84.8930 H 119 PHE119 0.1312 1863 CA 111.0440 107.3550 86.9050 C.3 119 PHE119 0.0917 1864 HA 112.0854 107.1739 87.1706 H 119 PHE119 0.0560 1865 C 110.1940 106.6920 87.9870 C.2 119 PHE119 0.2190 1866 O 110.5940 106.5930 89.1350 O.2 119 PHE119 -0.2778 1867 CB 110.7571 108.8683 86.9276 C.3 119 PHE119 -0.0036 1868 HB1 110.9826 109.2746 87.9147 H 119 PHE119 0.0333 1869 HB2 109.6912 109.0342 86.7700 H 119 PHE119 0.0333 1870 CG 111.5263 109.6828 85.9147 C.ar 119 PHE119 -0.0454 1871 CD1 112.8277 109.3562 85.5338 C.ar 119 PHE119 -0.0585 1872 HD1 113.3246 108.4917 85.9442 H 119 PHE119 0.0620 1873 CD2 110.9500 110.8377 85.3918 C.ar 119 PHE119 -0.0585 1874 HD2 109.9543 111.1311 85.6911 H 119 PHE119 0.0620 1875 CE1 113.5217 110.1493 84.6290 C.ar 119 PHE119 -0.0615 1876 HE1 114.5316 109.8919 84.3452 H 119 PHE119 0.0618 1877 CE2 111.6454 111.6382 84.4970 C.ar 119 PHE119 -0.0615 1878 HE2 111.1860 112.5351 84.1080 H 119 PHE119 0.0618 1879 CZ 112.9305 111.2910 84.1087 C.ar 119 PHE119 -0.0617 1880 HZ 113.4756 111.9188 83.4186 H 119 PHE119 0.0618 1881 N 109.0040 106.1820 87.6700 N.am 120 ARG120 -0.2456 1882 H 108.7770 106.0890 86.6800 H 120 ARG120 0.1312 1883 CA 108.0220 105.7550 88.6200 C.3 120 ARG120 0.0879 1884 HA 108.1033 106.4149 89.4871 H 120 ARG120 0.0557 1885 C 108.2750 104.3210 89.0610 C.2 120 ARG120 0.2187 1886 O 107.9200 103.3500 88.3980 O.2 120 ARG120 -0.2778 1887 CB 106.6231 105.9180 87.9981 C.3 120 ARG120 -0.0258 1888 HB1 106.4233 105.1081 87.2943 H 120 ARG120 0.0286 1889 HB2 106.5796 106.8361 87.4243 H 120 ARG120 0.0286 1890 CG 105.4831 106.0902 89.0009 C.3 120 ARG120 -0.0154 1891 HG1 105.4265 107.1433 89.2834 H 120 ARG120 0.0299 1892 HG2 105.6985 105.5699 89.9269 H 120 ARG120 0.0299 1893 CD 104.1418 105.6398 88.4072 C.3 120 ARG120 0.1045 1894 HD1 103.9673 104.5785 88.5956 H 120 ARG120 0.0711 1895 HD2 104.1022 105.8168 87.3301 H 120 ARG120 0.0711 1896 NE 103.0724 106.4341 88.9821 N.pl3 120 ARG120 -0.4450 1897 HE 103.2084 107.3528 89.3711 H 120 ARG120 0.3153 1898 CZ 101.8051 106.0853 89.1034 C.cat 120 ARG120 0.5062 1899 NH1 101.3606 104.8874 88.8490 N.pl3 120 ARG120 -0.4573 1900 HH11 100.4273 104.6813 89.1735 H 120 ARG120 0.3114 1901 HH12 101.9102 104.2035 88.3918 H 120 ARG120 0.3114 1902 NH2 100.9633 106.9712 89.5121 N.pl3 120 ARG120 -0.4573 1903 HH21 99.9946 106.7292 89.5509 H 120 ARG120 0.3114 1904 HH22 101.2873 107.8690 89.8416 H 120 ARG120 0.3114 1905 N 108.9200 104.1580 90.2300 N.am 121 LYS121 -0.2456 1906 H 109.1200 104.9830 90.7950 H 121 LYS121 0.1312 1907 CA 109.3410 102.8710 90.7200 C.3 121 LYS121 0.0880 1908 HA 108.7602 102.0889 90.2312 H 121 LYS121 0.0557 1909 C 109.0670 102.8490 92.2150 C.2 121 LYS121 0.2213 1910 O 108.9200 103.9160 92.8130 O.2 121 LYS121 -0.2776 1911 CB 110.8492 102.7391 90.4576 C.3 121 LYS121 -0.0289 1912 HB1 111.2966 101.9699 91.0883 H 121 LYS121 0.0285 1913 HB2 111.3329 103.6747 90.7448 H 121 LYS121 0.0285 1914 CG 111.1633 102.4107 88.9928 C.3 121 LYS121 -0.0496 1915 HG1 110.4608 102.9138 88.3292 H 121 LYS121 0.0266 1916 HG2 111.0241 101.3419 88.8251 H 121 LYS121 0.0266 1917 CD 112.5742 102.8440 88.5946 C.3 121 LYS121 -0.0278 1918 HD1 113.3068 102.4465 89.2984 H 121 LYS121 0.0282 1919 HD2 112.6253 103.9315 88.6740 H 121 LYS121 0.0282 1920 CE 112.9267 102.4082 87.1697 C.3 121 LYS121 0.1103 1921 HE1 112.0533 102.4818 86.5174 H 121 LYS121 0.0559 1922 HE2 113.2523 101.3658 87.1550 H 121 LYS121 0.0559 1923 NZ 113.9797 103.2462 86.6000 N.4 121 LYS121 -0.0749 1924 HZ1 114.2421 102.8958 85.6573 H 121 LYS121 0.2742 1925 HZ2 114.8141 103.2390 87.2210 H 121 LYS121 0.2742 1926 HZ3 113.6208 104.2218 86.5143 H 121 LYS121 0.2742 1927 N 109.0270 101.6990 92.8830 N.am 122 PRO122 -0.2316 1928 CA 108.8810 101.6150 94.3350 C.3 122 PRO122 0.0907 1929 HA 107.8817 101.9816 94.5762 H 122 PRO122 0.0559 1930 C 109.9180 102.4000 95.1030 C.2 122 PRO122 0.2190 1931 O 109.5810 103.0140 96.1090 O.2 122 PRO122 -0.2778 1932 CB 109.0207 100.1170 94.6381 C.3 122 PRO122 -0.0276 1933 HB1 108.3923 99.8020 95.4719 H 122 PRO122 0.0285 1934 HB2 110.0499 99.8514 94.8867 H 122 PRO122 0.0285 1935 CG 108.6514 99.4243 93.3364 C.3 122 PRO122 -0.0379 1936 HG1 107.5700 99.3009 93.3141 H 122 PRO122 0.0278 1937 HG2 109.1011 98.4357 93.2385 H 122 PRO122 0.0278 1938 CD 109.0852 100.3901 92.2321 C.3 122 PRO122 0.0071 1939 HD1 110.1134 100.2155 91.9150 H 122 PRO122 0.0431 1940 HD2 108.4004 100.3499 91.3841 H 122 PRO122 0.0431 1941 N 111.1800 102.4100 94.6190 N.am 123 SER123 -0.2436 1942 H 111.3760 101.8390 93.7970 H 123 SER123 0.1312 1943 CA 112.2810 103.1780 95.1880 C.3 123 SER123 0.1109 1944 HA 112.4035 102.8192 96.2108 H 123 SER123 0.0580 1945 C 111.9860 104.6580 95.2340 C.2 123 SER123 0.2209 1946 O 112.2080 105.3040 96.2500 O.2 123 SER123 -0.2777 1947 CB 113.5663 102.9273 94.3854 C.3 123 SER123 0.0681 1948 HB1 114.4129 103.3815 94.9154 H 123 SER123 0.0577 1949 HB2 113.4909 103.3997 93.4008 H 123 SER123 0.0577 1950 OG 113.7638 101.5294 94.2130 O.3 123 SER123 -0.3930 1951 HG 114.6279 101.3360 93.8567 H 123 SER123 0.2095 1952 N 111.4160 105.2210 94.1480 N.am 124 VAL124 -0.2453 1953 H 111.2790 104.6370 93.3230 H 124 VAL124 0.1312 1954 CA 110.9850 106.6090 94.0790 C.3 124 VAL124 0.0901 1955 HA 111.8396 107.1918 94.4247 H 124 VAL124 0.0560 1956 C 109.8920 106.9240 95.0610 C.2 124 VAL124 0.2189 1957 O 109.9790 107.9060 95.7910 O.2 124 VAL124 -0.2778 1958 CB 110.7034 107.0210 92.6228 C.3 124 VAL124 -0.0227 1959 HB 109.9635 106.3421 92.1964 H 124 VAL124 0.0315 1960 CG1 110.1421 108.4489 92.5149 C.3 124 VAL124 -0.0608 1961 HG11 109.9933 108.7320 91.4724 H 124 VAL124 0.0233 1962 HG12 110.8204 109.1743 92.9650 H 124 VAL124 0.0233 1963 HG13 109.1768 108.5407 93.0137 H 124 VAL124 0.0233 1964 CG2 112.0045 106.9069 91.8098 C.3 124 VAL124 -0.0608 1965 HG21 111.9255 107.4073 90.8477 H 124 VAL124 0.0233 1966 HG22 112.2734 105.8660 91.6299 H 124 VAL124 0.0233 1967 HG23 112.8357 107.3812 92.3326 H 124 VAL124 0.0233 1968 N 108.8700 106.0550 95.1700 N.am 125 ALA125 -0.2459 1969 H 108.8350 105.2530 94.5400 H 125 ALA125 0.1312 1970 CA 107.8210 106.2210 96.1500 C.3 125 ALA125 0.0850 1971 HA 107.3861 107.2077 95.9807 H 125 ALA125 0.0554 1972 C 108.3560 106.1960 97.5820 C.2 125 ALA125 0.2185 1973 O 108.0340 107.0760 98.3770 O.2 125 ALA125 -0.2778 1974 CB 106.7515 105.1524 95.9239 C.3 125 ALA125 -0.0411 1975 HB1 105.9709 105.1942 96.6847 H 125 ALA125 0.0249 1976 HB2 107.1882 104.1544 95.9171 H 125 ALA125 0.0249 1977 HB3 106.2695 105.3039 94.9617 H 125 ALA125 0.0249 1978 N 109.2700 105.2420 97.8970 N.am 126 THR126 -0.2434 1979 H 109.4650 104.5290 97.1940 H 126 THR126 0.1313 1980 CA 110.0000 105.1550 99.1690 C.3 126 THR126 0.1135 1981 HA 109.2418 105.0218 99.9413 H 126 THR126 0.0583 1982 C 110.7620 106.4260 99.4790 C.2 126 THR126 0.2212 1983 O 110.6570 106.9680 100.5760 O.2 126 THR126 -0.2777 1984 CB 110.9473 103.9378 99.1527 C.3 126 THR126 0.0763 1985 HB 111.6829 104.0919 98.3556 H 126 THR126 0.0611 1986 OG1 110.1733 102.7852 98.8629 O.3 126 THR126 -0.3900 1987 HG1 110.7233 102.0137 98.7715 H 126 THR126 0.2098 1988 CG2 111.6754 103.7415 100.4956 C.3 126 THR126 -0.0370 1989 HG21 112.3520 102.8873 100.4699 H 126 THR126 0.0255 1990 HG22 110.9611 103.5779 101.3027 H 126 THR126 0.0255 1991 HG23 112.2767 104.6122 100.7568 H 126 THR126 0.0255 1992 N 111.5040 106.9770 98.4940 N.am 127 LEU127 -0.2456 1993 H 111.5650 106.4830 97.6030 H 127 LEU127 0.1312 1994 CA 112.2210 108.2340 98.6310 C.3 127 LEU127 0.0880 1995 HA 112.8713 108.1226 99.4983 H 127 LEU127 0.0557 1996 C 111.3120 109.4160 98.9200 C.2 127 LEU127 0.2187 1997 O 111.5770 110.1910 99.8350 O.2 127 LEU127 -0.2778 1998 CB 113.0573 108.4824 97.3634 C.3 127 LEU127 -0.0266 1999 HB1 113.4234 109.5104 97.3422 H 127 LEU127 0.0287 2000 HB2 112.4074 108.3801 96.4940 H 127 LEU127 0.0287 2001 CG 114.2611 107.5302 97.2263 C.3 127 LEU127 -0.0449 2002 HG 113.9390 106.5154 97.4566 H 127 LEU127 0.0296 2003 CD1 114.7930 107.5254 95.7875 C.3 127 LEU127 -0.0626 2004 HD11 115.6381 106.8445 95.6846 H 127 LEU127 0.0232 2005 HD12 115.1253 108.5195 95.4873 H 127 LEU127 0.0232 2006 HD13 114.0250 107.2025 95.0854 H 127 LEU127 0.0232 2007 CD2 115.3836 107.8925 98.2091 C.3 127 LEU127 -0.0626 2008 HD21 116.2328 107.2182 98.0964 H 127 LEU127 0.0232 2009 HD22 115.0510 107.8242 99.2443 H 127 LEU127 0.0232 2010 HD23 115.7419 108.9083 98.0400 H 127 LEU127 0.0232 2011 N 110.1820 109.5440 98.1910 N.am 128 VAL128 -0.2454 2012 H 110.0230 108.8780 97.4340 H 128 VAL128 0.1312 2013 CA 109.1770 110.5730 98.4180 C.3 128 VAL128 0.0901 2014 HA 109.6904 111.5322 98.3541 H 128 VAL128 0.0560 2015 C 108.5650 110.4920 99.8100 C.2 128 VAL128 0.2189 2016 O 108.4570 111.4970 100.5110 O.2 128 VAL128 -0.2778 2017 CB 108.1339 110.4669 97.2850 C.3 128 VAL128 -0.0227 2018 HB 107.8214 109.4240 97.2116 H 128 VAL128 0.0315 2019 CG1 106.8726 111.3034 97.5335 C.3 128 VAL128 -0.0608 2020 HG11 106.2186 111.2547 96.6632 H 128 VAL128 0.0233 2021 HG12 107.1158 112.3506 97.7149 H 128 VAL128 0.0233 2022 HG13 106.3041 110.9334 98.3863 H 128 VAL128 0.0233 2023 CG2 108.7498 110.8671 95.9339 C.3 128 VAL128 -0.0608 2024 HG21 108.0482 110.6917 95.1179 H 128 VAL128 0.0233 2025 HG22 109.6559 110.3071 95.7094 H 128 VAL128 0.0233 2026 HG23 109.0124 111.9252 95.9240 H 128 VAL128 0.0233 2027 N 108.2050 109.2750 100.2730 N.am 129 ILE129 -0.2454 2028 H 108.3030 108.4770 99.6450 H 129 ILE129 0.1312 2029 CA 107.6850 109.0270 101.6130 C.3 129 ILE129 0.0903 2030 HA 106.8297 109.6897 101.7422 H 129 ILE129 0.0560 2031 C 108.6940 109.4140 102.6920 C.2 129 ILE129 0.2190 2032 O 108.3550 110.0890 103.6640 O.2 129 ILE129 -0.2778 2033 CB 107.1948 107.5594 101.6738 C.3 129 ILE129 -0.0201 2034 HB 107.9901 106.9305 101.2697 H 129 ILE129 0.0318 2035 CG1 105.9404 107.3753 100.7887 C.3 129 ILE129 -0.0514 2036 HG11 106.0733 107.8896 99.8368 H 129 ILE129 0.0266 2037 HG12 105.0815 107.8516 101.2631 H 129 ILE129 0.0266 2038 CG2 106.9117 107.0830 103.1081 C.3 129 ILE129 -0.0605 2039 HG21 106.5007 106.0746 103.1246 H 129 ILE129 0.0233 2040 HG22 106.2032 107.7420 103.6106 H 129 ILE129 0.0233 2041 HG23 107.8275 107.0505 103.6960 H 129 ILE129 0.0233 2042 CD1 105.6113 105.9097 100.4771 C.3 129 ILE129 -0.0650 2043 HD11 104.7579 105.8371 99.8021 H 129 ILE129 0.0230 2044 HD12 105.3645 105.3447 101.3752 H 129 ILE129 0.0230 2045 HD13 106.4563 105.4216 99.9919 H 129 ILE129 0.0230 2046 N 109.9810 109.0480 102.5190 N.am 130 CYS130 -0.2449 2047 H 110.2070 108.4530 101.7220 H 130 CYS130 0.1312 2048 CA 111.0660 109.4520 103.4020 C.3 130 CYS130 0.0965 2049 HA 110.7836 109.1307 104.4054 H 130 CYS130 0.0565 2050 C 111.2990 110.9560 103.4500 C.2 130 CYS130 0.2195 2051 O 111.5090 111.5160 104.5240 O.2 130 CYS130 -0.2778 2052 CB 112.3513 108.7306 102.9751 C.3 130 CYS130 0.0147 2053 HB1 113.1977 109.0841 103.5654 H 130 CYS130 0.0394 2054 HB2 112.5778 108.9592 101.9330 H 130 CYS130 0.0394 2055 SG 112.2503 106.9308 103.1643 S.3 130 CYS130 -0.1762 2056 HG 113.3461 106.3647 102.6541 H 130 CYS130 0.1017 2057 N 111.2350 111.6620 102.3000 N.am 131 LEU131 -0.2456 2058 H 111.1520 111.1500 101.4220 H 131 LEU131 0.1312 2059 CA 111.2790 113.1180 102.2490 C.3 131 LEU131 0.0880 2060 HA 112.1975 113.4181 102.7529 H 131 LEU131 0.0557 2061 C 110.1340 113.7750 102.9980 C.2 131 LEU131 0.2187 2062 O 110.3340 114.7230 103.7490 O.2 131 LEU131 -0.2778 2063 CB 111.2993 113.5685 100.7776 C.3 131 LEU131 -0.0266 2064 HB1 111.1253 114.6434 100.7051 H 131 LEU131 0.0287 2065 HB2 110.4649 113.0952 100.2585 H 131 LEU131 0.0287 2066 CG 112.6161 113.2322 100.0508 C.3 131 LEU131 -0.0449 2067 HG 112.8984 112.2061 100.2842 H 131 LEU131 0.0296 2068 CD1 112.4391 113.3183 98.5297 C.3 131 LEU131 -0.0626 2069 HD11 113.3662 113.0703 98.0126 H 131 LEU131 0.0232 2070 HD12 112.1421 114.3215 98.2231 H 131 LEU131 0.0232 2071 HD13 111.6764 112.6217 98.1832 H 131 LEU131 0.0232 2072 CD2 113.7637 114.1441 100.5072 C.3 131 LEU131 -0.0626 2073 HD21 114.6860 113.9039 99.9778 H 131 LEU131 0.0232 2074 HD22 113.9648 114.0367 101.5725 H 131 LEU131 0.0232 2075 HD23 113.5338 115.1923 100.3147 H 131 LEU131 0.0232 2076 N 108.9080 113.2590 102.8450 N.am 132 LEU132 -0.2456 2077 H 108.7890 112.5010 102.1730 H 132 LEU132 0.1312 2078 CA 107.7410 113.7100 103.5730 C.3 132 LEU132 0.0880 2079 HA 107.5988 114.7706 103.3678 H 132 LEU132 0.0557 2080 C 107.7890 113.5360 105.0700 C.2 132 LEU132 0.2187 2081 O 107.4360 114.4490 105.8090 O.2 132 LEU132 -0.2778 2082 CB 106.5467 112.8559 103.0729 C.3 132 LEU132 -0.0266 2083 HB1 105.7688 112.7800 103.8370 H 132 LEU132 0.0287 2084 HB2 106.8981 111.8335 102.9471 H 132 LEU132 0.0287 2085 CG 105.8292 113.2910 101.7802 C.3 132 LEU132 -0.0449 2086 HG 104.9659 113.8705 102.0868 H 132 LEU132 0.0296 2087 CD1 106.6483 114.1783 100.8294 C.3 132 LEU132 -0.0626 2088 HD11 106.0647 114.4353 99.9460 H 132 LEU132 0.0232 2089 HD12 107.5581 113.6901 100.4882 H 132 LEU132 0.0232 2090 HD13 106.9314 115.1177 101.3029 H 132 LEU132 0.0232 2091 CD2 105.2462 112.0709 101.0620 C.3 132 LEU132 -0.0626 2092 HD21 104.5664 112.3742 100.2747 H 132 LEU132 0.0232 2093 HD22 104.6848 111.4433 101.7514 H 132 LEU132 0.0232 2094 HD23 106.0213 111.4581 100.6109 H 132 LEU132 0.0232 2095 N 108.2540 112.3660 105.5380 N.am 133 TRP133 -0.2453 2096 H 108.4090 111.6110 104.8700 H 133 TRP133 0.1312 2097 CA 108.5490 112.1110 106.9330 C.3 133 TRP133 0.0918 2098 HA 107.6459 112.3346 107.4946 H 133 TRP133 0.0560 2099 C 109.6850 112.9550 107.4910 C.2 133 TRP133 0.2190 2100 O 109.6740 113.3570 108.6460 O.2 133 TRP133 -0.2778 2101 CB 108.9700 110.6368 107.1353 C.3 133 TRP133 -0.0021 2102 HB1 109.4759 110.5007 108.0936 H 133 TRP133 0.0334 2103 HB2 109.6845 110.3388 106.3665 H 133 TRP133 0.0334 2104 CG 107.7934 109.6826 107.1319 C.ar 133 TRP133 -0.0260 2105 CD1 107.5695 108.6633 106.2052 C.ar 133 TRP133 -0.0136 2106 HD1 108.2051 108.4519 105.3610 H 133 TRP133 0.0748 2107 CD2 106.7977 109.5107 108.1616 C.ar 133 TRP133 -0.0028 2108 NE1 106.4545 107.9730 106.5441 N.ar 133 TRP133 -0.2641 2109 HE1 106.0838 107.2190 106.0403 H 133 TRP133 0.1331 2110 CE2 105.9618 108.4429 107.7525 C.ar 133 TRP133 0.0269 2111 CE3 106.5747 110.1342 109.3600 C.ar 133 TRP133 -0.0528 2112 HE3 107.2416 110.9170 109.6913 H 133 TRP133 0.0624 2113 CZ2 104.9095 108.0567 108.5364 C.ar 133 TRP133 -0.0430 2114 HZ2 104.2681 107.2488 108.2164 H 133 TRP133 0.0633 2115 CZ3 105.5022 109.7412 110.1607 C.ar 133 TRP133 -0.0611 2116 HZ3 105.3244 110.2174 111.1123 H 133 TRP133 0.0618 2117 CH2 104.6580 108.7161 109.7389 C.ar 133 TRP133 -0.0602 2118 HH2 103.8122 108.4383 110.3460 H 133 TRP133 0.0618 2119 N 110.7320 113.2370 106.6890 N.am 134 ALA134 -0.2459 2120 H 110.8000 112.7750 105.7820 H 134 ALA134 0.1312 2121 CA 111.7610 114.1770 107.0780 C.3 134 ALA134 0.0850 2122 HA 112.1265 113.8613 108.0503 H 134 ALA134 0.0554 2123 C 111.2800 115.6180 107.1890 C.2 134 ALA134 0.2184 2124 O 111.6240 116.3310 108.1260 O.2 134 ALA134 -0.2778 2125 CB 112.9002 114.0839 106.0564 C.3 134 ALA134 -0.0411 2126 HB1 113.7349 114.7295 106.3309 H 134 ALA134 0.0249 2127 HB2 112.5661 114.3705 105.0589 H 134 ALA134 0.0249 2128 HB3 113.2787 113.0635 105.9941 H 134 ALA134 0.0249 2129 N 110.4390 116.0790 106.2400 N.am 135 LEU135 -0.2457 2130 H 110.2720 115.5030 105.4150 H 135 LEU135 0.1312 2131 CA 109.7620 117.3580 106.3420 C.3 135 LEU135 0.0880 2132 HA 110.5246 118.1197 106.5055 H 135 LEU135 0.0557 2133 C 108.7920 117.4210 107.4860 C.2 135 LEU135 0.2187 2134 O 108.6930 118.4210 108.1810 O.2 135 LEU135 -0.2778 2135 CB 108.9930 117.6115 105.0303 C.3 135 LEU135 -0.0266 2136 HB1 108.3075 118.4538 105.1421 H 135 LEU135 0.0287 2137 HB2 108.3638 116.7432 104.8275 H 135 LEU135 0.0287 2138 CG 109.8952 117.8806 103.8133 C.3 135 LEU135 -0.0449 2139 HG 110.7148 117.1623 103.8111 H 135 LEU135 0.0296 2140 CD1 109.1117 117.6850 102.5085 C.3 135 LEU135 -0.0626 2141 HD11 109.7471 117.8564 101.6395 H 135 LEU135 0.0232 2142 HD12 108.2683 118.3732 102.4490 H 135 LEU135 0.0232 2143 HD13 108.7209 116.6699 102.4342 H 135 LEU135 0.0232 2144 CD2 110.5041 119.2882 103.8690 C.3 135 LEU135 -0.0626 2145 HD21 111.1397 119.4730 103.0029 H 135 LEU135 0.0232 2146 HD22 111.1177 119.4238 104.7591 H 135 LEU135 0.0232 2147 HD23 109.7262 120.0527 103.8801 H 135 LEU135 0.0232 2148 N 108.0450 116.3680 107.7950 N.am 136 SER136 -0.2436 2149 H 108.0820 115.5260 107.2210 H 136 SER136 0.1312 2150 CA 107.1830 116.4230 108.9460 C.3 136 SER136 0.1109 2151 HA 106.5816 117.3280 108.8492 H 136 SER136 0.0580 2152 C 107.9020 116.4880 110.2880 C.2 136 SER136 0.2209 2153 O 107.2950 116.8710 111.2770 O.2 136 SER136 -0.2777 2154 CB 106.2391 115.2197 108.9431 C.3 136 SER136 0.0681 2155 HB1 105.7274 115.1582 107.9779 H 136 SER136 0.0577 2156 HB2 105.4814 115.3790 109.7152 H 136 SER136 0.0577 2157 OG 106.9448 114.0121 109.1852 O.3 136 SER136 -0.3930 2158 HG 106.3322 113.3003 109.3568 H 136 SER136 0.2095 2159 N 109.2430 116.2350 110.3360 N.am 137 PHE137 -0.2453 2160 H 109.6900 115.8660 109.4970 H 137 PHE137 0.1312 2161 CA 110.0730 116.4590 111.5080 C.3 137 PHE137 0.0917 2162 HA 109.4972 116.0956 112.3567 H 137 PHE137 0.0560 2163 C 110.2950 117.9290 111.8000 C.2 137 PHE137 0.2190 2164 O 110.9590 118.2180 112.7830 O.2 137 PHE137 -0.2778 2165 CB 111.4200 115.7096 111.4322 C.3 137 PHE137 -0.0036 2166 HB1 112.0392 115.9582 112.2942 H 137 PHE137 0.0333 2167 HB2 111.9734 116.0491 110.5572 H 137 PHE137 0.0333 2168 CG 111.3105 114.2029 111.3987 C.ar 137 PHE137 -0.0454 2169 CD1 110.3564 113.5129 112.1446 C.ar 137 PHE137 -0.0585 2170 HD1 109.6697 114.0390 112.7874 H 137 PHE137 0.0620 2171 CD2 112.2319 113.4651 110.6627 C.ar 137 PHE137 -0.0585 2172 HD2 113.0108 113.9748 110.1153 H 137 PHE137 0.0620 2173 CE1 110.2690 112.1286 112.0837 C.ar 137 PHE137 -0.0615 2174 HE1 109.5049 111.6127 112.6466 H 137 PHE137 0.0618 2175 CE2 112.1516 112.0801 110.5994 C.ar 137 PHE137 -0.0615 2176 HE2 112.8571 111.5257 109.9987 H 137 PHE137 0.0618 2177 CZ 111.1595 111.4104 111.3000 C.ar 137 PHE137 -0.0617 2178 HZ 111.0893 110.3341 111.2465 H 137 PHE137 0.0618 2179 N 109.5640 118.8490 111.0800 N.am 138 ILE138 -0.2454 2180 H 109.2670 118.5410 110.1540 H 138 ILE138 0.1312 2181 CA 109.1480 120.2130 111.4510 C.3 138 ILE138 0.0903 2182 HA 110.0527 120.8084 111.4802 H 138 ILE138 0.0560 2183 C 108.5380 120.2300 112.8510 C.2 138 ILE138 0.2190 2184 O 108.5940 121.1890 113.5810 O.2 138 ILE138 -0.2778 2185 CB 108.2349 120.8173 110.3589 C.3 138 ILE138 -0.0201 2186 HB 107.5057 120.0548 110.0805 H 138 ILE138 0.0318 2187 CG1 109.0712 121.1822 109.1150 C.3 138 ILE138 -0.0514 2188 HG11 109.7964 120.3985 108.8991 H 138 ILE138 0.0266 2189 HG12 109.6662 122.0730 109.3209 H 138 ILE138 0.0266 2190 CG2 107.4622 122.0623 110.8388 C.3 138 ILE138 -0.0605 2191 HG21 106.8210 122.4696 110.0581 H 138 ILE138 0.0233 2192 HG22 108.1404 122.8522 111.1596 H 138 ILE138 0.0233 2193 HG23 106.8130 121.8291 111.6774 H 138 ILE138 0.0233 2194 CD1 108.2171 121.4197 107.8657 C.3 138 ILE138 -0.0650 2195 HD11 108.8423 121.6271 106.9974 H 138 ILE138 0.0230 2196 HD12 107.5548 122.2679 108.0105 H 138 ILE138 0.0230 2197 HD13 107.5956 120.5563 107.6298 H 138 ILE138 0.0230 2198 N 108.0230 119.0700 113.2710 N.am 139 SER139 -0.2436 2199 H 108.0280 118.3040 112.5970 H 139 SER139 0.1312 2200 CA 107.4630 118.7770 114.5610 C.3 139 SER139 0.1109 2201 HA 106.9396 119.6639 114.9213 H 139 SER139 0.0580 2202 C 108.4990 118.3030 115.6550 C.2 139 SER139 0.2209 2203 O 108.0540 117.9110 116.6960 O.2 139 SER139 -0.2777 2204 CB 106.4942 117.6120 114.3585 C.3 139 SER139 0.0681 2205 HB1 105.7583 117.8772 113.5986 H 139 SER139 0.0577 2206 HB2 105.9385 117.3725 115.2709 H 139 SER139 0.0577 2207 OG 107.1932 116.4673 113.9030 O.3 139 SER139 -0.3930 2208 HG 107.8813 116.2470 114.5234 H 139 SER139 0.2095 2209 N 109.8260 118.4390 115.3860 N.am 140 ILE140 -0.2453 2210 H 110.1070 118.7530 114.4570 H 140 ILE140 0.1312 2211 CA 110.8590 118.1560 116.3660 C.3 140 ILE140 0.0903 2212 HA 110.5570 118.5680 117.3230 H 140 ILE140 0.0560 2213 C 112.1320 118.8550 115.9440 C.2 140 ILE140 0.2190 2214 O 113.2290 118.5710 116.4070 O.2 140 ILE140 -0.2778 2215 CB 111.1325 116.6321 116.5031 C.3 140 ILE140 -0.0201 2216 HB 112.0299 116.5222 117.1151 H 140 ILE140 0.0318 2217 CG1 111.4198 115.9580 115.1448 C.3 140 ILE140 -0.0514 2218 HG11 112.1791 116.5267 114.6080 H 140 ILE140 0.0266 2219 HG12 110.5305 115.9757 114.5163 H 140 ILE140 0.0266 2220 CG2 110.0342 115.8924 117.2849 C.3 140 ILE140 -0.0605 2221 HG21 110.3817 114.9131 117.6134 H 140 ILE140 0.0233 2222 HG22 109.1433 115.7261 116.6837 H 140 ILE140 0.0233 2223 HG23 109.7429 116.4461 118.1780 H 140 ILE140 0.0233 2224 CD1 111.9163 114.5145 115.2789 C.3 140 ILE140 -0.0650 2225 HD11 112.2098 114.1138 114.3091 H 140 ILE140 0.0230 2226 HD12 111.1423 113.8627 115.6836 H 140 ILE140 0.0230 2227 HD13 112.7850 114.4580 115.9350 H 140 ILE140 0.0230 2228 N 111.9640 119.8200 115.0270 N.am 141 THR141 -0.2434 2229 H 110.9950 120.0450 114.8020 H 141 THR141 0.1313 2230 CA 112.9670 120.5920 114.3070 C.3 141 THR141 0.1137 2231 HA 113.7699 119.9011 114.0483 H 141 THR141 0.0583 2232 C 113.5350 121.7350 115.2000 C.2 141 THR141 0.2239 2233 O 112.9950 121.8780 116.2860 O.2 141 THR141 -0.2775 2234 CB 112.2858 121.1438 113.0360 C.3 141 THR141 0.0763 2235 HB 111.5907 120.3651 112.7425 H 141 THR141 0.0611 2236 OG1 113.2196 121.2905 111.9791 O.3 141 THR141 -0.3900 2237 HG1 112.7915 121.5741 111.1766 H 141 THR141 0.2098 2238 CG2 111.4730 122.4326 113.2796 C.3 141 THR141 -0.0370 2239 HG21 110.8335 122.6713 112.4324 H 141 THR141 0.0255 2240 HG22 112.1188 123.2931 113.4521 H 141 THR141 0.0255 2241 HG23 110.8263 122.3276 114.1513 H 141 THR141 0.0255 2242 N 114.5320 122.6000 114.8980 N.am 142 PRO142 -0.2315 2243 CA 115.1490 123.6190 115.7860 C.3 142 PRO142 0.0907 2244 HA 115.9245 123.0545 116.3055 H 142 PRO142 0.0559 2245 C 114.3740 124.3320 116.8950 C.2 142 PRO142 0.2189 2246 O 114.9120 124.5570 117.9620 O.2 142 PRO142 -0.2778 2247 CB 115.8397 124.5660 114.8083 C.3 142 PRO142 -0.0276 2248 HB1 116.6809 125.0957 115.2565 H 142 PRO142 0.0285 2249 HB2 115.1321 125.3060 114.4315 H 142 PRO142 0.0285 2250 CG 116.2674 123.6344 113.6768 C.3 142 PRO142 -0.0379 2251 HG1 117.1837 123.1139 113.9583 H 142 PRO142 0.0278 2252 HG2 116.4571 124.1633 112.7426 H 142 PRO142 0.0278 2253 CD 115.1212 122.6272 113.5627 C.3 142 PRO142 0.0071 2254 HD1 114.3689 123.0322 112.8891 H 142 PRO142 0.0431 2255 HD2 115.4376 121.6273 113.2603 H 142 PRO142 0.0431 2256 N 113.1480 124.7940 116.6090 N.am 143 VAL143 -0.2454 2257 H 112.7950 124.6680 115.6610 H 143 VAL143 0.1312 2258 CA 112.3000 125.4610 117.5700 C.3 143 VAL143 0.0901 2259 HA 112.9869 125.9597 118.2547 H 143 VAL143 0.0560 2260 C 111.5120 124.4920 118.4230 C.2 143 VAL143 0.2189 2261 O 111.2440 124.7230 119.5920 O.2 143 VAL143 -0.2778 2262 CB 111.4190 126.5629 116.9753 C.3 143 VAL143 -0.0227 2263 HB 110.5623 126.0667 116.5353 H 143 VAL143 0.0315 2264 CG1 110.9229 127.5024 118.0940 C.3 143 VAL143 -0.0608 2265 HG11 110.2194 128.2486 117.7483 H 143 VAL143 0.0233 2266 HG12 111.7531 128.0459 118.5435 H 143 VAL143 0.0233 2267 HG13 110.4078 126.9563 118.8835 H 143 VAL143 0.0233 2268 CG2 112.1489 127.3591 115.8812 C.3 143 VAL143 -0.0608 2269 HG21 111.5357 128.1782 115.5105 H 143 VAL143 0.0233 2270 HG22 112.3948 126.7318 115.0242 H 143 VAL143 0.0233 2271 HG23 113.0759 127.7889 116.2615 H 143 VAL143 0.0233 2272 N 111.1320 123.3370 117.8650 N.am 144 TRP144 -0.2453 2273 H 111.3930 123.1350 116.9000 H 144 TRP144 0.1312 2274 CA 110.3620 122.3770 118.6050 C.3 144 TRP144 0.0918 2275 HA 109.5563 122.9267 119.0987 H 144 TRP144 0.0560 2276 C 111.2130 121.6940 119.6550 C.2 144 TRP144 0.2190 