NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 52 R 4.3146 8.2544 117.2809 56.3438 30.5701 175.5742 53 N 4.7078 8.0564 118.4668 50.9700 39.6633 172.8566 54 D 4.3728 8.8361 126.2636 56.6329 42.1010 177.2668 55 A 3.7351 7.9508 121.0758 54.8538 18.3175 179.1020 56 E 3.8278 8.0459 117.4107 59.5458 29.6778 178.9490 57 R 3.8691 7.4379 117.0182 59.1887 30.4308 177.8081 58 L 4.0649 8.7051 120.9324 58.2158 42.0511 178.7048 59 A 3.9988 8.5018 120.9837 55.2602 18.1634 178.9507 60 D 4.6333 7.8853 117.4555 57.0983 41.2300 177.8157 61 E 3.9056 8.0345 119.3371 59.3527 29.7516 178.4727 62 Q 4.0164 8.1082 117.4227 59.2579 29.0444 179.4446 63 S 4.1388 8.2759 115.0696 61.6017 63.0779 176.2352 64 E 3.9949 8.4506 123.0131 58.6867 29.3093 178.7930 65 L 4.0541 7.8788 119.4987 57.4770 41.5854 179.5368 66 V 3.6304 7.7569 118.1534 65.6637 31.5389 178.1427 67 K 3.9560 8.1809 118.7495 60.0311 32.1886 179.0106 68 K 4.0256 8.0015 120.4615 59.2291 32.1105 178.4869 69 M 4.0050 7.8547 118.0988 58.7264 32.2214 178.3140 70 V 3.5493 8.1700 118.7938 65.8387 31.5373 177.3811 71 F 4.2184 8.2551 120.3736 61.6301 39.1834 176.5944 72 D 4.0166 7.8072 117.7397 58.3220 40.7268 178.6487 73 T 3.7332 7.7819 115.9956 66.2865 68.2405 176.2191 74 L 3.3910 8.5961 120.8762 58.3296 41.9340 179.0220 75 K 3.7375 8.4160 119.7942 60.0557 31.7298 178.0697 76 D 4.2813 8.2431 117.9735 57.1194 41.1032 178.6073 77 L 3.9436 8.0480 120.6914 58.2990 41.9071 178.2648 78 Y 4.5838 8.6767 117.0977 60.2412 36.5669 177.8167 79 K 4.1795 7.9319 120.8106 59.0146 32.0668 178.5643 80 K 4.2106 7.7383 119.7900 59.3625 32.0345 178.7241 81 T 4.0417 7.3074 109.6519 64.5832 69.1656 174.4521 82 T 4.1332 7.3781 119.2071 61.2937 67.4004 173.7660 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 52 R 8.25 4.31 0.00 1.93 2.00 0.00 2.98 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 53 N 8.06 4.71 0.00 2.84 2.67 0.00 0.00 7.16 7.61 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 54 D 8.84 4.37 0.00 2.73 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 55 A 7.95 3.74 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.05 3.83 0.00 2.04 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 2.37 2.36 0.00 57 R 7.44 3.87 0.00 1.82 1.94 0.00 3.37 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 58 L 8.71 4.06 0.00 1.70 1.76 0.98 0.19 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 59 A 8.50 4.00 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 60 D 7.89 4.63 0.00 2.86 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 61 E 8.03 3.91 0.00 2.12 1.90 0.00 0.00 0.00 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 2.50 0.00 62 Q 8.11 4.02 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.67 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 63 S 8.28 4.14 0.00 4.04 4.15 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 64 E 8.45 3.99 0.00 2.25 2.08 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 2.29 2.34 0.00 65 L 7.88 4.05 0.00 1.93 1.70 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.76 3.63 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 1.22 0.00 0.00 0.96 0.00 0.00 67 K 8.18 3.96 0.00 2.03 2.16 0.00 1.36 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.45 7.81 68 K 8.00 4.03 0.00 2.08 1.88 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.47 7.81 69 M 7.85 4.00 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.68 0.00 70 V 8.17 3.55 2.25 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 1.02 0.00 0.00 0.99 0.00 0.00 71 F 8.26 4.22 0.00 3.12 3.33 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 72 D 7.81 4.02 0.00 2.78 2.59 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 73 T 7.78 3.73 4.27 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 1.11 0.00 0.00 74 L 8.60 3.39 0.00 1.39 0.68 0.91 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.42 3.74 0.00 0.98 1.36 0.00 1.48 0.00 0.00 0.94 0.00 0.00 2.13 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.15 1.26 7.81 76 D 8.24 4.28 0.00 2.72 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.05 3.94 0.00 1.51 1.62 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 78 Y 8.68 4.58 0.00 3.10 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 7.93 4.18 0.00 2.09 1.80 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.45 7.81 80 K 7.74 4.21 0.00 1.75 1.86 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.46 7.81 81 T 7.31 4.04 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 1.25 0.00 0.00 82 T 7.38 4.13 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 1.27 0.00 0.00