NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3856 0.0000 0.0000 61.2123 31.6044 175.8297 3 P 4.1571 0.0000 0.0000 61.8802 32.1150 174.7327 4 R 4.5926 8.9908 121.2510 54.0735 33.5479 175.0426 5 P 4.2646 0.0000 0.0000 65.6985 31.4891 178.8252 6 L 3.8778 7.8257 117.4717 57.7532 41.6056 179.0374 7 D 4.4156 8.0218 118.4977 57.3718 40.6377 178.8117 8 V 3.6569 7.4178 117.5085 65.5074 31.6173 177.4982 9 L 3.9740 7.4938 120.2046 57.6389 41.7358 178.3336 10 N 4.5827 7.8981 117.0120 56.6201 38.7972 176.6456 11 R 4.1837 7.8042 116.0668 57.5630 30.1788 177.1286 12 S 4.7164 7.5516 114.3493 57.8819 63.9721 173.9448 13 L 4.2604 8.0491 122.0369 55.9386 41.7348 177.3815 14 K 3.9915 9.0760 121.1585 56.8652 30.2833 175.5980 15 S 5.0376 7.5328 115.2637 55.6340 66.7062 171.6599 16 P 4.8695 0.0000 0.0000 63.3124 32.3252 175.5692 17 V 4.7492 8.5985 113.7500 60.4034 37.0287 173.3756 18 I 4.9124 9.1278 122.9232 59.5918 40.3110 174.9919 19 V 4.4557 8.7465 126.2909 60.9875 34.2990 173.9066 20 R 4.7346 7.6621 128.2069 54.6466 32.7987 174.8687 21 L 5.6054 7.9650 124.5711 51.7213 45.6260 176.0788 22 K 4.2965 8.4978 118.5221 57.6776 32.6119 176.1110 23 G 4.0870 8.3713 109.0012 44.9873 0.0000 174.7695 24 G 4.0882 7.4802 104.4733 44.5935 0.0000 173.3623 25 R 4.2830 8.0001 117.5296 55.7638 31.1393 175.6656 26 E 5.2121 8.2746 119.3940 54.8388 32.8490 174.8372 27 F 5.0341 9.2167 119.3590 55.7827 43.6645 173.9776 28 R 4.9545 9.1872 122.2065 54.2418 33.3558 174.9824 29 G 4.0384 7.7268 110.0937 46.7963 0.0000 170.7402 30 T 5.0394 8.0961 116.9725 61.6272 70.5797 174.4366 31 L 4.3928 8.4614 128.9392 55.7305 42.3596 176.3976 32 D 4.5015 9.3624 127.6450 56.1390 42.4566 176.3604 33 G 4.3846 7.7501 103.2646 45.7270 0.0000 170.7456 34 Y 6.0295 7.9387 117.3339 57.9287 41.0952 172.0355 35 D 4.5686 8.4636 117.3074 52.0725 42.1777 175.4228 36 I 3.7657 8.4589 111.6248 64.7383 37.5324 176.8749 37 H 4.3536 8.3668 117.0788 57.0155 28.5220 176.5503 38 M 3.3928 8.4733 118.8259 55.3531 29.9208 175.7981 39 N 4.8730 8.2279 116.6529 53.4625 40.0778 174.1753 40 L 5.3385 9.0704 122.3067 53.0341 46.1246 175.8061 41 V 4.5663 8.4308 118.8684 61.7033 34.4823 173.7825 42 L 5.3308 8.9023 128.3049 52.9573 44.7677 175.6864 43 L 4.9288 8.7878 122.5169 53.4703 44.9099 175.8426 44 D 4.1947 8.6129 120.3849 55.6164 38.9467 172.6549 45 A 5.9400 8.3233 120.7637 49.5063 22.7566 176.7110 46 E 5.0148 8.4136 116.9417 54.4257 33.8460 173.9063 47 E 3.9814 8.2339 122.1923 55.4783 31.0010 175.0416 48 I 4.9947 8.0157 127.0856 59.0642 39.3661 174.9164 49 Q 4.3626 8.5394 126.7659 54.5391 29.9438 174.3925 50 N 4.1630 8.5508 117.1592 51.4547 35.7242 172.7131 51 G 3.4581 7.2776 120.2006 46.7296 0.0000 170.1551 52 E 4.5771 7.3279 120.8415 55.5749 33.1284 173.7873 53 V 5.0632 8.0863 119.0901 60.3088 32.5019 176.0891 54 V 4.3166 7.8916 114.8507 61.4625 33.3533 175.0915 55 R 4.5710 7.3517 119.0548 55.4807 33.4114 173.2406 56 K 4.8857 8.4174 120.7516 54.9617 36.5033 176.4842 57 V 4.3830 8.6580 115.8364 60.0823 36.0492 175.6528 58 G 3.8721 9.1060 113.1122 49.4960 0.0000 173.1706 59 S 5.8135 7.5104 110.6710 58.6507 65.4225 175.2473 60 V 4.5545 8.1452 113.5587 59.8031 36.5104 174.5234 61 V 4.6572 8.3070 121.9685 61.4853 33.5165 174.4754 62 I 4.3206 8.0996 129.6300 59.4361 39.3097 175.9810 63 R 4.4971 8.4926 126.2627 55.8425 30.7634 178.0898 64 G 3.7709 9.4144 112.2472 47.2581 0.0000 174.8979 65 D 4.5727 8.2022 118.8914 56.8186 41.3871 176.8896 66 T 4.4143 7.9415 106.9946 61.0361 69.5679 173.9699 67 V 4.1116 7.9942 123.3855 62.6004 32.4819 175.1666 68 V 4.3302 8.4267 127.2990 64.4466 32.7399 175.5135 69 F 4.9405 7.2513 112.4713 56.0270 40.9493 172.8450 70 V 4.9702 8.5373 119.2722 61.2393 34.2195 174.6985 71 S 4.9202 9.2851 122.1306 55.6341 66.6746 171.5105 72 P 4.8221 0.0000 0.0000 62.0518 31.6698 176.1271 73 A 4.1850 8.6558 126.4850 52.3897 18.3096 176.7560 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 2 P 0.00 4.39 0.00 2.06 2.10 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 P 0.00 4.16 0.00 2.11 2.00 0.00 3.63 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 4 R 8.99 4.59 0.00 1.90 2.13 0.00 3.24 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 0.00 5 P 0.00 4.26 0.00 2.18 2.07 0.00 3.65 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 6 L 7.83 3.88 0.00 1.69 1.82 0.99 1.12 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 7 D 8.02 4.42 0.00 2.85 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 8 V 7.42 3.66 2.16 0.00 0.00 0.00 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 0.96 0.00 0.00 9 L 7.49 3.97 0.00 1.62 1.29 0.75 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 10 N 7.90 4.58 0.00 3.07 3.05 0.00 0.00 7.14 7.16 0.00 0.00 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 R 7.80 4.18 0.00 2.00 1.97 0.00 3.17 0.00 0.00 3.35 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 12 S 7.55 4.72 0.00 3.96 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.05 4.26 0.00 1.75 1.65 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 14 K 9.08 3.99 0.00 1.92 1.98 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.55 7.81 15 S 7.53 5.04 0.00 3.83 3.73 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 