2277 O 112.3240 121.3200 119.3780 O.2 144 TRP144 -0.2778 2278 CB 109.7592 121.3695 117.6211 C.3 144 TRP144 -0.0021 2279 HB1 110.5331 120.7157 117.2307 H 144 TRP144 0.0334 2280 HB2 109.3365 121.8908 116.7614 H 144 TRP144 0.0334 2281 CG 108.6662 120.5697 118.3016 C.ar 144 TRP144 -0.0260 2282 CD1 108.8372 119.4754 119.1554 C.ar 144 TRP144 -0.0136 2283 HD1 109.7883 119.0384 119.4164 H 144 TRP144 0.0748 2284 CD2 107.2472 120.7980 118.2192 C.ar 144 TRP144 -0.0028 2285 NE1 107.6288 119.0530 119.5967 N.ar 144 TRP144 -0.2641 2286 HE1 107.4735 118.3067 120.2122 H 144 TRP144 0.1331 2287 CE2 106.6261 119.8402 119.0490 C.ar 144 TRP144 0.0269 2288 CE3 106.4874 121.7120 117.5455 C.ar 144 TRP144 -0.0528 2289 HE3 106.9657 122.4446 116.9215 H 144 TRP144 0.0624 2290 CZ2 105.2676 119.8373 119.1813 C.ar 144 TRP144 -0.0430 2291 HZ2 104.8135 119.1143 119.8335 H 144 TRP144 0.0633 2292 CZ3 105.1009 121.7132 117.6786 C.ar 144 TRP144 -0.0611 2293 HZ3 104.5123 122.4641 117.1714 H 144 TRP144 0.0618 2294 CH2 104.4862 120.7706 118.4999 C.ar 144 TRP144 -0.0602 2295 HH2 103.4133 120.7825 118.6241 H 144 TRP144 0.0618 2296 N 110.6720 121.4830 120.8700 N.am 145 LEU145 -0.2456 2297 H 109.7270 121.8360 121.0240 H 145 LEU145 0.1312 2298 CA 111.3070 120.8010 121.9790 C.3 145 LEU145 0.0880 2299 HA 110.5573 120.8298 122.7699 H 145 LEU145 0.0557 2300 C 112.5650 121.4720 122.5700 C.2 145 LEU145 0.2187 2301 O 112.6870 121.6460 123.6910 O.2 145 LEU145 -0.2778 2302 CB 111.5927 119.3245 121.6230 C.3 145 LEU145 -0.0266 2303 HB1 112.1637 119.2716 120.6960 H 145 LEU145 0.0287 2304 HB2 110.6441 118.8285 121.4224 H 145 LEU145 0.0287 2305 CG 112.3493 118.5142 122.6956 C.3 145 LEU145 -0.0449 2306 HG 113.3350 118.9571 122.8446 H 145 LEU145 0.0296 2307 CD1 111.6164 118.5217 124.0425 C.3 145 LEU145 -0.0626 2308 HD11 112.1185 117.8837 124.7700 H 145 LEU145 0.0232 2309 HD12 110.5995 118.1595 123.9188 H 145 LEU145 0.0232 2310 HD13 111.5604 119.5211 124.4724 H 145 LEU145 0.0232 2311 CD2 112.5772 117.0767 122.2119 C.3 145 LEU145 -0.0626 2312 HD21 113.1455 116.5016 122.9431 H 145 LEU145 0.0232 2313 HD22 113.1357 117.0632 121.2752 H 145 LEU145 0.0232 2314 HD23 111.6305 116.5623 122.0441 H 145 LEU145 0.0232 2315 N 113.4720 121.9460 121.6630 N.am 146 TYR146 -0.2453 2316 H 113.2880 121.7250 120.6840 H 146 TYR146 0.1312 2317 CA 114.6520 122.7180 121.9280 C.3 146 TYR146 0.0917 2318 HA 115.1487 122.2179 122.7605 H 146 TYR146 0.0560 2319 C 114.3910 124.1470 122.3690 C.2 146 TYR146 0.2190 2320 O 115.0980 124.6490 123.2510 O.2 146 TYR146 -0.2778 2321 CB 115.5720 122.6972 120.7003 C.3 146 TYR146 -0.0036 2322 HB1 116.5541 123.1003 120.9492 H 146 TYR146 0.0333 2323 HB2 115.1537 123.3462 119.9356 H 146 TYR146 0.0333 2324 CG 115.7415 121.3157 120.1221 C.ar 146 TYR146 -0.0453 2325 CD1 116.2262 120.2664 120.8991 C.ar 146 TYR146 -0.0561 2326 HD1 116.5052 120.4382 121.9282 H 146 TYR146 0.0621 2327 CD2 115.3857 121.0657 118.8006 C.ar 146 TYR146 -0.0561 2328 HD2 114.9883 121.8584 118.1853 H 146 TYR146 0.0621 2329 CE1 116.3263 118.9854 120.3699 C.ar 146 TYR146 -0.0317 2330 HE1 116.6824 118.1692 120.9801 H 146 TYR146 0.0643 2331 CE2 115.5023 119.7920 118.2659 C.ar 146 TYR146 -0.0317 2332 HE2 115.2272 119.6166 117.2382 H 146 TYR146 0.0643 2333 CZ 115.9584 118.7471 119.0542 C.ar 146 TYR146 0.0726 2334 OH 116.0368 117.4726 118.5331 O.3 146 TYR146 -0.3598 2335 HH 115.6045 117.4565 117.6886 H 146 TYR146 0.2173 2336 N 113.3990 124.8640 121.7860 N.am 147 ALA147 -0.2459 2337 H 112.8390 124.4280 121.0540 H 147 ALA147 0.1312 2338 CA 113.1080 126.2410 122.1740 C.3 147 ALA147 0.0850 2339 HA 114.0567 126.7773 122.1198 H 147 ALA147 0.0554 2340 C 112.6040 126.3640 123.5910 C.2 147 ALA147 0.2184 2341 O 113.0280 127.2280 124.3570 O.2 147 ALA147 -0.2778 2342 CB 112.1158 126.9016 121.2202 C.3 147 ALA147 -0.0411 2343 HB1 111.9890 127.9604 121.4487 H 147 ALA147 0.0249 2344 HB2 111.1311 126.4360 121.2687 H 147 ALA147 0.0249 2345 HB3 112.4885 126.8310 120.2034 H 147 ALA147 0.0249 2346 N 111.6780 125.4670 123.9610 N.am 148 ARG148 -0.2457 2347 H 111.2900 124.8380 123.2580 H 148 ARG148 0.1312 2348 CA 111.2170 125.3650 125.3120 C.3 148 ARG148 0.0879 2349 HA 111.9983 125.7401 125.9764 H 148 ARG148 0.0557 2350 C 110.9940 123.8950 125.6120 C.2 148 ARG148 0.2187 2351 O 110.0700 123.2630 125.1070 O.2 148 ARG148 -0.2778 2352 CB 109.9447 126.2194 125.4198 C.3 148 ARG148 -0.0258 2353 HB1 109.1106 125.7624 124.8846 H 148 ARG148 0.0286 2354 HB2 110.1398 127.1584 124.8979 H 148 ARG148 0.0286 2355 CG 109.5403 126.5536 126.8589 C.3 148 ARG148 -0.0154 2356 HG1 110.4344 126.6687 127.4724 H 148 ARG148 0.0299 2357 HG2 108.9652 125.7342 127.2914 H 148 ARG148 0.0299 2358 CD 108.7483 127.8623 126.9088 C.3 148 ARG148 0.1045 2359 HD1 107.7922 127.7797 126.3811 H 148 ARG148 0.0711 2360 HD2 109.3343 128.6601 126.4458 H 148 ARG148 0.0711 2361 NE 108.5011 128.2417 128.2976 N.pl3 148 ARG148 -0.4450 2362 HE 108.7653 127.6269 129.0343 H 148 ARG148 0.3153 2363 CZ 107.9094 129.3925 128.5998 C.cat 148 ARG148 0.5062 2364 NH1 107.6866 129.6890 129.8470 N.pl3 148 ARG148 -0.4573 2365 HH11 107.2300 130.5533 130.0359 H 148 ARG148 0.3114 2366 HH12 107.9424 129.0633 130.5764 H 148 ARG148 0.3114 2367 NH2 107.5266 130.2272 127.6855 N.pl3 148 ARG148 -0.4573 2368 HH21 107.0408 131.0786 127.8555 H 148 ARG148 0.3114 2369 HH22 107.6909 130.0517 126.7061 H 148 ARG148 0.3114 2370 N 111.8560 123.3110 126.4670 N.am 149 LEU149 -0.2456 2371 H 112.6120 123.8810 126.8480 H 149 LEU149 0.1312 2372 CA 111.7770 121.9370 126.8750 C.3 149 LEU149 0.0880 2373 HA 111.0504 121.4094 126.2542 H 149 LEU149 0.0557 2374 C 111.3280 121.9030 128.2980 C.2 149 LEU149 0.2187 2375 O 111.4030 122.8900 129.0190 O.2 149 LEU149 -0.2778 2376 CB 113.1655 121.2555 126.7838 C.3 149 LEU149 -0.0266 2377 HB1 113.4440 121.1996 125.7392 H 149 LEU149 0.0287 2378 HB2 113.0908 120.2120 127.0934 H 149 LEU149 0.0287 2379 CG 114.3363 121.9344 127.5388 C.3 149 LEU149 -0.0449 2380 HG 114.2094 123.0163 127.5113 H 149 LEU149 0.0296 2381 CD1 114.4327 121.5023 129.0122 C.3 149 LEU149 -0.0626 2382 HD11 115.3359 121.8992 129.4756 H 149 LEU149 0.0232 2383 HD12 114.4650 120.4165 129.1055 H 149 LEU149 0.0232 2384 HD13 113.5975 121.8630 129.6076 H 149 LEU149 0.0232 2385 CD2 115.6654 121.6327 126.8310 C.3 149 LEU149 -0.0626 2386 HD21 116.4997 122.1233 127.3328 H 149 LEU149 0.0232 2387 HD22 115.6501 121.9863 125.7993 H 149 LEU149 0.0232 2388 HD23 115.8679 120.5615 126.8143 H 149 LEU149 0.0232 2389 N 110.8170 120.7370 128.7030 N.am 150 ILE150 -0.2454 2390 H 110.6760 120.0210 127.9900 H 150 ILE150 0.1312 2391 CA 110.4460 120.3960 130.0520 C.3 150 ILE150 0.0906 2392 HA 109.8081 121.2080 130.3934 H 150 ILE150 0.0560 2393 C 111.6510 120.2930 130.9900 C.2 150 ILE150 0.2216 2394 O 112.4690 119.3990 130.8010 O.2 150 ILE150 -0.2776 2395 CB 109.5924 119.1243 129.9915 C.3 150 ILE150 -0.0201 2396 HB 110.2048 118.3221 129.5776 H 150 ILE150 0.0318 2397 CG1 108.3948 119.3178 129.0449 C.3 150 ILE150 -0.0514 2398 HG11 107.7365 118.4590 129.1512 H 150 ILE150 0.0266 2399 HG12 108.7502 119.3405 128.0166 H 150 ILE150 0.0266 2400 CG2 109.1395 118.6609 131.3786 C.3 150 ILE150 -0.0605 2401 HG21 108.5018 117.7787 131.3195 H 150 ILE150 0.0233 2402 HG22 108.5911 119.4400 131.9104 H 150 ILE150 0.0233 2403 HG23 110.0116 118.3909 131.9690 H 150 ILE150 0.0233 2404 CD1 107.5885 120.6014 129.2766 C.3 150 ILE150 -0.0650 2405 HD11 106.6241 120.5547 128.7711 H 150 ILE150 0.0230 2406 HD12 108.1115 121.4799 128.8993 H 150 ILE150 0.0230 2407 HD13 107.4087 120.7622 130.3365 H 150 ILE150 0.0230 2408 N 111.8390 121.1540 131.9970 N.am 151 PRO151 -0.2316 2409 CA 113.0220 121.1050 132.8450 C.3 151 PRO151 0.0907 2410 HA 113.8982 120.8655 132.2406 H 151 PRO151 0.0559 2411 C 112.8960 120.0970 133.9860 C.2 151 PRO151 0.2189 2412 O 113.9150 119.7620 134.5870 O.2 151 PRO151 -0.2778 2413 CB 113.0787 122.5385 133.3813 C.3 151 PRO151 -0.0276 2414 HB1 113.6100 123.1628 132.6623 H 151 PRO151 0.0285 2415 HB2 113.5945 122.6313 134.3379 H 151 PRO151 0.0285 2416 CG 111.6198 122.9891 133.4459 C.3 151 PRO151 -0.0379 2417 HG1 111.5063 124.0701 133.3682 H 151 PRO151 0.0278 2418 HG2 111.1920 122.6801 134.3942 H 151 PRO151 0.0278 2419 CD 110.9150 122.2399 132.3155 C.3 151 PRO151 0.0071 2420 HD1 109.9512 121.8206 132.6144 H 151 PRO151 0.0431 2421 HD2 110.8045 122.8684 131.4316 H 151 PRO151 0.0431 2422 N 111.6830 119.6190 134.3260 N.am 152 PHE152 -0.2453 2423 H 110.8870 119.8740 133.7410 H 152 PHE152 0.1312 2424 CA 111.4380 118.7640 135.4740 C.3 152 PHE152 0.0920 2425 HA 112.3530 118.2017 135.6606 H 152 PHE152 0.0560 2426 C 110.3530 117.7420 135.1200 C.2 152 PHE152 0.2217 2427 O 109.5990 117.9930 134.1990 O.2 152 PHE152 -0.2776 2428 CB 111.0687 119.5901 136.7288 C.3 152 PHE152 -0.0036 2429 HB1 111.9618 120.1204 137.0599 H 152 PHE152 0.0333 2430 HB2 110.7936 118.9362 137.5552 H 152 PHE152 0.0333 2431 CG 109.9558 120.5957 136.5378 C.ar 152 PHE152 -0.0454 2432 CD1 110.2085 121.9541 136.7124 C.ar 152 PHE152 -0.0585 2433 HD1 111.2028 122.2907 136.9649 H 152 PHE152 0.0620 2434 CD2 108.6532 120.1967 136.2404 C.ar 152 PHE152 -0.0585 2435 HD2 108.3982 119.1537 136.1391 H 152 PHE152 0.0620 2436 CE1 109.2045 122.8957 136.5234 C.ar 152 PHE152 -0.0615 2437 HE1 109.4208 123.9478 136.6307 H 152 PHE152 0.0618 2438 CE2 107.6518 121.1349 136.0342 C.ar 152 PHE152 -0.0615 2439 HE2 106.6608 120.8147 135.7425 H 152 PHE152 0.0618 2440 CZ 107.9282 122.4866 136.1671 C.ar 152 PHE152 -0.0617 2441 HZ 107.1481 123.2111 135.9843 H 152 PHE152 0.0618 2442 N 110.1530 116.6080 135.7750 N.am 153 PRO153 -0.2316 2443 CA 108.9900 115.7700 135.5060 C.3 153 PRO153 0.0907 2444 HA 108.7398 115.7794 134.4430 H 153 PRO153 0.0559 2445 C 107.7970 116.1980 136.3490 C.2 153 PRO153 0.2187 2446 O 107.8810 116.2690 137.5730 O.2 153 PRO153 -0.2778 2447 CB 109.5052 114.4012 135.9649 C.3 153 PRO153 -0.0276 2448 HB1 110.0539 113.9393 135.1435 H 153 PRO153 0.0285 2449 HB2 108.7140 113.7089 136.2559 H 153 PRO153 0.0285 2450 CG 110.4809 114.7062 137.1070 C.3 153 PRO153 -0.0379 2451 HG1 111.2462 113.9381 137.2178 H 153 PRO153 0.0278 2452 HG2 109.9343 114.7634 138.0488 H 153 PRO153 0.0278 2453 CD 111.0726 116.0805 136.7759 C.3 153 PRO153 0.0071 2454 HD1 111.0982 116.7488 137.6365 H 153 PRO153 0.0431 2455 HD2 112.0596 116.0014 136.3175 H 153 PRO153 0.0431 2456 N 106.6410 116.4880 135.7200 N.am 154 GLY154 -0.2485 2457 H 106.5650 116.3740 134.7090 H 154 GLY154 0.1309 2458 CA 105.5090 116.9610 136.4840 C.3 154 GLY154 0.0765 2459 HA1 105.8234 117.8241 137.0742 H 154 GLY154 0.0521 2460 HA2 105.1669 116.1575 137.1362 H 154 GLY154 0.0521 2461 C 104.4320 117.3520 135.5370 C.2 154 GLY154 0.2153 2462 O 104.2260 116.6770 134.5380 O.2 154 GLY154 -0.2781 2463 N 103.7020 118.4460 135.8180 N.am 155 GLY155 -0.2487 2464 H 103.9900 119.0420 136.5940 H 155 GLY155 0.1309 2465 CA 102.5220 118.8090 135.0600 C.3 155 GLY155 0.0765 2466 HA1 101.6446 118.5334 135.6435 H 155 GLY155 0.0521 2467 HA2 102.5289 118.2685 134.1225 H 155 GLY155 0.0521 2468 C 102.4750 120.2600 134.7130 C.2 155 GLY155 0.2155 2469 O 102.6300 121.1180 135.5750 O.2 155 GLY155 -0.2781 2470 N 102.1710 120.5200 133.4200 N.am 156 ALA156 -0.2462 2471 H 102.1310 119.7240 132.7840 H 156 ALA156 0.1311 2472 CA 101.8990 121.8220 132.8610 C.3 156 ALA156 0.0850 2473 HA 102.5544 122.5514 133.3415 H 156 ALA156 0.0554 2474 C 100.4680 122.1320 133.1460 C.2 156 ALA156 0.2184 2475 O 99.6720 121.2790 133.5260 O.2 156 ALA156 -0.2778 2476 CB 102.0533 121.8362 131.3272 C.3 156 ALA156 -0.0411 2477 HB1 101.5846 122.7079 130.8683 H 156 ALA156 0.0249 2478 HB2 101.6128 120.9489 130.8713 H 156 ALA156 0.0249 2479 HB3 103.0917 121.8928 131.0259 H 156 ALA156 0.0249 2480 N 100.1030 123.3980 132.9450 N.am 157 VAL157 -0.2454 2481 H 100.8060 124.0810 132.6620 H 157 VAL157 0.1312 2482 CA 98.7410 123.8220 133.1190 C.3 157 VAL157 0.0901 2483 HA 98.3877 123.4062 134.0650 H 157 VAL157 0.0560 2484 C 97.8470 123.2880 132.0060 C.2 157 VAL157 0.2187 2485 O 96.8180 122.6530 132.2250 O.2 157 VAL157 -0.2778 2486 CB 98.6958 125.3665 133.1829 C.3 157 VAL157 -0.0227 2487 HB 99.0667 125.7611 132.2356 H 157 VAL157 0.0315 2488 CG1 97.2662 125.8979 133.3815 C.3 157 VAL157 -0.0608 2489 HG11 97.2587 126.9862 133.4448 H 157 VAL157 0.0233 2490 HG12 96.8277 125.5084 134.3007 H 157 VAL157 0.0233 2491 HG13 96.6119 125.6188 132.5555 H 157 VAL157 0.0233 2492 CG2 99.6112 125.9130 134.2907 C.3 157 VAL157 -0.0608 2493 HG21 99.5577 127.0007 134.3406 H 157 VAL157 0.0233 2494 HG22 100.6561 125.6511 134.1233 H 157 VAL157 0.0233 2495 HG23 99.3224 125.5216 135.2666 H 157 VAL157 0.0233 2496 N 98.2820 123.4940 130.7520 N.am 158 GLY158 -0.2485 2497 H 99.1440 124.0220 130.6180 H 158 GLY158 0.1309 2498 CA 97.5900 123.0050 129.5880 C.3 158 GLY158 0.0765 2499 HA1 96.9083 123.7790 129.2394 H 158 GLY158 0.0521 2500 HA2 97.0271 122.1057 129.8466 H 158 GLY158 0.0521 2501 C 98.6120 122.6730 128.5570 C.2 158 GLY158 0.2156 2502 O 99.7340 123.1650 128.5980 O.2 158 GLY158 -0.2781 2503 N 98.2020 121.8460 127.5910 N.am 159 CYS159 -0.2451 2504 H 97.2250 121.5510 127.6040 H 159 CYS159 0.1312 2505 CA 99.0420 121.3370 126.5270 C.3 159 CYS159 0.0965 2506 HA 100.0624 121.6908 126.6884 H 159 CYS159 0.0565 2507 C 98.6450 121.8150 125.1800 C.2 159 CYS159 0.2192 2508 O 99.1070 121.3430 124.1460 O.2 159 CYS159 -0.2778 2509 CB 99.0322 119.8182 126.6058 C.3 159 CYS159 0.0147 2510 HB1 99.5821 119.3682 125.7783 H 159 CYS159 0.0394 2511 HB2 98.0200 119.4177 126.5787 H 159 CYS159 0.0394 2512 SG 99.8128 119.3563 128.1577 S.3 159 CYS159 -0.1762 2513 HG 100.0620 118.0489 128.1127 H 159 CYS159 0.1017 2514 N 97.8010 122.8520 125.1740 N.am 160 GLY160 -0.2484 2515 H 97.3620 123.1550 126.0440 H 160 GLY160 0.1309 2516 CA 97.5110 123.5390 123.9520 C.3 160 GLY160 0.0765 2517 HA1 96.5709 124.0701 124.0985 H 160 GLY160 0.0521 2518 HA2 97.4017 122.8228 123.1351 H 160 GLY160 0.0521 2519 C 98.6030 124.4830 123.6750 C.2 160 GLY160 0.2155 2520 O 99.7200 124.3930 124.1850 O.2 160 GLY160 -0.2781 2521 N 98.2420 125.4750 122.8770 N.am 161 ILE161 -0.2456 2522 H 97.2900 125.5150 122.5130 H 161 ILE161 0.1312 2523 CA 99.1700 126.4750 122.5300 C.3 161 ILE161 0.0903 2524 HA 100.1652 126.2203 122.9003 H 161 ILE161 0.0560 2525 C 98.7790 127.8290 123.2060 C.2 161 ILE161 0.2189 2526 O 97.6630 127.9640 123.6860 O.2 161 ILE161 -0.2778 2527 CB 99.2550 126.5305 120.9935 C.3 161 ILE161 -0.0201 2528 HB 98.3337 126.9861 120.6379 H 161 ILE161 0.0318 2529 CG1 99.3321 125.1386 120.3217 C.3 161 ILE161 -0.0514 2530 HG11 99.4105 125.2653 119.2416 H 161 ILE161 0.0266 2531 HG12 98.4063 124.5855 120.4783 H 161 ILE161 0.0266 2532 CG2 100.4267 127.4102 120.5498 C.3 161 ILE161 -0.0605 2533 HG21 100.6175 127.3515 119.4786 H 161 ILE161 0.0233 2534 HG22 101.3539 127.1404 121.0565 H 161 ILE161 0.0233 2535 HG23 100.2004 128.4413 120.7907 H 161 ILE161 0.0233 2536 CD1 100.5134 124.2749 120.7773 C.3 161 ILE161 -0.0650 2537 HD11 100.5378 123.3328 120.2299 H 161 ILE161 0.0230 2538 HD12 100.4783 124.0314 121.8353 H 161 ILE161 0.0230 2539 HD13 101.4566 124.7821 120.5964 H 161 ILE161 0.0230 2540 N 99.7120 128.8240 123.3420 N.am 162 ARG162 -0.2456 2541 H 100.6610 128.5540 123.0840 H 162 ARG162 0.1312 2542 CA 99.5720 130.2270 123.8020 C.3 162 ARG162 0.0879 2543 HA 100.4712 130.7394 123.4668 H 162 ARG162 0.0557 2544 C 99.4300 130.5160 125.2970 C.2 162 ARG162 0.2187 2545 O 99.3690 131.6440 125.7410 O.2 162 ARG162 -0.2778 2546 CB 98.3144 130.8965 123.2163 C.3 162 ARG162 -0.0258 2547 HB1 98.2129 131.9217 123.5808 H 162 ARG162 0.0286 2548 HB2 97.4373 130.3789 123.6070 H 162 ARG162 0.0286 2549 CG 98.2334 130.9840 121.6967 C.3 162 ARG162 -0.0154 2550 HG1 98.7991 130.1914 121.2069 H 162 ARG162 0.0299 2551 HG2 98.6746 131.9242 121.3668 H 162 ARG162 0.0299 2552 CD 96.7701 130.9258 121.2711 C.3 162 ARG162 0.1045 2553 HD1 96.6550 131.3683 120.2900 H 162 ARG162 0.0711 2554 HD2 96.1207 131.4835 121.9502 H 162 ARG162 0.0711 2555 NE 96.3583 129.5193 121.2868 N.pl3 162 ARG162 -0.4450 2556 HE 96.5597 128.9957 122.1153 H 162 ARG162 0.3153 2557 CZ 95.7803 128.8978 120.2677 C.cat 162 ARG162 0.5062 2558 NH1 95.6015 127.6082 120.3203 N.pl3 162 ARG162 -0.4573 2559 HH11 95.1896 127.1414 119.5410 H 162 ARG162 0.3114 2560 HH12 95.8830 127.1033 121.1304 H 162 ARG162 0.3114 2561 NH2 95.3973 129.5467 119.2071 N.pl3 162 ARG162 -0.4573 2562 HH21 95.0827 129.0639 118.3918 H 162 ARG162 0.3114 2563 HH22 95.4247 130.5455 119.2254 H 162 ARG162 0.3114 2564 N 99.3440 129.4300 126.0700 N.am 163 LEU163 -0.2456 2565 H 99.0600 128.5740 125.5940 H 163 LEU163 0.1312 2566 CA 99.5960 129.2990 127.4800 C.3 163 LEU163 0.0883 2567 HA 98.8156 129.8835 127.9660 H 163 LEU163 0.0557 2568 C 100.9400 129.8960 127.9550 C.2 163 LEU163 0.2214 2569 O 101.5960 130.5620 127.1730 O.2 163 LEU163 -0.2776 2570 CB 99.3979 127.7938 127.7927 C.3 163 LEU163 -0.0266 2571 HB1 99.4886 127.5763 128.8511 H 163 LEU163 0.0287 2572 HB2 100.1870 127.2192 127.3188 H 163 LEU163 0.0287 2573 CG 98.0457 127.2082 127.3324 C.3 163 LEU163 -0.0449 2574 HG 97.8906 127.3885 126.2695 H 163 LEU163 0.0296 2575 CD1 98.0586 125.6895 127.5063 C.3 163 LEU163 -0.0626 2576 HD11 97.1080 125.2427 127.2148 H 163 LEU163 0.0232 2577 HD12 98.2524 125.4397 128.5481 H 163 LEU163 0.0232 2578 HD13 98.8411 125.2295 126.9008 H 163 LEU163 0.0232 2579 CD2 96.8681 127.8286 128.0956 C.3 163 LEU163 -0.0626 2580 HD21 95.9243 127.3732 127.7946 H 163 LEU163 0.0232 2581 HD22 96.7873 128.8982 127.9037 H 163 LEU163 0.0232 2582 HD23 96.9773 127.6872 129.1714 H 163 LEU163 0.0232 2583 N 101.4080 129.7480 129.1900 N.am 164 PRO164 -0.2316 2584 CA 102.7260 130.2990 129.5790 C.3 164 PRO164 0.0907 2585 HA 102.7842 131.3197 129.1958 H 164 PRO164 0.0559 2586 C 104.0050 129.5430 129.1780 C.2 164 PRO164 0.2189 2587 O 105.0530 130.1640 129.0910 O.2 164 PRO164 -0.2778 2588 CB 102.6413 130.3123 131.1216 C.3 164 PRO164 -0.0276 2589 HB1 102.9425 131.2749 131.5355 H 164 PRO164 0.0285 2590 HB2 103.2904 129.5591 131.5737 H 164 PRO164 0.0285 2591 CG 101.1960 129.9672 131.4813 C.3 164 PRO164 -0.0379 2592 HG1 100.6175 130.8876 131.5690 H 164 PRO164 0.0278 2593 HG2 101.1117 129.4307 132.4267 H 164 PRO164 0.0278 2594 CD 100.6746 129.1584 130.2990 C.3 164 PRO164 0.0071 2595 HD1 100.9604 128.1073 130.3634 H 164 PRO164 0.0431 2596 HD2 99.5978 129.2782 130.1701 H 164 PRO164 0.0431 2597 N 103.9400 128.1900 129.0760 N.am 165 ASN165 -0.2452 2598 H 103.0650 127.7510 129.3610 H 165 ASN165 0.1312 2599 CA 105.0060 127.2920 128.5950 C.3 165 ASN165 0.0959 2600 HA 105.9162 127.8733 128.6023 H 165 ASN165 0.0562 2601 C 104.9700 126.6640 127.1600 C.2 165 ASN165 0.2218 2602 O 105.9050 125.9100 126.8920 O.2 165 ASN165 -0.2776 2603 CB 105.1551 126.1197 129.5958 C.3 165 ASN165 0.0446 2604 HB1 105.8335 125.3494 129.2259 H 165 ASN165 0.0375 2605 HB2 104.1939 125.6313 129.7570 H 165 ASN165 0.0375 2606 CG 105.7226 126.5552 130.9542 C.2 165 ASN165 0.2000 2607 OD1 106.0831 127.7055 131.1773 O.2 165 ASN165 -0.2797 2608 ND2 105.7829 125.5517 131.8441 N.am 165 ASN165 -0.2723 2609 HD21 106.1101 125.7058 132.7747 H 165 ASN165 0.1266 2610 HD22 105.5159 124.6100 131.6155 H 165 ASN165 0.1266 2611 N 103.9980 126.8380 126.2420 N.am 166 PRO166 -0.2316 2612 CA 104.0080 126.3030 124.8780 C.3 166 PRO166 0.0907 2613 HA 104.3547 125.2695 124.9148 H 166 PRO166 0.0559 2614 C 104.8950 127.0700 123.9440 C.2 166 PRO166 0.2189 2615 O 105.4840 128.0580 124.3390 O.2 166 PRO166 -0.2778 2616 CB 102.5428 126.3809 124.4535 C.3 166 PRO166 -0.0276 2617 HB1 102.0226 125.4910 124.8084 H 166 PRO166 0.0285 2618 HB2 102.3868 126.4381 123.3749 H 166 PRO166 0.0285 2619 CG 102.0179 127.5969 125.1959 C.3 166 PRO166 -0.0379 2620 HG1 100.9450 127.5314 125.3465 H 166 PRO166 0.0278 2621 HG2 102.2245 128.4956 124.6130 H 166 PRO166 0.0278 2622 CD 102.8167 127.6452 126.5028 C.3 166 PRO166 0.0071 2623 HD1 103.1401 128.6626 126.7194 H 166 PRO166 0.0431 2624 HD2 102.2929 127.1934 127.3432 H 166 PRO166 0.0431 2625 N 104.9140 126.6620 122.6610 N.am 167 ASP167 -0.2451 2626 H 104.2550 125.9360 122.3810 H 167 ASP167 0.1312 2627 CA 105.8100 127.1880 121.6540 C.3 167 ASP167 0.0974 2628 HA 106.7805 127.2901 122.1408 H 167 ASP167 0.0563 2629 C 105.4920 128.5610 121.0260 C.2 167 ASP167 0.2193 2630 O 106.2860 129.1220 120.2730 O.2 167 ASP167 -0.2778 2631 CB 105.9417 126.1415 120.5297 C.3 167 ASP167 0.0576 2632 HB1 106.2099 125.1735 120.9489 H 167 ASP167 0.0394 2633 HB2 106.7474 126.4195 119.8499 H 167 ASP167 0.0394 2634 CG 104.6566 125.9442 119.7005 C.2 167 ASP167 0.1780 2635 OD1 103.5619 125.9576 120.2587 O.co2 167 ASP167 -0.6478 2636 OD2 104.7618 125.7748 118.4907 O.co2 167 ASP167 -0.6478 2637 N 104.3080 129.1440 121.3100 N.am 168 THR168 -0.2434 2638 H 103.6650 128.6240 121.9080 H 168 THR168 0.1313 2639 CA 103.8620 130.4630 120.8340 C.3 168 THR168 0.1135 2640 HA 103.9789 130.4198 119.7505 H 168 THR168 0.0583 2641 C 104.6810 131.6280 121.2640 C.2 168 THR168 0.2212 2642 O 104.5370 132.7110 120.7200 O.2 168 THR168 -0.2777 2643 CB 102.3629 130.6755 121.2068 C.3 168 THR168 0.0763 2644 HB 102.1750 130.0755 122.0981 H 168 THR168 0.0611 2645 OG1 101.4943 130.1798 120.2097 O.3 168 THR168 -0.3900 2646 HG1 101.5839 130.7014 119.4192 H 168 THR168 0.2098 2647 CG2 101.9077 132.1151 121.5407 C.3 168 THR168 -0.0370 2648 HG21 100.8423 132.1461 121.7548 H 168 THR168 0.0255 2649 HG22 102.0851 132.8075 120.7173 H 168 THR168 0.0255 2650 HG23 102.4206 132.5006 122.4221 H 168 THR168 0.0255 2651 N 105.6560 131.3980 122.1680 N.am 169 ASP169 -0.2450 2652 H 105.7790 130.4410 122.5000 H 169 ASP169 0.1312 2653 CA 106.5340 132.4060 122.6970 C.3 169 ASP169 0.0974 2654 HA 105.9637 133.0381 123.3783 H 169 ASP169 0.0563 2655 C 107.1660 133.2610 121.5970 C.2 169 ASP169 0.2192 2656 O 107.2960 134.4810 121.7100 O.2 169 ASP169 -0.2778 2657 CB 107.7585 131.7558 123.3807 C.3 169 ASP169 0.0576 2658 HB1 108.5491 132.4887 123.5468 H 169 ASP169 0.0394 2659 HB2 108.1822 130.9874 122.7322 H 169 ASP169 0.0394 2660 CG 107.5116 131.1422 124.7570 C.2 169 ASP169 0.1780 2661 OD1 106.8624 131.7628 125.5952 O.co2 169 ASP169 -0.6478 2662 OD2 107.9944 130.0398 124.9986 O.co2 169 ASP169 -0.6478 2663 N 107.4950 132.6190 120.4530 N.am 170 LEU170 -0.2456 2664 H 107.3960 131.6040 120.4180 H 170 LEU170 0.1312 2665 CA 107.9810 133.3070 119.2780 C.3 170 LEU170 0.0880 2666 HA 108.0326 134.3763 119.4853 H 170 LEU170 0.0557 2667 C 107.1100 133.1240 118.0440 C.2 170 LEU170 0.2187 2668 O 106.7780 132.0170 117.6260 O.2 170 LEU170 -0.2778 2669 CB 109.3888 132.7681 118.9553 C.3 170 LEU170 -0.0266 2670 HB1 109.7789 133.2619 118.0639 H 170 LEU170 0.0287 2671 HB2 109.3079 131.7090 118.7030 H 170 LEU170 0.0287 2672 CG 110.4137 132.9190 120.0959 C.3 170 LEU170 -0.0449 2673 HG 110.0234 132.4303 120.9899 H 170 LEU170 0.0296 2674 CD1 111.7236 132.2066 119.7349 C.3 170 LEU170 -0.0626 2675 HD11 112.4437 132.2741 120.5508 H 170 LEU170 0.0232 2676 HD12 112.1805 132.6455 118.8476 H 170 LEU170 0.0232 2677 HD13 111.5516 131.1484 119.5350 H 170 LEU170 0.0232 2678 CD2 110.6795 134.3909 120.4401 C.3 170 LEU170 -0.0626 2679 HD21 111.4318 134.4770 121.2244 H 170 LEU170 0.0232 2680 HD22 109.7796 134.8857 120.8041 H 170 LEU170 0.0232 2681 HD23 111.0388 134.9417 119.5708 H 170 LEU170 0.0232 2682 N 106.7770 134.2430 117.3550 N.am 171 TYR171 -0.2453 2683 H 107.1290 135.1420 117.6840 H 171 TYR171 0.1312 2684 CA 105.9390 134.2170 116.1660 C.3 171 TYR171 0.0917 2685 HA 105.1031 133.5540 116.4007 H 171 TYR171 0.0560 2686 C 106.6210 133.6370 114.9240 C.2 171 TYR171 0.2190 2687 O 105.9570 133.1660 114.0030 O.2 171 TYR171 -0.2778 2688 CB 105.3776 135.6239 115.8933 C.3 171 TYR171 -0.0036 2689 HB1 104.8129 135.9651 116.7621 H 