NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4873 0.0000 0.0000 62.3591 33.6354 174.8997 2 I 4.8962 8.2769 122.6808 59.1066 40.0447 173.0415 3 A 4.8066 9.5250 129.8023 49.9855 22.3133 174.4037 4 Q 4.8791 8.6524 122.1951 54.3336 31.6891 174.3634 5 I 4.4769 8.7684 127.7141 59.8350 40.0258 174.2505 6 H 5.2382 8.8137 124.4199 54.3374 29.8190 174.3584 7 I 4.6343 8.2671 116.6407 58.5574 41.2123 174.9822 8 L 4.6356 8.3404 123.2294 54.3832 42.2228 176.9509 9 E 4.5040 8.0540 120.6952 56.6364 29.9392 176.0822 10 G 3.6067 8.7785 108.8865 45.6112 0.0000 174.5867 11 R 4.4301 7.6429 119.3721 55.3025 31.5314 176.7743 12 S 4.5270 8.2773 116.0269 57.7643 65.5705 175.1789 13 D 4.3827 8.5176 121.7504 57.4246 40.4845 178.9342 14 E 3.9467 8.0953 118.5606 59.6145 29.5302 179.0721 15 Q 4.0120 7.7832 117.8689 59.2023 28.8241 179.4519 16 K 3.9829 7.9624 118.7780 59.2212 31.9047 179.1198 17 E 3.9813 8.2234 119.8675 59.3931 29.4397 179.0587 18 T 3.9123 8.0676 116.0295 66.2361 68.5536 176.4963 19 L 3.9267 8.0955 122.4487 58.3951 42.1060 179.1277 20 I 3.6998 7.7732 119.6132 64.2771 36.9983 178.5107 21 R 3.8938 7.7983 119.6242 59.2972 30.0262 178.2772 22 E 3.9460 8.4457 118.7794 59.5873 29.5201 179.6327 23 V 3.6184 7.8948 118.1396 66.0924 31.5503 178.2285 24 S 4.1512 7.9631 114.5926 61.4453 62.5801 176.6269 25 E 3.9086 8.3509 121.1466 59.2753 29.2621 178.9698 26 A 3.9803 8.0283 120.7829 55.3134 18.4762 179.7930 27 I 3.6267 7.8582 118.0680 64.6329 37.2702 178.5809 28 S 4.0844 7.9852 113.9582 61.3016 61.9947 176.1697 29 R 3.8323 8.6266 121.5737 59.7054 29.7272 178.5749 30 S 4.1058 7.9884 113.5403 61.2130 62.9079 175.4990 31 L 4.3867 7.7546 116.6538 53.6901 42.0681 175.6096 32 D 4.3394 7.5836 117.0997 55.2768 40.0219 172.8601 33 A 4.7744 7.4729 118.6965 48.9243 21.5254 175.7767 34 P 4.2998 0.0000 0.0000 62.5504 32.1000 176.9027 35 L 3.9000 8.9452 125.2350 58.4982 41.9009 178.8345 36 T 4.0620 7.8803 106.3494 63.4528 68.7215 174.6764 37 S 4.4351 8.0605 116.4292 58.9210 63.8677 174.4232 38 V 4.1072 7.5548 122.4442 62.7657 32.2321 175.3861 39 R 4.6901 8.8939 126.0874 54.3433 33.3639 174.5118 40 V 4.8723 8.5147 123.1647 61.0516 34.5215 174.4917 41 I 4.5725 8.7973 127.7677 59.6059 40.3014 174.2897 42 I 4.7611 8.4038 127.6133 60.0225 39.1995 175.2986 43 T 4.5157 8.6796 122.7704 61.7986 71.6014 173.0946 44 E 4.8325 8.7684 126.2658 55.9562 31.6113 175.3868 45 M 4.9407 8.6548 122.1913 53.2346 35.3036 175.6570 46 A 4.5606 8.5545 125.2642 51.6735 19.3498 178.7323 47 K 3.9310 8.5554 120.4728 59.1648 32.2494 178.3976 48 G 4.0490 7.9918 105.3911 45.6414 0.0000 173.4872 49 H 4.9688 8.5272 114.8870 54.9561 29.8152 173.4684 50 F 5.0936 8.2308 122.5929 56.2362 41.5725 173.7130 51 G 4.1764 8.3520 116.1693 43.5363 0.0000 172.2033 52 I 4.1217 8.1307 122.2964 60.0486 39.9133 176.1497 53 G 3.8619 9.6366 113.2497 46.4361 0.0000 174.0115 54 G 3.9390 8.8708 105.6636 44.8504 0.0000 173.6928 55 E 4.6915 7.6921 117.7557 53.6404 33.1156 175.2252 56 L 4.3260 8.4467 121.1772 55.1708 42.5549 178.6113 57 A 4.0224 8.8928 125.8304 55.0280 18.7798 180.2150 58 S 4.1340 8.2075 109.9804 61.5026 62.9904 175.4241 59 K 4.3629 7.6165 117.0592 56.1181 32.1229 177.2668 60 V 4.0230 7.4534 124.2385 61.8466 31.4674 175.1068 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 P 0.00 4.49 0.00 2.09 2.03 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 2 I 8.28 4.90 1.87 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 1.27 0.72 0.90 0.00 0.00 3 A 9.52 4.81 1.18 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 0.00 0.00 4 Q 8.65 4.88 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.64 0.00 0.00 0.00 0.00 0.00 2.09 2.24 0.00 5 I 8.77 4.48 1.83 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 1.21 0.59 0.88 0.00 0.00 6 H 8.81 5.24 0.00 2.91 3.10 0.00 5.84 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.27 4.63 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.76 0.86 0.00 0.00 8 L 8.34 4.64 0.00 1.53 1.64 1.02 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.05 4.50 0.00 1.97 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 0.00 2.31 2.11 0.00 10 G 8.78 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 11 R 7.64 4.43 0.00 1.78 1.85 0.00 3.25 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 12 S 8.28 4.53 0.00 3.99 