NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4121 0.0000 0.0000 62.1285 32.6490 175.8291 2 K 4.1026 8.4094 119.6500 55.4111 32.7113 175.8188 3 I 3.8514 9.2713 125.9194 61.4243 38.3949 175.6853 4 K 4.2995 8.5768 125.5759 55.9883 32.8459 176.5618 5 T 4.3103 8.2957 113.5681 60.7228 69.9549 176.2485 6 V 3.8558 8.6734 125.7899 62.9968 29.5042 176.7193 7 R 3.9037 8.3062 122.3239 59.0144 29.9863 177.6487 8 G 3.8837 8.3078 104.3783 48.3754 0.0000 175.0951 9 A 4.2386 8.3289 122.6103 54.5471 18.1991 178.7138 10 A 4.4796 7.9387 117.4926 52.9269 18.3353 177.7786 11 K 4.6294 7.7823 114.3622 56.5433 32.7289 176.9523 12 R 4.3970 7.9041 116.1094 55.1349 32.0428 174.3596 13 F 5.1746 7.4856 114.7532 55.5822 43.2443 174.7210 14 K 4.3545 9.0276 114.0303 55.6187 35.0405 173.5806 15 K 3.6230 9.1233 128.7528 57.2800 32.3502 176.3375 16 T 4.7294 8.3013 117.6875 60.3353 70.3897 175.2504 17 G 3.9120 8.7793 108.4109 48.5853 0.0000 172.7182 18 K 4.3196 7.3557 116.0213 55.6869 34.7059 175.3720 19 G 3.8115 9.0167 106.1379 49.1893 0.0000 174.0704 20 G 4.0070 7.8316 107.9481 45.7311 0.0000 173.4281 21 F 4.5779 8.3760 114.1828 55.8194 41.8587 173.6942 22 K 4.5222 8.8224 123.8476 56.3145 33.1162 174.7527 23 H 4.6366 8.8572 118.5798 54.6608 30.3789 171.6110 24 K 4.5065 8.3484 119.3165 54.9494 34.4967 176.6023 25 H 4.4389 8.5056 122.0981 55.6534 29.4508 175.8251 26 A 4.2211 8.4613 125.1777 52.9631 20.8357 176.8580 27 N 4.1095 8.6832 109.0364 53.6819 35.7098 174.6883 28 L 4.5639 7.3320 116.1601 55.5232 43.3037 175.8676 29 R 4.6690 7.9447 108.4885 56.1058 32.1871 173.8306 30 H 4.7201 7.8925 117.2917 55.8497 32.8976 172.9421 31 I 3.1848 8.2618 117.8744 62.2744 35.4047 172.6443 32 L 4.6657 7.8253 125.5605 54.8070 44.4175 178.7553 33 T 3.8609 8.2431 112.6591 64.7027 67.1004 174.0951 34 K 4.5904 7.7634 118.5125 56.9114 33.4250 176.2178 35 K 4.5424 7.7833 117.6119 54.6077 35.6756 177.0256 36 A 4.0315 8.5686 124.7748 52.5136 19.2999 178.5021 37 T 3.8098 8.7371 116.0182 65.4665 68.2717 175.6894 38 K 3.7691 8.1273 120.6213 58.9982 32.4362 177.9823 39 R 3.9924 7.8585 117.8234 59.7407 30.1538 178.4485 40 K 3.9539 8.0974 117.7310 59.5041 32.0181 179.2165 41 R 4.1211 8.3288 116.8131 58.6481 29.9893 176.9796 42 H 4.8197 7.9986 113.8874 57.0893 29.6309 175.9979 43 L 4.3355 8.0748 119.0461 54.9293 41.8957 178.5418 44 R 4.0776 7.7951 118.7330 57.8257 30.6507 175.3710 45 P 4.3857 0.0000 0.0000 62.4391 31.8800 175.8516 46 K 4.4770 8.2928 119.4227 56.7542 33.4915 175.8639 47 A 4.5854 8.0037 120.5175 51.0196 22.6937 176.3614 48 M 4.6683 8.6878 121.1626 55.2677 33.2153 176.8998 49 V 4.0202 8.5539 114.3388 61.1020 32.5321 177.8467 50 S 3.9921 8.8615 118.0169 59.2293 62.9182 176.6437 51 K 3.9135 8.5055 120.5324 57.4098 32.5575 176.5203 52 G 3.7839 8.3083 106.7410 48.0578 0.0000 174.4590 53 D 4.6765 7.5315 118.2818 53.7347 41.6486 177.7829 54 L 3.9339 8.1674 122.6470 58.5330 41.6165 178.7390 55 G 3.8794 8.1943 103.3927 48.0977 0.0000 175.1313 56 L 4.0491 8.0238 121.0134 57.5966 41.5022 179.4573 57 V 3.0218 7.4205 117.5961 65.6244 31.3471 177.1644 58 I 4.0120 7.7035 118.3856 61.2416 37.5324 176.5621 59 A 4.5711 7.4881 120.5548 53.2881 23.4627 177.9843 60 C 4.3347 7.8056 112.2676 60.8838 29.3592 173.3337 61 L 4.8714 7.2424 118.8102 52.2556 41.4244 175.2319 62 P 4.1366 0.0000 0.0000 65.3609 31.9308 177.4180 63 Y 4.4962 7.8909 113.2863 57.4421 38.2550 175.3705 64 A 4.3250 8.0737 129.3158 52.7912 18.4296 178.3367 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 4.41 0.00 2.21 2.14 0.00 3.74 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 1.90 2.01 0.00 2 K 8.41 4.10 0.00 1.89 1.91 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.55 7.81 3 I 9.27 3.85 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.50 0.96 0.00 0.00 4 K 8.58 4.30 0.00 1.77 1.75 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.44 7.81 5 T 8.30 4.31 4.32 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 1.39 0.00 0.00 6 V 8.67 3.86 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 1.11 0.00 0.00 0.93 0.00 0.00 7 R 8.31 3.90 0.00 1.95 1.96 0.00 3.31 0.00 0.00 3.44 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 8 G 8.31 3.88 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 0.00 0.00 0.00 9 A 8.33 4.24 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 10 A 7.94 4.48 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 11 K 7.78 4.63 0.00 1.83 1.79 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.70 7.81 12 R 7.90 4.40 0.00 1.13 1.38 0.00 3.10 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.55 