NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 H 4.8157 8.4449 120.3957 56.0321 29.9146 172.6125 15 M 3.9832 8.7268 126.8143 57.1553 32.1264 175.6180 16 L 4.6165 7.4840 117.3498 53.0978 45.2816 175.8246 17 T 4.2626 7.9858 110.7844 61.6191 69.8536 174.4102 18 Q 4.1567 8.8951 117.2986 59.6721 29.1708 176.6132 19 G 4.2918 7.6220 104.4772 44.6222 0.0000 174.6766 20 E 4.1528 8.6975 120.6460 57.7561 30.4677 176.7330 21 L 4.0283 7.6986 116.9854 56.1417 42.8134 178.1022 22 M 4.2497 8.0886 119.0636 58.4566 31.9707 177.9419 23 K 4.3750 7.5820 116.0120 57.2693 33.2765 177.4770 24 L 4.4406 7.6692 120.3840 56.6766 43.5096 178.2030 25 I 3.6326 7.5046 113.0893 64.1973 37.2854 178.1637 26 K 4.0950 7.8816 120.3382 58.5403 32.6333 178.4454 27 E 3.9171 7.9899 119.9610 58.7332 30.0586 177.9187 28 I 3.9994 8.3540 113.6132 63.1150 38.2442 178.3050 29 V 3.5009 7.6497 120.4187 65.7367 31.4671 177.2579 30 E 4.2789 8.2645 116.5920 57.5969 29.3535 176.6320 31 N 4.9681 7.8362 115.9974 53.2561 41.3014 174.1322 32 E 4.3940 7.9596 114.3977 57.4106 28.6525 178.7551 33 D 4.8038 9.1283 135.0000 53.1513 41.0139 176.6881 34 K 4.0303 8.5975 124.8538 59.4590 32.2257 179.0090 35 R 4.2002 7.8612 114.9490 57.4803 30.2902 177.1529 36 K 4.4522 7.6672 117.2970 53.5502 32.9329 174.0677 37 P 4.4647 0.0000 0.0000 62.4571 32.3196 176.8190 38 Y 4.3743 8.5393 118.1787 57.0010 39.6005 174.7443 39 S 4.7860 7.9746 114.1598 56.8686 65.9041 175.6970 40 D 4.3220 8.3275 124.7463 56.0008 40.2114 179.0403 41 Q 3.9259 8.0821 121.2602 58.7225 29.1762 177.7955 42 E 4.0314 8.8749 120.3181 59.4358 29.5286 179.2951 43 I 3.6082 7.9148 112.4391 64.1767 37.6017 177.9139 44 A 3.9576 8.2294 122.5247 54.5367 17.9062 179.2176 45 N 4.2505 7.9665 114.9547 57.0941 39.3720 176.9795 46 I 3.9052 7.9745 121.3134 64.3686 37.1748 178.4759 47 L 4.2518 8.2658 120.2298 57.4449 41.2161 179.1842 48 K 4.3456 7.7659 116.6944 58.7882 32.8702 178.2775 49 E 4.2444 8.1613 119.1782 58.4258 29.6874 177.5829 50 K 4.3247 8.0359 118.2506 55.3851 32.5584 177.4931 51 G 4.5818 6.3592 114.1440 46.2251 0.0000 173.1623 52 F 4.5587 7.6315 119.2926 57.4970 40.6052 177.2696 53 K 4.2550 7.4157 120.0947 57.6793 31.3358 174.7634 54 V 4.0825 7.5182 121.3530 61.3882 33.4186 176.3968 55 A 4.2271 8.1691 124.2131 51.7026 20.5080 178.8143 56 R 3.8853 8.4993 121.0963 59.2472 29.5906 179.3902 57 R 3.9235 7.8870 117.8122 59.4200 30.0183 178.7621 58 T 3.9375 7.6892 115.1943 66.2323 68.7359 177.3565 59 V 3.4503 7.7788 120.8760 64.6778 31.0315 178.3790 60 A 4.0193 7.9428 120.7424 54.9107 18.3856 179.4756 61 K 4.1632 7.8495 116.2157 59.7191 32.0053 179.1920 62 Y 4.0934 8.6664 117.7356 61.0520 37.8384 178.3764 63 R 3.6230 8.1315 117.1218 59.6701 28.9391 177.9227 64 E 4.5803 7.9761 118.8942 57.9545 29.7903 177.9860 65 M 4.1653 8.5393 117.4631 58.1019 31.4926 178.3104 66 L 4.1867 7.8957 118.7401 56.5639 42.1027 179.0546 67 G 4.4079 6.9400 117.8818 46.0730 0.0000 172.1224 68 I 4.6148 7.7070 121.7116 58.3234 40.4877 175.2079 69 P 4.2521 0.0000 0.0000 65.5691 31.6124 177.2324 70 S 4.5279 8.2272 109.9934 57.5944 64.0763 177.6783 71 S 3.7867 7.9209 115.4974 59.9892 61.6681 173.6382 72 R 3.9694 8.0389 120.3242 58.8478 29.6943 178.0294 73 E 4.0185 7.4876 114.6472 59.3543 29.5321 179.0874 74 R 4.0648 7.9067 116.8441 59.1309 30.2230 178.6517 75 R 4.0077 7.3194 117.4368 59.2245 30.2550 176.0760 76 I 3.9411 7.4327 121.4598 61.1266 37.9964 174.9538 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 14 H 8.44 4.82 0.00 3.17 3.34 0.00 5.70 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 15 M 8.73 3.98 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.59 0.00 16 L 7.48 4.62 0.00 1.73 1.72 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.99 4.26 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 18 Q 8.90 4.16 0.00 2.20 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.65 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 19 G 7.62 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.70 4.15 0.00 2.15 2.31 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 2.60 2.42 0.00 21 L 7.70 4.03 0.00 1.62 1.72 0.54 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 22 M 8.09 4.25 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.58 0.00 23 K 7.58 4.37 0.00 1.89 1.87 0.00 1.60 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.47 7.81 24 L 7.67 4.44 0.00 1.34 1.27 0.94 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.50 3.63 1.84 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.82 0.83 0.00 0.00 26 K 7.88 4.10 0.00 2.15 2.09 0.00 1.49 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.46 