NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2644 8.1633 120.3366 54.8278 32.4697 174.4754 2 K 3.9823 8.2876 127.1068 57.3049 32.5592 175.7222 3 G 3.9723 9.7189 111.3593 45.2411 0.0000 174.2351 4 M 3.7371 7.6048 119.2239 59.0955 32.4464 178.0748 5 S 4.1591 7.9546 113.8716 60.1405 63.5019 174.8403 6 K 4.2578 7.9824 121.3202 58.4761 32.8931 176.5253 7 M 4.0662 7.2115 115.8025 54.9904 32.4067 174.9111 8 P 4.3891 0.0000 0.0000 62.7210 32.1764 175.9836 9 Q 4.4277 8.3921 119.5873 55.0058 30.0703 174.7930 10 F 4.4877 8.4319 121.9332 56.0475 41.0299 174.4116 11 N 4.1791 7.8871 127.0606 53.2794 38.2613 173.5441 12 L 4.4547 7.9213 127.5588 53.7089 43.5529 176.6452 13 R 4.3776 8.1687 122.7638 54.7991 32.0333 174.1204 14 W 5.2127 8.3558 121.8023 53.2571 33.0491 174.2276 15 P 4.5497 0.0000 0.0000 62.4981 32.7048 176.9558 16 R 3.9497 8.7379 120.8029 60.0185 30.2009 178.6271 17 E 3.9263 8.3826 117.3282 59.7200 29.3683 179.8215 18 V 3.5821 7.7132 117.2178 65.9503 31.7662 177.5598 19 L 4.1529 8.1698 118.8380 58.4280 41.6032 179.5275 20 D 4.3716 8.8560 118.7071 57.0407 40.6835 178.6114 21 L 3.9337 7.7462 120.4825 58.1881 42.0607 179.1730 22 V 3.6073 7.9806 118.0744 66.0370 31.4315 177.5559 23 R 3.8843 8.2569 118.7496 59.5192 29.9286 178.2004 24 K 3.8829 8.0829 118.9123 59.7211 31.8364 178.8952 25 V 3.6236 7.8993 118.2059 65.8677 31.2705 177.8546 26 A 4.1611 8.2280 122.1865 54.5840 18.1945 179.1965 27 E 3.9392 7.9712 116.9889 59.6146 29.4933 179.2100 28 E 4.2597 7.9200 113.8551 57.8253 29.6814 177.2978 29 N 4.9478 7.3367 115.9152 52.2154 39.6383 174.8741 30 G 3.9035 8.0108 108.1972 46.0970 0.0000 173.7579 31 R 4.6451 7.8517 117.8936 53.9362 32.7940 176.4715 32 S 4.5613 8.1083 114.1955 57.5671 65.6564 175.2722 33 V 3.5593 8.2708 122.6449 66.3983 31.1194 177.6231 34 N 4.2505 8.2509 116.1275 57.0863 38.5563 176.5448 35 S 4.2808 7.9690 115.6580 60.6774 62.9100 176.3141 36 E 3.9436 8.4191 122.6004 59.3201 29.4702 178.7300 37 I 3.7871 8.1444 120.1927 64.6319 37.2494 177.3759 38 Y 4.0387 7.6949 120.2988 61.1657 38.4390 178.2167 39 Q 4.0077 8.4923 118.5231 59.1407 28.9096 178.8908 40 R 3.8587 7.9554 118.6985 59.5556 30.2508 179.1038 41 V 3.2943 7.5602 118.6943 65.6738 31.4636 177.8528 42 M 3.9640 7.6369 118.1511 58.3150 31.6955 178.6856 43 E 3.9425 8.1762 118.9901 59.4473 29.6011 179.3802 44 S 4.1132 7.9123 114.2017 61.5708 62.7390 176.4513 45 F 4.6989 8.0551 121.2466 60.5577 38.2792 177.8189 46 K 4.1164 8.3143 117.3220 58.6243 31.6447 178.8822 47 K 4.0755 7.8399 117.3523 57.7906 32.1656 177.1006 48 E 4.5657 7.8216 115.3902 55.2024 32.2126 176.0044 49 G 4.2433 8.3484 114.6170 45.3112 0.0000 173.8943 50 R 3.9303 7.6672 122.3763 55.9641 30.3144 176.2069 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 1 M 8.16 4.26 0.00 1.96 1.87 0.00 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 2 K 8.29 3.98 0.00 1.84 1.73 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.47 7.81 3 G 9.72 3.97 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 0.00 0.00 0.00 4 M 7.60 3.74 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 5 S 7.95 4.16 0.00 4.00 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 6 K 7.98 4.26 0.00 1.80 1.88 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.53 7.81 7 M 7.21 4.07 0.00 2.14 2.02 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.55 0.00 8 P 0.00 4.39 0.00 2.08 2.02 0.00 3.70 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 9 Q 8.39 4.43 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.72 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 10 F 8.43 4.49 0.00 3.00 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 11 N 7.89 4.18 0.00 2.48 2.37 0.00 