171 TYR171 0.0333 2690 HB2 104.6630 135.5892 115.0693 H 171 TYR171 0.0333 2691 CG 106.4520 136.6342 115.5764 C.ar 171 TYR171 -0.0453 2692 CD1 107.0436 137.3848 116.5890 C.ar 171 TYR171 -0.0561 2693 HD1 106.7249 137.2576 117.6139 H 171 TYR171 0.0621 2694 CD2 106.8709 136.8272 114.2633 C.ar 171 TYR171 -0.0561 2695 HD2 106.4178 136.2554 113.4677 H 171 TYR171 0.0621 2696 CE1 108.0530 138.2928 116.2959 C.ar 171 TYR171 -0.0317 2697 HE1 108.5144 138.8685 117.0846 H 171 TYR171 0.0643 2698 CE2 107.8792 137.7348 113.9673 C.ar 171 TYR171 -0.0317 2699 HE2 108.2027 137.8711 112.9464 H 171 TYR171 0.0643 2700 CZ 108.4738 138.4649 114.9858 C.ar 171 TYR171 0.0726 2701 OH 109.4823 139.3613 114.7012 O.3 171 TYR171 -0.3598 2702 HH 109.6048 139.4214 113.7633 H 171 TYR171 0.2173 2703 N 107.9770 133.6550 114.8730 N.am 172 TRP172 -0.2453 2704 H 108.4800 134.0280 115.6780 H 172 TRP172 0.1312 2705 CA 108.7600 133.1760 113.7420 C.3 172 TRP172 0.0918 2706 HA 108.4193 133.7391 112.8715 H 172 TRP172 0.0560 2707 C 108.5350 131.6960 113.4590 C.2 172 TRP172 0.2190 2708 O 108.3010 131.2880 112.3230 O.2 172 TRP172 -0.2778 2709 CB 110.2557 133.4420 113.9967 C.3 172 TRP172 -0.0021 2710 HB1 110.6040 132.9061 114.8808 H 172 TRP172 0.0334 2711 HB2 110.4187 134.5032 114.1869 H 172 TRP172 0.0334 2712 CG 111.0743 133.0286 112.7872 C.ar 172 TRP172 -0.0260 2713 CD1 111.3638 133.8358 111.6836 C.ar 172 TRP172 -0.0136 2714 HD1 111.0710 134.8700 111.5729 H 172 TRP172 0.0748 2715 CD2 111.6360 131.7274 112.5016 C.ar 172 TRP172 -0.0028 2716 NE1 112.0423 133.1080 110.7632 N.ar 172 TRP172 -0.2641 2717 HE1 112.3503 133.4427 109.8950 H 172 TRP172 0.1331 2718 CE2 112.2142 131.8056 111.2130 C.ar 172 TRP172 0.0269 2719 CE3 111.6632 130.5425 113.1908 C.ar 172 TRP172 -0.0528 2720 HE3 111.2233 130.4789 114.1745 H 172 TRP172 0.0624 2721 CZ2 112.7918 130.6987 110.6523 C.ar 172 TRP172 -0.0430 2722 HZ2 113.2275 130.7640 109.6664 H 172 TRP172 0.0633 2723 CZ3 112.2412 129.4097 112.6175 C.ar 172 TRP172 -0.0611 2724 HZ3 112.2491 128.4727 113.1544 H 172 TRP172 0.0618 2725 CH2 112.8064 129.4876 111.3452 C.ar 172 TRP172 -0.0602 2726 HH2 113.2532 128.6124 110.8962 H 172 TRP172 0.0618 2727 N 108.5330 130.8680 114.5250 N.am 173 PHE173 -0.2453 2728 H 108.7720 131.2590 115.4360 H 173 PHE173 0.1312 2729 CA 108.2130 129.4610 114.4520 C.3 173 PHE173 0.0917 2730 HA 108.8509 129.0838 113.6539 H 173 PHE173 0.0560 2731 C 106.7910 129.2440 114.0120 C.2 173 PHE173 0.2191 2732 O 106.5420 128.4270 113.1340 O.2 173 PHE173 -0.2778 2733 CB 108.5224 128.7289 115.7419 C.3 173 PHE173 -0.0036 2734 HB1 107.8994 129.0924 116.5616 H 173 PHE173 0.0333 2735 HB2 109.5522 128.9562 115.9926 H 173 PHE173 0.0333 2736 CG 108.3594 127.2402 115.5673 C.ar 173 PHE173 -0.0454 2737 CD1 109.0254 126.5597 114.5457 C.ar 173 PHE173 -0.0585 2738 HD1 109.6845 127.0872 113.8734 H 173 PHE173 0.0620 2739 CD2 107.5233 126.5258 116.4168 C.ar 173 PHE173 -0.0585 2740 HD2 106.9688 127.0258 117.2003 H 173 PHE173 0.0620 2741 CE1 108.8943 125.1854 114.4066 C.ar 173 PHE173 -0.0615 2742 HE1 109.4285 124.6625 113.6278 H 173 PHE173 0.0618 2743 CE2 107.3811 125.1553 116.2708 C.ar 173 PHE173 -0.0615 2744 HE2 106.7085 124.6330 116.9367 H 173 PHE173 0.0618 2745 CZ 108.0796 124.4810 115.2775 C.ar 173 PHE173 -0.0617 2746 HZ 107.9802 123.4122 115.1699 H 173 PHE173 0.0618 2747 N 105.8430 130.0240 114.5610 N.am 174 THR174 -0.2434 2748 H 106.1110 130.7120 115.2640 H 174 THR174 0.1313 2749 CA 104.4480 129.9100 114.1770 C.3 174 THR174 0.1135 2750 HA 104.1788 128.8704 114.3753 H 174 THR174 0.0583 2751 C 104.2280 130.1370 112.6970 C.2 174 THR174 0.2212 2752 O 103.5480 129.3610 112.0270 O.2 174 THR174 -0.2777 2753 CB 103.5286 130.8341 114.9932 C.3 174 THR174 0.0763 2754 HB 103.7993 131.8627 114.7607 H 174 THR174 0.0611 2755 OG1 103.7258 130.7048 116.3860 O.3 174 THR174 -0.3900 2756 HG1 103.5751 129.8031 116.6556 H 174 THR174 0.2098 2757 CG2 102.0513 130.5930 114.6253 C.3 174 THR174 -0.0370 2758 HG21 101.3547 130.9533 115.3790 H 174 THR174 0.0255 2759 HG22 101.8689 129.5286 114.4940 H 174 THR174 0.0255 2760 HG23 101.7943 131.0744 113.6817 H 174 THR174 0.0255 2761 N 104.8570 131.1900 112.1320 N.am 175 LEU175 -0.2456 2762 H 105.3810 131.8280 112.7310 H 175 LEU175 0.1312 2763 CA 104.8160 131.4490 110.7070 C.3 175 LEU175 0.0880 2764 HA 103.7638 131.5019 110.4269 H 175 LEU175 0.0557 2765 C 105.4470 130.3510 109.8620 C.2 175 LEU175 0.2187 2766 O 104.8590 129.9070 108.8790 O.2 175 LEU175 -0.2778 2767 CB 105.5262 132.7859 110.4227 C.3 175 LEU175 -0.0266 2768 HB1 105.6097 132.9426 109.3459 H 175 LEU175 0.0287 2769 HB2 106.5492 132.7230 110.7979 H 175 LEU175 0.0287 2770 CG 104.8412 134.0181 111.0426 C.3 175 LEU175 -0.0449 2771 HG 104.6802 133.8419 112.1045 H 175 LEU175 0.0296 2772 CD1 105.7422 135.2518 110.9138 C.3 175 LEU175 -0.0626 2773 HD11 105.2788 136.1259 111.3719 H 175 LEU175 0.0232 2774 HD12 105.9383 135.4884 109.8677 H 175 LEU175 0.0232 2775 HD13 106.7021 135.0874 111.4044 H 175 LEU175 0.0232 2776 CD2 103.4697 134.2865 110.4139 C.3 175 LEU175 -0.0626 2777 HD21 103.0057 135.1734 110.8463 H 175 LEU175 0.0232 2778 HD22 102.7945 133.4519 110.5877 H 175 LEU175 0.0232 2779 HD23 103.5482 134.4397 109.3373 H 175 LEU175 0.0232 2780 N 106.6470 129.8680 110.2550 N.am 176 TYR176 -0.2453 2781 H 107.0890 130.3000 111.0670 H 176 TYR176 0.1312 2782 CA 107.3530 128.7770 109.6030 C.3 176 TYR176 0.0917 2783 HA 107.5285 129.0652 108.5659 H 176 TYR176 0.0560 2784 C 106.5620 127.4730 109.6250 C.2 176 TYR176 0.2190 2785 O 106.3440 126.8510 108.5860 O.2 176 TYR176 -0.2778 2786 CB 108.6795 128.6540 110.3856 C.3 176 TYR176 -0.0036 2787 HB1 108.4661 128.6313 111.4540 H 176 TYR176 0.0333 2788 HB2 109.2771 129.5536 110.2322 H 176 TYR176 0.0333 2789 CG 109.5206 127.4445 110.0670 C.ar 176 TYR176 -0.0453 2790 CD1 110.5469 127.5163 109.1302 C.ar 176 TYR176 -0.0561 2791 HD1 110.7171 128.4327 108.5837 H 176 TYR176 0.0621 2792 CD2 109.3394 126.2614 110.7787 C.ar 176 TYR176 -0.0561 2793 HD2 108.5614 126.1933 111.5255 H 176 TYR176 0.0621 2794 CE1 111.3771 126.4230 108.9105 C.ar 176 TYR176 -0.0317 2795 HE1 112.1741 126.4816 108.1844 H 176 TYR176 0.0643 2796 CE2 110.1534 125.1631 110.5455 C.ar 176 TYR176 -0.0317 2797 HE2 109.9946 124.2495 111.0949 H 176 TYR176 0.0643 2798 CZ 111.1764 125.2441 109.6142 C.ar 176 TYR176 0.0726 2799 OH 111.9868 124.1525 109.3833 O.3 176 TYR176 -0.3598 2800 HH 111.6198 123.3875 109.8040 H 176 TYR176 0.2173 2801 N 106.0680 127.0610 110.8090 N.am 177 GLN177 -0.2456 2802 H 106.2220 127.6510 111.6270 H 177 GLN177 0.1312 2803 CA 105.3330 125.8320 110.9840 C.3 177 GLN177 0.0882 2804 HA 105.9522 125.0670 110.5115 H 177 GLN177 0.0557 2805 C 104.0130 125.8210 110.2500 C.2 177 GLN177 0.2187 2806 O 103.6970 124.8560 109.5660 O.2 177 GLN177 -0.2778 2807 CB 105.2019 125.4776 112.4706 C.3 177 GLN177 -0.0210 2808 HB1 104.5631 126.1957 112.9881 H 177 GLN177 0.0289 2809 HB2 106.1888 125.5691 112.9276 H 177 GLN177 0.0289 2810 CG 104.6763 124.0438 112.6646 C.3 177 GLN177 0.0225 2811 HG1 105.1587 123.3608 111.9672 H 177 GLN177 0.0356 2812 HG2 103.6059 123.9990 112.4647 H 177 GLN177 0.0356 2813 CD 104.9211 123.5482 114.0922 C.2 177 GLN177 0.1981 2814 OE1 104.4602 124.1368 115.0514 O.2 177 GLN177 -0.2798 2815 NE2 105.6663 122.4387 114.1873 N.am 177 GLN177 -0.2724 2816 HE21 105.8347 122.0765 115.1034 H 177 GLN177 0.1266 2817 HE22 106.0540 121.9775 113.3925 H 177 GLN177 0.1266 2818 N 103.2280 126.9160 110.3270 N.am 178 PHE178 -0.2453 2819 H 103.5140 127.6790 110.9410 H 178 PHE178 0.1312 2820 CA 101.9940 127.0550 109.5740 C.3 178 PHE178 0.0917 2821 HA 101.3445 126.2207 109.8420 H 178 PHE178 0.0560 2822 C 102.2380 127.0130 108.0640 C.2 178 PHE178 0.2190 2823 O 101.5350 126.3220 107.3240 O.2 178 PHE178 -0.2778 2824 CB 101.3382 128.4071 109.9461 C.3 178 PHE178 -0.0036 2825 HB1 102.1068 129.1787 110.0068 H 178 PHE178 0.0333 2826 HB2 100.8920 128.3496 110.9396 H 178 PHE178 0.0333 2827 CG 100.3023 128.8704 108.9458 C.ar 178 PHE178 -0.0454 2828 CD1 100.6668 129.7327 107.9130 C.ar 178 PHE178 -0.0585 2829 HD1 101.6817 130.0985 107.8497 H 178 PHE178 0.0620 2830 CD2 98.9905 128.4132 109.0039 C.ar 178 PHE178 -0.0585 2831 HD2 98.6767 127.7846 109.8225 H 178 PHE178 0.0620 2832 CE1 99.7524 130.0992 106.9365 C.ar 178 PHE178 -0.0615 2833 HE1 100.0539 130.7564 106.1342 H 178 PHE178 0.0618 2834 CE2 98.0638 128.8071 108.0452 C.ar 178 PHE178 -0.0615 2835 HE2 97.0362 128.4878 108.1157 H 178 PHE178 0.0618 2836 CZ 98.4474 129.6354 107.0018 C.ar 178 PHE178 -0.0617 2837 HZ 97.7267 129.9364 106.2558 H 178 PHE178 0.0618 2838 N 103.2520 127.7580 107.5670 N.am 179 PHE179 -0.2453 2839 H 103.8360 128.2840 108.2170 H 179 PHE179 0.1312 2840 CA 103.5420 127.8400 106.1520 C.3 179 PHE179 0.0917 2841 HA 102.6225 128.1706 105.6759 H 179 PHE179 0.0560 2842 C 103.9340 126.4950 105.5690 C.2 179 PHE179 0.2190 2843 O 103.4240 126.0600 104.5520 O.2 179 PHE179 -0.2778 2844 CB 104.6575 128.8814 105.9535 C.3 179 PHE179 -0.0036 2845 HB1 105.5284 128.6174 106.5561 H 179 PHE179 0.0333 2846 HB2 104.3199 129.8509 106.3205 H 179 PHE179 0.0333 2847 CG 105.0741 129.0313 104.5128 C.ar 179 PHE179 -0.0454 2848 CD1 106.2493 128.4436 104.0545 C.ar 179 PHE179 -0.0585 2849 HD1 106.8744 127.8872 104.7367 H 179 PHE179 0.0620 2850 CD2 104.2858 129.7476 103.6182 C.ar 179 PHE179 -0.0585 2851 HD2 103.3746 130.2166 103.9590 H 179 PHE179 0.0620 2852 CE1 106.6240 128.5556 102.7223 C.ar 179 PHE179 -0.0615 2853 HE1 107.5329 128.0851 102.3767 H 179 PHE179 0.0618 2854 CE2 104.6510 129.8524 102.2822 C.ar 179 PHE179 -0.0615 2855 HE2 104.0250 130.3992 101.5925 H 179 PHE179 0.0618 2856 CZ 105.8204 129.2548 101.8327 C.ar 179 PHE179 -0.0617 2857 HZ 106.1046 129.3330 100.7935 H 179 PHE179 0.0618 2858 N 104.8510 125.7950 106.2440 N.am 180 LEU180 -0.2456 2859 H 105.2360 126.1740 107.1090 H 180 LEU180 0.1312 2860 CA 105.3020 124.5190 105.7690 C.3 180 LEU180 0.0880 2861 HA 105.4045 124.5802 104.6851 H 180 LEU180 0.0557 2862 C 104.3470 123.3920 106.0460 C.2 180 LEU180 0.2187 2863 O 104.4320 122.3630 105.3910 O.2 180 LEU180 -0.2778 2864 CB 106.6693 124.2131 106.3907 C.3 180 LEU180 -0.0266 2865 HB1 107.0015 123.2257 106.0669 H 180 LEU180 0.0287 2866 HB2 106.5551 124.1722 107.4752 H 180 LEU180 0.0287 2867 CG 107.7668 125.2332 106.0436 C.3 180 LEU180 -0.0449 2868 HG 107.4363 126.2272 106.3454 H 180 LEU180 0.0296 2869 CD1 109.0393 124.9223 106.8353 C.3 180 LEU180 -0.0626 2870 HD11 109.8138 125.6615 106.6326 H 180 LEU180 0.0232 2871 HD12 109.4385 123.9413 106.5778 H 180 LEU180 0.0232 2872 HD13 108.8361 124.9303 107.9057 H 180 LEU180 0.0232 2873 CD2 108.0674 125.2676 104.5393 C.3 180 LEU180 -0.0626 2874 HD21 108.8773 125.9629 104.3180 H 180 LEU180 0.0232 2875 HD22 107.2001 125.5935 103.9670 H 180 LEU180 0.0232 2876 HD23 108.3620 124.2839 104.1727 H 180 LEU180 0.0232 2877 N 103.4200 123.5250 107.0020 N.am 181 ALA181 -0.2459 2878 H 103.4060 124.3770 107.5630 H 181 ALA181 0.1312 2879 CA 102.4440 122.5020 107.2610 C.3 181 ALA181 0.0850 2880 HA 102.9000 121.5242 107.0927 H 181 ALA181 0.0554 2881 C 101.1950 122.6010 106.4210 C.2 181 ALA181 0.2184 2882 O 100.6120 121.5870 106.0540 O.2 181 ALA181 -0.2778 2883 CB 102.0309 122.6309 108.7263 C.3 181 ALA181 -0.0411 2884 HB1 101.2639 121.9036 108.9889 H 181 ALA181 0.0249 2885 HB2 101.6310 123.6235 108.9339 H 181 ALA181 0.0249 2886 HB3 102.8883 122.4760 109.3804 H 181 ALA181 0.0249 2887 N 100.7530 123.8360 106.1080 N.am 182 PHE182 -0.2453 2888 H 101.2780 124.6480 106.4330 H 182 PHE182 0.1312 2889 CA 99.5600 124.0400 105.3270 C.3 182 PHE182 0.0917 2890 HA 99.2043 123.0805 104.9480 H 182 PHE182 0.0560 2891 C 99.8260 124.8960 104.1210 C.2 182 PHE182 0.2190 2892 O 99.5240 124.4690 103.0180 O.2 182 PHE182 -0.2778 2893 CB 98.4667 124.6410 106.2188 C.3 182 PHE182 -0.0036 2894 HB1 98.8175 125.5533 106.7042 H 182 PHE182 0.0333 2895 HB2 98.2515 123.9235 107.0065 H 182 PHE182 0.0333 2896 CG 97.1907 124.9166 105.4648 C.ar 182 PHE182 -0.0454 2897 CD1 96.3161 123.8792 105.1540 C.ar 182 PHE182 -0.0585 2898 HD1 96.5340 122.8716 105.4784 H 182 PHE182 0.0620 2899 CD2 96.8965 126.2040 105.0248 C.ar 182 PHE182 -0.0585 2900 HD2 97.5714 127.0175 105.2486 H 182 PHE182 0.0620 2901 CE1 95.1784 124.1206 104.3949 C.ar 182 PHE182 -0.0615 2902 HE1 94.5159 123.3066 104.1378 H 182 PHE182 0.0618 2903 CE2 95.7626 126.4464 104.2616 C.ar 182 PHE182 -0.0615 2904 HE2 95.5557 127.4436 103.9017 H 182 PHE182 0.0618 2905 CZ 94.9090 125.4020 103.9371 C.ar 182 PHE182 -0.0617 2906 HZ 94.0440 125.5843 103.3172 H 182 PHE182 0.0618 2907 N 100.3620 126.1230 104.2460 N.am 183 ALA183 -0.2459 2908 H 100.7950 126.4090 105.1240 H 183 ALA183 0.1312 2909 CA 100.3180 127.0370 103.1190 C.3 183 ALA183 0.0850 2910 HA 99.2718 127.0813 102.8098 H 183 ALA183 0.0554 2911 C 101.1310 126.6230 101.8950 C.2 183 ALA183 0.2184 2912 O 100.6150 126.6210 100.7840 O.2 183 ALA183 -0.2778 2913 CB 100.7427 128.4342 103.5711 C.3 183 ALA183 -0.0411 2914 HB1 100.5225 129.1799 102.8065 H 183 ALA183 0.0249 2915 HB2 101.8110 128.4719 103.7647 H 183 ALA183 0.0249 2916 HB3 100.2191 128.7253 104.4804 H 183 ALA183 0.0249 2917 N 102.3970 126.2030 102.0800 N.am 184 LEU184 -0.2456 2918 H 102.7990 126.2960 103.0130 H 184 LEU184 0.1312 2919 CA 103.2260 125.6280 101.0400 C.3 184 LEU184 0.0883 2920 HA 103.2598 126.3673 100.2420 H 184 LEU184 0.0557 2921 C 102.6590 124.3350 100.4760 C.2 184 LEU184 0.2214 2922 O 102.5120 124.2730 99.2590 O.2 184 LEU184 -0.2776 2923 CB 104.6471 125.4286 101.5967 C.3 184 LEU184 -0.0266 2924 HB1 104.6067 124.8179 102.4968 H 184 LEU184 0.0287 2925 HB2 105.0277 126.3934 101.9270 H 184 LEU184 0.0287 2926 CG 105.6468 124.8008 100.6064 C.3 184 LEU184 -0.0449 2927 HG 105.2705 123.8236 100.3014 H 184 LEU184 0.0296 2928 CD1 105.8161 125.6568 99.3437 C.3 184 LEU184 -0.0626 2929 HD11 106.5536 125.2181 98.6714 H 184 LEU184 0.0232 2930 HD12 106.1489 126.6646 99.5936 H 184 LEU184 0.0232 2931 HD13 104.8821 125.7386 98.7877 H 184 LEU184 0.0232 2932 CD2 106.9999 124.5634 101.2863 C.3 184 LEU184 -0.0626 2933 HD21 107.7005 124.0765 100.6077 H 184 LEU184 0.0232 2934 HD22 106.8896 123.9216 102.1612 H 184 LEU184 0.0232 2935 HD23 107.4478 125.5030 101.6103 H 184 LEU184 0.0232 2936 N 102.2430 123.3080 101.2210 N.am 185 PRO185 -0.2316 2937 CA 101.5960 122.1570 100.6200 C.3 185 PRO185 0.0907 2938 HA 102.2659 121.7508 99.8608 H 185 PRO185 0.0559 2939 C 100.2650 122.5070 99.9580 C.2 185 PRO185 0.2189 2940 O 100.0230 121.9830 98.8830 O.2 185 PRO185 -0.2778 2941 CB 101.4644 121.1881 101.8063 C.3 185 PRO185 -0.0276 2942 HB1 102.3353 120.5343 101.8318 H 185 PRO185 0.0285 2943 HB2 100.5486 120.5961 101.7955 H 185 PRO185 0.0285 2944 CG 101.5654 122.0229 103.0660 C.3 185 PRO185 -0.0379 2945 HG1 101.9815 121.4640 103.9039 H 185 PRO185 0.0278 2946 HG2 100.5692 122.3501 103.3449 H 185 PRO185 0.0278 2947 CD 102.4439 123.1986 102.6682 C.3 185 PRO185 0.0071 2948 HD1 102.1769 124.1028 103.2024 H 185 PRO185 0.0431 2949 HD2 103.4973 122.9669 102.8307 H 185 PRO185 0.0431 2950 N 99.4250 123.4100 100.5210 N.am 186 PHE186 -0.2453 2951 H 99.7010 123.8110 101.4170 H 186 PHE186 0.1312 2952 CA 98.1570 123.8560 99.9500 C.3 186 PHE186 0.0917 2953 HA 97.5536 122.9550 99.8377 H 186 PHE186 0.0560 2954 C 98.3320 124.4720 98.5760 C.2 186 PHE186 0.2190 2955 O 97.6670 124.0720 97.6260 O.2 186 PHE186 -0.2778 2956 CB 97.4830 124.8493 100.9145 C.3 186 PHE186 -0.0036 2957 HB1 98.1602 125.6824 101.1050 H 186 PHE186 0.0333 2958 HB2 97.3135 124.3748 101.8800 H 186 PHE186 0.0333 2959 CG 96.1618 125.3865 100.4174 C.ar 186 PHE186 -0.0454 2960 CD1 95.8991 126.7523 100.4737 C.ar 186 PHE186 -0.0585 2961 HD1 96.6443 127.4289 100.8661 H 186 PHE186 0.0620 2962 CD2 95.1819 124.5361 99.9090 C.ar 186 PHE186 -0.0585 2963 HD2 95.3586 123.4733 99.8437 H 186 PHE186 0.0620 2964 CE1 94.6849 127.2593 100.0289 C.ar 186 PHE186 -0.0615 2965 HE1 94.4942 128.3213 100.0756 H 186 PHE186 0.0618 2966 CE2 93.9679 125.0396 99.4621 C.ar 186 PHE186 -0.0615 2967 HE2 93.2216 124.3686 99.0621 H 186 PHE186 0.0618 2968 CZ 93.7179 126.4027 99.5219 C.ar 186 PHE186 -0.0617 2969 HZ 92.7743 126.7950 99.1718 H 186 PHE186 0.0618 2970 N 99.2690 125.4260 98.4160 N.am 187 VAL187 -0.2454 2971 H 99.8200 125.7160 99.2240 H 187 VAL187 0.1312 2972 CA 99.5230 126.0580 97.1280 C.3 187 VAL187 0.0901 2973 HA 98.5414 126.3662 96.7644 H 187 VAL187 0.0560 2974 C 100.0570 125.0750 96.0930 C.2 187 VAL187 0.2189 2975 O 99.6550 125.1100 94.9300 O.2 187 VAL187 -0.2778 2976 CB 100.3914 127.3277 97.2421 C.3 187 VAL187 -0.0227 2977 HB 100.4794 127.7552 96.2421 H 187 VAL187 0.0315 2978 CG1 99.7043 128.3938 98.1085 C.3 187 VAL187 -0.0608 2979 HG11 100.2959 129.3086 98.1461 H 187 VAL187 0.0233 2980 HG12 99.5573 128.0535 99.1320 H 187 VAL187 0.0233 2981 HG13 98.7246 128.6513 97.7057 H 187 VAL187 0.0233 2982 CG2 101.8169 127.0465 97.7310 C.3 187 VAL187 -0.0608 2983 HG21 102.3874 127.9688 97.8391 H 187 VAL187 0.0233 2984 HG22 102.3630 126.4034 97.0417 H 187 VAL187 0.0233 2985 HG23 101.7958 126.5547 98.6964 H 187 VAL187 0.0233 2986 N 100.9430 124.1410 96.5180 N.am 188 VAL188 -0.2454 2987 H 101.2600 124.2020 97.4850 H 188 VAL188 0.1312 2988 CA 101.4790 123.0570 95.7040 C.3 188 VAL188 0.0901 2989 HA 101.8861 123.5286 94.8090 H 188 VAL188 0.0560 2990 C 100.3840 122.1050 95.2350 C.2 188 VAL188 0.2189 2991 O 100.3000 121.7850 94.0490 O.2 188 VAL188 -0.2778 2992 CB 102.6185 122.3355 96.4576 C.3 188 VAL188 -0.0227 2993 HB 102.2380 122.0375 97.4356 H 188 VAL188 0.0315 2994 CG1 103.1070 121.0677 95.7325 C.3 188 VAL188 -0.0608 2995 HG11 103.9162 120.5907 96.2859 H 188 VAL188 0.0233 2996 HG12 103.4811 121.3051 94.7365 H 188 VAL188 0.0233 2997 HG13 102.3151 120.3279 95.6184 H 188 VAL188 0.0233 2998 CG2 103.8149 123.2772 96.6755 C.3 188 VAL188 -0.0608 2999 HG21 104.5517 122.8255 97.3401 H 188 VAL188 0.0233 3000 HG22 103.5207 124.2298 97.1116 H 188 VAL188 0.0233 3001 HG23 104.3116 123.5009 95.7314 H 188 VAL188 0.0233 3002 N 99.4860 121.6760 96.1570 N.am 189 ILE189 -0.2454 3003 H 99.6400 121.9620 97.1240 H 189 ILE189 0.1312 3004 CA 98.3190 120.8410 95.8880 C.3 189 ILE189 0.0903 3005 HA 98.6814 119.9276 95.4148 H 189 ILE189 0.0560 3006 C 97.3740 121.5160 94.9260 C.2 189 ILE189 0.2190 3007 O 96.9710 120.9220 93.9250 O.2 189 ILE189 -0.2778 3008 CB 97.6071 120.5124 97.2328 C.3 189 ILE189 -0.0201 3009 HB 97.5209 121.4478 97.7881 H 189 ILE189 0.0318 3010 CG1 98.4281 119.5252 98.0875 C.3 189 ILE189 -0.0514 3011 HG11 99.4871 119.7727 98.0444 H 189 ILE189 0.0266 3012 HG12 98.3401 118.5255 97.6627 H 189 ILE189 0.0266 3013 CG2 96.1802 119.9526 97.0538 C.3 189 ILE189 -0.0605 3014 HG21 95.6939 119.7820 98.0132 H 189 ILE189 0.0233 3015 HG22 96.2052 119.0005 96.5259 H 189 ILE189 0.0233 3016 HG23 95.5296 120.6314 96.5027 H 189 ILE189 0.0233 3017 CD1 97.9967 119.4896 99.5621 C.3 189 ILE189 -0.0650 3018 HD11 98.5996 118.7840 100.1320 H 189 ILE189 0.0230 3019 HD12 96.9591 119.1800 99.6774 H 189 ILE189 0.0230 3020 HD13 98.1063 120.4688 100.0276 H 189 ILE189 0.0230 3021 N 97.0460 122.8030 95.1890 N.am 190 THR190 -0.2434 3022 H 97.4340 123.2310 96.0290 H 190 THR190 0.1313 3023 CA 96.1740 123.6170 94.3490 C.3 190 THR190 0.1135 3024 HA 95.2306 123.0745 94.2755 H 190 THR190 0.0583 3025 C 96.7200 123.7680 92.9610 C.2 190 THR190 0.2212 3026 O 96.0260 123.5020 91.9920 O.2 190 THR190 -0.2777 3027 CB 95.9294 124.9721 95.0386 C.3 190 THR190 0.0763 3028 HB 96.9072 125.4301 95.2330 H 190 THR190 0.0611 3029 OG1 95.2642 124.6993 96.2631 O.3 190 THR190 -0.3900 3030 HG1 95.2255 125.4737 96.8165 H 190 THR190 0.2098 3031 CG2 95.0612 125.9276 94.2011 C.3 190 THR190 -0.0370 3032 HG21 94.8888 126.8715 94.7182 H 190 THR190 0.0255 3033 HG22 94.0896 125.4813 93.9879 H 190 THR190 0.0255 3034 HG23 95.5332 126.1678 93.2486 H 190 THR190 0.0255 3035 N 98.0090 124.1260 92.8080 N.am 191 ALA191 -0.2458 3036 H 98.5710 124.3240 93.6360 H 191 ALA191 0.1312 3037 CA 98.6160 124.2370 91.5020 C.3 191 ALA191 0.0850 3038 HA 98.0017 124.9324 90.9276 H 191 ALA191 0.0554 3039 C 98.6860 122.9170 90.7360 C.2 191 ALA191 0.2184 3040 O 98.3250 122.8650 89.5640 O.2 191 ALA191 -0.2778 3041 CB 100.0254 124.8105 91.6877 C.3 191 ALA191 -0.0411 3042 HB1 100.5270 124.9590 90.7313 H 191 ALA191 0.0249 3043 HB2 100.6433 124.1496 92.2978 H 191 ALA191 0.0249 3044 HB3 99.9836 125.7751 92.1942 H 191 ALA191 0.0249 3045 N 99.1050 121.8080 91.3860 N.am 192 ALA192 -0.2459 3046 H 99.3810 121.9020 92.3640 H 192 ALA192 0.1312 3047 CA 99.1860 120.4920 90.7780 C.3 192 ALA192 0.0850 3048 HA 99.8379 120.5850 89.9091 H 192 ALA192 0.0554 3049 C 97.8390 119.9440 90.2990 C.2 192 ALA192 0.2184 3050 O 97.7380 119.3910 89.2100 O.2 192 ALA192 -0.2778 3051 CB 99.8034 119.5230 91.7960 C.3 192 ALA192 -0.0411 3052 HB1 99.9263 118.5234 91.3759 H 192 ALA192 0.0249 3053 HB2 99.1822 119.4370 92.6891 H 192 ALA192 0.0249 3054 HB3 100.7865 119.8691 92.1150 H 192 ALA192 0.0249 3055 N 96.7700 120.1260 91.1050 N.am 193 TYR193 -0.2453 3056 H 96.9200 120.5740 92.0090 H 193 TYR193 0.1312 3057 CA 95.4150 119.7190 90.7550 C.3 193 TYR193 0.0917 3058 HA 95.5107 118.8397 90.1197 H 193 TYR193 0.0560 3059 C 94.6400 120.7060 89.9060 C.2 193 TYR193 0.2190 3060 O 93.5570 120.3640 89.4210 O.2 193 TYR193 -0.2778 3061 CB 94.6071 119.3643 92.0127 C.3 193 TYR193 -0.0036 3062 HB1 93.5466 119.3067 91.7649 H 193 TYR193 0.0333 3063 HB2 94.7154 120.1690 92.7412 H 193 TYR193 0.0333 3064 CG 94.9555 118.0371 92.6479 C.ar 193 TYR193 -0.0453 3065 CD1 95.0372 116.8688 91.8910 C.ar 193 TYR193 -0.0561 3066 HD1 94.9128 116.8980 90.8191 H 193 TYR193 0.0621 3067 CD2 95.0616 117.9382 94.0324 C.ar 193 TYR193 -0.0561 3068 HD2 94.9649 118.8269 94.6387 H 193 TYR193 0.0621 3069 CE1 95.2480 115.6388 92.5020 C.ar 193 TYR193 -0.0317 3070 HE1 95.3163 114.7411 91.9067 H 193 TYR193 0.0643 3071 CE2 95.2433 116.7054 94.6487 C.ar 193 TYR193 -0.0317 3072 HE2 95.3125 116.6428 95.7246 H 193 TYR193 0.0643 3073 CZ 95.3413 115.5529 93.8821 C.ar 193 TYR193 0.0726 3074 OH 95.5223 114.3222 94.4826 O.3 193 TYR193 -0.3598 3075 HH 95.4310 114.4104 95.4252 H 193 TYR193 0.2173 3076 N 95.1240 121.9330 89.7100 N.am 194 VAL194 -0.2454 3077 H 95.8440 122.2600 90.3540 H 194 VAL194 0.1312 3078 CA 94.7100 122.8450 88.6520 C.3 194 VAL194 0.0901 3079 HA 93.6258 122.7561 88.5620 H 194 VAL194 0.0560 3080 C 95.2830 122.4300 87.3070 C.2 194 VAL194 0.2189 3081 O 94.6250 122.5410 86.2780 O.2 194 VAL194 -0.2778 3082 CB 95.0656 124.2951 89.0540 C.3 194 VAL194 -0.0227 3083 HB 96.0686 124.2865 89.4816 H 194 VAL194 0.0315 3084 CG1 95.0817 125.2813 87.8727 C.3 194 VAL194 -0.0608 3085 HG11 95.2758 126.2976 88.2162 H 194 VAL194 0.0233 3086 HG12 94.1241 125.2843 87.3509 H 194 VAL194 0.0233 3087 HG13 95.8580 125.0331 87.1490 H 194 VAL194 0.0233 3088 CG2 94.0905 124.8083 90.1267 C.3 194 VAL194 -0.0608 3089 HG21 94.4336 125.7524 90.5503 H 194 VAL194 0.0233 3090 HG22 93.9690 124.1012 90.9461 H 194 VAL194 0.0233 3091 HG23 93.0997 124.9745 89.7030 H 194 VAL194 0.0233 3092 N 96.5420 121.9340 87.2770 N.am 195 ARG195 -0.2456 3093 H 97.0600 121.8860 88.1540 H 195 ARG195 0.1312 3094 CA 97.2000 121.4650 86.0660 C.3 195 ARG195 0.0879 3095 HA 97.0029 122.2096 85.2926 H 195 ARG195 0.0557 3096 C 96.6430 120.1300 85.5550 C.2 195 ARG195 0.2187 3097 O 97.3250 119.1080 85.5110 O.2 195 ARG195 -0.2778 3098 CB 98.7103 121.3697 86.3070 C.3 195 ARG195 -0.0258 3099 HB1 99.1795 120.8901 85.4479 H 195 ARG195 0.0286 3100 HB2 98.9003 120.7286 87.1695 H 195 ARG195 0.0286 3101 CG 99.3700 122.7392 86.5100 C.3 195 ARG195 -0.0154 3102 HG1 98.8764 123.2803 87.3140 H 195 ARG195 0.0299 3103 HG2 99.2325 123.3456 85.6141 H 195 ARG195 0.0299 3104 CD 100.8632 122.6068 86.8158 C.3 195 ARG195 0.1045 3105 HD1 101.3870 122.2027 