0.00 13 F 7.49 5.17 0.00 2.86 2.97 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 14 K 9.03 4.35 0.00 1.91 1.75 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.48 7.81 15 K 9.12 3.62 0.00 1.71 1.66 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.70 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.25 1.07 7.81 16 T 8.30 4.73 4.21 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 0.00 0.00 0.00 1.27 0.00 0.00 17 G 8.78 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.36 4.32 0.00 1.78 1.74 0.00 1.58 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.37 7.81 19 G 9.02 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 20 G 7.83 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 21 F 8.38 4.58 0.00 3.27 3.34 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 22 K 8.82 4.52 0.00 1.94 1.88 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.55 7.81 23 H 8.86 4.64 0.00 3.07 3.14 0.00 5.45 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.35 4.51 0.00 1.63 1.64 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.32 7.81 25 H 8.51 4.44 0.00 3.38 3.21 0.00 5.75 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.46 4.22 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.68 4.11 0.00 2.90 3.04 0.00 0.00 5.62 7.79 0.00 0.00 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 L 7.33 4.56 0.00 1.73 1.62 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.94 4.67 0.00 1.90 1.94 0.00 3.05 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 30 H 7.89 4.72 0.00 3.04 3.11 0.00 5.87 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.26 3.18 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 1.40 0.83 0.83 0.00 0.00 32 L 7.83 4.67 0.00 1.71 1.64 0.93 0.67 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 33 T 8.24 3.86 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 34 K 7.76 4.59 0.00 1.89 1.87 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.44 7.81 35 K 7.78 4.54 0.00 1.92 1.70 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.35 1.34 7.81 36 A 8.57 4.03 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.74 3.81 4.23 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 1.20 0.00 0.00 38 K 8.13 3.77 0.00 1.72 1.80 0.00 1.79 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.38 7.81 39 R 7.86 3.99 0.00 1.91 2.16 0.00 3.24 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 40 K 8.10 3.95 0.00 1.86 1.85 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.73 7.81 41 R 8.33 4.12 0.00 1.88 2.09 0.00 3.23 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 42 H 8.00 4.82 0.00 3.36 3.24 0.00 5.71 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.07 4.34 0.00 1.68 1.72 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 44 R 7.80 4.08 0.00 1.80 2.00 0.00 3.22 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 45 P 0.00 4.39 0.00 2.19 2.07 0.00 3.73 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 46 K 8.29 4.48 0.00 1.64 1.87 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.38 7.81 47 A 8.00 4.59 1.10 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 0.00 0.00 48 M 8.69 4.67 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 49 V 8.55 4.02 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 1.13 0.00 0.00 1.11 0.00 0.00 50 S 8.86 3.99 0.00 4.03 4.20 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 51 K 8.51 3.91 0.00 1.88 1.99 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.43 7.81 52 G 8.31 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 7.53 4.68 0.00 2.88 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 54 L 8.17 3.93 0.00 1.79 1.80 1.18 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.19 3.88 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 0.00 0.00 0.00 56 L 8.02 4.05 0.00 1.86 1.61 0.88 1.03 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 57 V 7.42 3.02 1.45 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 -0.87 0.00 0.00 0.32 0.00 0.00 58 I 7.70 4.01 1.88 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.99 1.01 0.00 0.00 59 A 7.49 4.57 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 60 C 7.81 4.33 0.00 2.87 2.94 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 61 L 7.24 4.87 0.00 1.63 1.61 0.71 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.14 0.00 2.00 2.00 0.00 3.75 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 2.06 2.25 0.00 63 Y 7.89 4.50 0.00 2.98 2.99 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 64 A 8.07 4.33 1.55 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