7.81 27 E 7.99 3.92 0.00 1.96 2.01 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 2.27 2.35 0.00 28 I 8.35 4.00 1.76 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.41 0.82 0.00 0.00 29 V 7.65 3.50 2.15 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 1.09 0.00 0.00 0.73 0.00 0.00 30 E 8.26 4.28 0.00 2.13 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 2.36 2.34 0.00 31 N 7.84 4.97 0.00 2.95 2.79 0.00 0.00 7.04 7.12 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 32 E 7.96 4.39 0.00 2.25 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 33 D 9.13 4.80 0.00 2.76 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 34 K 8.60 4.03 0.00 1.76 1.89 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 35 R 7.86 4.20 0.00 1.78 1.96 0.00 3.31 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 36 K 7.67 4.45 0.00 1.54 1.54 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.30 7.81 37 P 0.00 4.46 0.00 2.16 2.14 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 38 Y 8.54 4.37 0.00 2.98 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.97 4.79 0.00 3.97 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 40 D 8.33 4.32 0.00 2.95 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 8.08 3.93 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 42 E 8.87 4.03 0.00 2.38 2.19 0.00 0.00 0.00 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 2.42 0.00 43 I 7.91 3.61 1.83 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.81 0.75 0.00 0.00 44 A 8.23 3.96 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 45 N 7.97 4.25 0.00 2.82 3.09 0.00 0.00 7.30 7.48 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 46 I 7.97 3.91 1.85 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.54 0.92 0.00 0.00 47 L 8.27 4.25 0.00 2.02 1.84 0.89 0.35 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 48 K 7.77 4.35 0.00 1.96 2.17 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.64 1.48 7.81 49 E 8.16 4.24 0.00 2.17 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 2.33 2.59 0.00 50 K 8.04 4.32 0.00 1.48 1.71 0.00 1.93 0.00 0.00 1.73 0.00 0.00 3.17 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.74 1.70 7.81 51 G 6.36 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.63 4.56 0.00 3.24 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.42 4.26 0.00 1.93 2.29 0.00 1.45 0.00 0.00 1.78 0.00 0.00 3.16 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.47 7.81 54 V 7.52 4.08 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 0.68 0.00 0.00 0.77 0.00 0.00 55 A 8.17 4.23 1.26 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 0.00 0.00 56 R 8.50 3.89 0.00 1.85 1.94 0.00 3.35 0.00 0.00 3.53 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 57 R 7.89 3.92 0.00 1.87 1.95 0.00 3.16 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 58 T 7.69 3.94 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 0.65 0.00 0.00 59 V 7.78 3.45 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 0.96 0.00 0.00 0.86 0.00 0.00 60 A 7.94 4.02 1.36 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 0.00 0.00 61 K 7.85 4.16 0.00 2.11 2.00 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.70 7.81 62 Y 8.67 4.09 0.00 3.17 3.01 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 63 R 8.13 3.62 0.00 2.08 2.27 0.00 2.79 0.00 0.00 3.12 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.74 0.00 64 E 7.98 4.58 0.00 2.05 2.20 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 2.30 2.17 0.00 65 M 8.54 4.17 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 66 L 7.90 4.19 0.00 1.62 1.74 1.00 0.87 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 67 G 6.94 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 I 7.71 4.61 2.05 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 1.36 0.92 0.97 0.00 0.00 69 P 0.00 4.25 0.00 2.41 2.18 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 70 S 8.23 4.53 0.00 3.97 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 7.92 3.79 0.00 4.12 4.07 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 0.00 0.00 0.00 72 R 8.04 3.97 0.00 1.87 1.91 0.00 3.09 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 73 E 7.49 4.02 0.00 1.99 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 2.35 2.35 0.00 74 R 7.91 4.06 0.00 1.79 2.01 0.00 3.22 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 75 R 7.32 4.01 0.00 1.70 2.11 0.00 3.23 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 76 I 7.43 3.94 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 1.15 0.82 0.96 0.00 0.00