85.9464 H 195 ARG195 0.0711 3106 HD2 101.0274 121.9507 87.6752 H 195 ARG195 0.0711 3107 NE 101.4213 123.9182 87.1374 N.pl3 195 ARG195 -0.4450 3108 HE 100.7791 124.6637 87.3100 H 195 ARG195 0.3153 3109 CZ 102.7263 124.1592 87.2149 C.cat 195 ARG195 0.5062 3110 NH1 103.1362 125.3612 87.5192 N.pl3 195 ARG195 -0.4573 3111 HH11 104.1115 125.5600 87.5795 H 195 ARG195 0.3114 3112 HH12 102.4713 126.0843 87.6909 H 195 ARG195 0.3114 3113 NH2 103.6083 123.2202 86.9925 N.pl3 195 ARG195 -0.4573 3114 HH21 104.5833 123.4085 87.0676 H 195 ARG195 0.3114 3115 HH22 103.3049 122.2991 86.7404 H 195 ARG195 0.3114 3116 N 95.3680 120.1450 85.1250 N.am 196 ILE196 -0.2454 3117 H 94.9060 121.0540 85.0990 H 196 ILE196 0.1312 3118 CA 94.5850 119.0130 84.6970 C.3 196 ILE196 0.0903 3119 HA 95.1957 118.1222 84.8555 H 196 ILE196 0.0560 3120 C 94.2840 119.0750 83.2450 C.2 196 ILE196 0.2189 3121 O 94.3040 120.1240 82.6070 O.2 196 ILE196 -0.2778 3122 CB 93.3145 118.8957 85.5635 C.3 196 ILE196 -0.0201 3123 HB 92.7581 118.0159 85.2365 H 196 ILE196 0.0318 3124 CG1 92.3735 120.1118 85.4255 C.3 196 ILE196 -0.0514 3125 HG11 92.1917 120.3185 84.3710 H 196 ILE196 0.0266 3126 HG12 92.8471 121.0033 85.8303 H 196 ILE196 0.0266 3127 CG2 93.7275 118.6528 87.0208 C.3 196 ILE196 -0.0605 3128 HG21 92.8677 118.6501 87.6819 H 196 ILE196 0.0233 3129 HG22 94.4042 119.4274 87.3769 H 196 ILE196 0.0233 3130 HG23 94.2395 117.6973 87.1332 H 196 ILE196 0.0233 3131 CD1 91.0140 119.9193 86.1088 C.3 196 ILE196 -0.0650 3132 HD11 90.3482 120.7514 85.8798 H 196 ILE196 0.0230 3133 HD12 91.1136 119.8775 87.1930 H 196 ILE196 0.0230 3134 HD13 90.5281 119.0025 85.7745 H 196 ILE196 0.0230 3135 N 93.9760 117.9050 82.6790 N.am 197 LEU197 -0.2456 3136 H 94.0260 117.0490 83.2320 H 197 LEU197 0.1312 3137 CA 93.5790 117.8370 81.3140 C.3 197 LEU197 0.0880 3138 HA 92.9963 118.7308 81.0790 H 197 LEU197 0.0557 3139 C 92.6660 116.6370 81.1960 C.2 197 LEU197 0.2187 3140 O 92.8530 115.6450 81.8930 O.2 197 LEU197 -0.2778 3141 CB 94.8238 117.7230 80.4140 C.3 197 LEU197 -0.0266 3142 HB1 95.4266 116.8789 80.7470 H 197 LEU197 0.0287 3143 HB2 95.4469 118.6058 80.5647 H 197 LEU197 0.0287 3144 CG 94.5263 117.5757 78.9088 C.3 197 LEU197 -0.0449 3145 HG 93.9133 116.6888 78.7574 H 197 LEU197 0.0296 3146 CD1 93.7530 118.7799 78.3542 C.3 197 LEU197 -0.0626 3147 HD11 93.5736 118.6695 77.2844 H 197 LEU197 0.0232 3148 HD12 94.3084 119.7066 78.5036 H 197 LEU197 0.0232 3149 HD13 92.7810 118.8930 78.8327 H 197 LEU197 0.0232 3150 CD2 95.8246 117.3706 78.1184 C.3 197 LEU197 -0.0626 3151 HD21 95.6169 117.1972 77.0620 H 197 LEU197 0.0232 3152 HD22 96.3878 116.5162 78.4907 H 197 LEU197 0.0232 3153 HD23 96.4696 118.2472 78.1905 H 197 LEU197 0.0232 3154 N 91.6260 116.7370 80.3420 N.am 198 GLN198 -0.2456 3155 H 91.4940 117.6240 79.8560 H 198 GLN198 0.1312 3156 CA 90.6830 115.6700 80.0670 C.3 198 GLN198 0.0882 3157 HA 90.8849 114.8211 80.7224 H 198 GLN198 0.0557 3158 C 90.8650 115.2160 78.6350 C.2 198 GLN198 0.2187 3159 O 91.5880 115.8390 77.8620 O.2 198 GLN198 -0.2778 3160 CB 89.2541 116.2177 80.2777 C.3 198 GLN198 -0.0210 3161 HB1 88.5204 115.6406 79.7109 H 198 GLN198 0.0289 3162 HB2 89.2014 117.2268 79.8667 H 198 GLN198 0.0289 3163 CG 88.8153 116.2527 81.7531 C.3 198 GLN198 0.0225 3164 HG1 87.9444 116.8992 81.8660 H 198 GLN198 0.0356 3165 HG2 89.6011 116.6547 82.3929 H 198 GLN198 0.0356 3166 CD 88.4260 114.8506 82.2482 C.2 198 GLN198 0.1981 3167 OE1 88.7185 113.8402 81.6204 O.2 198 GLN198 -0.2798 3168 NE2 87.7418 114.8571 83.4019 N.am 198 GLN198 -0.2724 3169 HE21 87.4064 113.9964 83.7831 H 198 GLN198 0.1266 3170 HE22 87.5409 115.6994 83.9033 H 198 GLN198 0.1266 3171 N 90.2270 114.1000 78.2370 N.am 199 ARG199 -0.2457 3172 H 89.6110 113.6130 78.8870 H 199 ARG199 0.1312 3173 CA 90.4050 113.5840 76.8990 C.3 199 ARG199 0.0879 3174 HA 90.5115 114.4318 76.2181 H 199 ARG199 0.0557 3175 C 89.1990 112.7890 76.4600 C.2 199 ARG199 0.2187 3176 O 88.3930 112.3160 77.2620 O.2 199 ARG199 -0.2778 3177 CB 91.6705 112.6579 76.8458 C.3 199 ARG199 -0.0258 3178 HB1 92.1801 112.7933 75.8912 H 199 ARG199 0.0286 3179 HB2 91.3441 111.6156 76.8286 H 199 ARG199 0.0286 3180 CG 92.7022 112.7259 78.0096 C.3 199 ARG199 -0.0154 3181 HG1 93.1639 111.7421 78.1030 H 199 ARG199 0.0299 3182 HG2 92.2120 112.8647 78.9722 H 199 ARG199 0.0299 3183 CD 93.8608 113.7278 77.8383 C.3 199 ARG199 0.1045 3184 HD1 93.5273 114.6811 77.4309 H 199 ARG199 0.0711 3185 HD2 94.6014 113.3336 77.1404 H 199 ARG199 0.0711 3186 NE 94.4683 114.0096 79.1506 N.pl3 199 ARG199 -0.4450 3187 HE 93.8592 114.2954 79.8919 H 199 ARG199 0.3153 3188 CZ 95.7632 113.9344 79.4708 C.cat 199 ARG199 0.5062 3189 NH1 96.1416 114.2177 80.6887 N.pl3 199 ARG199 -0.4573 3190 HH11 97.1104 114.1628 80.9352 H 199 ARG199 0.3114 3191 HH12 95.4677 114.4904 81.3724 H 199 ARG199 0.3114 3192 NH2 96.6767 113.5868 78.6044 N.pl3 199 ARG199 -0.4573 3193 HH21 97.6348 113.5356 78.8832 H 199 ARG199 0.3114 3194 HH22 96.4175 113.3742 77.6672 H 199 ARG199 0.3114 3195 N 89.0630 112.6150 75.1380 N.am 200 MET200 -0.2456 3196 H 89.7670 113.0220 74.5220 H 200 MET200 0.1312 3197 CA 87.9830 111.8880 74.5450 C.3 200 MET200 0.0886 3198 HA 87.8543 110.9704 75.1207 H 200 MET200 0.0557 3199 C 88.4420 111.5010 73.1590 C.2 200 MET200 0.2188 3200 O 89.3660 112.1020 72.6250 O.2 200 MET200 -0.2778 3201 CB 86.6738 112.6970 74.4988 C.3 200 MET200 -0.0199 3202 HB1 86.3208 112.8672 75.5156 H 200 MET200 0.0293 3203 HB2 85.9072 112.0867 74.0195 H 200 MET200 0.0293 3204 CG 86.7648 114.0397 73.7548 C.3 200 MET200 -0.0047 3205 HG1 85.7589 114.3358 73.4626 H 200 MET200 0.0377 3206 HG2 87.3300 113.9625 72.8250 H 200 MET200 0.0377 3207 SD 87.4249 115.3491 74.8070 S.3 200 MET200 -0.1641 3208 CE 88.9305 115.7318 73.8889 C.3 200 MET200 -0.0181 3209 HE1 89.6353 116.2688 74.5239 H 200 MET200 0.0340 3210 HE2 88.6999 116.3318 73.0084 H 200 MET200 0.0340 3211 HE3 89.4188 114.8168 73.5538 H 200 MET200 0.0340 3212 N 87.8280 110.4610 72.5680 N.am 201 THR201 -0.2434 3213 H 87.1270 109.9510 73.1050 H 201 THR201 0.1313 3214 CA 88.1010 110.0190 71.2140 C.3 201 THR201 0.1135 3215 HA 89.1221 110.2994 70.9486 H 201 THR201 0.0583 3216 C 87.1560 110.7220 70.2650 C.2 201 THR201 0.2213 3217 O 86.2530 111.4480 70.6790 O.2 201 THR201 -0.2777 3218 CB 87.9262 108.4879 71.1464 C.3 201 THR201 0.0763 3219 HB 87.9299 108.1843 70.0910 H 201 THR201 0.0611 3220 OG1 86.6906 108.1282 71.7570 O.3 201 THR201 -0.3900 3221 HG1 86.5347 107.1939 71.6497 H 201 THR201 0.2098 3222 CG2 89.0853 107.7701 71.8569 C.3 201 THR201 -0.0370 3223 HG21 89.0228 106.6875 71.7425 H 201 THR201 0.0255 3224 HG22 89.0958 107.9932 72.9237 H 201 THR201 0.0255 3225 HG23 90.0453 108.0809 71.4439 H 201 THR201 0.0255 3226 N 87.3970 110.5630 68.9480 N.am 202 SER202 -0.2435 3227 H 88.2950 110.1560 68.6860 H 202 SER202 0.1312 3228 CA 86.4900 110.9210 67.8660 C.3 202 SER202 0.1109 3229 HA 86.4187 112.0091 67.8809 H 202 SER202 0.0580 3230 C 85.0910 110.3600 68.0010 C.2 202 SER202 0.2210 3231 O 84.7830 109.5000 68.8270 O.2 202 SER202 -0.2777 3232 CB 87.1138 110.4571 66.5397 C.3 202 SER202 0.0681 3233 HB1 88.0862 110.9464 66.4164 H 202 SER202 0.0577 3234 HB2 86.4849 110.7623 65.6949 H 202 SER202 0.0577 3235 OG 87.2813 109.0435 66.5522 O.3 202 SER202 -0.3930 3236 HG 87.6616 108.7326 65.7330 H 202 SER202 0.2095 3237 N 84.1720 110.8550 67.1710 N.am 203 SER203 -0.2435 3238 H 84.4450 111.5760 66.5030 H 203 SER203 0.1312 3239 CA 82.8140 110.4040 67.1910 C.3 203 SER203 0.1109 3240 HA 82.6604 109.6948 68.0022 H 203 SER203 0.0580 3241 C 82.4920 109.7140 65.8940 C.2 203 SER203 0.2209 3242 O 82.9660 110.0640 64.8190 O.2 203 SER203 -0.2777 3243 CB 81.8893 111.5974 67.3857 C.3 203 SER203 0.0681 3244 HB1 82.1090 112.0888 68.3371 H 203 SER203 0.0577 3245 HB2 80.8840 111.1833 67.4284 H 203 SER203 0.0577 3246 OG 82.0329 112.5331 66.3266 O.3 203 SER203 -0.3930 3247 HG 81.3371 113.1866 66.3249 H 203 SER203 0.2095 3248 N 81.6860 108.6330 66.0060 N.am 204 VAL204 -0.2453 3249 H 81.5380 108.2430 66.9370 H 204 VAL204 0.1312 3250 CA 81.0170 107.9900 64.8860 C.3 204 VAL204 0.0901 3251 HA 81.7845 107.7169 64.1592 H 204 VAL204 0.0560 3252 C 80.0880 109.0150 64.2420 C.2 204 VAL204 0.2189 3253 O 79.2830 109.6040 64.9530 O.2 204 VAL204 -0.2778 3254 CB 80.2962 106.7369 65.4329 C.3 204 VAL204 -0.0227 3255 HB 79.8008 107.0179 66.3625 H 204 VAL204 0.0315 3256 CG1 79.2059 106.1877 64.5040 C.3 204 VAL204 -0.0608 3257 HG11 78.8006 105.2492 64.8827 H 204 VAL204 0.0233 3258 HG12 79.5918 106.0035 63.5010 H 204 VAL204 0.0233 3259 HG13 78.3716 106.8845 64.4352 H 204 VAL204 0.0233 3260 CG2 81.3133 105.6328 65.7586 C.3 204 VAL204 -0.0608 3261 HG21 80.8241 104.7622 66.1947 H 204 VAL204 0.0233 3262 HG22 82.0743 105.9762 66.4586 H 204 VAL204 0.0233 3263 HG23 81.8267 105.3010 64.8552 H 204 VAL204 0.0233 3264 N 80.1620 109.2390 62.9080 N.am 205 ALA205 -0.2459 3265 H 80.7580 108.6230 62.3550 H 205 ALA205 0.1312 3266 CA 79.4450 110.3050 62.2060 C.3 205 ALA205 0.0852 3267 HA 79.8888 111.2294 62.5799 H 205 ALA205 0.0554 3268 C 77.9250 110.4230 62.4750 C.2 205 ALA205 0.2211 3269 O 77.4790 111.5210 62.7910 O.2 205 ALA205 -0.2776 3270 CB 79.7390 110.2053 60.7043 C.3 205 ALA205 -0.0411 3271 HB1 79.2691 111.0207 60.1530 H 205 ALA205 0.0249 3272 HB2 79.3867 109.2660 60.2810 H 205 ALA205 0.0249 3273 HB3 80.8118 110.2625 60.5197 H 205 ALA205 0.0249 3274 N 77.0860 109.3820 62.4420 N.am 206 PRO206 -0.2316 3275 CA 75.6730 109.4890 62.8170 C.3 206 PRO206 0.0907 3276 HA 75.2415 110.3536 62.3098 H 206 PRO206 0.0559 3277 C 75.4480 109.6350 64.3090 C.2 206 PRO206 0.2189 3278 O 74.3690 110.0460 64.7250 O.2 206 PRO206 -0.2778 3279 CB 75.0711 108.1796 62.2932 C.3 206 PRO206 -0.0276 3280 HB1 74.7352 108.3290 61.2664 H 206 PRO206 0.0285 3281 HB2 74.2120 107.8244 62.8644 H 206 PRO206 0.0285 3282 CG 76.2348 107.1942 62.2956 C.3 206 PRO206 -0.0379 3283 HG1 76.0926 106.3706 61.5957 H 206 PRO206 0.0278 3284 HG2 76.3457 106.7700 63.2937 H 206 PRO206 0.0278 3285 CD 77.4539 108.0516 61.9583 C.3 206 PRO206 0.0071 3286 HD1 78.3618 107.6844 62.4208 H 206 PRO206 0.0431 3287 HD2 77.5891 108.1296 60.8792 H 206 PRO206 0.0431 3288 N 76.4390 109.2930 65.1380 N.am 207 ALA207 -0.2459 3289 H 77.3520 109.0870 64.7320 H 207 ALA207 0.1312 3290 CA 76.3000 109.1970 66.5670 C.3 207 ALA207 0.0850 3291 HA 75.2837 109.4757 66.8505 H 207 ALA207 0.0554 3292 C 77.2530 110.1660 67.2450 C.2 207 ALA207 0.2185 3293 O 77.8410 109.8440 68.2770 O.2 207 ALA207 -0.2778 3294 CB 76.5765 107.7445 66.9732 C.3 207 ALA207 -0.0411 3295 HB1 76.4011 107.5849 68.0355 H 207 ALA207 0.0249 3296 HB2 77.6037 107.4587 66.7501 H 207 ALA207 0.0249 3297 HB3 75.9200 107.0647 66.4294 H 207 ALA207 0.0249 3298 N 77.4020 111.4100 66.7170 N.am 208 SER208 -0.2436 3299 H 76.9600 111.6160 65.8210 H 208 SER208 0.1312 3300 CA 78.1720 112.4710 67.3800 C.3 208 SER208 0.1109 3301 HA 79.1894 112.1277 67.4188 H 208 SER208 0.0580 3302 C 77.7320 112.7170 68.8060 C.2 208 SER208 0.2209 3303 O 78.5410 112.8020 69.7240 O.2 208 SER208 -0.2777 3304 CB 78.1215 113.7539 66.5415 C.3 208 SER208 0.0681 3305 HB1 78.5943 114.5820 67.0804 H 208 SER208 0.0577 3306 HB2 77.0798 114.0254 66.3351 H 208 SER208 0.0577 3307 OG 78.8324 113.5134 65.3363 O.3 208 SER208 -0.3930 3308 HG 78.7518 114.2424 64.7241 H 208 SER208 0.2095 3309 N 76.4020 112.7270 69.0150 N.am 209 GLN209 -0.2456 3310 H 75.8020 112.6420 68.1940 H 209 GLN209 0.1312 3311 CA 75.7460 112.8480 70.3010 C.3 209 GLN209 0.0882 3312 HA 76.1278 113.7747 70.7203 H 209 GLN209 0.0557 3313 C 76.0950 111.7460 71.2980 C.2 209 GLN209 0.2187 3314 O 76.2320 111.9950 72.4930 O.2 209 GLN209 -0.2778 3315 CB 74.2172 112.9593 70.1070 C.3 209 GLN209 -0.0210 3316 HB1 73.6785 112.2602 70.7497 H 209 GLN209 0.0289 3317 HB2 73.9543 112.6620 69.0908 H 209 GLN209 0.0289 3318 CG 73.6839 114.3785 70.3655 C.3 209 GLN209 0.0225 3319 HG1 72.6147 114.4255 70.1589 H 209 GLN209 0.0356 3320 HG2 74.1705 115.0910 69.6981 H 209 GLN209 0.0356 3321 CD 73.9098 114.8036 71.8287 C.2 209 GLN209 0.1981 3322 OE1 73.6977 114.0426 72.7658 O.2 209 GLN209 -0.2798 3323 NE2 74.3557 116.0607 71.9632 N.am 209 GLN209 -0.2724 3324 HE21 74.5385 116.4390 72.8698 H 209 GLN209 0.1266 3325 HE22 74.5081 116.6427 71.1640 H 209 GLN209 0.1266 3326 N 76.2870 110.4900 70.8340 N.am 210 ARG210 -0.2457 3327 H 76.1520 110.3150 69.8380 H 210 ARG210 0.1312 3328 CA 76.6760 109.3760 71.6840 C.3 210 ARG210 0.0879 3329 HA 75.9231 109.2825 72.4682 H 210 ARG210 0.0557 3330 C 78.0390 109.5860 72.3360 C.2 210 ARG210 0.2187 3331 O 78.2230 109.3380 73.5290 O.2 210 ARG210 -0.2778 3332 CB 76.7116 108.1137 70.8030 C.3 210 ARG210 -0.0258 3333 HB1 77.3497 108.3330 69.9535 H 210 ARG210 0.0286 3334 HB2 75.7239 107.9388 70.3748 H 210 ARG210 0.0286 3335 CG 77.2090 106.8194 71.4841 C.3 210 ARG210 -0.0154 3336 HG1 76.3562 106.2742 71.8901 H 210 ARG210 0.0299 3337 HG2 77.8481 107.0336 72.3397 H 210 ARG210 0.0299 3338 CD 78.0019 105.9187 70.5239 C.3 210 ARG210 0.1045 3339 HD1 77.4002 105.6497 69.6516 H 210 ARG210 0.0711 3340 HD2 78.3156 105.0039 71.0339 H 210 ARG210 0.0711 3341 NE 79.1970 106.6339 70.0598 N.pl3 210 ARG210 -0.4450 3342 HE 79.3092 107.5996 70.2936 H 210 ARG210 0.3153 3343 CZ 80.1674 106.0983 69.3284 C.cat 210 ARG210 0.5062 3344 NH1 81.1795 106.8438 68.9756 N.pl3 210 ARG210 -0.4573 3345 HH11 81.9274 106.4615 68.4373 H 210 ARG210 0.3114 3346 HH12 81.2048 107.8066 69.2490 H 210 ARG210 0.3114 3347 NH2 80.1284 104.8457 68.9587 N.pl3 210 ARG210 -0.4573 3348 HH21 80.8641 104.4534 68.4112 H 210 ARG210 0.3114 3349 HH22 79.3544 104.2787 69.2286 H 210 ARG210 0.3114 3350 N 79.0200 110.0700 71.5470 N.am 211 SER211 -0.2436 3351 H 78.8270 110.1650 70.5500 H 211 SER211 0.1312 3352 CA 80.3360 110.4650 72.0260 C.3 211 SER211 0.1109 3353 HA 80.6983 109.6504 72.6546 H 211 SER211 0.0580 3354 C 80.3190 111.7060 72.8890 C.2 211 SER211 0.2209 3355 O 81.0390 111.7840 73.8830 O.2 211 SER211 -0.2777 3356 CB 81.2532 110.6271 70.8025 C.3 211 SER211 0.0681 3357 HB1 82.1741 111.1771 71.0429 H 211 SER211 0.0577 3358 HB2 80.7430 111.2314 70.0494 H 211 SER211 0.0577 3359 OG 81.5362 109.3558 70.2189 O.3 211 SER211 -0.3930 3360 HG 82.2748 108.9465 70.6684 H 211 SER211 0.2095 3361 N 79.4790 112.7110 72.5300 N.am 212 ILE212 -0.2453 3362 H 78.9660 112.6120 71.6540 H 212 ILE212 0.1312 3363 CA 79.2590 113.9270 73.3150 C.3 212 ILE212 0.0903 3364 HA 80.2419 114.3846 73.4305 H 212 ILE212 0.0560 3365 C 78.7700 113.6050 74.7150 C.2 212 ILE212 0.2189 3366 O 79.3120 114.1310 75.6800 O.2 212 ILE212 -0.2778 3367 CB 78.3362 114.9111 72.5615 C.3 212 ILE212 -0.0201 3368 HB 77.4622 114.3491 72.2419 H 212 ILE212 0.0318 3369 CG1 79.0518 115.4738 71.3152 C.3 212 ILE212 -0.0514 3370 HG11 79.5877 114.6814 70.7954 H 212 ILE212 0.0266 3371 HG12 79.8195 116.1833 71.6247 H 212 ILE212 0.0266 3372 CG2 77.8396 116.0663 73.4542 C.3 212 ILE212 -0.0605 3373 HG21 77.2067 116.7572 72.8986 H 212 ILE212 0.0233 3374 HG22 78.6746 116.6353 73.8632 H 212 ILE212 0.0233 3375 HG23 77.2404 115.7049 74.2901 H 212 ILE212 0.0233 3376 CD1 78.1121 116.1505 70.3090 C.3 212 ILE212 -0.0650 3377 HD11 78.6682 116.4921 69.4356 H 212 ILE212 0.0230 3378 HD12 77.6143 117.0195 70.7376 H 212 ILE212 0.0230 3379 HD13 77.3444 115.4642 69.9557 H 212 ILE212 0.0230 3380 N 77.7890 112.6890 74.8540 N.am 213 ARG213 -0.2456 3381 H 77.4130 112.2650 74.0060 H 213 ARG213 0.1312 3382 CA 77.2310 112.2640 76.1250 C.3 213 ARG213 0.0879 3383 HA 76.9102 113.1887 76.6001 H 213 ARG213 0.0557 3384 C 78.2110 111.5990 77.0850 C.2 213 ARG213 0.2187 3385 O 78.2010 111.8270 78.2900 O.2 213 ARG213 -0.2778 3386 CB 76.0086 111.3686 75.8408 C.3 213 ARG213 -0.0258 3387 HB1 76.3257 110.3291 75.7382 H 213 ARG213 0.0286 3388 HB2 75.5791 111.6262 74.8732 H 213 ARG213 0.0286 3389 CG 74.9047 111.4789 76.9070 C.3 213 ARG213 -0.0154 3390 HG1 75.3428 111.3486 77.8972 H 213 ARG213 0.0299 3391 HG2 74.2017 110.6557 76.7773 H 213 ARG213 0.0299 3392 CD 74.1273 112.8084 76.8542 C.3 213 ARG213 0.1045 3393 HD1 74.7991 113.6641 76.9402 H 213 ARG213 0.0711 3394 HD2 73.4189 112.8963 77.6812 H 213 ARG213 0.0711 3395 NE 73.4151 112.9589 75.5798 N.pl3 213 ARG213 -0.4450 3396 HE 73.8621 113.4083 74.8035 H 213 ARG213 0.3153 3397 CZ 72.1749 112.5398 75.3392 C.cat 213 ARG213 0.5062 3398 NH1 71.4713 111.9172 76.2471 N.pl3 213 ARG213 -0.4573 3399 HH11 70.5425 111.6141 76.0467 H 213 ARG213 0.3114 3400 HH12 71.8698 111.7488 77.1434 H 213 ARG213 0.3114 3401 NH2 71.6481 112.7575 74.1665 N.pl3 213 ARG213 -0.4573 3402 HH21 70.7209 112.4576 73.9570 H 213 ARG213 0.3114 3403 HH22 72.1895 113.2351 73.4742 H 213 ARG213 0.3114 3404 N 79.0730 110.7010 76.5690 N.am 214 LEU214 -0.2456 3405 H 78.9720 110.4200 75.5940 H 214 LEU214 0.1312 3406 CA 80.1400 110.1240 77.3620 C.3 214 LEU214 0.0880 3407 HA 79.7086 109.7861 78.3051 H 214 LEU214 0.0557 3408 C 81.2440 111.1050 77.6750 C.2 214 LEU214 0.2187 3409 O 81.8120 111.0800 78.7620 O.2 214 LEU214 -0.2778 3410 CB 80.7249 108.9375 76.5727 C.3 214 LEU214 -0.0266 3411 HB1 81.5610 108.4978 77.1191 H 214 LEU214 0.0287 3412 HB2 81.1378 109.3132 75.6347 H 214 LEU214 0.0287 3413 CG 79.7041 107.8300 76.2476 C.3 214 LEU214 -0.0449 3414 HG 78.8228 108.2757 75.7866 H 214 LEU214 0.0296 3415 CD1 80.2837 106.8447 75.2249 C.3 214 LEU214 -0.0626 3416 HD11 79.5572 106.0722 74.9709 H 214 LEU214 0.0232 3417 HD12 81.1742 106.3497 75.6133 H 214 LEU214 0.0232 3418 HD13 80.5571 107.3546 74.3006 H 214 LEU214 0.0232 3419 CD2 79.2454 107.0902 77.5113 C.3 214 LEU214 -0.0626 3420 HD21 78.5429 106.2942 77.2625 H 214 LEU214 0.0232 3421 HD22 78.7416 107.7604 78.2071 H 214 LEU214 0.0232 3422 HD23 80.0894 106.6364 78.0313 H 214 LEU214 0.0232 3423 N 81.5760 112.0070 76.7290 N.am 215 ARG215 -0.2457 3424 H 81.1590 111.9220 75.8020 H 215 ARG215 0.1312 3425 CA 82.5010 113.0890 76.9800 C.3 215 ARG215 0.0879 3426 HA 83.4412 112.6387 77.3013 H 215 ARG215 0.0557 3427 C 82.0220 114.0240 78.0820 C.2 215 ARG215 0.2187 3428 O 82.7770 114.2950 79.0060 O.2 215 ARG215 -0.2778 3429 CB 82.7136 113.9057 75.6898 C.3 215 ARG215 -0.0258 3430 HB1 81.7722 114.3697 75.3959 H 215 ARG215 0.0286 3431 HB2 82.9778 113.2324 74.8739 H 215 ARG215 0.0286 3432 CG 83.8085 114.9851 75.8173 C.3 215 ARG215 -0.0154 3433 HG1 84.7769 114.4923 75.8906 H 215 ARG215 0.0299 3434 HG2 83.6974 115.5451 76.7456 H 215 ARG215 0.0299 3435 CD 83.8264 115.9772 74.6430 C.3 215 ARG215 0.1045 3436 HD1 83.7256 115.4564 73.6879 H 215 ARG215 0.0711 3437 HD2 84.7648 116.5364 74.5964 H 215 ARG215 0.0711 3438 NE 82.7112 116.9250 74.7398 N.pl3 215 ARG215 -0.4450 3439 HE 81.8848 116.7629 74.2033 H 215 ARG215 0.3153 3440 CZ 82.7203 118.0180 75.5035 C.cat 215 ARG215 0.5062 3441 NH1 81.6794 118.8070 75.5071 N.pl3 215 ARG215 -0.4573 3442 HH11 81.6757 119.6275 76.0752 H 215 ARG215 0.3114 3443 HH12 80.8856 118.5985 74.9413 H 215 ARG215 0.3114 3444 NH2 83.7497 118.3221 76.2502 N.pl3 215 ARG215 -0.4573 3445 HH21 83.7433 119.1448 76.8143 H 215 ARG215 0.3114 3446 HH22 84.5489 117.7265 76.2523 H 215 ARG215 0.3114 3447 N 80.7540 114.4970 78.0570 N.am 216 THR216 -0.2434 3448 H 80.1600 114.2520 77.2640 H 216 THR216 0.1313 3449 CA 80.1930 115.3430 79.1120 C.3 216 THR216 0.1135 3450 HA 80.8774 116.1853 79.2181 H 216 THR216 0.0583 3451 C 80.1770 114.6410 80.4540 C.2 216 THR216 0.2212 3452 O 80.6100 115.2100 81.4490 O.2 216 THR216 -0.2777 3453 CB 78.7962 115.8807 78.7477 C.3 216 THR216 0.0763 3454 HB 78.4200 116.4239 79.6257 H 216 THR216 0.0611 3455 OG1 77.9247 114.8044 78.4356 O.3 216 THR216 -0.3900 3456 HG1 77.0315 115.1204 78.3399 H 216 THR216 0.2098 3457 CG2 78.8616 116.8665 77.5700 C.3 216 THR216 -0.0370 3458 HG21 77.8871 117.3083 77.3607 H 216 THR216 0.0255 3459 HG22 79.2078 116.3806 76.6594 H 216 THR216 0.0255 3460 HG23 79.5465 117.6851 77.7902 H 216 THR216 0.0255 3461 N 79.7590 113.3580 80.4940 N.am 217 LYS217 -0.2456 3462 H 79.4060 112.9450 79.6310 H 217 LYS217 0.1312 3463 CA 79.7790 112.5260 81.6850 C.3 217 LYS217 0.0878 3464 HA 79.2067 113.0925 82.4178 H 217 LYS217 0.0557 3465 C 81.1550 112.2920 82.3040 C.2 217 LYS217 0.2187 3466 O 81.3020 112.2100 83.5160 O.2 217 LYS217 -0.2778 3467 CB 79.0383 111.2050 81.4162 C.3 217 LYS217 -0.0289 3468 HB1 79.6148 110.5768 80.7358 H 217 LYS217 0.0285 3469 HB2 78.1056 111.4354 80.9002 H 217 LYS217 0.0285 3470 CG 78.7090 110.4443 82.7139 C.3 217 LYS217 -0.0496 3471 HG1 78.2549 111.1406 83.4207 H 217 LYS217 0.0266 3472 HG2 79.6322 110.0990 83.1809 H 217 LYS217 0.0266 3473 CD 77.7582 109.2556 82.5070 C.3 217 LYS217 -0.0278 3474 HD1 78.2253 108.5276 81.8424 H 217 LYS217 0.0282 3475 HD2 76.8563 109.6041 82.0018 H 217 LYS217 0.0282 3476 CE 77.3764 108.5895 83.8393 C.3 217 LYS217 0.1103 3477 HE1 76.9326 109.3281 84.5112 H 217 LYS217 0.0559 3478 HE2 78.2703 108.2060 84.3364 H 217 LYS217 0.0559 3479 NZ 76.4245 107.4833 83.6959 N.4 217 LYS217 -0.0749 3480 HZ1 76.2028 107.0823 84.6312 H 217 LYS217 0.2742 3481 HZ2 76.8327 106.7372 83.0957 H 217 LYS217 0.2742 3482 HZ3 75.5440 107.8278 83.2611 H 217 LYS217 0.2742 3483 N 82.2030 112.1260 81.4750 N.am 218 ARG218 -0.2457 3484 H 82.0180 112.0140 80.4780 H 218 ARG218 0.1312 3485 CA 83.5830 112.0980 81.9250 C.3 218 ARG218 0.0879 3486 HA 83.6203 111.4402 82.7920 H 218 ARG218 0.0557 3487 C 84.1650 113.4340 82.3420 C.2 218 ARG218 0.2187 3488 O 85.0350 113.4770 83.1980 O.2 218 ARG218 -0.2778 3489 CB 84.4492 111.4965 80.8074 C.3 218 ARG218 -0.0258 3490 HB1 85.5071 111.6732 81.0136 H 218 ARG218 0.0286 3491 HB2 84.2330 112.0081 79.8683 H 218 ARG218 0.0286 3492 CG 84.2445 109.9815 80.6633 C.3 218 ARG218 -0.0154 3493 HG1 83.1882 109.7494 80.5239 H 218 ARG218 0.0299 3494 HG2 84.5403 109.4982 81.5951 H 218 ARG218 0.0299 3495 CD 85.0581 109.3836 79.5116 C.3 218 ARG218 0.1045 3496 HD1 85.0257 108.2916 79.5482 H 218 ARG218 0.0711 3497 HD2 86.1009 109.7098 79.5589 H 218 ARG218 0.0711 3498 NE 84.4775 109.8127 78.2405 N.pl3 218 ARG218 -0.4450 3499 HE 83.6587 110.3856 78.2877 H 218 ARG218 0.3153 3500 CZ 84.9699 109.4793 77.0530 C.cat 218 ARG218 0.5062 3501 NH1 86.0543 108.7573 76.9481 N.pl3 218 ARG218 -0.4573 3502 HH11 86.4125 108.4885 76.0578 H 218 ARG218 0.3114 3503 HH12 86.5279 108.4721 77.7777 H 218 ARG218 0.3114 3504 NH2 84.3558 109.8788 75.9721 N.pl3 218 ARG218 -0.4573 3505 HH21 84.7150 109.6332 75.0752 H 218 ARG218 0.3114 3506 HH22 83.5262 110.4258 76.0519 H 218 ARG218 0.3114 3507 N 83.7250 114.5600 81.7580 N.am 219 VAL219 -0.2454 3508 H 83.1190 114.4780 80.9420 H 219 VAL219 0.1312 3509 CA 84.0700 115.8900 82.2320 C.3 219 VAL219 0.0901 3510 HA 85.1504 115.8958 82.3880 H 219 VAL219 0.0560 3511 C 83.4440 116.2220 83.5900 C.2 219 VAL219 0.2190 3512 O 84.0750 116.8300 84.4480 O.2 219 VAL219 -0.2778 3513 CB 83.7202 116.9240 81.1384 C.3 219 VAL219 -0.0227 3514 HB 82.6915 116.7432 80.8243 H 219 VAL219 0.0315 3515 CG1 83.8053 118.3792 81.6314 C.3 219 VAL219 -0.0608 3516 HG11 83.6122 119.0809 80.8202 H 219 VAL219 0.0233 3517 HG12 84.7940 118.5996 82.0354 H 219 VAL219 0.0233 3518 HG13 83.0726 118.5847 82.4123 H 219 VAL219 0.0233 3519 CG2 84.6347 116.7510 79.9138 C.3 219 VAL219 -0.0608 3520 HG21 84.3256 117.4057 79.0996 H 219 VAL219 0.0233 3521 HG22 84.6310 115.7302 79.5370 H 219 VAL219 0.0233 3522 HG23 85.6674 116.9960 80.1650 H 219 VAL219 0.0233 3523 N 82.1770 115.8040 83.8330 N.am 220 THR220 -0.2434 3524 H 81.6800 115.3290 83.0790 H 220 THR220 0.1313 3525 CA 81.4710 115.9880 85.1070 C.3 220 THR220 0.1135 3526 HA 81.6931 117.0057 85.4307 H 220 THR220 0.0583 3527 C 82.0200 115.0680 86.1900 C.2 220 THR220 0.2212 3528 O 81.8220 115.2910 87.3810 O.2 220 THR220 -0.2777 3529 CB 79.9443 115.8450 84.9710 C.3 220 THR220 0.0763 3530 HB 79.5248 115.9910 85.9752 H 220 THR220 0.0611 3531 OG1 79.6035 114.5490 84.5007 O.3 220 THR220 -0.3900 3532 HG1 78.6577 114.4435 84.5007 H 220 THR220 0.2098 3533 CG2 79.3591 116.9319 84.0544 C.3 220 THR220 -0.0370 3534 HG21 78.2698 116.8991 84.0305 H 220 THR220 0.0255 3535 HG22 79.7174 116.8306 83.0319 H 220 THR220 0.0255 3536 HG23 79.6430 117.9245 84.4041 H 220 THR220 0.0255 3537 N 82.8030 114.0350 85.7920 N.am 221 ARG221 -0.2456 3538 H 82.9870 113.9580 84.7920 H 221 ARG221 0.1312 3539 CA 83.4030 113.0320 86.6430 C.3 221 ARG221 0.0879 3540 HA 82.7042 112.8481 87.4604 H 221 ARG221 0.0557 3541 C 84.6850 113.5340 87.2760 C.2 221 ARG221 0.2187 3542 O 85.3460 112.8040 88.0220 O.2 221 ARG221 -0.2778 3543 CB 83.6027 111.7141 85.8318 C.3 221 ARG221 -0.0258 3544 HB1 83.8261 112.0324 84.8183 H 221 ARG221 0.0286 3545 HB2 82.6430 111.2031 85.7539 H 221 ARG221 0.0286 3546 CG 84.7201 110.6746 86.1855 C.3 221 ARG221 -0.0154 3547 HG1 85.6974 111.1576 86.2044 H 221 ARG221 0.0299 3548 HG2 84.7767 110.0019 85.3291 H 221 ARG221 0.0299 3549 CD 84.5497 109.7829 87.4466 C.3 221 ARG221 0.1045 3550 HD1 83.5018 109.7569 87.7522 H 221 ARG221 0.0711 3551 HD2 85.1216 110.1849 88.2855 H 221 ARG221 0.0711 3552 NE 84.9422 108.3710 87.1816 N.pl3 221 ARG221 -0.4450 3553 HE 84.5824 107.9210 86.3684 H 221 ARG221 0.3153 3554 CZ 85.7364 107.5533 87.9048 C.cat 221 ARG221 0.5062 3555 NH1 85.8808 106.2913 87.5647 N.pl3 221 ARG221 -0.4573 3556 HH11 86.4702 105.6552 88.0826 H 221 ARG221 0.3114 3557 HH12 85.4095 105.8992 86.7823 H 221 ARG221 0.3114 3558 NH2 86.3837 107.9710 88.9560 N.pl3 221 ARG221 -0.4573 3559 HH21 86.9572 107.3143 89.4486 H 221 ARG221 0.3114 3560 HH22 86.3084 108.9171 89.2515 H 221 ARG221 0.3114 3561 N 85.0130 114.8260 87.0350 N.am 222 THR222 -0.2434 3562 H 84.4950 115.2940 86.2910 H 222 THR222 0.1313 3563 CA 86.0240 115.6210 87.7210 C.3 222 THR222 0.1135 3564 HA 86.9688 115.0991 87.5660 H 222 THR222 0.0583 3565 C 85.7540 115.6670 89.2150 C.2 222 THR222 0.2212 3566 O 85.2060 116.6150 89.7710 O.2 222 THR222 -0.2777 3567 CB 86.1167 117.0108 87.0659 C.3 222 THR222 0.0763 3568 HB 85.1231 117.4751 87.1218 H 222 THR222 0.0611 3569 OG1 86.4969 116.7970 85.7132 O.3 222 THR222 -0.3900 3570 HG1 86.3693 117.5881 85.1972 H 222 THR222 0.2098 3571 CG2 87.1656 117.9267 87.7218 C.3 222 THR222 -0.0370 3572 HG21 87.2146 118.8967 87.2269 H 222 THR222 0.0255 3573 HG22 88.1573 117.4790 87.6686 H 222 THR222 0.0255 3574 HG23 86.9400 118.1175 88.7701 H 222 THR222 0.0255 3575 N 86.2130 114.6220 89.9400 N.am 223 ALA223 -0.2458 3576 H 86.7270 113.8920 89.4470 H 223 ALA223 0.1312 3577 CA 86.0250 114.4660 91.3710 C.3 223 ALA223 0.0850 3578 HA 85.0782 114.9347 91.6458 H 223 ALA223 0.0554 3579 C 87.1400 115.1530 92.1400 C.2 223 ALA223 0.2184 3580 O 87.3000 115.0280 93.3510 O.2 223 ALA223 -0.2778 3581 CB 85.9838 112.9684 91.6929 C.3 223 ALA223 -0.0411 3582 HB1 85.8604 112.7887 92.7615 H 223 ALA223 0.0249 3583 HB2 86.9005 112.4755 91.3702 H 223 ALA223 0.0249 3584 HB3 85.1523 112.4867 91.1783 H 223 ALA223 0.0249 3585 N 87.8920 115.9860 91.3990 N.am 224 ILE224 -0.2454 3586 H 87.6990 115.9900 90.3970 H 224 ILE224 0.1312 3587 CA 88.9360 116.8730 91.8450 C.3 224 ILE224 0.0903 3588 HA 89.6528 116.2380 92.3683 H 224 ILE224 0.0560 3589 C 88.3810 117.8360 92.8730 C.2 224 ILE224 0.2189 3590 O 88.9910 118.0210 93.9100 O.2 224 ILE224 -0.2778 3591 CB 89.6358 117.5242 90.6357 C.3 224 ILE224 -0.0201 3592 HB 88.9172 118.1557 90.1124 H 224 ILE224 0.0318 3593 CG1 90.1001 116.4174 89.6606 C.3 224 ILE224 -0.0514 3594 HG11 89.2329 115.9252 89.2198 H 224 ILE224 0.0266 3595 HG12 90.6406 115.6459 90.2105 H 224 ILE224 0.0266 3596 CG2 90.8034 118.4224 91.0844 C.3 224 ILE224 -0.0605 3597 HG21 91.2904 118.9068 90.2380 H 224 ILE224 0.0233 3598 HG22 91.5591 117.8503 91.6235 H 224 ILE224 0.0233 3599 HG23 90.4576 119.2224 91.7383 H 224 ILE224 0.0233 3600 CD1 90.9892 116.9069 88.5190 C.3 224 ILE224 -0.0650 3601 HD11 91.1459 116.1216 87.7796 H 224 ILE224 0.0230 3602 HD12 91.9675 117.1887 88.9049 H 224 ILE224 0.0230 3603 HD13 90.5495 117.7645 88.0113 H 224 ILE224 0.0230 3604 N 87.1490 118.3740 92.6650 N.am 225 ALA225 -0.2459 3605 H 86.6600 118.1350 91.8020 H 225 ALA225 0.1312 3606 CA 86.4880 119.2690 93.6000 C.3 225 ALA225 0.0850 3607 HA 87.1157 120.1579 93.6775 H 225 ALA225 0.0554 3608 C 86.3600 118.6550 94.9910 C.2 225 ALA225 0.2184 3609 O 86.7030 119.2930 95.9780 O.2 225 ALA225 -0.2778 3610 CB 85.1076 119.6354 93.0443 C.3 225 ALA225 -0.0411 3611 HB1 84.5903 120.3381 93.6986 H 225 ALA225 0.0249 3612 HB2 84.4767 118.7526 92.9318 H 225 ALA225 0.0249 3613 HB3 85.1978 120.1028 92.0637 H 225 ALA225 0.0249 3614 N 85.9610 117.3640 95.0840 N.am 226 ILE226 -0.2454 3615 H 85.6730 116.8890 94.2280 H 226 ILE226 0.1312 3616 CA 85.9180 116.6090 96.3340 C.3 226 ILE226 0.0903 3617 HA 85.2777 117.1713 97.0152 H 226 ILE226 0.0560 3618 C 87.2920 116.4820 96.9720 C.2 226 ILE226 0.2190 3619 O 87.4620 116.7450 98.1600 O.2 226 ILE226 -0.2778 3620 CB 85.3168 115.2037 96.0700 C.3 226 ILE226 -0.0201 3621 HB 86.0132 114.6529 95.4372 H 226 ILE226 0.0318 3622 CG1 83.9733 115.2776 95.3111 C.3 226 ILE226 -0.0514 3623 HG11 84.0826 115.8594 94.3966 H 226 ILE226 0.0266 3624 HG12 83.2353 115.8030 95.9183 H 226 ILE226 0.0266 3625 CG2 85.1572 114.4056 97.3772 C.3 226 ILE226 -0.0605 3626 HG21 84.8407 113.3807 97.1885 H 226 ILE226 0.0233 3627 HG22 84.4142 114.8714 98.0237 H 226 ILE226 0.0233 3628 HG23 86.0911 114.3407 97.9350 H 226 ILE226 0.0233 3629 CD1 83.4227 113.9051 94.9041 C.3 226 ILE226 -0.0650 3630 HD11 82.5327 114.0159 94.2843 H 226 ILE226 0.0230 3631 HD12 83.1405 113.3097 95.7718 H 226 ILE226 0.0230 3632 HD13 84.1585 113.3413 94.3308 H 226 ILE226 0.0230 3633 N 88.3240 116.1220 96.1800 N.am 227 CYS227 -0.2449 3634 H 88.1340 115.9320 95.1960 H 227 CYS227 0.1312 3635 CA 89.6920 115.9910 96.6550 C.3 227 CYS227 0.0965 3636 HA 89.6665 115.2698 97.4734 H 227 CYS227 0.0565 3637 C 90.2850 117.2840 97.1930 C.2 227 CYS227 0.2195 3638 O 90.9360 117.2850 98.2340 O.2 227 CYS227 -0.2778 3639 CB 90.5690 115.4503 95.5159 C.3 227 CYS227 0.0147 3640 HB1 91.5952 115.3181 95.8630 H 227 CYS227 0.0394 3641 HB2 90.6087 116.1702 94.6976 H 227 CYS227 0.0394 3642 SG 89.9863 113.8666 94.8553 S.3 227 CYS227 -0.1762 3643 HG 88.7251 113.9987 94.4379 H 227 CYS227 0.1017 3644 N 90.0600 118.4250 96.5040 N.am 228 LEU228 -0.2456 3645 H 89.5840 118.3680 95.6040 H 228 LEU228 0.1312 3646 CA 90.4700 119.7330 96.9960 C.3 228 LEU228 0.0880 3647 HA 91.5300 119.6709 97.2483 H 228 LEU228 0.0557 3648 C 89.7310 120.1090 98.2750 C.2 228 LEU228 0.2187 3649 O 90.3510 120.4240 99.2850 O.2 228 LEU228 -0.2778 3650 CB 90.2332 120.7837 95.8962 C.3 228 LEU228 -0.0266 3651 HB1 90.0215 121.7592 96.3379 H 228 LEU228 0.0287 3652 HB2 89.3421 120.5177 95.3248 H 228 LEU228 0.0287 3653 CG 91.4382 120.9579 94.9586 C.3 228 LEU228 -0.0449 3654 HG 92.2504 121.3997 95.5381 H 228 LEU228 0.0296 3655 CD1 91.9500 119.6259 94.4051 C.3 228 LEU228 -0.0626 3656 HD11 92.7604 119.8108 93.7122 H 228 LEU228 0.0232 3657 HD12 91.1727 119.0844 93.8723 H 228 LEU228 0.0232 3658 HD13 92.3418 118.9767 95.1875 H 228 LEU228 0.0232 3659 CD2 91.1068 121.9244 93.8149 C.3 228 LEU228 -0.0626 3660 HD21 91.9767 122.0924 93.1788 H 228 LEU228 0.0232 3661 HD22 90.7860 122.8930 94.1990 H 228 LEU228 0.0232 3662 HD23 90.3067 121.5300 93.1876 H 228 LEU228 0.0232 3663 N 88.3780 119.9860 98.2700 N.am 229 VAL229 -0.2454 3664 H 87.9440 119.6460 97.4120 H 229 VAL229 0.1312 3665 CA 87.4910 120.2990 99.3900 C.3 229 VAL229 0.0901 3666 HA 87.6777 121.3462 99.6228 H 229 VAL229 0.0560 3667 C 87.8250 119.5150 100.6330 C.2 229 VAL229 0.2189 3668 O 87.8620 120.0610 101.7280 O.2 229 VAL229 -0.2778 3669 CB 86.0177 120.1379 98.9537 C.3 229 VAL229 -0.0227 3670 HB 85.9227 119.1776 98.4447 H 229 VAL229 0.0315 3671 CG1 85.0251 120.1356 100.1305 C.3 229 VAL229 -0.0608 3672 HG11 83.9966 120.0830 99.7729 H 229 VAL229 0.0233 3673 HG12 85.1239 121.0417 100.7292 H 229 VAL229 0.0233 3674 HG13 85.1777 119.2809 100.7893 H 229 VAL229 0.0233 3675 CG2 85.6242 121.2521 97.9697 C.3 229 VAL229 -0.0608 3676 HG21 84.6414 121.0628 97.5375 H 229 VAL229 0.0233 3677 HG22 86.3336 121.3498 97.1494 H 229 VAL229 0.0233 3678 HG23 85.5850 122.2183 98.4734 H 229 VAL229 0.0233 3679 N 88.1360 118.2170 100.5270 N.am 230 PHE230 -0.2453 3680 H 88.1440 117.7750 99.6080 H 230 PHE230 0.1312 3681 CA 88.4610 117.4330 101.6970 C.3 230 PHE230 0.0917 3682 HA 87.6439 117.5702 102.4073 H 230 PHE230 0.0560 3683 C 89.7130 117.8820 102.4570 C.2 230 PHE230 0.2190 3684 O 89.8140 117.7020 103.6700 O.2 230 PHE230 -0.2778 3685 CB 88.5462 115.9440 101.3001 C.3 230 PHE230 -0.0036 3686 HB1 89.0643 115.3847 102.0817 H 230 PHE230 0.0333 3687 HB2 89.1514 115.8356 100.3988 H 230 PHE230 0.0333 3688 CG 87.2136 115.2523 101.0813 C.ar 230 PHE230 -0.0454 3689 CD1 85.9981 115.9363 100.9983 C.ar 230 PHE230 -0.0585 3690 HD1 85.9494 117.0117 101.0518 H 230 PHE230 0.0620 3691 CD2 87.1895 113.8635 100.9904 C.ar 230 PHE230 -0.0585 3692 HD2 88.1116 113.3056 101.0661 H 230 PHE230 0.0620 3693 CE1 84.7998 115.2489 100.8585 C.ar 230 PHE230 -0.0615 3694 HE1 83.8697 115.7950 100.8013 H 230 PHE230 0.0618 3695 CE2 85.9918 113.1717 100.8651 C.ar 230 PHE230 -0.0615 3696 HE2 85.9923 112.0921 100.8342 H 230 PHE230 0.0618 3697 CZ 84.7938 113.8642 100.7971 C.ar 230 PHE230 -0.0617 3698 HZ 83.8616 113.3280 100.6973 H 230 PHE230 0.0618 3699 N 90.6610 118.5490 101.7740 N.am 231 PHE231 -0.2453 3700 H 90.5590 118.6170 100.7610 H 231 PHE231 0.1312 3701 CA 91.8080 119.1720 102.3750 C.3 231 PHE231 0.0917 3702 HA 92.1043 118.5812 103.2436 H 231 PHE231 0.0560 3703 C 91.5170 120.6230 102.8240 C.2 231 PHE231 0.2190 3704 O 92.1850 121.1270 103.7180 O.2 231 PHE231 -0.2778 3705 CB 92.9137 119.1466 101.3035 C.3 231 PHE231 -0.0036 3706 HB1 92.6077 119.7194 100.4268 H 231 PHE231 0.0333 3707 HB2 93.0587 118.1227 100.9563 H 231 PHE231 0.0333 3708 CG 94.2332 119.6670 101.8038 C.ar 231 PHE231 -0.0454 3709 CD1 94.6144 120.9838 101.5667 C.ar 231 PHE231 -0.0585 3710 HD1 93.9665 121.6413 101.0055 H 231 PHE231 0.0620 3711 CD2 95.0792 118.8393 102.5319 C.ar 231 PHE231 -0.0585 3712 HD2 94.7885 117.8209 102.7422 H 231 PHE231 0.0620 3713 CE1 95.8116 121.4704 102.0726 C.ar 231 PHE231 -0.0615 3714 HE1 96.0934 122.4965 101.9010 H 231 PHE231 0.0618 3715 CE2 96.2705 119.3269 103.0469 C.ar 231 PHE231 -0.0615 3716 HE2 96.8970 118.6768 103.6384 H 231 PHE231 0.0618 3717 CZ 96.6377 120.6459 102.8198 C.ar 231 PHE231 -0.0617 3718 HZ 97.5607 121.0344 103.2238 H 231 PHE231 0.0618 3719 N 90.4490 121.3260 102.3460 N.am 232 VAL232 -0.2454 3720 H 89.8310 120.8890 101.6620 H 232 VAL232 0.1312 3721 CA 90.1690 122.7000 102.7950 C.3 232 VAL232 0.0901 3722 HA 91.1463 123.1764 102.8935 H 232 VAL232 0.0560 3723 C 89.5660 122.6980 104.1860 C.2 232 VAL232 0.2189 3724 O 89.4160 123.7390 104.8070 O.2 232 VAL232 -0.2778 3725 CB 89.3603 123.5787 101.8098 C.3 232 VAL232 -0.0227 3726 HB 89.5127 124.6086 102.1375 H 232 VAL232 0.0315 3727 CG1 89.9087 123.5076 100.3810 C.3 232 VAL232 -0.0608 3728 HG11 89.4832 124.2961 99.7602 H 232 VAL232 0.0233 3729 HG12 89.6550 122.5608 99.9151 H 232 VAL232 0.0233 3730 HG13 90.9934 123.6180 100.3628 H 232 VAL232 0.0233 3731 CG2 87.8384 123.3619 101.8374 C.3 232 VAL232 -0.0608 3732 HG21 87.3401 124.0287 101.1336 H 232 VAL232 0.0233 3733 HG22 87.4191 123.5652 102.8226 H 232 VAL232 0.0233 3734 HG23 87.5665 122.3482 101.5693 H 232 VAL232 0.0233 3735 N 89.2880 121.4940 104.7300 N.am 233 CYS233 -0.2449 3736 H 89.3690 120.6890 104.1080 H 233 CYS233 0.1312 3737 CA 88.8880 121.2110 106.0960 C.3 233 CYS233 0.0965 3738 HA 88.0593 121.8793 106.3329 H 233 CYS233 0.0565 3739 C 90.0010 121.4610 107.0860 C.2 233 CYS233 0.2195 3740 O 89.7860 121.6500 108.2770 O.2 233 CYS233 -0.2778 3741 CB 88.4385 119.7451 106.1911 C.3 233 CYS233 0.0147 3742 HB1 88.1413 119.5034 107.2129 H 233 CYS233 0.0394 3743 HB2 89.2712 119.0837 105.9458 H 233 CYS233 0.0394 3744 SG 87.0562 119.3487 105.0889 S.3 233 CYS233 -0.1762 3745 HG 86.8197 118.0351 105.1296 H 233 CYS233 0.1017 3746 N 91.2400 121.5150 106.5850 N.am 234 TRP234 -0.2453 3747 H 91.3850 121.2260 105.6180 H 234 TRP234 0.1312 3748 CA 92.3730 121.9590 107.3410 C.3 234 TRP234 0.0918 3749 HA 92.2807 121.5686 108.3554 H 234 TRP234 0.0560 3750 C 92.4660 123.4660 107.4260 C.2 234 TRP234 0.2190 3751 O 92.8400 123.9960 108.4640 O.2 234 TRP234 -0.2778 3752 CB 93.6636 121.4604 106.6721 C.3 234 TRP234 -0.0021 3753 HB1 94.5456 121.9592 107.0697 H 234 TRP234 0.0334 3754 HB2 93.6546 121.6801 105.6052 H 234 TRP234 0.0334 3755 CG 93.8642 119.9787 106.8748 C.ar 234 TRP234 -0.0260 3756 CD1 93.9096 119.0244 105.8613 C.ar 234 TRP234 -0.0136 3757 HD1 93.7345 119.2265 104.8172 H 234 TRP234 0.0748 3758 CD2 94.1581 119.2851 108.1048 C.ar 234 TRP234 -0.0028 3759 NE1 94.2757 117.8356 106.3901 N.ar 234 TRP234 -0.2641 3760 HE1 94.4259 117.0123 105.8797 H 234 TRP234 0.1331 3761 CE2 94.4240 117.9411 107.7634 C.ar 234 TRP234 0.0269 3762 CE3 94.2372 119.6846 109.4092 C.ar 234 TRP234 -0.0528 3763 HE3 94.0259 120.7125 109.6531 H 234 TRP234 0.0624 3764 CZ2 94.7637 117.0396 108.7338 C.ar 234 TRP234 -0.0430 3765 HZ2 94.9365 116.0088 108.4645 H 234 TRP234 0.0633 3766 CZ3 94.5901 118.7728 110.4048 C.ar 234 TRP234 -0.0611 3767 HZ3 94.6449 119.0874 111.4360 H 234 TRP234 0.0618 3768 CH2 94.8537 117.4455 110.0652 C.ar 234 TRP234 -0.0602 3769 HH2 95.0993 116.7228 110.8286 H 234 TRP234 0.0618 3770 N 92.0820 124.2080 106.3650 N.am 235 ALA235 -0.2459 3771 H 91.7660 123.7180 105.5280 H 235 ALA235 0.1312 3772 CA 92.0910 125.6630 106.3410 C.3 235 ALA235 0.0852 3773 HA 93.1448 125.9420 106.3821 H 235 ALA235 0.0554 3774 C 91.3860 126.3560 107.5290 C.2 235 ALA235 0.2211 3775 O 92.0120 127.2650 108.0660 O.2 235 ALA235 -0.2776 3776 CB 91.4946 126.1502 105.0145 C.3 235 ALA235 -0.0411 3777 HB1 91.6768 127.2156 104.8709 H 235 ALA235 0.0249 3778 HB2 90.4184 125.9923 104.9692 H 235 ALA235 0.0249 3779 HB3 91.9334 125.6212 104.1695 H 235 ALA235 0.0249 3780 N 90.1820 126.0010 108.0350 N.am 236 PRO236 -0.2316 3781 CA 89.5860 126.5740 109.2380 C.3 236 PRO236 0.0907 3782 HA 89.5119 127.6507 109.0845 H 236 PRO236 0.0559 3783 C 90.4130 126.3250 110.4750 C.2 236 PRO236 0.2189 3784 O 90.4110 127.1600 111.3730 O.2 236 PRO236 -0.2778 3785 CB 88.1911 125.9446 109.3312 C.3 236 PRO236 -0.0276 3786 HB1 87.4656 126.6139 108.8679 H 236 PRO236 0.0285 3787 HB2 87.8541 125.7580 110.3522 H 236 PRO236 0.0285 3788 CG 88.2876 124.6717 108.5055 C.3 236 PRO236 -0.0379 3789 HG1 87.3293 124.3567 108.0930 H 236 PRO236 0.0278 3790 HG2 88.6638 123.8628 109.1331 H 236 PRO236 0.0278 3791 CD 89.3143 124.9947 107.4244 C.3 236 PRO236 0.0071 3792 HD1 89.8559 124.0999 107.1568 H 236 PRO236 0.0431 3793 HD2 88.8528 125.4494 106.5476 H 236 PRO236 0.0431 3794 N 91.1110 125.1790 110.5590 N.am 237 TYR237 -0.2453 3795 H 91.0230 124.4920 109.8100 H 237 TYR237 0.1312 3796 CA 91.9760 124.8900 111.6680 C.3 237 TYR237 0.0917 3797 HA 91.4528 125.2075 112.5704 H 237 TYR237 0.0560 3798 C 93.2830 125.6770 111.5960 C.2 237 TYR237 0.2190 3799 O 93.6640 126.3690 112.5340 O.2 237 TYR237 -0.2778 3800 CB 92.2402 123.3747 111.7219 C.3 237 TYR237 -0.0036 3801 HB1 92.6224 123.0347 110.7592 H 237 TYR237 0.0333 3802 HB2 91.3014 122.8451 111.8731 H 237 TYR237 0.0333 3803 CG 93.2074 122.9666 112.8084 C.ar 237 TYR237 -0.0453 3804 CD1 93.1044 123.4785 114.0994 C.ar 237 TYR237 -0.0561 3805 HD1 92.3133 124.1685 114.3550 H 237 TYR237 0.0621 3806 CD2 94.2339 122.0713 112.5263 C.ar 237 TYR237 -0.0561 3807 HD2 94.3416 121.6720 111.5322 H 237 TYR237 0.0621 3808 CE1 94.0281 123.1222 115.0723 C.ar 237 TYR237 -0.0317 3809 HE1 93.9533 123.5419 116.0639 H 237 TYR237 0.0643 3810 CE2 95.1293 121.6774 113.5097 C.ar 237 TYR237 -0.0317 3811 HE2 95.9044 120.9647 113.2730 H 237 TYR237 0.0643 3812 CZ 95.0277 122.2039 114.7871 C.ar 237 TYR237 0.0726 3813 OH 95.9204 121.8210 115.7679 O.3 237 TYR237 -0.3598 3814 HH 95.6864 122.2365 116.5889 H 237 TYR237 0.2173 3815 N 93.9280 125.6370 110.4110 N.am 238 TYR238 -0.2453 3816 H 93.4870 125.1230 109.6480 H 238 TYR238 0.1312 3817 CA 95.1960 126.2700 110.1490 C.3 238 TYR238 0.0917 3818 HA 95.8376 125.9797 110.9746 H 238 TYR238 0.0560 3819 C 95.1100 127.7790 110.2010 C.2 238 TYR238 0.2190 3820 O 96.0000 128.4020 110.7490 O.2 238 TYR238 -0.2778 3821 CB 95.8165 125.7001 108.8655 C.3 238 TYR238 -0.0036 3822 HB1 96.4646 126.4264 108.3800 H 238 TYR238 0.0333 3823 HB2 95.0473 125.4461 108.1348 H 238 TYR238 0.0333 3824 CG 96.6581 124.4921 109.1917 C.ar 238 TYR238 -0.0453 3825 CD1 97.9773 124.6555 109.6054 C.ar 238 TYR238 -0.0561 3826 HD1 98.4055 125.6417 109.6770 H 238 TYR238 0.0621 3827 CD2 96.1322 123.2067 109.1271 C.ar 238 TYR238 -0.0561 3828 HD2 95.1011 123.0631 108.8484 H 238 TYR238 0.0621 3829 CE1 98.7641 123.5571 109.9171 C.ar 238 TYR238 -0.0317 3830 HE1 99.7852 123.6965 110.2371 H 238 TYR238 0.0643 3831 CE2 96.9241 122.1036 109.4240 C.ar 238 TYR238 -0.0317 3832 HE2 96.5241 121.1052 109.3548 H 238 TYR238 0.0643 3833 CZ 98.2394 122.2782 109.8226 C.ar 238 TYR238 0.0726 3834 OH 99.0185 121.1876 110.1489 O.3 238 TYR238 -0.3598 3835 HH 98.5828 120.3885 109.8778 H 238 TYR238 0.2173 3836 N 94.0380 128.4280 109.6800 N.am 239 VAL239 -0.2454 3837 H 93.3200 127.8820 109.2030 H 239 VAL239 0.1312 3838 CA 93.8700 129.8800 109.7750 C.3 239 VAL239 0.0901 3839 HA 94.7738 130.2952 109.3254 H 239 VAL239 0.0560 3840 C 93.8330 130.3770 111.2120 C.2 239 VAL239 0.2189 3841 O 94.5400 131.3130 111.5680 O.2 239 VAL239 -0.2778 3842 CB 92.6552 130.3524 108.9496 C.3 239 VAL239 -0.0227 3843 HB 92.7301 129.8687 107.9747 H 239 VAL239 0.0315 3844 CG1 91.3063 129.9436 109.5587 C.3 239 VAL239 -0.0608 3845 HG11 90.4937 130.1001 108.8493 H 239 VAL239 0.0233 3846 HG12 91.0763 130.5225 110.4531 H 239 VAL239 0.0233 3847 HG13 91.3078 128.8932 109.8361 H 239 VAL239 0.0233 3848 CG2 92.6978 131.8683 108.7058 C.3 239 VAL239 -0.0608 3849 HG21 91.8781 132.1839 108.0600 H 239 VAL239 0.0233 3850 HG22 93.6307 132.1628 108.2244 H 239 VAL239 0.0233 3851 HG23 92.6171 132.4238 109.6408 H 239 VAL239 0.0233 3852 N 93.0690 129.7050 112.1000 N.am 240 LEU240 -0.2456 3853 H 92.5010 128.9350 111.7460 H 240 LEU240 0.1312 3854 CA 92.9940 129.9950 113.5190 C.3 240 LEU240 0.0880 3855 HA 92.8092 131.0635 113.6199 H 240 LEU240 0.0557 3856 C 94.2890 129.6820 114.2530 C.2 240 LEU240 0.2187 3857 O 94.7110 130.3960 115.1600 O.2 240 LEU240 -0.2778 3858 CB 91.8510 129.1741 114.1446 C.3 240 LEU240 -0.0266 3859 HB1 91.8347 129.3314 115.2221 H 240 LEU240 0.0287 3860 HB2 92.0557 128.1124 113.9942 H 240 LEU240 0.0287 3861 CG 90.4488 129.4918 113.5978 C.3 240 LEU240 -0.0449 3862 HG 90.4590 129.3812 112.5136 H 240 LEU240 0.0296 3863 CD1 89.4243 128.4915 114.1539 C.3 240 LEU240 -0.0626 3864 HD11 88.4321 128.6738 113.7405 H 240 LEU240 0.0232 3865 HD12 89.3517 128.5601 115.2398 H 240 LEU240 0.0232 3866 HD13 89.6995 127.4662 113.9044 H 240 LEU240 0.0232 3867 CD2 90.0231 130.9299 113.9216 C.3 240 LEU240 -0.0626 3868 HD21 89.0093 131.1244 113.5708 H 240 LEU240 0.0232 3869 HD22 90.6758 131.6592 113.4425 H 240 LEU240 0.0232 3870 HD23 90.0452 131.1111 114.9958 H 240 LEU240 0.0232 3871 N 94.9590 128.5870 113.8440 N.am 241 GLN241 -0.2456 3872 H 94.4770 127.9380 113.2220 H 241 GLN241 0.1312 3873 CA 96.3160 128.2720 114.2280 C.3 241 GLN241 0.0882 3874 HA 96.3940 128.3620 115.3037 H 241 GLN241 0.0557 3875 C 97.3820 129.1170 113.5630 C.2 241 GLN241 0.2187 3876 O 98.5390 128.9600 113.8510 O.2 241 GLN241 -0.2778 3877 CB 96.6353 126.8207 113.8118 C.3 241 GLN241 -0.0210 3878 HB1 97.7102 126.6400 113.7368 H 241 GLN241 0.0289 3879 HB2 96.2724 126.7011 112.7991 H 241 GLN241 0.0289 3880 CG 96.0184 125.7143 114.6774 C.3 241 GLN241 0.0225 3881 HG1 95.9490 124.8121 114.0720 H 241 GLN241 0.0356 3882 HG2 95.0054 125.9701 114.9870 H 241 GLN241 0.0356 3883 CD 96.8728 125.3675 115.9135 C.2 241 GLN241 0.1981 3884 OE1 96.4557 125.5209 117.0531 O.2 241 GLN241 -0.2798 3885 NE2 98.0884 124.8854 115.6222 N.am 241 GLN241 -0.2724 3886 HE21 98.7186 124.6355 116.3584 H 241 GLN241 0.1266 3887 HE22 98.4045 124.7738 114.6802 H 241 GLN241 0.1266 3888 N 97.1090 130.0040 112.6280 N.am 242 LEU242 -0.2456 3889 H 96.2280 129.9620 112.1160 H 242 LEU242 0.1312 3890 CA 98.0640 131.0250 112.3420 C.3 242 LEU242 0.0880 3891 HA 99.0899 130.7096 112.5424 H 242 LEU242 0.0557 3892 C 97.7620 132.2720 113.1250 C.2 242 LEU242 0.2187 3893 O 98.6450 132.8920 113.7030 O.2 242 LEU242 -0.2778 3894 CB 97.9108 131.3890 110.8489 C.3 242 LEU242 -0.0266 3895 HB1 96.8512 131.4904 110.6117 H 242 LEU242 0.0287 3896 HB2 98.2570 130.5529 110.2541 H 242 LEU242 0.0287 3897 CG 98.6333 132.6736 110.3834 C.3 242 LEU242 -0.0449 3898 HG 98.2758 133.5220 110.9677 H 242 LEU242 0.0296 3899 CD1 100.1501 132.5833 110.5792 C.3 242 LEU242 -0.0626 3900 HD11 100.6268 133.4986 110.2307 H 242 LEU242 0.0232 3901 HD12 100.5763 131.7485 110.0238 H 242 LEU242 0.0232 3902 HD13 100.4125 132.4561 111.6298 H 242 LEU242 0.0232 3903 CD2 98.2854 133.0007 108.9276 C.3 242 LEU242 -0.0626 3904 HD21 98.7493 133.9362 108.6144 H 242 LEU242 0.0232 3905 HD22 97.2080 133.1048 108.7962 H 242 LEU242 0.0232 3906 HD23 98.6290 132.2190 108.2550 H 242 LEU242 0.0232 3907 N 96.4740 132.6570 113.1650 N.am 243 THR243 -0.2434 3908 H 95.7560 132.0120 112.8350 H 243 THR243 0.1313 3909 CA 96.0700 133.9600 113.6620 C.3 243 THR243 0.1135 3910 HA 96.8473 134.6646 113.3676 H 243 THR243 0.0583 3911 C 96.0370 133.9780 115.1470 C.2 243 THR243 0.2212 3912 O 96.8970 134.5470 115.8100 O.2 243 THR243 -0.2777 3913 CB 94.7405 134.4060 113.0188 C.3 243 THR243 0.0763 3914 HB 94.4733 135.3755 113.4550 H 243 THR243 0.0611 3915 OG1 93.7089 133.4730 113.3120 O.3 243 THR243 -0.3900 3916 HG1 92.9138 133.6987 112.8397 H 243 THR243 0.2098 3917 CG2 94.9134 134.5921 111.4991 C.3 243 THR243 -0.0370 3918 HG21 94.0238 135.0175 111.0343 H 243 THR243 0.0255 3919 HG22 95.1312 133.6489 110.9990 H 243 THR243 0.0255 3920 HG23 95.7401 135.2701 111.2861 H 243 THR243 0.0255 3921 N 95.0670 133.2910 115.7510 N.am 244 GLN244 -0.2456 3922 H 94.4550 132.7040 115.1840 H 244 GLN244 0.1312 3923 CA 94.8520 133.3470 117.1680 C.3 244 GLN244 0.0882 3924 HA 94.8325 134.4004 117.3900 H 244 GLN244 0.0557 3925 C 96.0160 132.8090 117.9570 C.2 244 GLN244 0.2187 3926 O 96.3770 133.3110 119.0090 O.2 244 GLN244 -0.2778 3927 CB 93.4829 132.7261 117.5100 C.3 244 GLN244 -0.0210 3928 HB1 93.5269 131.6385 117.4601 H 244 GLN244 0.0289 3929 HB2 92.7949 133.0160 116.7143 H 244 GLN244 0.0289 3930 CG 92.8590 133.2177 118.8358 C.3 244 GLN244 0.0225 3931 HG1 91.7830 133.3297 118.7214 H 244 GLN244 0.0356 3932 HG2 93.2211 134.2042 119.1072 H 244 GLN244 0.0356 3933 CD 93.1286 132.2811 120.0195 C.2 244 GLN244 0.1981 3934 OE1 94.2271 131.7816 120.2053 O.2 244 GLN244 -0.2798 3935 NE2 92.0670 132.0768 120.8122 N.am 244 GLN244 -0.2724 3936 HE21 92.1667 131.5576 121.6605 H 244 GLN244 0.1266 3937 HE22 91.1607 132.4322 120.5832 H 244 GLN244 0.1266 3938 N 96.6760 131.8350 117.3250 N.am 245 LEU245 -0.2456 3939 H 96.2560 131.4930 116.4600 H 245 LEU245 0.1312 3940 CA 97.9020 131.2170 117.7200 C.3 245 LEU245 0.0880 3941 HA 97.6749 130.7012 118.6427 H 245 LEU245 0.0557 3942 C 99.0790 132.1240 118.0270 C.2 245 LEU245 0.2187 3943 O 99.7050 131.9090 119.0570 O.2 245 LEU245 -0.2778 3944 CB 98.3331 130.1765 116.6793 C.3 245 LEU245 -0.0266 3945 HB1 98.8980 130.6476 115.8721 H 245 LEU245 0.0287 3946 HB2 97.4351 129.7928 116.2170 H 245 LEU245 0.0287 3947 CG 99.1282 129.0041 117.2907 C.3 245 LEU245 -0.0449 3948 HG 99.9712 129.4080 117.8511 H 245 LEU245 0.0296 3949 CD1 98.2606 128.1806 118.2394 C.3 245 LEU245 -0.0626 3950 HD11 98.6869 127.1936 118.4015 H 245 LEU245 0.0232 3951 HD12 97.2659 128.0250 117.8293 H 245 LEU245 0.0232 3952 HD13 98.1837 128.6734 119.2051 