16 P 0.00 4.87 0.00 2.13 2.18 0.00 3.69 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 2.08 2.01 0.00 17 V 8.60 4.75 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 0.85 0.00 0.00 0.99 0.00 0.00 18 I 9.13 4.91 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 1.15 0.84 0.94 0.00 0.00 19 V 8.75 4.46 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 0.87 0.00 0.00 0.87 0.00 0.00 20 R 7.66 4.73 0.00 1.48 0.93 0.00 3.30 0.00 0.00 3.61 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 21 L 7.96 5.61 0.00 1.65 1.70 0.89 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.50 4.30 0.00 1.75 1.75 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.38 7.81 23 G 8.37 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 7.48 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.00 4.28 0.00 2.18 2.11 0.00 3.20 0.00 0.00 3.45 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 26 E 8.27 5.21 0.00 2.29 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 2.27 2.30 0.00 27 F 9.22 5.03 0.00 3.01 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 28 R 9.19 4.95 0.00 1.83 1.83 0.00 3.19 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 29 G 7.73 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.10 5.04 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 1.27 0.00 0.00 31 L 8.46 4.39 0.00 1.76 1.76 1.02 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 32 D 9.36 4.50 0.00 2.67 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.75 4.38 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 0.00 34 Y 7.94 6.03 0.00 3.01 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 35 D 8.46 4.57 0.00 2.84 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 36 I 8.46 3.77 1.83 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 1.34 0.37 0.91 0.00 0.00 37 H 8.37 4.35 0.00 3.46 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 M 8.47 3.39 0.00 2.24 2.31 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.66 0.00 39 N 8.23 4.87 0.00 2.87 2.73 0.00 0.00 6.85 6.74 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 40 L 9.07 5.34 0.00 1.45 1.52 0.84 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.43 4.57 2.28 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 0.94 0.00 0.00 0.96 0.00 0.00 42 L 8.90 5.33 0.00 1.61 1.56 0.95 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.79 4.93 0.00 1.56 1.55 0.93 0.96 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 44 D 8.61 4.19 0.00 2.86 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.32 5.94 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.41 5.01 0.00 2.00 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 2.22 2.22 0.00 47 E 8.23 3.98 0.00 1.50 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 48 I 8.02 4.99 1.83 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 1.19 1.79 0.89 0.00 0.00 49 Q 8.54 4.36 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.28 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 50 N 8.55 4.16 0.00 2.90 3.11 0.00 0.00 6.30 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 7.28 3.46 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 0.00 52 E 7.33 4.58 0.00 2.10 1.75 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 0.00 2.12 2.16 0.00 53 V 8.09 5.06 2.17 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 0.91 0.00 0.00 0.93 0.00 0.00 54 V 7.89 4.32 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 0.72 0.00 0.00 0.83 0.00 0.00 55 R 7.35 4.57 0.00 1.80 1.61 0.00 3.13 0.00 0.00 3.39 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 56 K 8.42 4.89 0.00 1.61 1.63 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.42 7.81 57 V 8.66 4.38 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 0.85 0.00 0.00 1.11 0.00 0.00 58 G 9.11 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.51 5.81 0.00 3.89 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.15 4.55 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 0.77 0.00 0.00 0.85 0.00 0.00 61 V 8.31 4.66 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 0.79 0.00 0.00 0.91 0.00 0.00 62 I 8.10 4.32 1.72 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.16 0.73 0.00 0.00 63 R 8.49 4.50 0.00 1.80 1.83 0.00 3.26 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 1.68 1.54 0.00 64 G 9.41 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.20 4.57 0.00 2.62 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 66 T 7.94 4.41 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 67 V 7.99 4.11 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 0.69 0.00 0.00 0.93 0.00 0.00 68 V 8.43 4.33 2.28 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 1.05 0.00 0.00 0.97 0.00 0.00 69 F 7.25 4.94 0.00 3.15 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 70 V 8.54 4.97 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 0.83 0.00 0.00 0.86 0.00 0.00 71 S 9.29 4.92 0.00 3.95 4.09 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 0.00 0.00 0.00 0.00 72 P 0.00 4.82 0.00 2.11 2.13 0.00 3.41 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.83 0.00 73 A 8.66 4.18 1.28 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 0.00 0.00 0.00