NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.3361 8.3049 118.1832 55.0607 32.7383 174.2159 1 L 4.2391 7.7373 119.2506 53.1201 43.8663 176.1212 2 M 4.0082 8.8242 118.4001 58.9684 32.5654 178.6595 3 G 4.0886 7.9815 106.2570 47.4599 0.0000 175.2701 4 E 3.9944 8.1046 120.9086 58.8249 29.4386 179.3247 5 R 3.9508 7.9791 118.1207 59.4935 30.1786 179.1750 6 I 3.8510 8.1257 119.6114 64.4008 37.1561 178.4300 7 R 3.9034 8.2537 119.4198 59.5729 29.9208 178.0000 8 A 4.0206 8.5201 120.8588 55.5015 18.4243 179.5784 9 R 3.9862 8.7273 116.7898 59.1955 30.2024 178.8143 10 R 3.8876 8.1214 118.6170 59.7467 30.0970 178.7017 11 I 3.7593 7.9385 119.4578 64.2424 36.8109 178.1058 12 Q 3.9535 8.4589 120.2486 58.9490 28.9455 177.5374 13 L 4.2783 7.9610 118.6658 54.5999 42.3072 176.8547 14 G 3.9435 7.7351 105.2418 46.9733 0.0000 173.7672 15 L 4.3740 7.7750 118.8620 53.8074 42.9103 176.5251 16 N 4.8363 8.1299 117.7144 51.7538 41.6159 176.5479 17 Q 3.9566 8.4353 119.5244 59.4344 28.7663 179.1238 18 A 3.9945 7.9523 121.0599 55.1729 18.4130 179.4548 19 E 3.8599 8.0164 116.5389 59.3184 29.7309 178.8663 20 L 3.8538 8.0465 120.2321 58.1842 42.1043 178.5132 21 A 3.8364 8.1888 120.8799 55.4465 18.0560 179.1762 22 Q 3.8458 8.1142 116.6259 59.4278 29.2119 178.4913 23 K 4.0841 7.8453 118.6814 58.7069 32.2673 178.7269 24 V 3.7496 7.5572 118.4487 66.6830 31.6232 175.8746 25 G 3.6193 7.7159 105.5735 45.5403 0.0000 174.2883 26 V 3.8702 7.2279 113.6828 60.0498 32.8229 174.9471 27 D 4.6462 7.9992 120.0827 52.5397 40.7452 176.7291 28 Q 4.0461 8.7613 121.4849 59.7021 28.8337 178.7723 29 Q 3.9410 8.1057 119.5382 59.2891 29.0782 177.9168 30 A 4.1172 7.8961 121.0622 55.4506 18.2212 179.7610 31 I 3.7945 7.7584 118.3248 64.2425 37.1950 178.1781 32 E 3.9369 8.1379 119.9902 59.4093 29.6112 178.7775 33 Q 4.0693 8.2967 117.7179 59.2382 28.6892 178.4845 34 L 4.0528 7.9039 120.5726 57.5049 41.7706 179.1085 35 E 4.1744 8.4790 119.0470 59.4575 29.3399 178.6003 36 N 4.7510 7.9744 113.3247 53.2783 37.7250 175.7837 37 G 3.9442 7.7724 109.3643 45.7741 0.0000 174.8189 38 K 3.9782 8.4487 120.8011 57.9753 32.3107 177.1041 39 A 4.4574 7.7291 121.7343 50.2143 18.9045 175.8331 40 K 3.9979 7.9424 126.6175 57.1383 32.8832 176.8356 41 R 4.2865 7.3330 129.3049 53.3576 30.7278 173.8453 42 P 4.3822 0.0000 0.0000 61.1367 32.5570 178.0260 43 R 3.8068 8.4540 115.5946 59.4169 29.0289 177.6245 44 F 5.0058 7.4222 110.5312 55.8787 38.6582 176.3766 45 L 3.9180 7.5753 124.8657 58.3712 41.6105 177.2827 46 P 4.3360 0.0000 0.0000 65.6244 31.1783 178.3924 47 E 3.9625 8.0935 118.0821 59.2843 29.5187 178.7088 48 L 3.9923 8.5226 120.4920 58.0298 42.1296 178.7281 49 A 4.0460 8.2729 120.7326 55.2157 18.5023 179.4061 50 R 3.7969 8.3668 117.2343 59.7804 29.9665 178.5937 51 A 4.0187 8.1703 119.3301 55.0325 18.4133 179.0455 52 L 4.0877 8.1843 118.4677 56.1680 42.1730 177.5356 53 G 3.8124 8.3902 105.8238 45.7342 0.0000 173.0743 54 V 4.2758 7.5442 110.7682 58.0847 35.8670 175.7725 55 A 4.4064 8.2667 122.3660 51.5757 20.5398 178.7020 56 V 3.5952 8.3322 120.3238 66.2441 31.4896 178.0015 57 D 4.3592 8.1354 117.4019 56.9067 41.1815 177.8663 58 W 4.0374 8.2324 128.4868 60.3114 30.5948 177.6141 59 L 4.0398 8.2924 117.9956 57.9283 41.2366 179.1188 60 L 4.1074 8.2735 117.4529 57.5125 41.7069 178.2420 61 N 4.7671 8.3896 113.0343 53.0147 41.9802 175.1331 62 G 2.8890 7.3179 106.6226 45.3403 0.0000 173.1504 63 A 4.1930 7.5619 124.5206 52.9153 18.3681 177.9037 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 0 M 8.30 4.34 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 1 L 7.74 4.24 0.00 1.77 1.61 0.90 0.51 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 2 M 8.82 4.01 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.72 0.00 3 G 7.98 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 4 E 8.10 3.99 0.00 1.97 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 2.40 2.34 0.00 5 R 7.98 3.95 0.00 1.96 1.85 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.30 0.00 6 I 8.13 3.85 2.15 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.99 0.99 0.00 0.00 7 R 8.25 3.90 0.00 1.97 2.09 0.00 3.29 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 8 A 8.52 4.02 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.73 3.99 0.00 2.22 2.03 0.00 3.21 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.51 0.00 10 R 8.12 3.89 0.00 2.08 2.17 0.00 3.24 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 11 I 7.94 3.76 2.07 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.70 0.92 0.00 0.00 12 Q 8.46 3.95 0.00 2.20 