NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 D 4.9770 8.2076 120.4471 52.8681 42.0389 174.0843 9 F 5.2383 7.6604 112.5211 55.5554 41.3523 168.4807 10 V 4.5005 9.0226 112.5496 59.5458 36.0111 176.0046 11 V 4.7969 8.6777 123.7149 61.3347 33.8049 174.4201 12 I 4.9476 9.0324 128.6398 59.3471 40.6332 174.1352 13 K 5.0475 9.0017 128.6014 54.2725 34.6861 174.8860 14 A 4.3996 8.8866 130.2687 52.1988 18.7943 178.0004 15 V 3.9988 8.9085 122.9344 63.9161 32.6701 175.5004 16 E 4.7975 7.8756 117.2809 54.0014 33.5678 174.6227 17 D 4.4201 8.3511 119.7679 55.7725 41.3267 176.8695 18 G 3.8513 8.6220 108.8803 45.6879 0.0000 173.9352 19 V 3.9769 7.5347 119.8767 62.7286 32.9476 174.5864 20 N 5.3789 9.1271 124.4678 51.4311 41.9823 173.4668 21 V 4.6085 8.9229 124.4939 61.5226 33.4097 174.2633 22 I 4.8491 8.7541 130.3693 59.4618 39.5341 175.2270 23 G 4.1226 8.8082 115.1917 45.4894 0.0000 172.3778 24 L 5.4085 8.6935 125.2149 52.8764 44.3412 176.1820 25 T 4.5242 8.6975 114.2593 61.7415 69.4022 174.1894 26 R 4.3127 7.9073 126.3091 56.3362 30.8681 175.3560 27 G 3.8151 8.8296 111.0676 44.3125 0.0000 172.9613 28 T 3.9590 8.5802 109.1119 64.1198 68.9058 174.1288 29 D 4.7968 7.7966 120.0077 52.8495 42.5343 176.1109 30 T 4.6836 8.2896 119.0538 61.7523 70.1739 173.1513 31 K 4.8785 9.1008 125.6063 54.4810 36.8648 175.6366 32 F 4.9970 8.8191 116.4775 57.4512 37.9902 174.6289 33 H 4.9085 8.8395 116.2748 56.1214 30.7366 173.4977 34 H 4.8239 7.8794 116.4583 55.3394 33.2244 172.4030 35 S 4.9769 8.4806 120.7879 56.7154 65.2925 172.9145 36 E 4.3655 9.1254 127.5403 54.7235 30.7709 175.1322 37 K 4.6794 8.5810 128.5893 55.9889 33.6217 175.6198 38 L 4.8348 9.0767 128.1132 53.6046 45.1112 175.4840 39 D 4.8978 9.3977 126.6300 52.4426 43.2893 175.8517 40 K 3.8782 8.7230 121.0401 58.5247 32.1509 176.7151 41 G 4.0116 9.1925 115.9464 45.2704 0.0000 173.2795 42 E 4.3805 8.2799 119.5777 56.0568 31.1241 175.9304 43 V 4.8698 8.1572 120.4468 61.2021 34.7225 174.3284 44 I 4.5605 8.9567 127.6901 59.1825 41.1126 173.9022 45 I 5.0003 8.4174 129.0417 59.6045 38.9753 174.7328 46 A 4.7244 8.9469 128.9319 50.1632 22.0378 175.1922 47 Q 4.8878 8.5734 120.4156 54.6628 30.7936 175.5745 48 F 4.5968 8.5516 120.3972 57.8708 39.8767 175.2573 49 T 4.7304 8.7978 111.6348 60.3092 71.8805 173.4588 50 E 4.0533 8.8684 119.9905 59.4753 29.6366 178.0966 51 H 4.5845 8.1430 114.2976 56.1851 29.9848 174.4563 52 T 5.1894 8.3238 117.4243 61.8993 70.1001 174.1917 53 S 5.1118 8.8416 119.0135 57.9132 64.9184 173.3333 54 A 5.0676 7.9818 121.4805 51.1019 22.6493 175.2242 55 I 5.0076 8.5756 120.8166 59.3894 40.6037 174.6939 56 K 4.6421 9.1928 128.5060 54.5413 34.7276 174.7445 57 V 4.8523 8.3888 126.1536 61.0600 33.9410 174.3744 58 R 4.5083 8.9527 127.7695 55.4982 33.2107 174.1087 59 G 3.9364 8.9224 110.5982 43.9933 0.0000 172.1863 60 E 4.5882 8.6923 119.4866 55.5192 30.2608 174.9861 61 A 5.0922 8.7544 127.8059 50.7653 23.7439 173.9693 62 L 4.8282 9.0457 121.5222 53.3377 44.8676 175.1287 63 I 5.0099 8.7659 127.1043 59.6300 40.0121 174.4755 64 Q 5.2635 9.0782 125.9050 54.4407 32.1130 174.9330 65 T 4.9460 8.4889 112.2961 59.7032 72.4405 174.2708 66 A 3.9629 8.3875 123.1246 54.7560 18.2295 177.7417 67 Y 4.8644 7.6869 111.8952 57.2201 39.4128 175.1123 68 G 3.9829 7.1739 106.2296 44.1862 0.0000 172.6164 69 E 5.3645 8.6589 121.1399 54.8793 32.9566 175.4786 70 M 4.8541 8.9302 121.4130 53.9142 36.3294 173.6262 71 K 5.0633 8.6662 124.5671 54.7007 34.3253 176.1823 72 S 4.6502 8.5125 120.0101 57.8423 65.0211 173.0047 73 E 5.1915 8.4170 119.7002 53.9237 33.2033 176.0562 74 K 4.1111 8.7378 121.1435 57.3065 32.5461 176.7474 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 8 D 8.21 4.98 0.00 2.89 3.03 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 0.00 0.00 0.00 9 F 7.66 5.24 0.00 3.03 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 10 V 9.02 4.50 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.85 0.00 0.00 11 V 8.68 4.80 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.15 0.00 0.00 12 I 9.03 4.95 1.86 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 1.11 0.62 0.91 0.00 0.00 13 K 9.00 5.05 0.00 1.79 1.64 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.35 7.81 14 A 8.89 4.40 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 V 8.91 4.00 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 0.78 0.00 0.00 0.93 0.00 0.00 16 E 7.88 4.80 0.00 1.92 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 17 D 8.35 4.42 0.00 2.66 2.59 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 0.00 18 G 8.62 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.53 3.98 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.00 0.00 0.00 20 N 9.13 5.38 0.00 2.65 2.59 0.00 0.00 6.36 8.