0.00 7.11 7.78 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 12 L 7.92 4.45 0.00 1.40 1.04 1.20 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.17 4.38 0.00 1.84 1.85 0.00 3.19 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.59 0.00 14 W 8.36 5.21 0.00 3.30 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 15 P 0.00 4.55 0.00 2.29 2.20 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 16 R 8.74 3.95 0.00 1.90 2.08 0.00 3.18 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.79 0.00 17 E 8.38 3.93 0.00 2.06 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 0.00 2.42 2.47 0.00 18 V 7.71 3.58 2.32 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 1.00 0.00 0.00 0.86 0.00 0.00 19 L 8.17 4.15 0.00 1.96 1.79 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.86 4.37 0.00 2.87 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.75 3.93 0.00 2.07 1.85 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 22 V 7.98 3.61 2.32 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 1.12 0.00 0.00 1.17 0.00 0.00 23 R 8.26 3.88 0.00 2.04 2.14 0.00 3.16 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 24 K 8.08 3.88 0.00 1.90 1.99 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.46 7.81 25 V 7.90 3.62 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.99 0.00 0.00 26 A 8.23 4.16 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 7.97 3.94 0.00 2.25 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 2.34 2.56 0.00 28 E 7.92 4.26 0.00 2.17 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 2.56 2.43 0.00 29 N 7.34 4.95 0.00 2.85 2.86 0.00 0.00 6.92 7.53 0.00 0.00 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 G 8.01 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 31 R 7.85 4.65 0.00 1.81 1.86 0.00 3.19 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 32 S 8.11 4.56 0.00 4.03 3.97 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 33 V 8.27 3.56 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 1.10 0.00 0.00 0.94 0.00 0.00 34 N 8.25 4.25 0.00 2.85 2.80 0.00 0.00 7.19 8.10 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 35 S 7.97 4.28 0.00 4.06 3.88 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 36 E 8.42 3.94 0.00 2.21 2.11 0.00 0.00 0.00 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 2.44 0.00 37 I 8.14 3.79 1.93 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.76 1.02 0.00 0.00 38 Y 7.69 4.04 0.00 3.24 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 39 Q 8.49 4.01 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.48 0.00 0.00 0.00 0.00 0.00 2.86 2.64 0.00 40 R 7.96 3.86 0.00 2.02 1.96 0.00 3.36 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 41 V 7.56 3.29 1.88 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 0.46 0.00 0.00 0.85 0.00 0.00 42 M 7.64 3.96 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 43 E 8.18 3.94 0.00 2.10 1.97 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 2.43 2.45 0.00 44 S 7.91 4.11 0.00 3.98 4.03 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 45 F 8.06 4.70 0.00 3.16 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 46 K 8.31 4.12 0.00 1.90 1.88 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.23 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.74 1.65 7.81 47 K 7.84 4.08 0.00 1.95 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.66 7.81 48 E 7.82 4.57 0.00 1.77 1.92 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 2.25 2.27 0.00 49 G 8.35 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 0.00 0.00 0.00 0.00 50 R 7.67 3.93 0.00 1.81 1.36 0.00 3.30 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00