NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 42 N 4.7180 8.2676 119.2061 53.1962 40.1801 174.9064 43 S 4.1143 8.7242 121.7725 60.9929 62.7974 175.0469 44 A 3.9502 8.6965 125.2056 55.1258 18.7328 180.6973 45 L 4.0077 7.8794 117.0450 57.8186 41.8185 179.1824 46 D 4.2587 8.6242 119.3014 57.4692 40.8356 178.4593 47 F 3.9850 8.2714 120.8763 61.3507 38.8519 176.9036 48 L 4.0792 8.0720 119.7711 58.1944 41.7309 178.9264 49 K 3.7349 8.3571 118.5337 59.4021 32.0990 177.7791 50 H 4.6202 7.7083 115.0027 57.7575 29.0611 176.1159 51 H 4.5616 7.6928 115.8631 54.5032 29.0876 174.8003 52 L 4.7485 7.1836 120.2006 53.6747 45.1216 175.2670 53 G 3.6123 8.7319 106.3087 43.9872 0.0000 172.6685 54 A 3.9423 8.5104 124.2394 51.7262 18.0956 177.7518 55 A 4.1814 8.3045 125.4564 52.6612 19.2421 176.5631 56 T 4.2362 8.0949 116.4818 62.0766 69.0819 173.7691 57 P 4.2434 0.0000 0.0000 62.1924 31.8975 175.9791 58 E 3.9192 8.6550 122.0054 56.6437 29.3498 176.4621 59 N 4.6588 8.5297 123.3415 51.9862 40.4057 173.6198 60 P 4.8590 0.0000 0.0000 65.0561 31.4948 178.3136 61 E 3.9476 9.0701 118.7579 59.2429 29.4699 178.9240 62 I 3.7455 7.8491 119.4538 64.3654 37.3571 178.0909 63 E 3.9569 8.1014 119.0719 59.3544 29.1831 179.1199 64 L 3.9581 7.8799 118.9170 57.8926 41.7193 179.2856 65 L 4.2287 7.9253 119.8296 57.4710 41.5920 180.0505 66 R 3.9674 8.2719 117.8748 59.3334 29.9892 179.1640 67 L 4.0220 7.9400 118.6446 57.4967 41.2464 179.3766 68 E 4.0026 8.3494 119.1736 58.9162 29.3137 178.8848 69 L 3.9345 8.3696 120.6468 58.1311 42.2279 178.7262 70 A 3.9744 8.1422 120.8189 55.1961 18.3019 179.1398 71 E 3.8446 8.2814 117.6072 59.7687 29.7196 178.7032 72 M 4.0573 8.6051 118.4942 58.5992 32.2934 178.0838 73 K 4.0195 8.4428 120.0709 59.2623 32.2086 178.7358 74 E 3.9881 8.1676 119.0582 59.4462 29.5667 179.3995 75 K 3.9874 8.1031 118.4519 59.5154 32.1692 178.7659 76 Y 4.0552 8.2980 119.8115 60.9576 38.6938 178.1288 77 E 3.8342 8.4909 119.0843 59.0038 29.4347 179.3891 78 A 3.9399 7.7584 120.8031 55.2529 18.5772 179.6111 79 I 3.6560 7.5079 116.3461 63.8059 37.9498 178.2088 80 V 3.5898 7.3087 119.2701 65.5215 31.2816 177.9358 81 E 3.8682 7.6977 118.7345 59.2686 29.2820 178.7975 82 E 3.8638 8.0197 119.3021 59.3720 29.8668 178.1412 83 N 4.2099 8.5045 117.3449 56.9137 39.0231 176.9173 84 K 4.0537 8.0206 119.6871 59.0398 32.0807 179.6504 85 K 3.9863 7.8791 118.9241 59.3133 32.0047 179.2163 86 L 3.9950 8.1207 119.4982 57.9717 41.5668 179.8306 87 K 3.9895 8.0047 117.6018 59.3215 31.6901 179.2893 88 A 3.9836 7.5795 119.9819 54.9358 18.5344 179.5712 89 K 3.9748 8.0635 116.9788 59.7067 32.2103 179.5849 90 L 4.0841 7.9998 118.9107 57.7667 41.2345 179.3653 91 A 4.0099 7.5895 119.6335 55.2396 18.2678 178.7743 92 Q 3.8016 7.7385 115.8289 58.3865 28.9884 175.7860 93 Y 4.8824 6.9603 114.7254 57.4125 40.5580 175.5904 94 E 4.1732 8.9541 119.5762 57.7761 29.6615 174.4183 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 42 N 8.27 4.72 0.00 2.82 2.78 0.00 0.00 6.82 6.75 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 43 S 8.72 4.11 0.00 4.18 4.13 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 44 A 8.70 3.95 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 45 L 7.88 4.01 0.00 1.85 1.74 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.62 4.26 0.00 2.96 2.67 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 0.00 0.00 0.00 47 F 8.27 3.99 0.00 3.08 3.14 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 0.00 0.00 0.00 0.00 48 L 8.07 4.08 0.00 2.06 1.87 1.01 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.36 3.73 0.00 1.83 1.99 0.00 1.88 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.50 7.81 50 H 7.71 4.62 0.00 3.02 3.17 0.00 5.72 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 H 7.69 4.56 0.00 2.92 3.21 0.00 5.79 0.00 0.00 0.00 0.00 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.18 4.75 0.00 1.65 1.52 