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.92 4.61 2.06 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 0.82 0.00 0.00 0.91 0.00 0.00 22 I 8.75 4.85 1.86 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.56 0.96 0.00 0.00 23 G 8.81 4.12 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 0.00 0.00 0.00 24 L 8.69 5.41 0.00 1.69 1.64 0.98 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.70 4.52 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 26 R 7.91 4.31 0.00 1.91 1.97 0.00 3.19 0.00 0.00 3.08 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.44 0.00 27 G 8.83 3.82 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 0.00 28 T 8.58 3.96 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 29 D 7.80 4.80 0.00 2.66 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.29 4.68 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 31 K 9.10 4.88 0.00 1.54 1.78 0.00 1.18 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.26 1.23 7.81 32 F 8.82 5.00 0.00 3.02 3.10 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 0.00 0.00 0.00 33 H 8.84 4.91 0.00 3.10 3.43 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.88 4.82 0.00 3.33 3.17 0.00 5.80 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.48 4.98 0.00 3.61 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 9.13 4.37 0.00 2.08 1.81 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 2.27 2.30 0.00 37 K 8.58 4.68 0.00 1.78 1.66 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.59 7.81 38 L 9.08 4.83 0.00 1.68 1.44 0.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.40 4.90 0.00 2.62 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 40 K 8.72 3.88 0.00 1.87 1.78 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.46 1.58 7.81 41 G 9.19 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 0.00 0.00 0.00 42 E 8.28 4.38 0.00 1.97 1.86 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 2.32 2.36 0.00 43 V 8.16 4.87 2.07 0.00 0.00 0.00 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 0.93 0.00 0.00 44 I 8.96 4.56 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.20 0.90 0.00 0.00 45 I 8.42 5.00 1.73 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.63 0.62 0.00 0.00 46 A 8.95 4.72 1.13 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 0.00 0.00 47 Q 8.57 4.89 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 48 F 8.55 4.60 0.00 3.03 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 49 T 8.80 4.73 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 50 E 8.87 4.05 0.00 1.77 1.96 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 2.30 2.39 0.00 51 H 8.14 4.58 0.00 3.23 3.24 0.00 5.76 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.32 5.19 4.35 0.00 0.00 0.00 0.00 0.00 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 53 S 8.84 5.11 0.00 3.85 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 54 A 7.98 5.07 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.58 5.01 1.85 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.64 0.87 0.00 0.00 56 K 9.19 4.64 0.00 1.81 1.64 0.00 1.58 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.36 7.81 57 V 8.39 4.85 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 0.84 0.00 0.00 0.93 0.00 0.00 58 R 8.95 4.51 0.00 1.87 1.67 0.00 3.09 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 59 G 8.92 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.69 4.59 0.00 2.10 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 61 A 8.75 5.09 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 9.05 4.83 0.00 1.72 1.50 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 63 I 8.77 5.01 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.79 0.91 0.00 0.00 64 Q 9.08 5.26 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.52 0.00 0.00 0.00 0.00 0.00 2.37 2.27 0.00 65 T 8.49 4.95 3.89 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 0.00 0.00 0.00 1.13 0.00 0.00 66 A 8.39 3.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.69 4.86 0.00 2.98 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 68 G 7.17 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.66 5.36 0.00 1.83 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 70 M 8.93 4.85 0.00 2.11 1.85 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 71 K 8.67 5.06 0.00 1.66 1.71 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.41 7.81 72 S 8.51 4.65 0.00 3.85 3.98 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 0.00 0.00 0.00 0.00 73 E 8.42 5.19 0.00 1.82 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 74 K 8.74 4.11 0.00 1.87 1.79 0.00 1.63 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.42 0.00 0.00 0.00 0.00 1.65 1.38 7.81