NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9734 8.2133 109.7377 44.5235 0.0000 174.4090 2 P 4.0783 0.0000 0.0000 64.3823 31.4026 174.2734 3 E 4.6123 8.7828 116.7524 56.3866 31.5711 177.4071 4 T 3.8958 7.8299 118.2184 66.8020 68.4074 176.5462 5 L 4.0696 7.8962 120.2859 57.8426 41.6668 180.1253 6 C 4.4247 8.1639 116.4593 59.7756 34.3564 176.0696 7 G 3.5992 8.2980 107.1919 47.7801 0.0000 175.6141 8 A 4.0244 7.9411 123.1802 54.7276 18.3143 179.2497 9 E 3.8260 8.3744 117.9836 59.2742 29.6333 178.7922 10 L 3.9146 7.9560 120.2243 58.3315 42.2410 179.2197 11 V 3.5015 7.6678 117.6514 65.9995 31.3773 177.7163 12 D 4.3826 8.4574 118.8305 57.2316 40.5465 178.6515 13 A 4.0236 8.3627 121.7091 54.9865 18.3629 179.5226 14 L 3.7093 7.9174 117.6950 57.9876 41.5221 179.6347 15 Q 4.1494 7.9265 119.2634 59.0743 28.7852 178.0267 16 F 4.0324 8.2361 120.7524 61.3379 39.5851 177.0272 17 V 3.7142 8.0503 116.7752 66.1746 31.6981 176.8746 18 C 4.5540 8.6984 115.8097 56.3799 38.9669 175.3424 19 G 3.5502 8.7528 109.1279 47.0776 0.0000 175.9655 20 D 4.6963 8.7842 124.0133 55.2068 40.9357 177.3208 21 R 3.8979 7.9207 118.9442 57.0222 30.4221 177.9897 22 G 4.0098 8.5885 103.4672 45.0671 0.0000 171.6404 23 F 5.5699 7.3283 112.0668 55.2612 41.0545 173.5186 24 Y 4.4786 9.2751 122.3468 57.6719 39.2522 174.4700 25 F 4.8310 7.8648 126.8295 56.8073 43.4091 173.4755 26 N 4.5377 7.0470 121.1416 51.2498 41.6706 174.8727 27 K 3.8075 8.8854 125.8928 59.3303 32.3032 177.3543 28 P 4.2034 0.0000 0.0000 65.6120 31.2838 178.9005 29 K 3.9869 7.8552 116.6026 59.1642 32.0107 179.1446 30 A 3.7987 7.8300 121.3954 54.9008 18.1384 179.5683 31 K 3.9758 8.3051 118.5072 59.5122 32.2368 179.2725 32 G 3.5914 8.0840 106.0781 47.7998 0.0000 175.7904 33 I 3.7450 7.8157 122.2704 64.0820 37.2627 178.6689 34 V 3.6039 7.9460 119.1299 66.1913 31.1307 177.8016 35 D 4.4012 8.1633 117.7643 57.3540 40.7067 178.1210 36 E 4.1454 8.1878 118.9991 58.5454 29.8145 177.1658 37 C 5.2391 7.9978 114.2617 55.9394 41.2552 174.8261 38 C 4.3877 7.9712 120.6546 59.5959 43.4671 174.3615 39 F 4.2912 8.0983 120.5543 60.7124 39.4203 174.9699 40 R 3.9889 7.7169 122.0140 54.0982 30.5475 175.1992 41 S 4.1268 8.4580 120.0578 59.0732 62.7665 173.8087 42 C 4.9965 8.3849 122.9115 54.9695 39.0083 173.4607 43 D 4.6823 8.3210 121.1738 53.5336 40.3318 177.7617 44 L 4.2346 8.4429 125.4908 56.6479 41.5764 179.2874 45 R 4.0690 7.9980 116.1636 58.9909 29.4441 178.5635 46 R 4.0257 8.0124 118.3902 58.2672 29.9710 178.2418 47 L 4.3399 7.9270 118.9243 56.5665 41.5778 178.2803 48 E 3.9335 8.0089 120.5306 59.5694 29.1515 178.5334 49 M 4.0244 7.7414 115.7982 57.6912 31.3210 177.1253 50 Y 4.6479 7.9989 116.6113 57.5227 38.7264 174.7964 51 C 4.9936 7.7194 118.3352 56.5297 41.0470 173.5734 52 A 4.2474 8.7169 125.7076 52.6068 17.8702 177.3555 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 G 8.21 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 2 P 0.00 4.08 0.00 2.14 2.14 0.00 3.65 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 3 E 8.78 4.61 0.00 2.02 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 2.33 2.31 0.00 4 T 7.83 3.90 4.25 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 1.22 0.00 0.00 5 L 7.90 4.07 0.00 1.69 1.72 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 6 C 8.16 4.42 0.00 3.18 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.30 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.94 4.02 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 9 E 8.37 3.83 0.00 2.15 2.12 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 2.29 2.29 0.00 10 L 7.96 3.91 0.00 1.83 1.86 