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 13 D 8.52 4.38 0.00 2.78 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 14 E 8.10 3.95 0.00 2.05 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 2.40 2.46 0.00 15 Q 7.78 4.01 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 16 K 7.96 3.98 0.00 1.93 1.84 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.67 7.81 17 E 8.22 3.98 0.00 2.28 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 2.30 2.34 0.00 18 T 8.07 3.91 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 1.21 0.00 0.00 19 L 8.10 3.93 0.00 1.81 1.83 0.91 1.12 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 20 I 7.77 3.70 1.99 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 1.39 1.05 0.90 0.00 0.00 21 R 7.80 3.89 0.00 1.82 1.90 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 22 E 8.45 3.95 0.00 2.02 1.98 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 2.48 2.46 0.00 23 V 7.89 3.62 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 1.02 0.00 0.00 0.95 0.00 0.00 24 S 7.96 4.15 0.00 4.11 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 25 E 8.35 3.91 0.00 2.10 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 2.50 2.47 0.00 26 A 8.03 3.98 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 27 I 7.86 3.63 1.87 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 1.40 1.11 0.91 0.00 0.00 28 S 7.99 4.08 0.00 3.90 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 29 R 8.63 3.83 0.00 2.12 1.90 0.00 3.16 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 30 S 7.99 4.11 0.00 3.94 3.92 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 0.00 0.00 0.00 31 L 7.75 4.39 0.00 1.66 1.69 0.92 1.03 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 32 D 7.58 4.34 0.00 2.76 2.71 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 0.00 0.00 0.00 0.00 33 A 7.47 4.77 1.23 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 0.00 0.00 0.00 34 P 0.00 4.30 0.00 2.23 2.21 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 35 L 8.95 3.90 0.00 1.73 1.74 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.88 4.06 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 37 S 8.06 4.44 0.00 3.96 4.02 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 38 V 7.55 4.11 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 0.75 0.00 0.00 0.93 0.00 0.00 39 R 8.89 4.69 0.00 1.81 1.76 0.00 3.16 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 40 V 8.51 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 0.80 0.00 0.00 0.92 0.00 0.00 41 I 8.80 4.57 1.84 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 1.21 0.66 0.87 0.00 0.00 42 I 8.40 4.76 1.84 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 1.31 0.51 0.87 0.00 0.00 43 T 8.68 4.52 3.96 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 1.21 0.00 0.00 44 E 8.77 4.83 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 2.34 2.31 0.00 45 M 8.65 4.94 0.00 1.96 1.86 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 46 A 8.55 4.56 1.11 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 0.00 0.00 0.00 0.00 0.00 47 K 8.56 3.93 0.00 1.80 1.95 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.46 7.81 48 G 7.99 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.53 4.97 0.00 3.32 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.23 5.09 0.00 2.97 2.92 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 0.00 0.00 0.00 51 G 8.35 4.18 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 0.00 0.00 0.00 52 I 8.13 4.12 1.68 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.20 0.82 0.00 0.00 53 G 9.64 3.86 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 0.00 0.00 0.00 54 G 8.87 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 55 E 7.69 4.69 0.00 1.95 1.74 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 2.18 2.21 0.00 56 L 8.45 4.33 0.00 1.69 1.61 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.89 4.02 1.47 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 0.00 0.00 58 S 8.21 4.13 0.00 4.00 4.18 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 59 K 7.62 4.36 0.00 1.77 1.87 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.36 7.81 60 V 7.45 4.02 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 0.64 0.00 0.00 0.91 0.00 0.00