NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 177 S 4.4127 8.3344 116.7977 58.5880 64.4224 172.1424 178 R 4.1114 7.0937 124.9177 55.1260 37.5126 173.1549 179 T 4.2312 7.8274 111.5281 62.7660 71.0652 174.4584 180 D 4.8292 7.9808 121.8989 53.3672 40.9829 175.6832 181 R 5.1092 7.9816 118.0462 55.0334 32.3088 174.7505 182 L 4.8311 8.7256 124.7350 52.7101 44.7362 176.2012 183 E 4.6070 8.6732 122.1029 56.4166 30.7630 176.2435 184 V 4.3343 8.2177 124.3804 62.0933 33.0924 175.9866 185 C 4.0209 9.1217 127.0365 59.6838 31.6602 174.7002 186 R 4.5922 7.9024 129.7946 58.6804 29.9183 178.4885 187 E 4.0852 7.9633 118.2540 59.4265 29.3322 178.4072 188 Y 4.1554 7.8510 118.0311 60.1920 39.3512 177.0316 189 Q 4.0615 7.9695 118.0813 56.7805 29.3283 176.3649 190 R 4.4343 7.2781 117.6031 60.3425 29.9550 178.3083 191 G 3.5643 7.4323 103.2890 46.9950 0.0000 174.6949 192 N 4.7349 7.3619 114.0523 54.8309 42.3575 176.2969 193 C 4.4945 7.9547 116.4995 58.7317 31.1988 172.8880 *195 R 4.0587 8.4555 116.5846 55.8698 30.9840 175.7141 196 G 3.9893 8.3420 111.5595 44.2406 0.0000 173.9387 197 E 3.7744 8.7905 116.5166 59.4405 29.2937 179.3456 198 N 4.3991 8.1542 115.3091 55.2780 38.7746 175.3096 199 D 4.7977 7.9769 115.9524 53.7183 41.2896 175.2666 200 C 4.8713 7.4622 118.7943 57.6918 33.6051 174.0588 201 R 4.2347 8.6349 123.7125 56.8772 30.1470 175.7015 202 F 5.0110 7.7599 115.4564 54.9723 42.8795 174.5973 203 A 4.1728 8.8147 122.3228 52.5160 19.4154 176.7691 204 H 4.5037 8.6764 119.6512 53.0414 28.8956 172.6685 205 P 4.3625 0.0000 0.0000 61.9479 32.1995 176.6790 206 A 4.3575 8.5145 124.5898 51.6111 19.1330 178.2935 207 D 4.3822 8.7236 119.2397 57.4709 41.3214 177.9432 208 S 4.2860 7.9644 112.4211 60.3417 63.6455 173.6796 209 T 4.4000 7.4740 119.2575 63.5715 68.5222 174.6476 210 M 4.3002 8.8323 127.0848 55.3562 32.9333 175.8709 211 I 4.6038 8.0935 122.2817 59.4816 40.4523 174.8120 212 D 4.5488 9.1729 127.9390 53.3593 40.6270 176.9592 213 T 4.1059 8.3724 117.5857 63.7114 69.2384 175.5309 214 N 4.5111 8.5775 120.4575 55.7870 38.5896 175.4193 215 D 4.6996 7.5007 112.7346 51.7742 41.1658 174.3976 216 N 4.1448 8.3457 117.5711 55.6562 37.8262 172.9395 217 T 5.1651 7.6545 105.7052 59.9625 72.8604 173.6962 218 V 4.8582 8.4046 115.0437 60.0334 35.2803 174.7858 219 T 5.0350 8.3127 119.3101 61.9437 70.5435 174.3744 220 V 4.3118 8.8782 127.6663 62.9321 32.6593 175.1517 221 C 4.1920 9.4054 129.0414 59.5367 31.7771 174.0366 222 M 4.0734 8.6934 127.5256 58.4812 31.6113 178.2967 223 D 4.3288 8.0575 118.5940 57.5234 41.0448 178.0906 224 Y 3.9212 7.9315 119.3379 60.8149 38.6564 177.9490 225 I 3.6018 7.5699 119.4000 64.2022 37.3202 177.9673 226 K 4.1889 7.9216 116.8784 56.7400 32.1007 176.7860 227 G 3.5200 6.7642 107.8220 45.3972 0.0000 174.4588 228 R 4.2378 7.6590 118.2787 55.6485 33.3460 173.1051 229 C 4.8107 8.8330 125.9805 57.7615 33.4323 173.1410 230 S 4.5785 8.7560 120.4016 58.2702 63.1005 173.6160 231 R 4.4616 7.7054 120.8018 54.9186 30.7881 175.9741 232 E 4.1171 8.9546 124.6364 58.5306 30.2728 176.9838 233 K 4.5826 7.5061 115.9162 54.5160 32.4238 175.0113 234 C 4.3473 7.7642 120.3001 58.8491 32.7654 173.5960 235 K 4.4698 8.3978 123.6193 57.9157 32.9466 175.9793 236 Y 5.1013 7.4482 116.7669 56.4665 40.1568 174.9193 237 F 4.5819 9.4639 125.0538 58.6636 40.8799 174.4070 238 H 4.3290 8.1067 123.8928 53.2167 28.0813 172.4195 239 P 3.5448 0.0000 0.0000 60.8892 32.4783 175.3848 240 P 4.3441 0.0000 0.0000 62.4148 32.2533 177.0522 241 