H 245 LEU245 0.0232 3953 CD2 99.7161 128.0633 116.2443 C.3 245 LEU245 -0.0626 3954 HD21 100.3725 127.3427 116.7279 H 245 LEU245 0.0232 3955 HD22 100.3060 128.6008 115.5103 H 245 LEU245 0.0232 3956 HD23 98.9393 127.5049 115.7257 H 245 LEU245 0.0232 3957 N 99.3980 133.1540 117.2230 N.am 246 SER246 -0.2436 3958 H 98.7940 133.3850 116.4340 H 246 SER246 0.1312 3959 CA 100.5940 133.9410 117.4680 C.3 246 SER246 0.1109 3960 HA 100.8780 133.8499 118.5175 H 246 SER246 0.0580 3961 C 100.4500 135.4210 117.2070 C.2 246 SER246 0.2209 3962 O 101.4120 136.1810 117.3250 O.2 246 SER246 -0.2777 3963 CB 101.7416 133.4463 116.5813 C.3 246 SER246 0.0681 3964 HB1 101.9270 132.3938 116.7958 H 246 SER246 0.0577 3965 HB2 102.6648 133.9859 116.8296 H 246 SER246 0.0577 3966 OG 101.3767 133.6152 115.2132 O.3 246 SER246 -0.3930 3967 HG 102.1327 133.6295 114.6363 H 246 SER246 0.2095 3968 N 99.2270 135.8430 116.8500 N.am 247 ILE247 -0.2453 3969 H 98.4580 135.1740 116.8900 H 247 ILE247 0.1312 3970 CA 98.9370 137.1880 116.4130 C.3 247 ILE247 0.0903 3971 HA 99.8365 137.7950 116.5297 H 247 ILE247 0.0560 3972 C 97.8890 137.7610 117.3320 C.2 247 ILE247 0.2190 3973 O 98.0360 138.8580 117.8680 O.2 247 ILE247 -0.2778 3974 CB 98.4982 137.1940 114.9273 C.3 247 ILE247 -0.0201 3975 HB 97.5133 136.7334 114.8498 H 247 ILE247 0.0318 3976 CG1 99.4610 136.3582 114.0529 C.3 247 ILE247 -0.0514 3977 HG11 99.4302 135.3162 114.3725 H 247 ILE247 0.0266 3978 HG12 100.4873 136.6920 114.2105 H 247 ILE247 0.0266 3979 CG2 98.3715 138.6363 114.4069 C.3 247 ILE247 -0.0605 3980 HG21 97.9718 138.6630 113.3937 H 247 ILE247 0.0233 3981 HG22 99.3401 139.1367 114.4000 H 247 ILE247 0.0233 3982 HG23 97.6976 139.2266 115.0277 H 247 ILE247 0.0233 3983 CD1 99.1465 136.3880 112.5514 C.3 247 ILE247 -0.0650 3984 HD11 99.7597 135.6617 112.0169 H 247 ILE247 0.0230 3985 HD12 99.3521 137.3681 112.1218 H 247 ILE247 0.0230 3986 HD13 98.1027 136.1485 112.3547 H 247 ILE247 0.0230 3987 N 96.7920 137.0210 117.5700 N.am 248 SER248 -0.2436 3988 H 96.7140 136.0930 117.1540 H 248 SER248 0.1312 3989 CA 95.7210 137.5180 118.4060 C.3 248 SER248 0.1109 3990 HA 95.5874 138.5601 118.1092 H 248 SER248 0.0580 3991 C 96.0490 137.5170 119.8610 C.2 248 SER248 0.2209 3992 O 96.8580 136.7390 120.3540 O.2 248 SER248 -0.2777 3993 CB 94.3867 136.8236 118.1406 C.3 248 SER248 0.0681 3994 HB1 93.5730 137.4291 118.5523 H 248 SER248 0.0577 3995 HB2 94.3751 135.8736 118.6720 H 248 SER248 0.0577 3996 OG 94.2069 136.6522 116.7389 O.3 248 SER248 -0.3930 3997 HG 93.3935 136.2026 116.5329 H 248 SER248 0.2095 3998 N 95.3240 138.3470 120.6350 N.am 249 ARG249 -0.2456 3999 H 94.8190 139.1260 120.2130 H 249 ARG249 0.1312 4000 CA 95.2620 138.1330 122.0630 C.3 249 ARG249 0.0881 4001 HA 96.2740 138.2534 122.4467 H 249 ARG249 0.0557 4002 C 94.6860 136.7190 122.3550 C.2 249 ARG249 0.2213 4003 O 93.8150 136.2890 121.5980 O.2 249 ARG249 -0.2776 4004 CB 94.2965 139.2012 122.6095 C.3 249 ARG249 -0.0258 4005 HB1 93.3400 139.1000 122.0928 H 249 ARG249 0.0286 4006 HB2 94.6753 140.1877 122.3391 H 249 ARG249 0.0286 4007 CG 94.0454 139.1622 124.1259 C.3 249 ARG249 -0.0154 4008 HG1 94.9718 139.3859 124.6556 H 249 ARG249 0.0299 4009 HG2 93.7375 138.1637 124.4348 H 249 ARG249 0.0299 4010 CD 92.9427 140.1471 124.5329 C.3 249 ARG249 0.1045 4011 HD1 91.9961 139.8400 124.0797 H 249 ARG249 0.0711 4012 HD2 93.1793 141.1606 124.1988 H 249 ARG249 0.0711 4013 NE 92.8037 140.1798 125.9915 N.pl3 249 ARG249 -0.4450 4014 HE 93.5639 139.8426 126.5449 H 249 ARG249 0.3153 4015 CZ 91.7266 140.6359 126.6279 C.cat 249 ARG249 0.5062 4016 NH1 91.7127 140.6526 127.9339 N.pl3 249 ARG249 -0.4573 4017 HH11 90.9102 140.9887 128.4225 H 249 ARG249 0.3114 4018 HH12 92.5037 140.3318 128.4500 H 249 ARG249 0.3114 4019 NH2 90.6796 141.0671 125.9748 N.pl3 249 ARG249 -0.4573 4020 HH21 89.8824 141.4197 126.4600 H 249 ARG249 0.3114 4021 HH22 90.6793 141.0408 124.9779 H 249 ARG249 0.3114 4022 N 95.0820 135.9370 123.3680 N.am 250 PRO250 -0.2316 4023 CA 94.6800 134.5320 123.4510 C.3 250 PRO250 0.0907 4024 HA 94.9702 134.0566 122.5120 H 250 PRO250 0.0559 4025 C 93.1920 134.3070 123.7020 C.2 250 PRO250 0.2190 4026 O 92.7270 133.1810 123.5760 O.2 250 PRO250 -0.2778 4027 CB 95.5115 133.9907 124.6276 C.3 250 PRO250 -0.0276 4028 HB1 95.9052 132.9929 124.4310 H 250 PRO250 0.0285 4029 HB2 94.9153 133.9288 125.5400 H 250 PRO250 0.0285 4030 CG 96.6208 135.0160 124.8491 C.3 250 PRO250 -0.0379 4031 HG1 97.4668 134.7746 124.2037 H 250 PRO250 0.0278 4032 HG2 96.9841 135.0326 125.8769 H 250 PRO250 0.0278 4033 CD 96.0154 136.3481 124.4113 C.3 250 PRO250 0.0071 4034 HD1 95.4380 136.8193 125.2066 H 250 PRO250 0.0431 4035 HD2 96.7781 137.0256 124.0305 H 250 PRO250 0.0431 4036 N 92.4530 135.3680 124.0540 N.am 251 THR251 -0.2434 4037 H 92.9380 136.2650 124.0760 H 251 THR251 0.1313 4038 CA 91.0470 135.3960 124.4070 C.3 251 THR251 0.1135 4039 HA 90.7599 134.3704 124.6456 H 251 THR251 0.0583 4040 C 90.1550 135.8210 123.2480 C.2 251 THR251 0.2212 4041 O 88.9850 136.1250 123.4600 O.2 251 THR251 -0.2777 4042 CB 90.8282 136.2720 125.6551 C.3 251 THR251 0.0763 4043 HB 89.7532 136.2535 125.8791 H 251 THR251 0.0611 4044 OG1 91.2505 137.6092 125.4093 O.3 251 THR251 -0.3900 4045 HG1 91.0437 138.1504 126.1622 H 251 THR251 0.2098 4046 CG2 91.5838 135.6992 126.8667 C.3 251 THR251 -0.0370 4047 HG21 91.3354 136.2271 127.7875 H 251 THR251 0.0255 4048 HG22 92.6636 135.7606 126.7277 H 251 THR251 0.0255 4049 HG23 91.3302 134.6499 127.0206 H 251 THR251 0.0255 4050 N 90.6660 135.8880 121.9910 N.am 252 LEU252 -0.2456 4051 H 91.6490 135.6620 121.8380 H 252 LEU252 0.1312 4052 CA 89.8360 136.2770 120.8560 C.3 252 LEU252 0.0880 4053 HA 89.3309 137.1871 121.1801 H 252 LEU252 0.0557 4054 C 88.7370 135.3040 120.4580 C.2 252 LEU252 0.2187 4055 O 87.5700 135.6630 120.3530 O.2 252 LEU252 -0.2778 4056 CB 90.7139 136.6176 119.6374 C.3 252 LEU252 -0.0266 4057 HB1 91.1601 135.7019 119.2472 H 252 LEU252 0.0287 4058 HB2 91.5513 137.2404 119.9541 H 252 LEU252 0.0287 4059 CG 89.9361 137.3447 118.5161 C.3 252 LEU252 -0.0449 4060 HG 89.0121 136.8021 118.3139 H 252 LEU252 0.0296 4061 CD1 89.5589 138.7783 118.9165 C.3 252 LEU252 -0.0626 4062 HD11 89.0421 139.2861 118.1017 H 252 LEU252 0.0232 4063 HD12 90.4443 139.3645 119.1633 H 252 LEU252 0.0232 4064 HD13 88.8915 138.7962 119.7771 H 252 LEU252 0.0232 4065 CD2 90.7186 137.3542 117.2018 C.3 252 LEU252 -0.0626 4066 HD21 90.1446 137.8368 116.4103 H 252 LEU252 0.0232 4067 HD22 90.9284 136.3367 116.8740 H 252 LEU252 0.0232 4068 HD23 91.6552 137.9004 117.3067 H 252 LEU252 0.0232 4069 N 89.1010 134.0380 120.1920 N.am 253 THR253 -0.2434 4070 H 90.0620 133.7560 120.3840 H 253 THR253 0.1313 4071 CA 88.1850 133.0560 119.6440 C.3 253 THR253 0.1135 4072 HA 87.2927 133.5822 119.2997 H 253 THR253 0.0583 4073 C 87.7220 132.1400 120.7430 C.2 253 THR253 0.2212 4074 O 88.4180 131.8950 121.7260 O.2 253 THR253 -0.2777 4075 CB 88.7862 132.3402 118.4204 C.3 253 THR253 0.0763 4076 HB 88.0533 131.5980 118.0811 H 253 THR253 0.0611 4077 OG1 89.9917 131.6791 118.7643 O.3 253 THR253 -0.3900 4078 HG1 90.3766 131.2859 117.9884 H 253 THR253 0.2098 4079 CG2 89.0336 133.3486 117.2818 C.3 253 THR253 -0.0370 4080 HG21 89.3321 132.8587 116.3554 H 253 THR253 0.0255 4081 HG22 89.8127 134.0642 117.5461 H 253 THR253 0.0255 4082 HG23 88.1288 133.9163 117.0636 H 253 THR253 0.0255 4083 N 86.4920 131.6010 120.6220 N.am 254 PHE254 -0.2453 4084 H 85.8810 131.9100 119.8660 H 254 PHE254 0.1312 4085 CA 86.0230 130.5900 121.5480 C.3 254 PHE254 0.0918 4086 HA 86.1337 131.0042 122.5523 H 254 PHE254 0.0560 4087 C 86.8060 129.2880 121.4510 C.2 254 PHE254 0.2190 4088 O 86.9930 128.7320 120.3700 O.2 254 PHE254 -0.2778 4089 CB 84.5421 130.2889 121.2595 C.3 254 PHE254 -0.0036 4090 HB1 84.1452 129.5958 122.0026 H 254 PHE254 0.0333 4091 HB2 84.4354 129.7959 120.2917 H 254 PHE254 0.0333 4092 CG 83.6973 131.5344 121.2680 C.ar 254 PHE254 -0.0454 4093 CD1 83.3903 132.1685 122.4680 C.ar 254 PHE254 -0.0585 4094 HD1 83.7554 131.7666 123.4019 H 254 PHE254 0.0620 4095 CD2 83.2206 132.0747 120.0763 C.ar 254 PHE254 -0.0585 4096 HD2 83.4494 131.5984 119.1340 H 254 PHE254 0.0620 4097 CE1 82.6239 133.3266 122.4779 C.ar 254 PHE254 -0.0615 4098 HE1 82.3952 133.8158 123.4136 H 254 PHE254 0.0618 4099 CE2 82.4536 133.2323 120.0839 C.ar 254 PHE254 -0.0615 4100 HE2 82.0902 133.6473 119.1550 H 254 PHE254 0.0618 4101 CZ 82.1553 133.8595 121.2853 C.ar 254 PHE254 -0.0617 4102 HZ 81.5616 134.7621 121.2924 H 254 PHE254 0.0618 4103 N 87.2190 128.7470 122.6210 N.am 255 VAL255 -0.2454 4104 H 86.9890 129.2580 123.4730 H 255 VAL255 0.1312 4105 CA 87.9650 127.4980 122.7780 C.3 255 VAL255 0.0901 4106 HA 88.8903 127.6317 122.2158 H 255 VAL255 0.0560 4107 C 87.2350 126.3050 122.1690 C.2 255 VAL255 0.2189 4108 O 87.8250 125.4640 121.4940 O.2 255 VAL255 -0.2778 4109 CB 88.2939 127.2630 124.2686 C.3 255 VAL255 -0.0227 4110 HB 87.3551 127.1605 124.8152 H 255 VAL255 0.0315 4111 CG1 89.1041 125.9729 124.4870 C.3 255 VAL255 -0.0608 4112 HG11 89.3543 125.8412 125.5401 H 255 VAL255 0.0233 4113 HG12 90.0372 125.9938 123.9235 H 255 VAL255 0.0233 4114 HG13 88.5484 125.0878 124.1773 H 255 VAL255 0.0233 4115 CG2 89.0497 128.4579 124.8725 C.3 255 VAL255 -0.0608 4116 HG21 89.2959 128.2747 125.9188 H 255 VAL255 0.0233 4117 HG22 88.4609 129.3746 124.8388 H 255 VAL255 0.0233 4118 HG23 89.9834 128.6419 124.3404 H 255 VAL255 0.0233 4119 N 85.8960 126.2410 122.3450 N.am 256 TYR256 -0.2453 4120 H 85.4580 126.9520 122.9310 H 256 TYR256 0.1312 4121 CA 85.0400 125.2270 121.7550 C.3 256 TYR256 0.0917 4122 HA 85.4122 124.2658 122.1134 H 256 TYR256 0.0560 4123 C 85.1060 125.2310 120.2270 C.2 256 TYR256 0.2190 4124 O 85.2290 124.1830 119.6000 O.2 256 TYR256 -0.2778 4125 CB 83.6007 125.4628 122.2435 C.3 256 TYR256 -0.0036 4126 HB1 83.1750 126.3554 121.7826 H 256 TYR256 0.0333 4127 HB2 83.6097 125.6571 123.3167 H 256 TYR256 0.0333 4128 CG 82.7002 124.2831 121.9837 C.ar 256 TYR256 -0.0453 4129 CD1 82.0768 124.1188 120.7492 C.ar 256 TYR256 -0.0561 4130 HD1 82.2381 124.8381 119.9593 H 256 TYR256 0.0621 4131 CD2 82.4738 123.3415 122.9836 C.ar 256 TYR256 -0.0561 4132 HD2 82.9436 123.4520 123.9503 H 256 TYR256 0.0621 4133 CE1 81.2570 123.0224 120.5130 C.ar 256 TYR256 -0.0317 4134 HE1 80.7855 122.8907 119.5504 H 256 TYR256 0.0643 4135 CE2 81.6395 122.2555 122.7547 C.ar 256 TYR256 -0.0317 4136 HE2 81.4663 121.5319 123.5372 H 256 TYR256 0.0643 4137 CZ 81.0388 122.0899 121.5156 C.ar 256 TYR256 0.0726 4138 OH 80.2313 120.9977 121.2760 O.3 256 TYR256 -0.3598 4139 HH 80.1820 120.4593 122.0558 H 256 TYR256 0.2173 4140 N 85.0760 126.4260 119.5990 N.am 257 LEU257 -0.2456 4141 H 84.9590 127.2650 120.1670 H 257 LEU257 0.1312 4142 CA 85.2000 126.5840 118.1630 C.3 257 LEU257 0.0880 4143 HA 84.4460 125.9340 117.7176 H 257 LEU257 0.0557 4144 C 86.5580 126.1560 117.6330 C.2 257 LEU257 0.2187 4145 O 86.6540 125.5110 116.5900 O.2 257 LEU257 -0.2778 4146 CB 84.9086 128.0552 117.8139 C.3 257 LEU257 -0.0266 4147 HB1 85.6080 128.6955 118.3506 H 257 LEU257 0.0287 4148 HB2 83.9196 128.3167 118.1917 H 257 LEU257 0.0287 4149 CG 84.9816 128.4010 116.3143 C.3 257 LEU257 -0.0449 4150 HG 85.9838 128.1723 115.9493 H 257 LEU257 0.0296 4151 CD1 83.9820 127.5826 115.4860 C.3 257 LEU257 -0.0626 4152 HD11 84.0220 127.8674 114.4344 H 257 LEU257 0.0232 4153 HD12 82.9605 127.7370 115.8343 H 257 LEU257 0.0232 4154 HD13 84.1982 126.5155 115.5384 H 257 LEU257 0.0232 4155 CD2 84.7591 129.9041 116.1032 C.3 257 LEU257 -0.0626 4156 HD21 84.8473 130.1696 115.0494 H 257 LEU257 0.0232 4157 HD22 85.4943 130.4911 116.6545 H 257 LEU257 0.0232 4158 HD23 83.7680 130.2072 116.4422 H 257 LEU257 0.0232 4159 N 87.6450 126.4690 118.3750 N.am 258 TYR258 -0.2453 4160 H 87.5220 127.0790 119.1830 H 258 TYR258 0.1312 4161 CA 88.9790 125.9780 118.0750 C.3 258 TYR258 0.0917 4162 HA 89.2376 126.3473 117.0809 H 258 TYR258 0.0560 4163 C 89.0190 124.4420 118.0950 C.2 258 TYR258 0.2190 4164 O 89.4550 123.8180 117.1350 O.2 258 TYR258 -0.2778 4165 CB 89.8883 126.5366 119.1773 C.3 258 TYR258 -0.0036 4166 HB1 89.9797 125.8630 120.0312 H 258 TYR258 0.0333 4167 HB2 89.4662 127.4574 119.5842 H 258 TYR258 0.0333 4168 CG 91.2388 126.8498 118.6260 C.ar 258 TYR258 -0.0453 4169 CD1 92.1880 125.8511 118.4555 C.ar 258 TYR258 -0.0561 4170 HD1 91.9605 124.8362 118.7483 H 258 TYR258 0.0621 4171 CD2 91.5178 128.1461 118.2220 C.ar 258 TYR258 -0.0561 4172 HD2 90.7639 128.9078 118.3346 H 258 TYR258 0.0621 4173 CE1 93.4212 126.1567 117.9027 C.ar 258 TYR258 -0.0317 4174 HE1 94.1600 125.3791 117.7875 H 258 TYR258 0.0643 4175 CE2 92.7492 128.4569 117.6787 C.ar 258 TYR258 -0.0317 4176 HE2 92.9709 129.4676 117.3724 H 258 TYR258 0.0643 4177 CZ 93.6984 127.4633 117.5266 C.ar 258 TYR258 0.0726 4178 OH 94.9470 127.8153 117.0790 O.3 258 TYR258 -0.3598 4179 HH 95.3561 127.0690 116.6597 H 258 TYR258 0.2173 4180 N 88.4580 123.8040 119.1480 N.am 259 ASN259 -0.2452 4181 H 88.0940 124.3750 119.9110 H 259 ASN259 0.1312 4182 CA 88.3380 122.3530 119.2660 C.3 259 ASN259 0.0957 4183 HA 89.3402 121.9418 119.1816 H 259 ASN259 0.0562 4184 C 87.4920 121.6880 118.1790 C.2 259 ASN259 0.2191 4185 O 87.7860 120.5870 117.7190 O.2 259 ASN259 -0.2778 4186 CB 87.7537 122.0100 120.6464 C.3 259 ASN259 0.0446 4187 HB1 87.6345 120.9320 120.7587 H 259 ASN259 0.0375 4188 HB2 86.7681 122.4598 120.7668 H 259 ASN259 0.0375 4189 CG 88.6577 122.5019 121.7884 C.2 259 ASN259 0.2000 4190 OD1 89.8063 122.8792 121.5961 O.2 259 ASN259 -0.2797 4191 ND2 88.0644 122.4697 122.9908 N.am 259 ASN259 -0.2723 4192 HD21 88.5762 122.7758 123.7927 H 259 ASN259 0.1266 4193 HD22 87.1264 122.1462 123.1067 H 259 ASN259 0.1266 4194 N 86.4040 122.3440 117.7440 N.am 260 ALA260 -0.2459 4195 H 86.1060 123.1750 118.2560 H 260 ALA260 0.1312 4196 CA 85.6290 121.9390 116.5890 C.3 260 ALA260 0.0850 4197 HA 85.3468 120.8995 116.7520 H 260 ALA260 0.0554 4198 C 86.3870 122.0200 115.2580 C.2 260 ALA260 0.2184 4199 O 86.2860 121.1420 114.4050 O.2 260 ALA260 -0.2778 4200 CB 84.3695 122.8110 116.5304 C.3 260 ALA260 -0.0411 4201 HB1 83.7085 122.4997 115.7209 H 260 ALA260 0.0249 4202 HB2 84.6191 123.8610 116.3757 H 260 ALA260 0.0249 4203 HB3 83.8074 122.7413 117.4620 H 260 ALA260 0.0249 4204 N 87.1960 123.0800 115.0450 N.am 261 ALA261 -0.2459 4205 H 87.1720 123.8480 115.7160 H 261 ALA261 0.1312 4206 CA 88.0970 123.1840 113.9130 C.3 261 ALA261 0.0850 4207 HA 87.4876 123.0407 113.0194 H 261 ALA261 0.0554 4208 C 89.1890 122.1030 113.9200 C.2 261 ALA261 0.2184 4209 O 89.4970 121.5160 112.8830 O.2 261 ALA261 -0.2778 4210 CB 88.7145 124.5870 113.8911 C.3 261 ALA261 -0.0411 4211 HB1 89.2936 124.7440 112.9819 H 261 ALA261 0.0249 4212 HB2 89.3704 124.7545 114.7456 H 261 ALA261 0.0249 4213 HB3 87.9378 125.3515 113.9184 H 261 ALA261 0.0249 4214 N 89.7520 121.7820 115.1160 N.am 262 ILE262 -0.2454 4215 H 89.5060 122.3650 115.9160 H 262 ILE262 0.1312 4216 CA 90.6830 120.6710 115.3610 C.3 262 ILE262 0.0903 4217 HA 91.5681 120.8747 114.7576 H 262 ILE262 0.0560 4218 C 90.1290 119.3500 114.8840 C.2 262 ILE262 0.2190 4219 O 90.7490 118.6180 114.1130 O.2 262 ILE262 -0.2778 4220 CB 91.0655 120.6226 116.8718 C.3 262 ILE262 -0.0201 4221 HB 90.1597 120.7928 117.4469 H 262 ILE262 0.0318 4222 CG1 92.0647 121.7402 117.2180 C.3 262 ILE262 -0.0514 4223 HG11 91.7607 122.6706 116.7386 H 262 ILE262 0.0266 4224 HG12 93.0273 121.4576 116.7980 H 262 ILE262 0.0266 4225 CG2 91.6402 119.2606 117.3196 C.3 262 ILE262 -0.0605 4226 HG21 91.9252 119.2635 118.3704 H 262 ILE262 0.0233 4227 HG22 92.5240 119.0000 116.7373 H 262 ILE262 0.0233 4228 HG23 90.9144 118.4552 117.2113 H 262 ILE262 0.0233 4229 CD1 92.2657 122.0150 118.7148 C.3 262 ILE262 -0.0650 4230 HD11 93.0685 122.7374 118.8601 H 262 ILE262 0.0230 4231 HD12 92.5394 121.1186 119.2691 H 262 ILE262 0.0230 4232 HD13 91.3734 122.4357 119.1715 H 262 ILE262 0.0230 4233 N 88.9050 119.0280 115.3390 N.am 263 SER263 -0.2436 4234 H 88.4300 119.6950 115.9480 H 263 SER263 0.1312 4235 CA 88.2200 117.7910 115.0170 C.3 263 SER263 0.1109 4236 HA 88.9393 116.9961 115.2128 H 263 SER263 0.0580 4237 C 87.8340 117.6980 113.5530 C.2 263 SER263 0.2209 4238 O 87.9520 116.6350 112.9470 O.2 263 SER263 -0.2777 4239 CB 87.0070 117.5788 115.9354 C.3 263 SER263 0.0681 4240 HB1 87.3347 117.6661 116.9767 H 263 SER263 0.0577 4241 HB2 86.6300 116.5593 115.7913 H 263 SER263 0.0577 4242 OG 85.9783 118.5250 115.6765 O.3 263 SER263 -0.3930 4243 HG 85.2023 118.3470 116.2019 H 263 SER263 0.2095 4244 N 87.4200 118.8240 112.9330 N.am 264 LEU264 -0.2456 4245 H 87.2500 119.6500 113.5060 H 264 LEU264 0.1312 4246 CA 87.2020 118.9320 111.5000 C.3 264 LEU264 0.0880 4247 HA 86.4635 118.1729 111.2402 H 264 LEU264 0.0557 4248 C 88.4540 118.6760 110.6630 C.2 264 LEU264 0.2185 4249 O 88.4160 117.9670 109.6570 O.2 264 LEU264 -0.2778 4250 CB 86.6446 120.3404 111.2168 C.3 264 LEU264 -0.0266 4251 HB1 87.3097 121.0765 111.6680 H 264 LEU264 0.0287 4252 HB2 85.6918 120.4510 111.7355 H 264 LEU264 0.0287 4253 CG 86.4621 120.6995 109.7275 C.3 264 LEU264 -0.0449 4254 HG 87.4349 120.6578 109.2364 H 264 LEU264 0.0296 4255 CD1 85.5264 119.7211 109.0053 C.3 264 LEU264 -0.0626 4256 HD11 85.4030 120.0020 107.9590 H 264 LEU264 0.0232 4257 HD12 84.5391 119.7070 109.4672 H 264 LEU264 0.0232 4258 HD13 85.9195 118.7047 109.0221 H 264 LEU264 0.0232 4259 CD2 85.9576 122.1398 109.5822 C.3 264 LEU264 -0.0626 4260 HD21 85.8833 122.4245 108.5324 H 264 LEU264 0.0232 4261 HD22 86.6339 122.8420 110.0701 H 264 LEU264 0.0232 4262 HD23 84.9721 122.2595 110.0329 H 264 LEU264 0.0232 4263 N 89.6190 119.2130 111.0860 N.am 265 GLY265 -0.2485 4264 H 89.6040 119.8510 111.8820 H 265 GLY265 0.1309 4265 CA 90.9000 118.9170 110.4490 C.3 265 GLY265 0.0765 4266 HA1 91.6372 119.5789 110.9007 H 265 GLY265 0.0521 4267 HA2 90.8170 119.1560 109.3876 H 265 GLY265 0.0521 4268 C 91.3390 117.4790 110.6230 C.2 265 GLY265 0.2155 4269 O 91.8450 116.8590 109.6960 O.2 265 GLY265 -0.2781 4270 N 91.0850 116.8720 111.7980 N.am 266 TYR266 -0.2456 4271 H 90.7410 117.4410 112.5720 H 266 TYR266 0.1312 4272 CA 91.2760 115.4400 112.0230 C.3 266 TYR266 0.0917 4273 HA 92.2899 115.2189 111.6862 H 266 TYR266 0.0560 4274 C 90.3820 114.5240 111.2200 C.2 266 TYR266 0.2190 4275 O 90.7520 113.4000 110.8940 O.2 266 TYR266 -0.2778 4276 CB 91.1201 115.1054 113.5198 C.3 266 TYR266 -0.0036 4277 HB1 90.8345 114.0609 113.6598 H 266 TYR266 0.0333 4278 HB2 90.3093 115.6931 113.9486 H 266 TYR266 0.0333 4279 CG 92.3860 115.2919 114.3163 C.ar 266 TYR266 -0.0453 4280 CD1 93.5253 114.5528 114.0040 C.ar 266 TYR266 -0.0561 4281 HD1 93.5301 113.8975 113.1447 H 266 TYR266 0.0621 4282 CD2 92.4030 116.1080 115.4439 C.ar 266 TYR266 -0.0561 4283 HD2 91.5240 116.6726 115.7167 H 266 TYR266 0.0621 4284 CE1 94.6519 114.6142 114.8121 C.ar 266 TYR266 -0.0317 4285 HE1 95.5253 114.0256 114.5821 H 266 TYR266 0.0643 4286 CE2 93.5296 116.1665 116.2554 C.ar 266 TYR266 -0.0317 4287 HE2 93.5323 116.7736 117.1487 H 266 TYR266 0.0643 4288 CZ 94.6483 115.4087 115.9453 C.ar 266 TYR266 0.0726 4289 OH 95.7321 115.3969 116.7951 O.3 266 TYR266 -0.3598 4290 HH 96.4694 115.8536 116.3982 H 266 TYR266 0.2173 4291 N 89.1690 114.9810 110.8720 N.am 267 ALA267 -0.2459 4292 H 88.8760 115.8930 111.2220 H 267 ALA267 0.1312 4293 CA 88.2590 114.2470 110.0280 C.3 267 ALA267 0.0850 4294 HA 88.1422 113.2591 110.4766 H 267 ALA267 0.0554 4295 C 88.7840 114.0570 108.6110 C.2 267 ALA267 0.2184 4296 O 88.3640 113.1300 107.9240 O.2 267 ALA267 -0.2778 4297 CB 86.9065 114.9680 110.0045 C.3 267 ALA267 -0.0411 4298 HB1 86.1626 114.3931 109.4521 H 267 ALA267 0.0249 4299 HB2 86.9826 115.9489 109.5363 H 267 ALA267 0.0249 4300 HB3 86.5283 115.1141 111.0165 H 267 ALA267 0.0249 4301 N 89.7790 114.8680 108.1660 N.am 268 ASN268 -0.2452 4302 H 90.0430 115.6640 108.7470 H 268 ASN268 0.1312 4303 CA 90.4910 114.6740 106.9150 C.3 268 ASN268 0.0957 4304 HA 89.7437 114.7435 106.1269 H 268 ASN268 0.0562 4305 C 91.1180 113.2810 106.8600 C.2 268 ASN268 0.2192 4306 O 91.0130 112.6130 105.8400 O.2 268 ASN268 -0.2778 4307 CB 91.5778 115.7462 106.7123 C.3 268 ASN268 0.0446 4308 HB1 92.3107 115.7022 107.5173 H 268 ASN268 0.0375 4309 HB2 91.1444 116.7457 106.7249 H 268 ASN268 0.0375 4310 CG 92.3278 115.5492 105.3801 C.2 268 ASN268 0.2000 4311 OD1 93.5325 115.3513 105.3450 O.2 268 ASN268 -0.2797 4312 ND2 91.5511 115.5981 104.2914 N.am 268 ASN268 -0.2723 4313 HD21 91.9713 115.3895 103.4087 H 268 ASN268 0.1266 4314 HD22 90.5797 115.8237 104.3373 H 268 ASN268 0.1266 4315 N 91.6920 112.7830 107.9780 N.am 269 SER269 -0.2436 4316 H 91.7070 113.3730 108.8100 H 269 SER269 0.1312 4317 CA 92.2910 111.4580 108.0730 C.3 269 SER269 0.1109 4318 HA 93.0882 111.4392 107.3278 H 269 SER269 0.0580 4319 C 91.3170 110.3340 107.7510 C.2 269 SER269 0.2209 4320 O 91.6380 109.3480 107.1060 O.2 269 SER269 -0.2777 4321 CB 92.8948 111.2768 109.4700 C.3 269 SER269 0.0681 4322 HB1 93.6666 110.5023 109.3963 H 269 SER269 0.0577 4323 HB2 92.1312 110.9321 110.1733 H 269 SER269 0.0577 4324 OG 93.4226 112.5124 109.9506 O.3 269 SER269 -0.3930 4325 HG 93.9835 112.3789 110.7084 H 269 SER269 0.2095 4326 N 90.0610 110.4600 108.2180 N.am 270 CYS270 -0.2448 4327 H 89.8700 111.2220 108.8680 H 270 CYS270 0.1312 4328 CA 88.9590 109.5840 107.8590 C.3 270 CYS270 0.0965 4329 HA 89.3309 108.5630 107.9608 H 270 CYS270 0.0565 4330 C 88.4460 109.7470 106.4250 C.2 270 CYS270 0.2195 4331 O 88.0770 108.7790 105.7670 O.2 270 CYS270 -0.2778 4332 CB 87.8080 109.8076 108.8509 C.3 270 CYS270 0.0147 4333 HB1 86.9919 109.1183 108.6310 H 270 CYS270 0.0394 4334 HB2 87.4063 110.8154 108.7388 H 270 CYS270 0.0394 4335 SG 88.2920 109.5769 110.5835 S.3 270 CYS270 -0.1762 4336 HG 87.2079 109.5797 111.3646 H 270 CYS270 0.1017 4337 N 88.3680 110.9990 105.9230 N.am 271 LEU271 -0.2456 4338 H 88.6250 111.7700 106.5400 H 271 LEU271 0.1312 4339 CA 87.9450 111.3340 104.5690 C.3 271 LEU271 0.0880 4340 HA 87.0064 110.8088 104.3955 H 271 LEU271 0.0557 4341 C 88.9020 110.9010 103.4630 C.2 271 LEU271 0.2187 4342 O 88.4660 110.4660 102.3930 O.2 271 LEU271 -0.2778 4343 CB 87.7334 112.8566 104.5021 C.3 271 LEU271 -0.0266 4344 HB1 87.6010 113.1740 103.4723 H 271 LEU271 0.0287 4345 HB2 88.6477 113.3428 104.8399 H 271 LEU271 0.0287 4346 CG 86.5361 113.3750 105.3212 C.3 271 LEU271 -0.0449 4347 HG 86.5742 112.9437 106.3204 H 271 LEU271 0.0296 4348 CD1 86.6080 114.9010 105.4721 C.3 271 LEU271 -0.0626 4349 HD11 85.7675 115.2785 106.0546 H 271 LEU271 0.0232 4350 HD12 86.5911 115.3943 104.4995 H 271 LEU271 0.0232 4351 HD13 87.5208 115.2044 105.9838 H 271 LEU271 0.0232 4352 CD2 85.1965 112.9678 104.6930 C.3 271 LEU271 -0.0626 4353 HD21 84.3602 113.3422 105.2836 H 271 LEU271 0.0232 4354 HD22 85.0911 111.8854 104.6310 H 271 LEU271 0.0232 4355 HD23 85.0969 113.3728 103.6866 H 271 LEU271 0.0232 4356 N 90.2300 111.0220 103.7020 N.am 272 ASN272 -0.2452 4357 H 90.5120 111.3980 104.6070 H 272 ASN272 0.1312 4358 CA 91.2870 110.6570 102.7670 C.3 272 ASN272 0.0959 4359 HA 91.2012 111.3324 101.9167 H 272 ASN272 0.0562 4360 C 91.2410 109.2320 102.2470 C.2 272 ASN272 0.2218 4361 O 91.2700 109.1050 101.0280 O.2 272 ASN272 -0.2776 4362 CB 92.6607 110.8297 103.4528 C.3 272 ASN272 0.0446 4363 HB1 93.4566 110.4039 102.8444 H 272 ASN272 0.0375 4364 HB2 92.6893 110.3188 104.4167 H 272 ASN272 0.0375 4365 CG 93.0377 112.2950 103.6652 C.2 272 ASN272 0.2000 4366 OD1 92.6023 113.1881 102.9471 O.2 272 ASN272 -0.2797 4367 ND2 93.8796 112.4721 104.6950 N.am 272 ASN272 -0.2723 4368 HD21 94.1893 113.3891 104.9413 H 272 ASN272 0.1266 4369 HD22 94.2102 111.6924 105.2350 H 272 ASN272 0.1266 4370 N 91.1270 108.1200 102.9660 N.am 273 PRO273 -0.2316 4371 CA 91.0500 