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.67 3.50 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 0.95 0.00 0.00 0.98 0.00 0.00 12 D 8.46 4.38 0.00 2.87 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.36 4.02 1.37 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 0.00 0.00 14 L 7.92 3.71 0.00 1.08 0.13 0.78 0.82 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 15 Q 7.93 4.15 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 16 F 8.24 4.03 0.00 3.13 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 17 V 8.05 3.71 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.10 0.00 0.00 18 C 8.70 4.55 0.00 3.35 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.75 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.78 4.70 0.00 2.68 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 21 R 7.92 3.90 0.00 2.04 2.19 0.00 3.43 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 22 G 8.59 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 23 F 7.33 5.57 0.00 3.23 3.09 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 24 Y 9.28 4.48 0.00 3.15 3.25 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 25 F 7.86 4.83 0.00 3.04 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 26 N 7.05 4.54 0.00 2.54 2.47 0.00 0.00 7.02 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 27 K 8.89 3.81 0.00 1.83 1.86 0.00 1.80 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.74 1.66 7.81 28 P 0.00 4.20 0.00 2.13 2.08 0.00 3.53 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 2.09 2.16 0.00 29 K 7.86 3.99 0.00 1.81 1.83 0.00 1.81 0.00 0.00 1.93 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.54 1.50 7.81 30 A 7.83 3.80 0.97 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 31 K 8.31 3.98 0.00 1.82 1.97 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 32 G 8.08 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.82 3.74 1.98 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 1.46 0.73 0.94 0.00 0.00 34 V 7.95 3.60 2.22 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 1.09 0.00 0.00 0.97 0.00 0.00 35 D 8.16 4.40 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 E 8.19 4.15 0.00 2.06 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 0.00 2.34 2.41 0.00 37 C 8.00 5.24 0.00 3.08 3.08 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 0.00 0.00 0.00 38 C 7.97 4.39 0.00 3.23 3.26 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 0.00 39 F 8.10 4.29 0.00 2.98 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 40 R 7.72 3.99 0.00 1.84 1.77 0.00 3.23 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.44 0.00 41 S 8.46 4.13 0.00 3.77 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.38 5.00 0.00 2.96 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 43 D 8.32 4.68 0.00 2.70 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.44 4.23 0.00 1.69 1.73 0.90 0.88 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 45 R 8.00 4.07 0.00 2.05 2.22 0.00 2.97 0.00 0.00 3.34 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 46 R 8.01 4.03 0.00 2.05 2.00 0.00 3.26 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 47 L 7.93 4.34 0.00 1.86 1.83 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.01 3.93 0.00 2.04 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 0.00 2.31 2.38 0.00 49 M 7.74 4.02 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 2.14 0.00 50 Y 8.00 4.65 0.00 3.36 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 51 C 7.72 4.99 0.00 3.06 3.11 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 52 A 8.72 4.25 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