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.94 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 13 L 7.96 4.28 0.00 1.76 1.89 0.89 0.94 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 14 G 7.74 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 15 L 7.77 4.37 0.00 1.65 1.60 0.90 0.84 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 16 N 8.13 4.84 0.00 2.72 2.74 0.00 0.00 6.81 7.99 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 17 Q 8.44 3.96 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.30 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 18 A 7.95 3.99 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.02 3.86 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 2.39 2.30 0.00 20 L 8.05 3.85 0.00 1.74 1.80 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.19 3.84 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 8.11 3.85 0.00 2.08 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 23 K 7.85 4.08 0.00 1.79 2.00 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.56 7.81 24 V 7.56 3.75 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 0.93 0.00 0.00 0.95 0.00 0.00 25 G 7.72 3.62 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 0.00 0.00 0.00 26 V 7.23 3.87 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.46 0.00 0.00 27 D 8.00 4.65 0.00 2.74 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.76 4.05 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 29 Q 8.11 3.94 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.63 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 30 A 7.90 4.12 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.76 3.79 1.99 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 1.51 1.01 0.94 0.00 0.00 32 E 8.14 3.94 0.00 2.25 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 2.39 2.44 0.00 33 Q 8.30 4.07 0.00 2.35 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.63 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 34 L 7.90 4.05 0.00 2.09 1.84 1.26 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.48 4.17 0.00 2.24 2.02 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 2.36 2.51 0.00 36 N 7.97 4.75 0.00 2.88 2.94 0.00 0.00 7.27 6.83 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 37 G 7.77 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 38 K 8.45 3.98 0.00 1.96 1.89 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.66 7.81 39 A 7.73 4.46 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.94 4.00 0.00 1.70 1.66 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.34 7.81 41 R 7.33 4.29 0.00 1.70 1.73 0.00 3.25 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.48 0.00 42 P 0.00 4.38 0.00 1.25 1.88 0.00 3.45 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.46 0.00 43 R 8.45 3.81 0.00 1.95 2.12 0.00 3.09 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 44 F 7.42 5.01 0.00 3.25 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 7.58 3.92 0.00 1.70 1.65 0.91 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.34 0.00 2.33 2.32 0.00 3.82 0.00 0.00 3.77 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 47 E 8.09 3.96 0.00 2.33 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 2.46 2.45 0.00 48 L 8.52 3.99 0.00 1.99 1.93 0.99 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.27 4.05 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.37 3.80 0.00 2.01 2.10 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 51 A 8.17 4.02 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 52 L 8.18 4.09 0.00 1.78 1.85 0.91 1.16 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 53 G 8.39 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.54 4.28 1.59 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 0.07 0.00 0.00 1.09 0.00 0.00 55 A 8.27 4.41 1.40 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 0.00 0.00 0.00 56 V 8.33 3.60 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 1.04 0.00 0.00 0.97 0.00 0.00 57 D 8.14 4.36 0.00 2.79 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 58 W 8.23 4.04 0.00 3.46 3.39 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.29 4.04 0.00 2.01 1.80 1.11 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.27 4.11 0.00 1.75 1.70 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 61 N 8.39 4.77 0.00 2.65 2.73 0.00 0.00 7.89 8.45 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 62 G 7.32 2.89 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 0.00 0.00 0.00 63 A 7.56 4.19 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00