106.8170 102.3340 C.3 273 PRO273 0.0907 4372 HA 91.9741 106.6499 101.7783 H 273 PRO273 0.0559 4373 C 89.8660 106.7320 101.3980 C.2 273 PRO273 0.2189 4374 O 90.0820 106.3860 100.2430 O.2 273 PRO273 -0.2778 4375 CB 90.9159 105.8532 103.5267 C.3 273 PRO273 -0.0276 4376 HB1 91.8902 105.4176 103.7512 H 273 PRO273 0.0285 4377 HB2 90.2176 105.0343 103.3556 H 273 PRO273 0.0285 4378 CG 90.4750 106.7176 104.7043 C.3 273 PRO273 -0.0379 4379 HG1 90.7650 106.3092 105.6711 H 273 PRO273 0.0278 4380 HG2 89.3891 106.8102 104.6980 H 273 PRO273 0.0278 4381 CD 91.0979 108.0788 104.4246 C.3 273 PRO273 0.0071 4382 HD1 90.5150 108.8913 104.8446 H 273 PRO273 0.0431 4383 HD2 92.1314 108.1336 104.7753 H 273 PRO273 0.0431 4384 N 88.6440 107.1290 101.8210 N.am 274 PHE274 -0.2453 4385 H 88.5660 107.5240 102.7580 H 274 PHE274 0.1312 4386 CA 87.4340 107.0270 101.0210 C.3 274 PHE274 0.0917 4387 HA 87.2601 105.9635 100.8549 H 274 PHE274 0.0560 4388 C 87.5940 107.7020 99.6630 C.2 274 PHE274 0.2190 4389 O 87.4250 107.0590 98.6340 O.2 274 PHE274 -0.2778 4390 CB 86.2693 107.6486 101.8078 C.3 274 PHE274 -0.0036 4391 HB1 86.5092 108.6751 102.0898 H 274 PHE274 0.0333 4392 HB2 86.1247 107.1049 102.7416 H 274 PHE274 0.0333 4393 CG 84.9810 107.6291 101.0262 C.ar 274 PHE274 -0.0454 4394 CD1 84.5007 108.7909 100.4280 C.ar 274 PHE274 -0.0585 4395 HD1 85.0433 109.7189 100.5380 H 274 PHE274 0.0620 4396 CD2 84.2789 106.4402 100.8546 C.ar 274 PHE274 -0.0585 4397 HD2 84.6458 105.5284 101.3027 H 274 PHE274 0.0620 4398 CE1 83.3348 108.7664 99.6745 C.ar 274 PHE274 -0.0615 4399 HE1 82.9716 109.6729 99.2130 H 274 PHE274 0.0618 4400 CE2 83.1130 106.4126 100.1005 C.ar 274 PHE274 -0.0615 4401 HE2 82.5750 105.4850 99.9718 H 274 PHE274 0.0618 4402 CZ 82.6397 107.5763 99.5106 C.ar 274 PHE274 -0.0617 4403 HZ 81.7327 107.5561 98.9244 H 274 PHE274 0.0618 4404 N 88.0250 108.9810 99.6340 N.am 275 VAL275 -0.2454 4405 H 88.2250 109.4490 100.5180 H 275 VAL275 0.1312 4406 CA 88.2170 109.7200 98.3970 C.3 275 VAL275 0.0901 4407 HA 87.2761 109.5939 97.8585 H 275 VAL275 0.0560 4408 C 89.3000 109.1250 97.4820 C.2 275 VAL275 0.2189 4409 O 89.1370 109.0480 96.2650 O.2 275 VAL275 -0.2778 4410 CB 88.3902 111.2286 98.6580 C.3 275 VAL275 -0.0227 4411 HB 87.5973 111.5113 99.3455 H 275 VAL275 0.0315 4412 CG1 89.7195 111.5752 99.3314 C.3 275 VAL275 -0.0608 4413 HG11 89.7697 112.6315 99.5947 H 275 VAL275 0.0233 4414 HG12 90.5546 111.3653 98.6676 H 275 VAL275 0.0233 4415 HG13 89.8499 110.9975 100.2425 H 275 VAL275 0.0233 4416 CG2 88.1931 112.0624 97.3819 C.3 275 VAL275 -0.0608 4417 HG21 88.2458 113.1298 97.5996 H 275 VAL275 0.0233 4418 HG22 87.2207 111.8672 96.9292 H 275 VAL275 0.0233 4419 HG23 88.9583 111.8375 96.6388 H 275 VAL275 0.0233 4420 N 90.4330 108.6490 98.0550 N.am 276 TYR276 -0.2453 4421 H 90.4840 108.6500 99.0740 H 276 TYR276 0.1312 4422 CA 91.5810 108.1370 97.3250 C.3 276 TYR276 0.0917 4423 HA 91.6302 108.7245 96.4071 H 276 TYR276 0.0560 4424 C 91.4150 106.6910 96.8350 C.2 276 TYR276 0.2190 4425 O 92.1280 106.2740 95.9210 O.2 276 TYR276 -0.2778 4426 CB 92.8907 108.3579 98.1070 C.3 276 TYR276 -0.0036 4427 HB1 93.6736 107.6853 97.7532 H 276 TYR276 0.0333 4428 HB2 92.7534 108.1358 99.1661 H 276 TYR276 0.0333 4429 CG 93.3843 109.7712 97.9162 C.ar 276 TYR276 -0.0453 4430 CD1 93.1609 110.7450 98.8829 C.ar 276 TYR276 -0.0561 4431 HD1 92.6845 110.4938 99.8157 H 276 TYR276 0.0621 4432 CD2 94.0026 110.1428 96.7243 C.ar 276 TYR276 -0.0561 4433 HD2 94.1826 109.4012 95.9604 H 276 TYR276 0.0621 4434 CE1 93.4925 112.0704 98.6442 C.ar 276 TYR276 -0.0317 4435 HE1 93.2583 112.8167 99.3878 H 276 TYR276 0.0643 4436 CE2 94.3612 111.4662 96.4941 C.ar 276 TYR276 -0.0317 4437 HE2 94.8332 111.7548 95.5669 H 276 TYR276 0.0643 4438 CZ 94.1055 112.4321 97.4543 C.ar 276 TYR276 0.0726 4439 OH 94.4574 113.7457 97.2206 O.3 276 TYR276 -0.3598 4440 HH 94.2499 114.2655 97.9879 H 276 TYR276 0.2173 4441 N 90.4470 105.9190 97.3890 N.am 277 ILE277 -0.2454 4442 H 89.8650 106.3300 98.1180 H 277 ILE277 0.1312 4443 CA 90.1900 104.5380 97.0040 C.3 277 ILE277 0.0903 4444 HA 91.0039 104.2045 96.3599 H 277 ILE277 0.0560 4445 C 88.8950 104.3730 96.2190 C.2 277 ILE277 0.2189 4446 O 88.8270 103.5770 95.2880 O.2 277 ILE277 -0.2778 4447 CB 90.1453 103.6381 98.2652 C.3 277 ILE277 -0.0201 4448 HB 90.1114 102.6030 97.9261 H 277 ILE277 0.0318 4449 CG1 88.8567 103.8503 99.0997 C.3 277 ILE277 -0.0514 4450 HG11 88.0118 103.4149 98.5660 H 277 ILE277 0.0266 4451 HG12 88.6273 104.9083 99.1850 H 277 ILE277 0.0266 4452 CG2 91.4477 103.7602 99.0784 C.3 277 ILE277 -0.0605 4453 HG21 91.5094 102.9921 99.8479 H 277 ILE277 0.0233 4454 HG22 91.5544 104.7246 99.5670 H 277 ILE277 0.0233 4455 HG23 92.3169 103.6385 98.4345 H 277 ILE277 0.0233 4456 CD1 88.8734 103.2362 100.4973 C.3 277 ILE277 -0.0650 4457 HD11 87.9041 103.3526 100.9818 H 277 ILE277 0.0230 4458 HD12 89.6090 103.7345 101.1254 H 277 ILE277 0.0230 4459 HD13 89.1001 102.1714 100.4544 H 277 ILE277 0.0230 4460 N 87.8140 105.1330 96.5290 N.am 278 VAL278 -0.2454 4461 H 87.9260 105.9050 97.1870 H 278 VAL278 0.1312 4462 CA 86.4960 104.8820 95.9510 C.3 278 VAL278 0.0901 4463 HA 86.3227 103.8116 96.0752 H 278 VAL278 0.0560 4464 C 86.4310 105.1840 94.4690 C.2 278 VAL278 0.2189 4465 O 85.7590 104.5270 93.6760 O.2 278 VAL278 -0.2778 4466 CB 85.4157 105.6580 96.7388 C.3 278 VAL278 -0.0227 4467 HB 85.6296 105.5115 97.7984 H 278 VAL278 0.0315 4468 CG1 85.4256 107.1743 96.4696 C.3 278 VAL278 -0.0608 4469 HG11 84.8081 107.7009 97.1971 H 278 VAL278 0.0233 4470 HG12 85.0332 107.4066 95.4797 H 278 VAL278 0.0233 4471 HG13 86.4299 107.5916 96.5280 H 278 VAL278 0.0233 4472 CG2 84.0135 105.0829 96.4919 C.3 278 VAL278 -0.0608 4473 HG21 83.2704 105.5908 97.1071 H 278 VAL278 0.0233 4474 HG22 83.9753 104.0216 96.7381 H 278 VAL278 0.0233 4475 HG23 83.7143 105.1966 95.4499 H 278 VAL278 0.0233 4476 N 87.1750 106.2160 94.0470 N.am 279 LEU279 -0.2456 4477 H 87.7760 106.6920 94.7200 H 279 LEU279 0.1312 4478 CA 87.1630 106.6810 92.6850 C.3 279 LEU279 0.0880 4479 HA 86.1305 106.6714 92.3334 H 279 LEU279 0.0557 4480 C 87.9940 105.8280 91.7530 C.2 279 LEU279 0.2187 4481 O 87.8350 105.9380 90.5390 O.2 279 LEU279 -0.2778 4482 CB 87.7291 108.1173 92.6703 C.3 279 LEU279 -0.0266 4483 HB1 87.7457 108.5014 91.6495 H 279 LEU279 0.0287 4484 HB2 88.7710 108.0838 92.9949 H 279 LEU279 0.0287 4485 CG 86.9808 109.1244 93.5664 C.3 279 LEU279 -0.0449 4486 HG 86.9394 108.7343 94.5829 H 279 LEU279 0.0296 4487 CD1 87.7473 110.4518 93.6427 C.3 279 LEU279 -0.0626 4488 HD11 87.2335 111.1694 94.2835 H 279 LEU279 0.0232 4489 HD12 87.8601 110.8999 92.6568 H 279 LEU279 0.0232 4490 HD13 88.7468 110.3065 94.0527 H 279 LEU279 0.0232 4491 CD2 85.5424 109.3617 93.0881 C.3 279 LEU279 -0.0626 4492 HD21 85.0387 110.0919 93.7225 H 279 LEU279 0.0232 4493 HD22 84.9542 108.4449 93.1208 H 279 LEU279 0.0232 4494 HD23 85.5232 109.7413 92.0664 H 279 LEU279 0.0232 4495 N 88.8660 104.9570 92.2990 N.am 280 CYS280 -0.2449 4496 H 88.9390 104.9230 93.3160 H 280 CYS280 0.1312 4497 CA 89.7040 104.0670 91.5240 C.3 280 CYS280 0.0965 4498 HA 89.8412 104.4827 90.5235 H 280 CYS280 0.0565 4499 C 89.0180 102.7190 91.4220 C.2 280 CYS280 0.2195 4500 O 88.5790 102.1360 92.4120 O.2 280 CYS280 -0.2778 4501 CB 91.0541 103.9223 92.2375 C.3 280 CYS280 0.0147 4502 HB1 90.8944 103.6483 93.2803 H 280 CYS280 0.0394 4503 HB2 91.5589 104.8882 92.2558 H 280 CYS280 0.0394 4504 SG 92.1639 102.7042 91.4792 S.3 280 CYS280 -0.1762 4505 HG 93.3029 102.6386 92.1753 H 280 CYS280 0.1017 4506 N 88.9200 102.1780 90.1990 N.am 281 GLU281 -0.2456 4507 H 89.2790 102.7220 89.4140 H 281 GLU281 0.1312 4508 CA 88.3450 100.8850 89.9050 C.3 281 GLU281 0.0883 4509 HA 87.3422 100.9023 90.3346 H 281 GLU281 0.0557 4510 C 89.0610 99.7270 90.5680 C.2 281 GLU281 0.2188 4511 O 88.4220 98.8230 91.0940 O.2 281 GLU281 -0.2778 4512 CB 88.2281 100.8254 88.3672 C.3 281 GLU281 -0.0193 4513 HB1 88.2424 99.7861 88.0431 H 281 GLU281 0.0290 4514 HB2 89.1143 101.2792 87.9206 H 281 GLU281 0.0290 4515 CG 86.9527 101.4832 87.7620 C.3 281 GLU281 0.0356 4516 HG1 86.0977 100.8515 88.0013 H 281 GLU281 0.0374 4517 HG2 87.0303 101.4798 86.6755 H 281 GLU281 0.0374 4518 CD 86.5664 102.9334 88.1740 C.2 281 GLU281 0.1760 4519 OE1 87.4068 103.7732 88.4530 O.co2 281 GLU281 -0.6478 4520 OE2 85.3817 103.2389 88.2258 O.co2 281 GLU281 -0.6478 4521 N 90.4080 99.7380 90.5630 N.am 282 THR282 -0.2434 4522 H 90.8730 100.5230 90.1070 H 282 THR282 0.1313 4523 CA 91.2520 98.7050 91.1640 C.3 282 THR282 0.1135 4524 HA 90.9422 97.7603 90.7191 H 282 THR282 0.0583 4525 C 91.0810 98.5620 92.6620 C.2 282 THR282 0.2212 4526 O 91.0760 97.4560 93.1860 O.2 282 THR282 -0.2777 4527 CB 92.7223 98.9748 90.7907 C.3 282 THR282 0.0763 4528 HB 93.0028 99.9478 91.2136 H 282 THR282 0.0611 4529 OG1 92.7843 99.0259 89.3713 O.3 282 THR282 -0.3900 4530 HG1 93.6547 99.2934 89.0868 H 282 THR282 0.2098 4531 CG2 93.6889 97.8930 91.3127 C.3 282 THR282 -0.0370 4532 HG21 94.7250 98.1166 91.0566 H 282 THR282 0.0255 4533 HG22 93.4437 96.9162 90.8966 H 282 THR282 0.0255 4534 HG23 93.6475 97.8082 92.3981 H 282 THR282 0.0255 4535 N 90.9550 99.6860 93.3930 N.am 283 PHE283 -0.2453 4536 H 91.0590 100.5850 92.9220 H 283 PHE283 0.1312 4537 CA 90.6780 99.6820 94.8210 C.3 283 PHE283 0.0917 4538 HA 91.3999 99.0095 95.2874 H 283 PHE283 0.0560 4539 C 89.2950 99.2150 95.2230 C.2 283 PHE283 0.2190 4540 O 89.1330 98.6020 96.2730 O.2 283 PHE283 -0.2778 4541 CB 90.8131 101.1318 95.3314 C.3 283 PHE283 -0.0036 4542 HB1 90.0007 101.4206 96.0006 H 283 PHE283 0.0333 4543 HB2 90.7550 101.8355 94.5028 H 283 PHE283 0.0333 4544 CG 92.0757 101.3437 96.1047 C.ar 283 PHE283 -0.0454 4545 CD1 92.2675 100.6638 97.3013 C.ar 283 PHE283 -0.0585 4546 HD1 91.5204 99.9667 97.6541 H 283 PHE283 0.0620 4547 CD2 93.0269 102.2602 95.6769 C.ar 283 PHE283 -0.0585 4548 HD2 92.8784 102.8141 94.7619 H 283 PHE283 0.0620 4549 CE1 93.4116 100.8742 98.0500 C.ar 283 PHE283 -0.0615 4550 HE1 93.5396 100.3411 98.9784 H 283 PHE283 0.0618 4551 CE2 94.1654 102.4829 96.4335 C.ar 283 PHE283 -0.0615 4552 HE2 94.8953 103.1990 96.0904 H 283 PHE283 0.0618 4553 CZ 94.3705 101.7727 97.6079 C.ar 283 PHE283 -0.0617 4554 HZ 95.2722 101.9192 98.1816 H 283 PHE283 0.0618 4555 N 88.2690 99.5920 94.4280 N.am 284 ARG284 -0.2456 4556 H 88.4580 100.2570 93.6780 H 284 ARG284 0.1312 4557 CA 86.9130 99.1010 94.5840 C.3 284 ARG284 0.0879 4558 HA 86.6280 99.3212 95.6141 H 284 ARG284 0.0557 4559 C 86.7480 97.6070 94.3470 C.2 284 ARG284 0.2187 4560 O 85.8900 96.9880 94.9670 O.2 284 ARG284 -0.2778 4561 CB 86.0691 99.9166 93.5935 C.3 284 ARG284 -0.0258 4562 HB1 86.0798 99.4551 92.6046 H 284 ARG284 0.0286 4563 HB2 86.5645 100.8793 93.4669 H 284 ARG284 0.0286 4564 CG 84.6287 100.1838 94.0548 C.3 284 ARG284 -0.0154 4565 HG1 84.6569 100.7270 95.0001 H 284 ARG284 0.0299 4566 HG2 84.1175 99.2416 94.2563 H 284 ARG284 0.0299 4567 CD 83.8340 101.0001 93.0233 C.3 284 ARG284 0.1045 4568 HD1 82.9107 101.3955 93.4525 H 284 ARG284 0.0711 4569 HD2 83.5724 100.3630 92.1768 H 284 ARG284 0.0711 4570 NE 84.6487 102.1342 92.5749 N.pl3 284 ARG284 -0.4450 4571 HE 85.1237 102.6996 93.2501 H 284 ARG284 0.3153 4572 CZ 84.8739 102.4946 91.3160 C.cat 284 ARG284 0.5062 4573 NH1 84.2270 101.9575 90.3238 N.pl3 284 ARG284 -0.4573 4574 HH11 84.4648 102.2845 89.4028 H 284 ARG284 0.3114 4575 HH12 83.5309 101.2661 90.4699 H 284 ARG284 0.3114 4576 NH2 85.7674 103.4039 91.0541 N.pl3 284 ARG284 -0.4573 4577 HH21 85.9678 103.6276 90.0891 H 284 ARG284 0.3114 4578 HH22 86.2555 103.8620 91.7923 H 284 ARG284 0.3114 4579 N 87.5220 97.0490 93.3940 N.am 285 LYS285 -0.2440 4580 H 88.0700 97.6760 92.8050 H 285 LYS285 0.1312 4581 CA 87.6330 95.6220 93.1440 C.3 285 LYS285 0.1006 4582 HA 86.6191 95.2225 93.1115 H 285 LYS285 0.0576 4583 C 88.4160 94.7960 94.2280 C.2 285 LYS285 0.1943 4584 O 88.9750 95.3470 95.2140 O.co2 285 LYS285 -0.6467 4585 CB 88.3206 95.4428 91.7833 C.3 285 LYS285 -0.0271 4586 HB1 88.5622 94.3930 91.6108 H 285 LYS285 0.0286 4587 HB2 89.2735 95.9734 91.8117 H 285 LYS285 0.0286 4588 CG 87.4697 95.9461 90.6109 C.3 285 LYS285 -0.0495 4589 HG1 86.9999 96.8949 90.8663 H 285 LYS285 0.0266 4590 HG2 86.6500 95.2496 90.4309 H 285 LYS285 0.0266 4591 CD 88.3110 96.1215 89.3445 C.3 285 LYS285 -0.0278 4592 HD1 88.6888 95.1508 89.0207 H 285 LYS285 0.0282 4593 HD2 89.1840 96.7308 89.5810 H 285 LYS285 0.0282 4594 CE 87.5248 96.7924 88.2181 C.3 285 LYS285 0.1103 4595 HE1 87.1177 97.7464 88.5606 H 285 LYS285 0.0559 4596 HE2 86.6828 96.1671 87.9134 H 285 LYS285 0.0559 4597 NZ 88.3670 97.0458 87.0495 N.4 285 LYS285 -0.0749 4598 HZ1 87.8129 97.5179 86.3061 H 285 LYS285 0.2742 4599 HZ2 88.7348 96.1439 86.6838 H 285 LYS285 0.2742 4600 HZ3 89.1679 97.6522 87.3226 H 285 LYS285 0.2742 4601 OXT 88.4985 93.5723 94.1086 O.co2 285 LYS285 -0.6467 @BOND 1 1 5 1 2 1 2 1 3 1 3 1 4 1 4 1 5 5 9 1 6 5 7 1 7 5 6 1 8 7 8 2 9 7 22 am 10 9 14 1 11 9 11 1 12 9 10 1 13 11 18 1 14 11 12 1 15 11 13 1 16 14 15 1 17 14 16 1 18 14 17 1 19 18 19 1 20 18 20 1 21 18 21 1 22 22 24 1 23 22 23 1 24 24 28 1 25 24 26 1 26 24 25 1 27 26 27 2 28 26 33 am 29 28 31 1 30 28 29 1 31 28 30 1 32 31 32 1 33 33 35 1 34 33 34 1 35 35 39 1 36 35 37 1 37 35 36 1 38 37 38 2 39 37 54 am 40 39 42 1 41 39 40 1 42 39 41 1 43 42 43 ar 44 42 45 ar 45 43 47 ar 46 43 44 1 47 45 49 ar 48 45 46 1 49 47 51 ar 50 47 48 1 51 49 51 ar 52 49 50 1 53 51 52 1 54 52 53 1 55 54 56 1 56 54 55 1 57 56 60 1 58 56 58 1 59 56 57 1 60 58 59 2 61 58 73 am 62 60 65 1 63 60 62 1 64 60 61 1 65 62 69 1 66 62 63 1 67 62 64 1 68 65 66 1 69 65 67 1 70 65 68 1 71 69 70 1 72 69 71 1 73 69 72 1 74 73 75 1 75 73 74 1 76 75 79 1 77 75 77 1 78 75 76 1 79 77 78 2 80 77 87 am 81 79 82 1 82 79 80 1 83 79 81 1 84 82 83 2 85 82 84 am 86 84 85 1 87 84 86 1 88 87 89 1 89 87 88 1 90 89 93 1 91 89 91 1 92 89 90 1 93 91 92 2 94 91 106 am 95 93 98 1 96 93 95 1 97 93 94 1 98 95 102 1 99 95 96 1 100 95 97 1 101 98 99 1 102 98 100 1 103 98 101 1 104 102 103 1 105 102 104 1 106 102 105 1 107 106 108 1 108 106 107 1 109 108 112 1 110 108 110 1 111 108 109 1 112 110 111 2 113 110 125 am 114 112 117 1 115 112 114 1 116 112 113 1 117 114 121 1 118 114 115 1 119 114 116 1 120 117 118 1 121 117 119 1 122 117 120 1 123 121 122 1 124 121 123 1 125 121 124 1 126 125 127 1 127 125 126 1 128 127 131 1 129 127 129 1 130 127 128 1 131 129 130 2 132 129 142 am 133 131 134 1 134 131 132 1 135 131 133 1 136 134 137 1 137 134 135 1 138 134 136 1 139 137 138 1 140 138 139 1 141 138 140 1 142 138 141 1 143 142 153 1 144 142 143 1 145 143 147 1 146 143 145 1 147 143 144 1 148 145 146 2 149 145 156 am 150 147 150 1 151 147 148 1 152 147 149 1 153 150 153 1 154 150 151 1 155 150 152 1 156 153 154 1 157 153 155 1 158 156 158 1 159 156 157 1 160 158 162 1 161 158 160 1 162 158 159 1 163 160 161 2 164 160 167 am 165 162 165 1 166 162 163 1 167 162 164 1 168 165 166 1 169 167 169 1 170 167 168 1 171 169 173 1 172 169 171 1 173 169 170 1 174 171 172 2 175 171 183 am 176 173 175 1 177 173 179 1 178 173 174 1 179 175 176 1 180 175 177 1 181 175 178 1 182 179 180 1 183 179 181 1 184 179 182 1 185 183 185 1 186 183 184 1 187 185 189 1 188 185 187 1 189 185 186 1 190 187 188 2 191 187 203 am 192 189 192 1 193 189 190 1 194 189 191 1 195 192 193 ar 196 192 195 ar 197 193 197 ar 198 193 194 1 199 195 199 ar 200 195 196 1 201 197 201 ar 202 197 198 1 203 199 201 ar 204 199 200 1 205 201 202 1 206 203 205 1 207 203 204 1 208 205 208 1 209 205 206 1 210 205 207 1 211 208 209 2 212 208 210 am 213 210 212 1 214 210 211 1 215 212 216 1 216 212 214 1 217 212 213 1 218 214 215 2 219 214 224 am 220 216 220 1 221 216 218 1 222 216 217 1 223 218 219 1 224 220 221 1 225 220 222 1 226 220 223 1 227 224 226 1 228 224 225 1 229 226 230 1 230 226 228 1 231 226 227 1 232 228 229 2 233 228 243 am 234 230 235 1 235 230 232 1 236 230 231 1 237 232 239 1 238 232 233 1 239 232 234 1 240 235 236 1 241 235 237 1 242 235 238 1 243 239 240 1 244 239 241 1 245 239 242 1 246 243 245 1 247 243 244 1 248 245 249 1 249 245 247 1 250 245 246 1 251 247 248 2 252 247 254 am 253 249 252 1 254 249 250 1 255 249 251 1 256 252 253 1 257 254 256 1 258 254 255 1 259 256 260 1 260 256 258 1 261 256 257 1 262 258 259 2 263 258 273 am 264 260 263 1 265 260 261 1 266 260 262 1 267 263 265 1 268 263 269 1 269 263 264 1 270 265 266 1 271 265 267 1 272 265 268 1 273 269 270 1 274 269 271 1 275 269 272 1 276 273 275 1 277 273 274 1 278 275 279 1 279 275 277 1 280 275 276 1 281 277 278 2 282 277 292 am 283 279 282 1 284 279 280 1 285 279 281 1 286 282 284 1 287 282 288 1 288 282 283 1 289 284 285 1 290 284 286 1 291 284 287 1 292 288 289 1 293 288 290 1 294 288 291 1 295 292 294 1 296 292 293 1 297 294 297 1 298 294 295 1 299 294 296 1 300 297 298 2 301 297 299 am 302 299 301 1 303 299 300 1 304 301 305 1 305 301 303 1 306 301 302 1 307 303 304 2 308 303 318 am 309 305 310 1 310 305 307 1 311 305 306 1 312 307 314 1 313 307 308 1 314 307 309 1 315 310 311 1 316 310 312 1 317 310 313 1 318 314 315 1 319 314 316 1 320 314 317 1 321 318 320 1 322 318 319 1 323 320 324 1 324 320 322 1 325 320 321 1 326 322 323 2 327 322 337 am 328 324 329 1 329 324 326 1 330 324 325 1 331 326 333 1 332 326 327 1 333 326 328 1 334 329 330 1 335 329 331 1 336 329 332 1 337 333 334 1 338 333 335 1 339 333 336 1 340 337 339 1 341 337 338 1 342 339 342 1 343 339 340 1 344 339 341 1 345 342 343 2 346 342 344 am 347 344 346 1 348 344 345 1 349 346 350 1 350 346 348 1 351 346 347 1 352 348 349 2 353 348 358 am 354 350 353 1 355 350 351 1 356 350 352 1 357 353 354 2 358 353 355 am 359 355 356 1 360 355 357 1 361 358 360 1 362 358 359 1 363 360 364 1 364 360 362 1 365 360 361 1 366 362 363 2 367 362 369 am 368 364 367 1 369 364 365 1 370 364 366 1 371 367 368 1 372 369 371 1 373 369 370 1 374 371 375 1 375 371 373 1 376 371 372 1 377 373 374 2 378 373 383 am 379 375 379 1 380 375 377 1 381 375 376 1 382 377 378 1 383 379 380 1 384 379 381 1 385 379 382 1 386 383 385 1 387 383 384 1 388 385 389 1 389 385 387 1 390 385 386 1 391 387 388 2 392 387 399 am 393 389 391 1 394 389 395 1 395 389 390 1 396 391 392 1 397 391 393 1 398 391 394 1 399 395 396 1 400 395 397 1 401 395 398 1 402 399 401 1 403 399 400 1 404 401 405 1 405 401 403 1 406 401 402 1 407 403 404 2 408 403 418 am 409 405 410 1 410 405 407 1 411 405 406 1 412 407 414 1 413 407 408 1 414 407 409 1 415 410 411 1 416 410 412 1 417 410 413 1 418 414 415 1 419 414 416 1 420 414 417 1 421 418 420 1 422 418 419 1 423 420 424 1 424 420 422 1 425 420 421 1 426 422 423 2 427 422 438 am 428 424 427 1 429 424 425 1 430 424 426 1 431 427 428 ar 432 427 430 ar 433 428 432 ar 434 428 429 1 435 430 434 ar 436 430 431 1 437 432 436 ar 438 432 433 1 439 434 436 ar 440 434 435 1 441 436 437 1 442 438 440 1 443 438 439 1 444 440 444 1 445 440 442 1 446 440 441 1 447 442 443 2 448 442 448 am 449 444 445 1 450 444 446 1 451 444 447 1 452 448 450 1 453 448 449 1 454 450 454 1 455 450 452 1 456 450 451 1 457 452 453 2 458 452 464 am 459 454 456 1 460 454 460 1 461 454 455 1 462 456 457 1 463 456 458 1 464 456 459 1 465 460 461 1 466 460 462 1 467 460 463 1 468 464 466 1 469 464 465 1 470 466 470 1 471 466 468 1 472 466 467 1 473 468 469 2 474 468 480 am 475 470 472 1 476 470 476 1 477 470 471 1 478 472 473 1 479 472 474 1 480 472 475 1 481 476 477 1 482 476 478 1 483 476 479 1 484 480 482 1 485 480 481 1 486 482 486 1 487 482 484 1 488 482 483 1 489 484 485 2 490 484 502 am 491 486 489 1 492 486 487 1 493 486 488 1 494 489 492 1 495 489 490 1 496 489 491 1 497 492 495 1 498 492 493 1 499 492 494 1 500 495 498 1 501 495 496 1 502 495 497 1 503 498 499 1 504 498 500 1 505 498 501 1 506 502 504 1 507 502 503 1 508 504 508 1 509 504 506 1 510 504 505 1 511 506 507 2 512 506 524 am 513 508 511 1 514 508 509 1 515 508 510 1 516 511 514 1 517 511 512 1 518 511 513 1 519 514 517 1 520 514 515 1 521 514 516 1 522 517 520 1 523 517 518 1 524 517 519 1 525 520 521 1 526 520 522 1 527 520 523 1 528 524 526 1 529 524 525 1 530 526 530 1 531 526 528 1 532 526 527 1 533 528 529 2 534 528 535 am 535 530 533 1 536 530 531 1 537 530 532 1 538 533 534 1 539 535 537 1 540 535 536 1 541 537 541 1 542 537 539 1 543 537 538 1 544 539 540 2 545 539 557 am 546 541 544 1 547 541 542 1 548 541 543 1 549 544 547 1 550 544 545 1 551 544 546 1 552 547 550 1 553 547 548 1 554 547 549 1 555 550 553 1 556 550 551 1 557 550 552 1 558 553 554 1 559 553 555 1 560 553 556 1 561 557 559 1 562 557 558 1 563 559 563 1 564 559 561 1 565 559 560 1 566 561 562 2 567 561 576 am 568 563 566 1 569 563 564 1 570 563 565 1 571 566 568 1 572 566 572 1 573 566 567 1 574 568 569 1 575 568 570 1 576 568 571 1 577 572 573 1 578 572 574 1 579 572 575 1 580 576 578 1 581 576 577 1 582 578 582 1 583 578 580 1 584 578 579 1 585 580 581 2 586 580 593 am 587 582 585 1 588 582 583 1 589 582 584 1 590 585 586 ar 591 585 587 ar 592 586 589 ar 593 587 591 ar 594 587 588 1 595 589 591 ar 596 589 590 1 597 591 592 1 598 593 595 1 599 593 594 1 600 595 599 1 601 595 597 1 602 595 596 1 603 597 598 2 604 597 617 am 605 599 602 1 606 599 600 1 607 599 601 1 608 602 603 ar 609 602 605 ar 610 603 606 ar 611 603 604 1 612 605 608 ar 613 605 609 ar 614 606 608 ar 615 606 607 1 616 608 611 ar 617 609 613 ar 618 609 610 1 619 611 615 ar 620 611 612 1 621 613 615 ar 622 613 614 1 623 615 616 1 624 617 619 1 625 617 618 1 626 619 623 1 627 619 621 1 628 619 620 1 629 621 622 2 630 621 628 am 631 623 626 1 632 623 624 1 633 623 625 1 634 626 627 1 635 628 630 1 636 628 629 1 637 630 634 1 638 630 632 1 639 630 631 1 640 632 633 2 641 632 642 am 642 634 637 1 643 634 635 1 644 634 636 1 645 637 638 2 646 637 639 am 647 639 640 1 648 639 641 1 649 642 644 1 650 642 643 1 651 644 648 1 652 644 646 1 653 644 645 1 654 646 647 2 655 646 656 am 656 648 651 1 657 648 649 1 658 648 650 1 659 651 652 2 660 651 653 am 661 653 654 1 662 653 655 1 663 656 658 1 664 656 657 1 665 658 662 1 666 658 660 1 667 658 659 1 668 660 661 2 669 660 672 am 670 662 664 1 671 662 668 1 672 662 663 1 673 664 665 1 674 664 666 1 675 664 667 1 676 668 669 1 677 668 670 1 678 668 671 1 679 672 683 1 680 672 673 1 681 673 677 1 682 673 675 1 683 673 674 1 684 675 676 2 685 675 686 am 686 677 680 1 687 677 678 1 688 677 679 1 689 680 683 1 690 680 681 1 691 680 682 1 692 683 684 1 693 683 685 1 694 686 688 1 695 686 687 1 696 688 692 1 697 688 690 1 698 688 689 1 699 690 691 2 700 690 698 am 701 692 695 1 702 692 693 1 703 692 694 1 704 695 696 ar 705 695 697 ar 706 698 700 1 707 698 699 1 708 700 704 1 709 700 702 1 710 700 701 1 711 702 703 2 712 702 717 am 713 704 709 1 714 704 706 1 715 704 705 1 716 706 713 1 717 706 707 1 718 706 708 1 719 709 710 1 720 709 711 1 721 709 712 1 722 713 714 1 723 713 715 1 724 713 716 1 725 717 719 1 726 717 718 1 727 719 723 1 728 719 721 1 729 719 720 1 730 721 722 2 731 721 737 am 732 723 726 1 733 723 724 1 734 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3759 3760 1 3814 3761 3764 ar 3815 3762 3766 ar 3816 3762 3763 1 3817 3764 3768 ar 3818 3764 3765 1 3819 3766 3768 ar 3820 3766 3767 1 3821 3768 3769 1 3822 3770 3772 1 3823 3770 3771 1 3824 3772 3776 1 3825 3772 3774 1 3826 3772 3773 1 3827 3774 3775 2 3828 3774 3780 am 3829 3776 3777 1 3830 3776 3778 1 3831 3776 3779 1 3832 3780 3791 1 3833 3780 3781 1 3834 3781 3785 1 3835 3781 3783 1 3836 3781 3782 1 3837 3783 3784 2 3838 3783 3794 am 3839 3785 3788 1 3840 3785 3786 1 3841 3785 3787 1 3842 3788 3791 1 3843 3788 3789 1 3844 3788 3790 1 3845 3791 3792 1 3846 3791 3793 1 3847 3794 3796 1 3848 3794 3795 1 3849 3796 3800 1 3850 3796 3798 1 