A 4.0128 8.8459 124.0509 55.8081 18.2649 179.4952 242 H 4.4606 8.2056 108.7069 57.2536 28.8821 175.7641 243 L 4.4345 7.5511 118.9688 54.7815 42.3871 176.8523 244 Q 4.2208 7.5787 117.8788 54.9794 29.3543 175.8400 245 A 4.0968 8.2952 123.7504 52.0897 19.1360 177.7855 246 K 4.1230 8.5377 122.0503 56.6601 32.3108 176.5873 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 177 S 8.33 4.41 0.00 3.88 4.01 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 0.00 0.00 0.00 0.00 178 R 7.09 4.11 0.00 1.69 1.73 0.00 3.31 0.00 0.00 3.26 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.68 0.00 179 T 7.83 4.23 4.25 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 1.22 0.00 0.00 180 D 7.98 4.83 0.00 2.76 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 0.00 181 R 7.98 5.11 0.00 1.70 1.92 0.00 3.21 0.00 0.00 3.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 182 L 8.73 4.83 0.00 1.58 1.59 1.21 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 183 E 8.67 4.61 0.00 2.22 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 2.47 2.39 0.00 184 V 8.22 4.33 2.13 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 0.76 0.00 0.00 0.84 0.00 0.00 185 C 9.12 4.02 0.00 3.19 3.01 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 0.00 0.00 0.00 0.00 186 R 7.90 4.59 0.00 1.62 1.87 0.00 3.24 0.00 0.00 3.81 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.36 0.00 187 E 7.96 4.09 0.00 2.00 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 0.00 2.33 2.30 0.00 188 Y 7.85 4.16 0.00 2.76 3.13 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 0.00 189 Q 7.97 4.06 0.00 2.29 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 190 R 7.28 4.43 0.00 1.79 1.91 0.00 3.19 0.00 0.00 3.34 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 191 G 7.43 3.56 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 0.00 192 N 7.36 4.73 0.00 2.73 2.73 0.00 0.00 7.24 7.65 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 0.00 193 C 7.95 4.49 0.00 3.18 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 *195 R 8.46 4.06 0.00 1.93 1.94 0.00 3.32 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 196 G 8.34 3.99 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 0.00 0.00 0.00 197 E 8.79 3.77 0.00 2.14 2.21 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 2.37 2.36 0.00 198 N 8.15 4.40 0.00 2.70 2.89 0.00 0.00 6.78 8.06 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 0.00 199 D 7.98 4.80 0.00 2.64 2.65 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 0.00 200 C 7.46 4.87 0.00 2.88 2.60 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 0.00 201 R 8.63 4.23 0.00 1.71 1.70 0.00 3.19 0.00 0.00 3.17 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 202 F 7.76 5.01 0.00 2.91 3.01 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 0.00 0.00 0.00 0.00 203 A 8.81 4.17 0.82 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 0.00 204 H 8.68 4.50 0.00 2.80 2.69 0.00 5.73 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 P 0.00 4.36 0.00 2.08 1.93 0.00 3.90 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.90 0.00 206 A 8.51 4.36 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 0.00 207 D 8.72 4.38 0.00 2.66 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 0.00 208 S 7.96 4.29 0.00 4.11 4.08 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 0.00 209 T 7.47 4.40 4.33 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 1.32 0.00 0.00 210 M 8.83 4.30 