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.73 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 0.00 0.00 0.00 54 A 8.51 3.94 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 55 A 8.30 4.18 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 56 T 8.09 4.24 4.22 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 1.19 0.00 0.00 57 P 0.00 4.24 0.00 2.03 1.98 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 58 E 8.66 3.92 0.00 1.93 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 2.31 2.44 0.00 59 N 8.53 4.66 0.00 2.74 2.68 0.00 0.00 7.13 7.71 0.00 0.00 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 P 0.00 4.86 0.00 2.19 2.08 0.00 3.92 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 61 E 9.07 3.95 0.00 2.02 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 2.30 2.38 0.00 62 I 7.85 3.75 2.02 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 1.63 0.51 0.90 0.00 0.00 63 E 8.10 3.96 0.00 2.04 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 2.32 2.57 0.00 64 L 7.88 3.96 0.00 2.00 1.71 0.98 0.62 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 65 L 7.93 4.23 0.00 1.84 1.73 0.91 0.62 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 66 R 8.27 3.97 0.00 1.99 1.98 0.00 3.12 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 67 L 7.94 4.02 0.00 1.89 1.71 0.92 0.99 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 68 E 8.35 4.00 0.00 2.14 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 2.33 2.31 0.00 69 L 8.37 3.93 0.00 1.86 1.79 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.14 3.97 1.33 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 0.00 0.00 0.00 71 E 8.28 3.84 0.00 2.28 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 0.00 2.32 2.47 0.00 72 M 8.61 4.06 0.00 2.21 2.10 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 2.60 2.59 0.00 73 K 8.44 4.02 0.00 1.96 1.97 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.51 7.81 74 E 8.17 3.99 0.00 2.31 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 2.45 2.51 0.00 75 K 8.10 3.99 0.00 2.01 1.90 0.00 1.69 0.00 0.00 1.59 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.63 7.81 76 Y 8.30 4.06 0.00 3.09 3.20 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 0.00 77 E 8.49 3.83 0.00 2.19 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 2.74 2.56 0.00 78 A 7.76 3.94 1.33 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 0.00 0.00 0.00 79 I 7.51 3.66 1.81 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 1.35 0.76 0.80 0.00 0.00 80 V 7.31 3.59 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 0.87 0.00 0.00 0.16 0.00 0.00 81 E 7.70 3.87 0.00 2.19 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 2.47 2.43 0.00 82 E 8.02 3.86 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 83 N 8.50 4.21 0.00 2.82 2.94 0.00 0.00 7.29 5.86 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 84 K 8.02 4.05 0.00 1.98 1.82 0.00 1.70 0.00 0.00 1.62 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.71 7.81 85 K 7.88 3.99 0.00 2.13 1.84 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.65 7.81 86 L 8.12 3.99 0.00 1.82 1.73 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.00 3.99 0.00 1.99 1.85 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.70 7.81 88 A 7.58 3.98 1.34 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 0.00 0.00 89 K 8.06 3.97 0.00 2.03 1.91 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.47 7.81 90 L 8.00 4.08 0.00 1.86 1.76 0.95 1.02 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 91 A 7.59 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 92 Q 7.74 3.80 0.00 1.04 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.58 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 93 Y 6.96 4.88 0.00 3.00 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 94 E 8.95 4.17 0.00 2.17 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 2.26 2.37 0.00