NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 L 4.3091 8.1844 120.6291 54.5733 43.0701 175.6354 14 V 4.0852 8.1022 121.9744 59.8648 33.7075 172.8805 15 D 4.4857 8.5858 127.5824 53.1740 42.1668 173.9636 16 P 4.2601 0.0000 0.0000 66.7314 30.8226 176.9161 17 L 3.8764 8.9083 119.7812 58.7246 41.8999 178.7280 18 T 3.9227 8.0551 108.7814 65.3959 68.5029 176.5753 19 T 3.8743 7.6925 117.7576 66.5657 68.6692 176.6637 20 V 3.7991 8.1827 119.3675 64.8517 31.4253 177.8153 21 R 4.1387 7.9418 120.0336 59.6651 30.0760 178.8591 22 E 3.9981 7.8121 116.7914 61.3352 30.0026 180.7252 23 Q 4.2637 7.9212 120.3280 59.1571 29.1285 177.4115 24 C 4.1456 8.1254 119.8852 60.9826 40.2614 176.7245 25 E 4.1504 8.8516 119.5614 60.5342 29.3552 179.6571 26 Q 4.6706 8.3312 117.7797 56.7432 29.7633 182.8925 27 L 4.3825 8.2031 122.9508 57.9271 42.5516 182.7692 28 E 4.1058 8.9855 117.1234 61.9662 29.3411 180.5792 29 K 4.2049 8.0521 117.2587 60.3354 31.7637 178.4668 30 C 4.3206 8.2016 116.1427 62.5628 28.2042 175.7405 31 V 3.9744 8.5209 121.9453 67.1870 30.6895 179.3920 32 K 4.0805 9.3560 123.6602 59.3764 31.3719 180.5463 33 A 4.4446 8.3892 120.9188 54.6527 18.8194 179.5431 34 R 3.4510 9.5593 120.2929 60.0811 30.0448 179.1092 35 E 3.9640 8.1827 120.0987 61.8027 29.5990 181.8502 36 R 4.1991 7.7262 120.8808 60.7193 29.2189 180.5862 37 L 4.1235 7.5696 120.9636 59.1726 42.3246 178.9293 38 E 3.8918 8.3696 118.5775 61.2127 29.4616 181.1983 39 L 4.1197 7.8620 118.8359 58.1698 41.7632 178.6714 40 C 4.2089 7.6631 118.2197 59.6567 40.0224 175.2105 41 D 4.2901 8.4921 122.3398 58.1164 40.7273 178.7190 42 E 4.2119 8.2220 120.3496 60.2471 29.7611 180.9044 43 R 4.4207 7.8770 119.0386 61.3453 29.5453 184.0764 44 V 4.0101 7.8411 117.3564 65.1229 32.0045 177.4659 45 S 4.4434 7.7864 112.9328 59.3784 63.1298 175.8988 46 S 4.3507 7.4815 116.3737 59.2457 63.3484 174.0281 47 R 4.5460 7.2527 121.0614 54.8224 31.8763 175.4523 48 S 4.4997 8.4622 116.5008 59.6250 63.8609 174.6613 49 Q 4.5518 7.7392 120.0698 53.8418 28.5385 173.5978 50 T 4.7307 7.6582 115.9860 61.3043 72.4093 174.1477 51 E 4.2626 8.6297 122.9142 57.4908 30.3361 176.8764 52 E 4.0526 8.0810 119.3565 56.3073 30.2112 175.3027 53 D 5.0545 8.3546 123.4846 52.8299 44.5140 176.6976 54 C 5.4460 8.5800 117.9876 56.6103 40.6393 176.2309 55 T 3.3792 7.8942 112.1509 65.4684 67.9323 174.5831 56 E 3.8104 8.1245 120.6947 59.1314 29.2611 178.5598 57 E 4.0713 8.1947 117.3114 59.6961 29.7291 179.5015 58 L 4.0284 7.8679 119.9517 58.1285 41.8358 178.8063 59 F 4.5268 8.1334 117.9733 61.0982 38.7194 177.1801 60 D 4.5814 8.2916 118.2905 57.8131 40.5986 179.4167 61 F 4.3444 8.0040 119.5282 61.3557 39.5680 177.3494 62 L 3.8204 8.0046 120.0570 57.3656 41.2625 178.8875 63 H 4.1372 9.3891 117.5834 58.1758 29.7014 176.5151 64 A 4.3840 7.4203 122.2486 54.9853 19.4711 178.3298 65 R 3.4965 8.0757 117.1334 59.5363 29.8352 177.8280 66 D 4.2914 8.0781 117.2029 58.0513 40.9915 178.6540 67 H 4.0563 7.3160 117.1844 59.5099 29.8239 173.9734 68 C 4.3816 8.2006 114.9389 57.2186 40.2883 175.8386 69 V 3.3844 7.6554 120.5184 65.8574 30.8122 177.7015 70 A 3.7897 8.2261 123.0272 56.0086 18.1114 179.8358 *71 H 4.1077 7.4024 115.6054 59.0054 28.0895 177.9985 72 K 4.5903 7.7138 115.4873 57.7032 35.2259 178.1210 73 L 3.9088 8.5080 120.5988 58.5741 41.6589 179.0083 74 F 4.5844 8.2352 116.7003 59.9469 38.7001 177.1243 75 N 4.2199 8.7944 116.6343 55.8841 38.3838 176.5985 76 S 4.4760 7.9749 115.0114 58.7623 63.8335 174.8195 77 L 4.2089 6.8086 121.0976 54.0300 42.1994 176.8684 78 K 4.0798 8.4013 121.6380 56.7342 32.1681 176.5625 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 13 L 8.18 4.31 0.00 1.66 1.68 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.10 4.09 2.09 0.00 0.00 0.00 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 0.94 0.00 0.00 15 D 8.59 4.49 0.00 2.73 2.56 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 16 P 0.00 4.26 0.00 2.32 2.35 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 17 L 8.91 3.88 0.00 1.80 1.81 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.06 3.92 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 1.23 0.00 0.00 19 T 7.69 3.87 4.40 0.00 0.00 0.00 0.00 0.00 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 20 V 8.18 3.80 2.09 0.00 0.00 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 1.00 0.00 0.00 21 R 7.94 4.14 0.00 2.10 1.97 0.00 3.20 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 22 E 7.81 4.00 0.00 2.09 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 0.00 2.26 2.20 0.00 23 Q 7.92 4.26 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.67 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 24 C 8.13 4.15 0.00 3.17 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 25 E 8.85 4.15 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.20 