0.00 1.82 1.90 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.42 0.00 211 I 8.09 4.60 1.85 0.00 0.00 0.84 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 0.58 0.94 0.00 0.00 212 D 9.17 4.55 0.00 2.66 2.68 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 0.00 213 T 8.37 4.11 4.23 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 0.00 214 N 8.58 4.51 0.00 2.88 2.92 0.00 0.00 6.72 7.58 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 0.00 215 D 7.50 4.70 0.00 2.71 2.69 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 0.00 216 N 8.35 4.14 0.00 2.97 2.84 0.00 0.00 6.71 6.89 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 0.00 217 T 7.65 5.17 4.32 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 1.36 0.00 0.00 218 V 8.40 4.86 2.04 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 0.59 0.00 0.00 0.40 0.00 0.00 219 T 8.31 5.04 4.59 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 1.33 0.00 0.00 220 V 8.88 4.31 2.15 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 1.13 0.00 0.00 221 C 9.41 4.19 0.00 3.26 3.01 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 0.00 0.00 0.00 0.00 222 M 8.69 4.07 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.48 0.00 223 D 8.06 4.33 0.00 2.73 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 0.00 224 Y 7.93 3.92 0.00 2.73 3.02 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 0.00 225 I 7.57 3.60 1.97 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.95 0.88 0.00 0.00 226 K 7.92 4.19 0.00 1.87 1.81 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.53 7.81 227 G 6.76 3.52 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 R 7.66 4.24 0.00 1.71 1.75 0.00 3.22 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 229 C 8.83 4.81 0.00 3.11 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 S 8.76 4.58 0.00 4.04 3.96 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 0.00 0.00 0.00 0.00 231 R 7.71 4.46 0.00 1.90 1.96 0.00 3.41 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 232 E 8.95 4.12 0.00 1.94 1.99 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 2.30 2.34 0.00 233 K 7.51 4.58 0.00 1.72 1.68 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.38 7.81 234 C 7.76 4.35 0.00 2.95 2.72 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 0.00 235 K 8.40 4.47 0.00 1.70 1.87 0.00 1.43 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.21 0.35 7.81 236 Y 7.45 5.10 0.00 3.01 3.18 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 F 9.46 4.58 0.00 3.06 3.01 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 0.00 0.00 0.00 0.00 238 H 8.11 4.33 0.00 2.35 1.41 0.00 5.77 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 P 0.00 3.54 0.00 2.12 2.09 0.00 3.59 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 240 P 0.00 4.34 0.00 2.13 2.06 0.00 3.62 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 241 A 8.85 4.01 1.32 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 0.00 242 H 8.21 4.46 0.00 3.27 3.43 0.00 5.51 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 L 7.55 4.43 0.00 1.78 1.79 1.05 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 244 Q 7.58 4.22 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 245 A 8.30 4.10 1.25 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 0.00 246 K 8.54 4.12 0.00 1.72 1.69 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.42 7.81 * Residues marked with a * may have inaccurate shift predictions.