NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 201 M 4.5158 8.3049 120.3344 55.1940 33.4049 174.6582 202 K 4.4482 8.5648 122.3126 54.4330 34.5350 174.5961 203 K 4.6850 9.1196 122.3131 56.4693 34.2018 175.3970 204 Y 4.9286 8.8792 120.0288 56.5023 42.2823 174.4402 205 T 5.1708 9.0318 115.2593 60.3919 71.7472 172.3903 206 C 3.2670 8.7661 128.7128 58.7835 31.9201 174.4025 207 K 4.0247 8.7349 126.6062 58.8602 31.7141 178.8140 208 I 3.9802 7.8023 120.6526 63.4482 37.4906 176.4084 209 C 4.5723 8.1418 111.0206 57.4203 31.0936 174.7570 210 G 3.9043 8.3420 108.6301 44.6488 0.0000 172.9080 211 Y 4.3051 7.8482 120.8394 58.5109 39.9410 174.9678 212 I 4.7282 7.4133 125.7089 59.4787 39.3030 174.5217 213 Y 4.2951 9.2880 130.2601 57.3423 40.0296 173.5989 214 N 4.8084 8.1044 126.4730 51.1257 40.1798 173.2522 215 P 4.1340 0.0000 0.0000 65.9705 31.8393 178.3519 216 E 3.9539 8.3269 118.1041 59.3463 29.3607 178.7500 217 D 4.3665 8.1279 119.5583 54.5574 41.7240 178.1349 218 G 4.0647 7.8570 106.8091 45.4668 0.0000 173.2171 219 D 4.9793 8.6145 112.3951 52.6200 42.0124 175.3317 220 P 4.4862 0.0000 0.0000 65.6421 32.1781 179.2697 221 D 4.4547 8.2409 117.7186 56.4733 40.8587 176.5396 222 N 4.8645 8.4043 115.4808 52.9431 38.8079 175.6019 223 G 3.8071 8.4039 105.6400 45.4186 0.0000 174.2257 224 V 4.0832 7.4167 119.9218 60.6775 31.9650 174.8708 225 N 4.8104 8.3906 125.5102 51.8888 39.2269 173.2254 226 P 4.3525 0.0000 0.0000 64.8888 31.4235 176.7603 227 G 3.9192 9.1346 110.0253 45.4541 0.0000 173.4566 228 T 4.1278 7.4524 116.9437 62.5280 68.9859 174.3017 229 D 4.5465 8.5638 126.5371 53.8777 42.3182 176.4409 230 F 3.3333 9.0105 127.8931 61.0003 39.3934 177.1031 231 K 3.6964 7.9072 119.8730 59.1857 31.9426 176.7451 232 D 4.5032 7.7609 116.0411 54.3301 41.2426 176.8418 233 I 3.4259 6.6610 121.2458 60.2004 37.6116 174.2552 234 P 4.1714 0.0000 0.0000 63.3774 31.5917 176.5586 235 D 4.6722 8.6079 120.5212 55.0603 40.7162 176.4637 236 D 4.7841 7.7503 117.5422 52.5634 39.8376 176.3061 237 W 4.3371 8.2268 131.2412 58.0203 31.8024 175.0469 238 V 4.2507 7.0300 116.7973 58.7571 35.3778 174.9269 239 C 3.8006 8.6074 123.5610 59.2427 31.7846 172.8836 240 P 4.1826 0.0000 0.0000 64.4720 31.5804 177.4968 241 I 3.9348 7.3038 119.9413 63.5368 37.4837 176.3508 242 C 4.4898 7.9737 111.3540 57.3921 30.9097 174.7678 243 G 3.7597 8.1912 108.3813 45.0078 0.0000 173.7140 244 A 4.1434 7.6023 122.7737 51.1834 19.1671 175.7270 245 P 4.6950 0.0000 0.0000 62.1574 32.4309 177.3304 246 K 4.1072 8.4723 121.0476 59.8692 32.1266 178.9839 247 S 4.4465 8.2469 111.4775 60.4351 63.1520 174.2043 248 E 4.5999 8.8059 121.4410 56.4629 29.3070 175.3441 249 F 5.2878 8.3733 118.0704 56.3400 41.2965 174.9528 250 E 4.9236 8.9750 117.3679 54.5742 33.2433 174.2597 251 E 3.3485 8.6933 122.2000 55.7237 30.5498 176.8576 252 V 3.6506 7.9900 125.0994 63.1974 31.5092 175.6239 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 201 M 8.30 4.52 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.63 0.00 202 K 8.56 4.45 0.00 1.72 1.55 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.68 7.81 203 K 9.12 4.68 0.00 1.63 1.68 0.00 1.55 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.44 7.81 204 Y 8.88 4.93 0.00 2.45 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 T 9.03 5.17 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 206 C 8.77 3.27 0.00 2.56 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 K 8.73 4.02 0.00 1.89 1.82 0.00 1.74 0.00 0.00 1.91 0.00 0.00 2.95 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.59 1.46 7.81 208 I 7.80 3.98 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.89 0.00 0.00 209 C 8.14 4.57 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 G 8.34 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 Y 7.85 4.31 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 7.41 4.73 1.67 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.81 0.81 0.00 0.00 213 Y 9.29 4.30 0.00 3.52 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 N 8.10 4.81 0.00 2.65 2.62 0.00 0.00 6.84 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 P 0.00 4.13 0.00 2.21 2.51 0.00 3.69 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.25 0.00 216 E 8.33 3.95 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.25 0.00 217 D 8.13 4.37 0.00 2.76 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 G 7.86 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 D 8.61 4.98 0.00 3.18 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 P 0.00 4.49 0.00 2.29 2.33 0.00 3.85 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 221 D 8.24 4.45 0.00 2.74 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 N 8.40 4.86 0.00 3.07 2.90 0.00 0.00 7.66 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 G 8.40 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 V 7.42 4.08 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.65 0.00 0.00 225 N 8.39 4.81 0.00 2.87 2.72 0.00 0.00 6.78 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 P 0.00 4.35 0.00 2.19 2.19 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 227 G 9.13 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 T 7.45 4.13 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 229 D 8.56 4.55 0.00 2.77 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 F 9.01 3.33 0.00 2.61 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 K 7.91 3.70 0.00 1.71 1.76 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.42 7.81 232 D 7.76 4.50 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 I 6.66 3.43 0.92 0.00 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 -0.08 -0.06 0.00 0.00 234 P 0.00 4.17 0.00 2.21 1.94 0.00 3.40 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 235 D 8.61 4.67 0.00 2.62 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 D 7.75 4.78 0.00 2.76 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.23 4.34 0.00 3.31 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 V 7.03 4.25 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.64 0.00 0.00 239 C 8.61 3.80 0.00 3.23 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 P 0.00 4.18 0.00 2.04 2.02 0.00 3.15 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.81 0.00 241 I 7.30 3.93 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.99 0.92 0.00 0.00 242 C 7.97 4.49 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 G 8.19 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 A 7.60 4.14 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 P 0.00 4.69 0.00 2.31 2.23 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.00 0.00 246 K 8.47 4.11 0.00 2.21 1.94 0.00 1.34 0.00 0.00 1.60 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.46 1.20 7.81 247 S 8.25 4.45 0.00 4.10 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 E 8.81 4.60 0.00 2.27 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 249 F 8.37 5.29 0.00 3.40 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 E 8.98 4.92 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.21 0.00 251 E 8.69 3.35 0.00 1.64 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.47 0.00 252 V 7.99 3.65 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.86 0.00 0.00