0.00 26 Q 8.33 4.67 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.89 0.00 0.00 0.00 0.00 0.00 2.22 2.15 0.00 27 L 8.20 4.38 0.00 1.60 1.58 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.99 4.11 0.00 1.96 1.94 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 2.32 2.00 0.00 29 K 8.05 4.20 0.00 1.81 1.96 0.00 1.66 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.59 7.81 30 C 8.20 4.32 0.00 3.23 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.52 3.97 2.23 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 1.00 0.00 0.00 1.09 0.00 0.00 32 K 9.36 4.08 0.00 1.63 1.80 0.00 1.85 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.33 7.81 33 A 8.39 4.44 1.61 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 0.00 0.00 34 R 9.56 3.45 0.00 1.61 2.09 0.00 2.89 0.00 0.00 2.68 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 35 E 8.18 3.96 0.00 2.05 1.93 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 2.24 2.19 0.00 36 R 7.73 4.20 0.00 1.83 2.00 0.00 3.22 0.00 0.00 3.09 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 37 L 7.57 4.12 0.00 1.70 1.74 0.78 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.37 3.89 0.00 1.97 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 2.25 2.25 0.00 39 L 7.86 4.12 0.00 1.72 1.72 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 40 C 7.66 4.21 0.00 2.90 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.49 4.29 0.00 2.92 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 42 E 8.22 4.21 0.00 2.11 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 2.26 2.05 0.00 43 R 7.88 4.42 0.00 1.83 1.95 0.00 3.23 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.50 0.00 44 V 7.84 4.01 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 1.06 0.00 0.00 1.00 0.00 0.00 45 S 7.79 4.44 0.00 4.05 4.07 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 46 S 7.48 4.35 0.00 4.08 4.19 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.25 4.55 0.00 1.75 1.84 0.00 3.30 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.76 0.00 48 S 8.46 4.50 0.00 3.89 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 0.00 49 Q 7.74 4.55 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 50 T 7.66 4.73 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 1.24 0.00 0.00 51 E 8.63 4.26 0.00 1.95 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 2.27 2.23 0.00 52 E 8.08 4.05 0.00 1.91 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 2.27 2.32 0.00 53 D 8.35 5.05 0.00 2.62 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.58 5.45 0.00 2.88 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 55 T 7.89 3.38 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 1.08 0.00 0.00 56 E 8.12 3.81 0.00 2.08 1.95 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 2.56 2.51 0.00 57 E 8.19 4.07 0.00 2.19 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 2.40 2.46 0.00 58 L 7.87 4.03 0.00 1.70 1.56 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.13 4.53 0.00 3.27 2.96 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 60 D 8.29 4.58 0.00 2.95 2.84 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 0.00 0.00 0.00 61 F 8.00 4.34 0.00 3.17 3.37 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 3.82 0.00 2.00 1.82 1.11 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 63 H 9.39 4.14 0.00 2.98 3.33 0.00 5.74 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.42 4.38 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 R 8.08 3.50 0.00 0.97 1.39 0.00 3.10 0.00 0.00 2.96 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.51 0.00 66 D 8.08 4.29 0.00 2.80 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 67 H 7.32 4.06 0.00 3.10 3.48 0.00 5.94 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 C 8.20 4.38 0.00 3.15 3.27 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 0.00 69 V 7.66 3.38 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 0.99 0.00 0.00 0.92 0.00 0.00 70 A 8.23 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *71 H 7.40 4.11 0.00 3.00 3.02 0.00 7.15 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.71 4.59 0.00 1.68 1.79 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.31 7.81 73 L 8.51 3.91 0.00 1.89 1.62 0.99 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 74 F 8.24 4.58 0.00 3.05 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 75 N 8.79 4.22 0.00 2.75 2.91 0.00 0.00 6.93 7.85 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 76 S 7.97 4.48 0.00 3.89 3.93 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 77 L 6.81 4.21 0.00 1.48 1.46 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.40 4.08 0.00 1.68 1.64 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.40 7.81 * Residues marked with a * may have inaccurate shift predictions.