3851 3796 3797 1 3852 3798 3799 2 3853 3798 3815 am 3854 3800 3803 1 3855 3800 3801 1 3856 3800 3802 1 3857 3803 3804 ar 3858 3803 3806 ar 3859 3804 3808 ar 3860 3804 3805 1 3861 3806 3810 ar 3862 3806 3807 1 3863 3808 3812 ar 3864 3808 3809 1 3865 3810 3812 ar 3866 3810 3811 1 3867 3812 3813 1 3868 3813 3814 1 3869 3815 3817 1 3870 3815 3816 1 3871 3817 3821 1 3872 3817 3819 1 3873 3817 3818 1 3874 3819 3820 2 3875 3819 3836 am 3876 3821 3824 1 3877 3821 3822 1 3878 3821 3823 1 3879 3824 3825 ar 3880 3824 3827 ar 3881 3825 3829 ar 3882 3825 3826 1 3883 3827 3831 ar 3884 3827 3828 1 3885 3829 3833 ar 3886 3829 3830 1 3887 3831 3833 ar 3888 3831 3832 1 3889 3833 3834 1 3890 3834 3835 1 3891 3836 3838 1 3892 3836 3837 1 3893 3838 3842 1 3894 3838 3840 1 3895 3838 3839 1 3896 3840 3841 2 3897 3840 3852 am 3898 3842 3844 1 3899 3842 3848 1 3900 3842 3843 1 3901 3844 3845 1 3902 3844 3846 1 3903 3844 3847 1 3904 3848 3849 1 3905 3848 3850 1 3906 3848 3851 1 3907 3852 3854 1 3908 3852 3853 1 3909 3854 3858 1 3910 3854 3856 1 3911 3854 3855 1 3912 3856 3857 2 3913 3856 3871 am 3914 3858 3861 1 3915 3858 3859 1 3916 3858 3860 1 3917 3861 3863 1 3918 3861 3867 1 3919 3861 3862 1 3920 3863 3864 1 3921 3863 3865 1 3922 3863 3866 1 3923 3867 3868 1 3924 3867 3869 1 3925 3867 3870 1 3926 3871 3873 1 3927 3871 3872 1 3928 3873 3877 1 3929 3873 3875 1 3930 3873 3874 1 3931 3875 3876 2 3932 3875 3888 am 3933 3877 3880 1 3934 3877 3878 1 3935 3877 3879 1 3936 3880 3883 1 3937 3880 3881 1 3938 3880 3882 1 3939 3883 3884 2 3940 3883 3885 am 3941 3885 3886 1 3942 3885 3887 1 3943 3888 3890 1 3944 3888 3889 1 3945 3890 3894 1 3946 3890 3892 1 3947 3890 3891 1 3948 3892 3893 2 3949 3892 3907 am 3950 3894 3897 1 3951 3894 3895 1 3952 3894 3896 1 3953 3897 3899 1 3954 3897 3903 1 3955 3897 3898 1 3956 3899 3900 1 3957 3899 3901 1 3958 3899 3902 1 3959 3903 3904 1 3960 3903 3905 1 3961 3903 3906 1 3962 3907 3909 1 3963 3907 3908 1 3964 3909 3913 1 3965 3909 3911 1 3966 3909 3910 1 3967 3911 3912 2 3968 3911 3921 am 3969 3913 3917 1 3970 3913 3915 1 3971 3913 3914 1 3972 3915 3916 1 3973 3917 3918 1 3974 3917 3919 1 3975 3917 3920 1 3976 3921 3923 1 3977 3921 3922 1 3978 3923 3927 1 3979 3923 3925 1 3980 3923 3924 1 3981 3925 3926 2 3982 3925 3938 am 3983 3927 3930 1 3984 3927 3928 1 3985 3927 3929 1 3986 3930 3933 1 3987 3930 3931 1 3988 3930 3932 1 3989 3933 3934 2 3990 3933 3935 am 3991 3935 3936 1 3992 3935 3937 1 3993 3938 3940 1 3994 3938 3939 1 3995 3940 3944 1 3996 3940 3942 1 3997 3940 3941 1 3998 3942 3943 2 3999 3942 3957 am 4000 3944 3947 1 4001 3944 3945 1 4002 3944 3946 1 4003 3947 3949 1 4004 3947 3953 1 4005 3947 3948 1 4006 3949 3950 1 4007 3949 3951 1 4008 3949 3952 1 4009 3953 3954 1 4010 3953 3955 1 4011 3953 3956 1 4012 3957 3959 1 4013 3957 3958 1 4014 3959 3963 1 4015 3959 3961 1 4016 3959 3960 1 4017 3961 3962 2 4018 3961 3968 am 4019 3963 3966 1 4020 3963 3964 1 4021 3963 3965 1 4022 3966 3967 1 4023 3968 3970 1 4024 3968 3969 1 4025 3970 3974 1 4026 3970 3972 1 4027 3970 3971 1 4028 3972 3973 2 4029 3972 3987 am 4030 3974 3979 1 4031 3974 3976 1 4032 3974 3975 1 4033 3976 3983 1 4034 3976 3977 1 4035 3976 3978 1 4036 3979 3980 1 4037 3979 3981 1 4038 3979 3982 1 4039 3983 3984 1 4040 3983 3985 1 4041 3983 3986 1 4042 3987 3989 1 4043 3987 3988 1 4044 3989 3993 1 4045 3989 3991 1 4046 3989 3990 1 4047 3991 3992 2 4048 3991 3998 am 4049 3993 3996 1 4050 3993 3994 1 4051 3993 3995 1 4052 3996 3997 1 4053 3998 4000 1 4054 3998 3999 1 4055 4000 4004 1 4056 4000 4002 1 4057 4000 4001 1 4058 4002 4003 2 4059 4002 4022 am 4060 4004 4007 1 4061 4004 4005 1 4062 4004 4006 1 4063 4007 4010 1 4064 4007 4008 1 4065 4007 4009 1 4066 4010 4013 1 4067 4010 4011 1 4068 4010 4012 1 4069 4013 4015 ar 4070 4013 4014 1 4071 4015 4016 ar 4072 4015 4019 ar 4073 4016 4017 1 4074 4016 4018 1 4075 4019 4020 1 4076 4019 4021 1 4077 4022 4033 1 4078 4022 4023 1 4079 4023 4027 1 4080 4023 4025 1 4081 4023 4024 1 4082 4025 4026 2 4083 4025 4036 am 4084 4027 4030 1 4085 4027 4028 1 4086 4027 4029 1 4087 4030 4033 1 4088 4030 4031 1 4089 4030 4032 1 4090 4033 4034 1 4091 4033 4035 1 4092 4036 4038 1 4093 4036 4037 1 4094 4038 4042 1 4095 4038 4040 1 4096 4038 4039 1 4097 4040 4041 2 4098 4040 4050 am 4099 4042 4046 1 4100 4042 4044 1 4101 4042 4043 1 4102 4044 4045 1 4103 4046 4047 1 4104 4046 4048 1 4105 4046 4049 1 4106 4050 4052 1 4107 4050 4051 1 4108 4052 4056 1 4109 4052 4054 1 4110 4052 4053 1 4111 4054 4055 2 4112 4054 4069 am 4113 4056 4059 1 4114 4056 4057 1 4115 4056 4058 1 4116 4059 4061 1 4117 4059 4065 1 4118 4059 4060 1 4119 4061 4062 1 4120 4061 4063 1 4121 4061 4064 1 4122 4065 4066 1 4123 4065 4067 1 4124 4065 4068 1 4125 4069 4071 1 4126 4069 4070 1 4127 4071 4075 1 4128 4071 4073 1 4129 4071 4072 1 4130 4073 4074 2 4131 4073 4083 am 4132 4075 4079 1 4133 4075 4077 1 4134 4075 4076 1 4135 4077 4078 1 4136 4079 4080 1 4137 4079 4081 1 4138 4079 4082 1 4139 4083 4085 1 4140 4083 4084 1 4141 4085 4089 1 4142 4085 4087 1 4143 4085 4086 1 4144 4087 4088 2 4145 4087 4103 am 4146 4089 4092 1 4147 4089 4090 1 4148 4089 4091 1 4149 4092 4093 ar 4150 4092 4095 ar 4151 4093 4097 ar 4152 4093 4094 1 4153 4095 4099 ar 4154 4095 4096 1 4155 4097 4101 ar 4156 4097 4098 1 4157 4099 4101 ar 4158 4099 4100 1 4159 4101 4102 1 4160 4103 4105 1 4161 4103 4104 1 4162 4105 4109 1 4163 4105 4107 1 4164 4105 4106 1 4165 4107 4108 2 4166 4107 4119 am 4167 4109 4111 1 4168 4109 4115 1 4169 4109 4110 1 4170 4111 4112 1 4171 4111 4113 1 4172 4111 4114 1 4173 4115 4116 1 4174 4115 4117 1 4175 4115 4118 1 4176 4119 4121 1 4177 4119 4120 1 4178 4121 4125 1 4179 4121 4123 1 4180 4121 4122 1 4181 4123 4124 2 4182 4123 4140 am 4183 4125 4128 1 4184 4125 4126 1 4185 4125 4127 1 4186 4128 4129 ar 4187 4128 4131 ar 4188 4129 4133 ar 4189 4129 4130 1 4190 4131 4135 ar 4191 4131 4132 1 4192 4133 4137 ar 4193 4133 4134 1 4194 4135 4137 ar 4195 4135 4136 1 4196 4137 4138 1 4197 4138 4139 1 4198 4140 4142 1 4199 4140 4141 1 4200 4142 4146 1 4201 4142 4144 1 4202 4142 4143 1 4203 4144 4145 2 4204 4144 4159 am 4205 4146 4149 1 4206 4146 4147 1 4207 4146 4148 1 4208 4149 4151 1 4209 4149 4155 1 4210 4149 4150 1 4211 4151 4152 1 4212 4151 4153 1 4213 4151 4154 1 4214 4155 4156 1 4215 4155 4157 1 4216 4155 4158 1 4217 4159 4161 1 4218 4159 4160 1 4219 4161 4165 1 4220 4161 4163 1 4221 4161 4162 1 4222 4163 4164 2 4223 4163 4180 am 4224 4165 4168 1 4225 4165 4166 1 4226 4165 4167 1 4227 4168 4169 ar 4228 4168 4171 ar 4229 4169 4173 ar 4230 4169 4170 1 4231 4171 4175 ar 4232 4171 4172 1 4233 4173 4177 ar 4234 4173 4174 1 4235 4175 4177 ar 4236 4175 4176 1 4237 4177 4178 1 4238 4178 4179 1 4239 4180 4182 1 4240 4180 4181 1 4241 4182 4186 1 4242 4182 4184 1 4243 4182 4183 1 4244 4184 4185 2 4245 4184 4194 am 4246 4186 4189 1 4247 4186 4187 1 4248 4186 4188 1 4249 4189 4190 2 4250 4189 4191 am 4251 4191 4192 1 4252 4191 4193 1 4253 4194 4196 1 4254 4194 4195 1 4255 4196 4200 1 4256 4196 4198 1 4257 4196 4197 1 4258 4198 4199 2 4259 4198 4204 am 4260 4200 4201 1 4261 4200 4202 1 4262 4200 4203 1 4263 4204 4206 1 4264 4204 4205 1 4265 4206 4210 1 4266 4206 4208 1 4267 4206 4207 1 4268 4208 4209 2 4269 4208 4214 am 4270 4210 4211 1 4271 4210 4212 1 4272 4210 4213 1 4273 4214 4216 1 4274 4214 4215 1 4275 4216 4220 1 4276 4216 4218 1 4277 4216 4217 1 4278 4218 4219 2 4279 4218 4233 am 4280 4220 4225 1 4281 4220 4222 1 4282 4220 4221 1 4283 4222 4229 1 4284 4222 4223 1 4285 4222 4224 1 4286 4225 4226 1 4287 4225 4227 1 4288 4225 4228 1 4289 4229 4230 1 4290 4229 4231 1 4291 4229 4232 1 4292 4233 4235 1 4293 4233 4234 1 4294 4235 4239 1 4295 4235 4237 1 4296 4235 4236 1 4297 4237 4238 2 4298 4237 4244 am 4299 4239 4242 1 4300 4239 4240 1 4301 4239 4241 1 4302 4242 4243 1 4303 4244 4246 1 4304 4244 4245 1 4305 4246 4250 1 4306 4246 4248 1 4307 4246 4247 1 4308 4248 4249 2 4309 4248 4263 am 4310 4250 4253 1 4311 4250 4251 1 4312 4250 4252 1 4313 4253 4255 1 4314 4253 4259 1 4315 4253 4254 1 4316 4255 4256 1 4317 4255 4257 1 4318 4255 4258 1 4319 4259 4260 1 4320 4259 4261 1 4321 4259 4262 1 4322 4263 4265 1 4323 4263 4264 1 4324 4265 4268 1 4325 4265 4266 1 4326 4265 4267 1 4327 4268 4269 2 4328 4268 4270 am 4329 4270 4272 1 4330 4270 4271 1 4331 4272 4276 1 4332 4272 4274 1 4333 4272 4273 1 4334 4274 4275 2 4335 4274 4291 am 4336 4276 4279 1 4337 4276 4277 1 4338 4276 4278 1 4339 4279 4280 ar 4340 4279 4282 ar 4341 4280 4284 ar 4342 4280 4281 1 4343 4282 4286 ar 4344 4282 4283 1 4345 4284 4288 ar 4346 4284 4285 1 4347 4286 4288 ar 4348 4286 4287 1 4349 4288 4289 1 4350 4289 4290 1 4351 4291 4293 1 4352 4291 4292 1 4353 4293 4297 1 4354 4293 4295 1 4355 4293 4294 1 4356 4295 4296 2 4357 4295 4301 am 4358 4297 4298 1 4359 4297 4299 1 4360 4297 4300 1 4361 4301 4303 1 4362 4301 4302 1 4363 4303 4307 1 4364 4303 4305 1 4365 4303 4304 1 4366 4305 4306 2 4367 4305 4315 am 4368 4307 4310 1 4369 4307 4308 1 4370 4307 4309 1 4371 4310 4311 2 4372 4310 4312 am 4373 4312 4313 1 4374 4312 4314 1 4375 4315 4317 1 4376 4315 4316 1 4377 4317 4321 1 4378 4317 4319 1 4379 4317 4318 1 4380 4319 4320 2 4381 4319 4326 am 4382 4321 4324 1 4383 4321 4322 1 4384 4321 4323 1 4385 4324 4325 1 4386 4326 4328 1 4387 4326 4327 1 4388 4328 4332 1 4389 4328 4330 1 4390 4328 4329 1 4391 4330 4331 2 4392 4330 4337 am 4393 4332 4335 1 4394 4332 4333 1 4395 4332 4334 1 4396 4335 4336 1 4397 4337 4339 1 4398 4337 4338 1 4399 4339 4343 1 4400 4339 4341 1 4401 4339 4340 1 4402 4341 4342 2 4403 4341 4356 am 4404 4343 4346 1 4405 4343 4344 1 4406 4343 4345 1 4407 4346 4348 1 4408 4346 4352 1 4409 4346 4347 1 4410 4348 4349 1 4411 4348 4350 1 4412 4348 4351 1 4413 4352 4353 1 4414 4352 4354 1 4415 4352 4355 1 4416 4356 4358 1 4417 4356 4357 1 4418 4358 4362 1 4419 4358 4360 1 4420 4358 4359 1 4421 4360 4361 2 4422 4360 4370 am 4423 4362 4365 1 4424 4362 4363 1 4425 4362 4364 1 4426 4365 4366 2 4427 4365 4367 am 4428 4367 4368 1 4429 4367 4369 1 4430 4370 4381 1 4431 4370 4371 1 4432 4371 4375 1 4433 4371 4373 1 4434 4371 4372 1 4435 4373 4374 2 4436 4373 4384 am 4437 4375 4378 1 4438 4375 4376 1 4439 4375 4377 1 4440 4378 4381 1 4441 4378 4379 1 4442 4378 4380 1 4443 4381 4382 1 4444 4381 4383 1 4445 4384 4386 1 4446 4384 4385 1 4447 4386 4390 1 4448 4386 4388 1 4449 4386 4387 1 4450 4388 4389 2 4451 4388 4404 am 4452 4390 4393 1 4453 4390 4391 1 4454 4390 4392 1 4455 4393 4394 ar 4456 4393 4396 ar 4457 4394 4398 ar 4458 4394 4395 1 4459 4396 4400 ar 4460 4396 4397 1 4461 4398 4402 ar 4462 4398 4399 1 4463 4400 4402 ar 4464 4400 4401 1 4465 4402 4403 1 4466 4404 4406 1 4467 4404 4405 1 4468 4406 4410 1 4469 4406 4408 1 4470 4406 4407 1 4471 4408 4409 2 4472 4408 4420 am 4473 4410 4412 1 4474 4410 4416 1 4475 4410 4411 1 4476 4412 4413 1 4477 4412 4414 1 4478 4412 4415 1 4479 4416 4417 1 4480 4416 4418 1 4481 4416 4419 1 4482 4420 4422 1 4483 4420 4421 1 4484 4422 4426 1 4485 4422 4424 1 4486 4422 4423 1 4487 4424 4425 2 4488 4424 4441 am 4489 4426 4429 1 4490 4426 4427 1 4491 4426 4428 1 4492 4429 4430 ar 4493 4429 4432 ar 4494 4430 4434 ar 4495 4430 4431 1 4496 4432 4436 ar 4497 4432 4433 1 4498 4434 4438 ar 4499 4434 4435 1 4500 4436 4438 ar 4501 4436 4437 1 4502 4438 4439 1 4503 4439 4440 1 4504 4441 4443 1 4505 4441 4442 1 4506 4443 4447 1 4507 4443 4445 1 4508 4443 4444 1 4509 4445 4446 2 4510 4445 4460 am 4511 4447 4452 1 4512 4447 4449 1 4513 4447 4448 1 4514 4449 4456 1 4515 4449 4450 1 4516 4449 4451 1 4517 4452 4453 1 4518 4452 4454 1 4519 4452 4455 1 4520 4456 4457 1 4521 4456 4458 1 4522 4456 4459 1 4523 4460 4462 1 4524 4460 4461 1 4525 4462 4466 1 4526 4462 4464 1 4527 4462 4463 1 4528 4464 4465 2 4529 4464 4476 am 4530 4466 4468 1 4531 4466 4472 1 4532 4466 4467 1 4533 4468 4469 1 4534 4468 4470 1 4535 4468 4471 1 4536 4472 4473 1 4537 4472 4474 1 4538 4472 4475 1 4539 4476 4478 1 4540 4476 4477 1 4541 4478 4482 1 4542 4478 4480 1 4543 4478 4479 1 4544 4480 4481 2 4545 4480 4495 am 4546 4482 4485 1 4547 4482 4483 1 4548 4482 4484 1 4549 4485 4487 1 4550 4485 4491 1 4551 4485 4486 1 4552 4487 4488 1 4553 4487 4489 1 4554 4487 4490 1 4555 4491 4492 1 4556 4491 4493 1 4557 4491 4494 1 4558 4495 4497 1 4559 4495 4496 1 4560 4497 4501 1 4561 4497 4499 1 4562 4497 4498 1 4563 4499 4500 2 4564 4499 4506 am 4565 4501 4504 1 4566 4501 4502 1 4567 4501 4503 1 4568 4504 4505 1 4569 4506 4508 1 4570 4506 4507 1 4571 4508 4512 1 4572 4508 4510 1 4573 4508 4509 1 4574 4510 4511 2 4575 4510 4521 am 4576 4512 4515 1 4577 4512 4513 1 4578 4512 4514 1 4579 4515 4518 1 4580 4515 4516 1 4581 4515 4517 1 4582 4518 4519 ar 4583 4518 4520 ar 4584 4521 4523 1 4585 4521 4522 1 4586 4523 4527 1 4587 4523 4525 1 4588 4523 4524 1 4589 4525 4526 2 4590 4525 4535 am 4591 4527 4531 1 4592 4527 4529 1 4593 4527 4528 1 4594 4529 4530 1 4595 4531 4532 1 4596 4531 4533 1 4597 4531 4534 1 4598 4535 4537 1 4599 4535 4536 1 4600 4537 4541 1 4601 4537 4539 1 4602 4537 4538 1 4603 4539 4540 2 4604 4539 4555 am 4605 4541 4544 1 4606 4541 4542 1 4607 4541 4543 1 4608 4544 4545 ar 4609 4544 4547 ar 4610 4545 4549 ar 4611 4545 4546 1 4612 4547 4551 ar 4613 4547 4548 1 4614 4549 4553 ar 4615 4549 4550 1 4616 4551 4553 ar 4617 4551 4552 1 4618 4553 4554 1 4619 4555 4557 1 4620 4555 4556 1 4621 4557 4561 1 4622 4557 4559 1 4623 4557 4558 1 4624 4559 4560 2 4625 4559 4579 am 4626 4561 4564 1 4627 4561 4562 1 4628 4561 4563 1 4629 4564 4567 1 4630 4564 4565 1 4631 4564 4566 1 4632 4567 4570 1 4633 4567 4568 1 4634 4567 4569 1 4635 4570 4572 ar 4636 4570 4571 1 4637 4572 4573 ar 4638 4572 4576 ar 4639 4573 4574 1 4640 4573 4575 1 4641 4576 4577 1 4642 4576 4578 1 4643 4579 4581 1 4644 4579 4580 1 4645 4581 4585 1 4646 4581 4583 1 4647 4581 4582 1 4648 4583 4584 ar 4649 4583 4601 ar 4650 4585 4588 1 4651 4585 4586 1 4652 4585 4587 1 4653 4588 4591 1 4654 4588 4589 1 4655 4588 4590 1 4656 4591 4594 1 4657 4591 4592 1 4658 4591 4593 1 4659 4594 4597 1 4660 4594 4595 1 4661 4594 4596 1 4662 4597 4598 1 4663 4597 4599 1 4664 4597 4600 1 @SUBSTRUCTURE 1 ILE1 5 RESIDUE 1 E ILE 1 ROOT 2 SER2 24 RESIDUE 1 E SER 2 3 TYR3 35 RESIDUE 1 E TYR 2 4 ILE4 56 RESIDUE 1 E ILE 2 5 ASN5 75 RESIDUE 1 E ASN 2 6 ILE6 89 RESIDUE 1 E ILE 2 7 ILE7 108 RESIDUE 1 E ILE 2 8 MET8 127 RESIDUE 1 E MET 2 9 PRO9 143 RESIDUE 1 E PRO 2 10 SER10 158 RESIDUE 1 E SER 2 11 VAL11 169 RESIDUE 1 E VAL 2 12 PHE12 185 RESIDUE 1 E PHE 2 13 GLY13 205 RESIDUE 1 E GLY 2 14 THR14 212 RESIDUE 1 E THR 2 15 ILE15 226 RESIDUE 1 E ILE 2 16 CYS16 245 RESIDUE 1 E CYS 2 17 LEU17 256 RESIDUE 1 E LEU 2 18 LEU18 275 RESIDUE 1 E LEU 2 19 GLY19 294 RESIDUE 1 E GLY 2 20 ILE20 301 RESIDUE 1 E ILE 2 21 ILE21 320 RESIDUE 1 E ILE 2 22 GLY22 339 RESIDUE 1 E GLY 2 23 ASN23 346 RESIDUE 1 E ASN 2 24 SER24 360 RESIDUE 1 E SER 2 25 THR25 371 RESIDUE 1 E THR 2 26 VAL26 385 RESIDUE 1 E VAL 2 27 ILE27 401 RESIDUE 1 E ILE 2 28 PHE28 420 RESIDUE 1 E PHE 2 29 ALA29 440 RESIDUE 1 E ALA 2 30 VAL30 450 RESIDUE 1 E VAL 2 31 VAL31 466 RESIDUE 1 E VAL 2 32 LYS32 482 RESIDUE 1 E LYS 2 33 LYS33 504 RESIDUE 1 E LYS 2 34 SER34 526 RESIDUE 1 E SER 2 35 LYS35 537 RESIDUE 1 E LYS 2 36 LEU36 559 RESIDUE 1 E LEU 2 37 HIS37 578 RESIDUE 1 E HIS 2 38 TRP38 595 RESIDUE 1 E TRP 2 39 CYS39 619 RESIDUE 1 E CYS 2 40 ASN40 630 RESIDUE 1 E ASN 2 41 ASN41 644 RESIDUE 1 E ASN 2 42 VAL42 658 RESIDUE 1 E VAL 2 43 PRO43 673 RESIDUE 1 E PRO 2 44 ASP44 688 RESIDUE 1 E ASP 2 45 ILE45 700 RESIDUE 1 E ILE 2 46 PHE46 719 RESIDUE 1 E PHE 2 47 ILE47 739 RESIDUE 1 E ILE 2 48 ILE48 758 RESIDUE 1 E ILE 2 49 ASN49 777 RESIDUE 1 E ASN 2 50 LEU50 791 RESIDUE 1 E LEU 2 51 SER51 810 RESIDUE 1 E SER 2 52 VAL52 821 RESIDUE 1 E VAL 2 53 VAL53 837 RESIDUE 1 E VAL 2 54 ASP54 853 RESIDUE 1 E ASP 2 55 LEU55 865 RESIDUE 1 E LEU 2 56 LEU56 884 RESIDUE 1 E LEU 2 57 PHE57 903 RESIDUE 1 E PHE 2 58 LEU58 923 RESIDUE 1 E LEU 2 59 LEU59 942 RESIDUE 1 E LEU 2 60 GLY60 961 RESIDUE 1 E GLY 2 61 MET61 968 RESIDUE 1 E MET 2 62 PRO62 984 RESIDUE 1 E PRO 2 63 PHE63 999 RESIDUE 1 E PHE 2 64 MET64 1019 RESIDUE 1 E MET 2 65 ILE65 1036 RESIDUE 1 E ILE 2 66 HIS66 1055 RESIDUE 1 E HIS 2 67 GLN67 1072 RESIDUE 1 E GLN 2 68 LEU68 1089 RESIDUE 1 E LEU 2 69 MET69 1108 RESIDUE 1 E MET 2 70 GLY70 1125 RESIDUE 1 E GLY 2 71 ASN71 1132 RESIDUE 1 E ASN 2 72 GLY72 1146 RESIDUE 1 E GLY 2 73 VAL73 1153 RESIDUE 1 E VAL 2 74 TRP74 1169 RESIDUE 1 E TRP 2 75 HIS75 1193 RESIDUE 1 E HIS 2 76 PHE76 1210 RESIDUE 1 E PHE 2 77 GLY77 1230 RESIDUE 1 E GLY 2 78 GLU78 1237 RESIDUE 1 E GLU 2 79 THR79 1252 RESIDUE 1 E THR 2 80 MET80 1266 RESIDUE 1 E MET 2 81 CYS81 1283 RESIDUE 1 E CYS 2 82 THR82 1294 RESIDUE 1 E THR 2 83 LEU83 1308 RESIDUE 1 E LEU 2 84 ILE84 1327 RESIDUE 1 E ILE 2 85 THR85 1346 RESIDUE 1 E THR 2 86 ALA86 1360 RESIDUE 1 E ALA 2 87 MET87 1370 RESIDUE 1 E MET 2 88 ASP88 1387 RESIDUE 1 E ASP 2 89 ALA89 1399 RESIDUE 1 E ALA 2 90 ASN90 1409 RESIDUE 1 E ASN 2 91 SER91 1423 RESIDUE 1 E SER 2 92 GLN92 1434 RESIDUE 1 E GLN 2 93 PHE93 1451 RESIDUE 1 E PHE 2 94 THR94 1471 RESIDUE 1 E THR 2 95 SER95 1485 RESIDUE 1 E SER 2 96 THR96 1496 RESIDUE 1 E THR 2 97 TYR97 1510 RESIDUE 1 E TYR 2 98 ILE98 1531 RESIDUE 1 E ILE 2 99 LEU99 1550 RESIDUE 1 E LEU 2 100 THR100 1569 RESIDUE 1 E THR 2 101 ALA101 1583 RESIDUE 1 E ALA 2 102 MET102 1593 RESIDUE 1 E MET 2 103 ALA103 1610 RESIDUE 1 E ALA 2 104 ILE104 1620 RESIDUE 1 E ILE 2 105 ASP105 1639 RESIDUE 1 E ASP 2 106 ARG106 1651 RESIDUE 1 E ARG 2 107 TYR107 1675 RESIDUE 1 E TYR 2 108 LEU108 1696 RESIDUE 1 E LEU 2 109 ALA109 1715 RESIDUE 1 E ALA 2 110 THR110 1725 RESIDUE 1 E THR 2 111 VAL111 1739 RESIDUE 1 E VAL 2 112 HIS112 1755 RESIDUE 1 E HIS 2 113 PRO113 1771 RESIDUE 1 E PRO 2 114 ILE114 1786 RESIDUE 1 E ILE 2 115 SER115 1805 RESIDUE 1 E SER 2 116 SER116 1816 RESIDUE 1 E SER 2 117 THR117 1827 RESIDUE 1 E THR 2 118 LYS118 1841 RESIDUE 1 E LYS 2 119 PHE119 1863 RESIDUE 1 E PHE 2 120 ARG120 1883 RESIDUE 1 E ARG 2 121 LYS121 1907 RESIDUE 1 E LYS 2 122 PRO122 1928 RESIDUE 1 E PRO 2 123 SER123 1943 RESIDUE 1 E SER 2 124 VAL124 1954 RESIDUE 1 E VAL 2 125 ALA125 1970 RESIDUE 1 E ALA 2 126 THR126 1980 RESIDUE 1 E THR 2 127 LEU127 1994 RESIDUE 1 E LEU 2 128 VAL128 2013 RESIDUE 1 E VAL 2 129 ILE129 2029 RESIDUE 1 E ILE 2 130 CYS130 2048 RESIDUE 1 E CYS 2 131 LEU131 2059 RESIDUE 1 E LEU 2 132 LEU132 2078 RESIDUE 1 E LEU 2 133 TRP133 2097 RESIDUE 1 E TRP 2 134 ALA134 2121 RESIDUE 1 E ALA 2 135 LEU135 2131 RESIDUE 1 E LEU 2 136 SER136 2150 RESIDUE 1 E SER 2 137 PHE137 2161 RESIDUE 1 E PHE 2 138 ILE138 2181 RESIDUE 1 E ILE 2 139 SER139 2200 RESIDUE 1 E SER 2 140 ILE140 2211 RESIDUE 1 E ILE 2 141 THR141 2230 RESIDUE 1 E THR 2 142 PRO142 2243 RESIDUE 1 E PRO 2 143 VAL143 2258 RESIDUE 1 E VAL 2 144 TRP144 2274 RESIDUE 1 E TRP 2 145 LEU145 2298 RESIDUE 1 E LEU 2 146 TYR146 2317 RESIDUE 1 E TYR 2 147 ALA147 2338 RESIDUE 1 E ALA 2 148 ARG148 2348 RESIDUE 1 E ARG 2 149 LEU149 2372 RESIDUE 1 E LEU 2 150 ILE150 2391 RESIDUE 1 E ILE 2 151 PRO151 2409 RESIDUE 1 E PRO 2 152 PHE152 2424 RESIDUE 1 E PHE 2 153 PRO153 2443 RESIDUE 1 E PRO 2 154 GLY154 2458 RESIDUE 1 E GLY 2 155 GLY155 2465 RESIDUE 1 E GLY 2 156 ALA156 2472 RESIDUE 1 E ALA 2 157 VAL157 2482 RESIDUE 1 E VAL 2 158 GLY158 2498 RESIDUE 1 E GLY 2 159 CYS159 2505 RESIDUE 1 E CYS 2 160 GLY160 2516 RESIDUE 1 E GLY 2 161 ILE161 2523 RESIDUE 1 E ILE 2 162 ARG162 2542 RESIDUE 1 E ARG 2 163 LEU163 2566 RESIDUE 1 E LEU 2 164 PRO164 2584 RESIDUE 1 E PRO 2 165 ASN165 2599 RESIDUE 1 E ASN 2 166 PRO166 2612 RESIDUE 1 E PRO 2 167 ASP167 2627 RESIDUE 1 E ASP 2 168 THR168 2639 RESIDUE 1 E THR 2 169 ASP169 2653 RESIDUE 1 E ASP 2 170 LEU170 2665 RESIDUE 1 E LEU 2 171 TYR171 2684 RESIDUE 1 E TYR 2 172 TRP172 2705 RESIDUE 1 E TRP 2 173 PHE173 2729 RESIDUE 1 E PHE 2 174 THR174 2749 RESIDUE 1 E THR 2 175 LEU175 2763 RESIDUE 1 E LEU 2 176 TYR176 2782 RESIDUE 1 E TYR 2 177 GLN177 2803 RESIDUE 1 E GLN 2 178 PHE178 2820 RESIDUE 1 E PHE 2 179 PHE179 2840 RESIDUE 1 E PHE 2 180 LEU180 2860 RESIDUE 1 E LEU 2 181 ALA181 2879 RESIDUE 1 E ALA 2 182 PHE182 2889 RESIDUE 1 E PHE 2 183 ALA183 2909 RESIDUE 1 E ALA 2 184 LEU184 2919 RESIDUE 1 E LEU 2 185 PRO185 2937 RESIDUE 1 E PRO 2 186 PHE186 2952 RESIDUE 1 E PHE 2 187 VAL187 2972 RESIDUE 1 E VAL 2 188 VAL188 2988 RESIDUE 1 E VAL 2 189 ILE189 3004 RESIDUE 1 E ILE 2 190 THR190 3023 RESIDUE 1 E THR 2 191 ALA191 3037 RESIDUE 1 E ALA 2 192 ALA192 3047 RESIDUE 1 E ALA 2 193 TYR193 3057 RESIDUE 1 E TYR 2 194 VAL194 3078 RESIDUE 1 E VAL 2 195 ARG195 3094 RESIDUE 1 E ARG 2 196 ILE196 3118 RESIDUE 1 E ILE 2 197 LEU197 3137 RESIDUE 1 E LEU 2 198 GLN198 3156 RESIDUE 1 E GLN 2 199 ARG199 3173 RESIDUE 1 E ARG 2 200 MET200 3197 RESIDUE 1 E MET 2 201 THR201 3214 RESIDUE 1 E THR 2 202 SER202 3228 RESIDUE 1 E SER 2 203 SER203 3239 RESIDUE 1 E SER 2 204 VAL204 3250 RESIDUE 1 E VAL 2 205 ALA205 3266 RESIDUE 1 E ALA 2 206 PRO206 3275 RESIDUE 1 E PRO 2 207 ALA207 3290 RESIDUE 1 E ALA 2 208 SER208 3300 RESIDUE 1 E SER 2 209 GLN209 3311 RESIDUE 1 E GLN 2 210 ARG210 3328 RESIDUE 1 E ARG 2 211 SER211 3352 RESIDUE 1 E SER 2 212 ILE212 3363 RESIDUE 1 E ILE 2 213 ARG213 3382 RESIDUE 1 E ARG 2 214 LEU214 3406 RESIDUE 1 E LEU 2 215 ARG215 3425 RESIDUE 1 E ARG 2 216 THR216 3449 RESIDUE 1 E THR 2 217 LYS217 3463 RESIDUE 1 E LYS 2 218 ARG218 3485 RESIDUE 1 E ARG 2 219 VAL219 3509 RESIDUE 1 E VAL 2 220 THR220 3525 RESIDUE 1 E THR 2 221 ARG221 3539 RESIDUE 1 E ARG 2 222 THR222 3563 RESIDUE 1 E THR 2 223 ALA223 3577 RESIDUE 1 E ALA 2 224 ILE224 3587 RESIDUE 1 E ILE 2 225 ALA225 3606 RESIDUE 1 E ALA 2 226 ILE226 3616 RESIDUE 1 E ILE 2 227 CYS227 3635 RESIDUE 1 E CYS 2 228 LEU228 3646 RESIDUE 1 E LEU 2 229 VAL229 3665 RESIDUE 1 E VAL 2 230 PHE230 3681 RESIDUE 1 E PHE 2 231 PHE231 3701 RESIDUE 1 E PHE 2 232 VAL232 3721 RESIDUE 1 E VAL 2 233 CYS233 3737 RESIDUE 1 E CYS 2 234 TRP234 3748 RESIDUE 1 E TRP 2 235 ALA235 3772 RESIDUE 1 E ALA 2 236 PRO236 3781 RESIDUE 1 E PRO 2 237 TYR237 3796 RESIDUE 1 E TYR 2 238 TYR238 3817 RESIDUE 1 E TYR 2 239 VAL239 3838 RESIDUE 1 E VAL 2 240 LEU240 3854 RESIDUE 1 E LEU 2 241 GLN241 3873 RESIDUE 1 E GLN 2 242 LEU242 3890 RESIDUE 1 E LEU 2 243 THR243 3909 RESIDUE 1 E THR 2 244 GLN244 3923 RESIDUE 1 E GLN 2 245 LEU245 3940 RESIDUE 1 E LEU 2 246 SER246 3959 RESIDUE 1 E SER 2 247 ILE247 3970 RESIDUE 1 E ILE 2 248 SER248 3989 RESIDUE 1 E SER 2 249 ARG249 4000 RESIDUE 1 E ARG 2 250 PRO250 4023 RESIDUE 1 E PRO 2 251 THR251 4038 RESIDUE 1 E THR 2 252 LEU252 4052 RESIDUE 1 E LEU 2 253 THR253 4071 RESIDUE 1 E THR 2 254 PHE254 4085 RESIDUE 1 E PHE 2 255 VAL255 4105 RESIDUE 1 E VAL 2 256 TYR256 4121 RESIDUE 1 E TYR 2 257 LEU257 4142 RESIDUE 1 E LEU 2 258 TYR258 4161 RESIDUE 1 E TYR 2 259 ASN259 4182 RESIDUE 1 E ASN 2 260 ALA260 4196 RESIDUE 1 E ALA 2 261 ALA261 4206 RESIDUE 1 E ALA 2 262 ILE262 4216 RESIDUE 1 E ILE 2 263 SER263 4235 RESIDUE 1 E SER 2 264 LEU264 4246 RESIDUE 1 E LEU 2 265 GLY265 4265 RESIDUE 1 E GLY 2 266 TYR266 4272 RESIDUE 1 E TYR 2 267 ALA267 4293 RESIDUE 1 E ALA 2 268 ASN268 4303 RESIDUE 1 E ASN 2 269 SER269 4317 RESIDUE 1 E SER 2 270 CYS270 4328 RESIDUE 1 E CYS 2 271 LEU271 4339 RESIDUE 1 E LEU 2 272 ASN272 4358 RESIDUE 1 E ASN 2 273 PRO273 4371 RESIDUE 1 E PRO 2 274 PHE274 4386 RESIDUE 1 E PHE 2 275 VAL275 4406 RESIDUE 1 E VAL 2 276 TYR276 4422 RESIDUE 1 E TYR 2 277 ILE277 4443 RESIDUE 1 E ILE 2 278 VAL278 4462 RESIDUE 1 E VAL 2 279 LEU279 4478 RESIDUE 1 E LEU 2 280 CYS280 4497 RESIDUE 1 E CYS 2 281 GLU281 4508 RESIDUE 1 E GLU 2 282 THR282 4523 RESIDUE 1 E THR 2 283 PHE283 4537 RESIDUE 1 E PHE 2 284 ARG284 4557 RESIDUE 1 E ARG 2 285 LYS285 4581 RESIDUE 1 E LYS 1