NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3390 0.0000 0.0000 61.7573 33.4984 176.9246 3 P 3.9728 0.0000 0.0000 61.1235 31.7001 174.4904 4 R 4.2095 9.4466 121.5344 54.9898 31.7417 175.0846 5 P 4.1926 0.0000 0.0000 66.2696 31.3141 178.9403 6 L 3.8877 7.9085 116.6665 57.6065 41.4168 179.2622 7 D 4.3469 8.0533 119.0952 57.4576 40.6025 178.9691 8 V 3.6336 7.6735 116.6872 65.6290 31.5081 177.7579 9 L 3.9049 7.2077 117.9682 57.5204 41.7646 178.1026 10 N 4.7197 7.9953 116.8891 57.2121 38.6258 177.1412 11 R 4.1920 7.9752 113.7074 57.2479 29.9681 177.1240 12 S 4.7043 8.2168 112.3449 57.8281 64.9087 174.1911 13 L 4.2786 7.9347 121.0928 55.9612 41.7560 176.8981 14 K 3.9704 9.2340 121.9384 57.7009 29.9765 175.7356 15 S 4.9879 7.6719 112.7420 55.8344 67.7782 171.4226 16 P 5.0226 0.0000 0.0000 62.9837 32.8060 175.6330 17 V 5.1095 8.8716 115.5075 59.9233 36.9858 173.9391 18 I 4.8770 9.1021 122.9304 59.7540 39.8329 175.2044 19 V 4.5810 8.8476 127.5036 60.9109 33.3836 173.8068 20 R 4.4197 7.8138 128.8271 55.7371 31.1633 175.4732 21 L 5.0905 9.0046 126.2703 52.5831 44.7764 176.0826 22 K 4.0457 8.4846 120.7037 58.1956 32.0394 176.1081 23 G 4.0886 8.4792 110.8727 45.9351 0.0000 173.5136 24 G 3.6520 7.4992 108.4668 45.5186 0.0000 174.7176 25 R 4.2585 8.0767 119.5101 56.6770 31.2974 175.7178 26 E 5.3412 9.0649 120.6828 54.6486 34.1953 174.7109 27 F 4.9416 9.0849 119.9629 55.5670 42.7910 174.2573 28 R 5.2330 7.7759 119.8712 54.1674 31.8599 175.1644 29 G 4.5053 8.2343 110.0787 46.2570 0.0000 170.6851 30 T 4.9859 8.7211 117.3498 62.0256 70.2652 174.5430 31 L 4.4265 8.8264 129.4826 55.3627 41.9468 176.5304 32 D 4.4707 9.0833 128.0071 56.2733 42.3657 175.7541 33 G 4.1316 7.4938 103.6189 46.9626 0.0000 171.2129 34 Y 5.4703 7.8554 116.4532 57.4547 40.2412 172.1530 35 D 4.8777 8.1049 118.6263 51.1016 42.8607 175.9658 36 I 3.6976 8.5073 111.6196 64.6960 37.1876 176.9683 37 H 4.3440 8.0881 116.5004 56.7887 28.7914 175.9424 38 M 3.2724 8.5472 119.0294 56.0643 29.6076 176.1261 39 N 4.8544 8.0755 116.0919 53.4562 40.0469 174.2969 40 L 5.2098 9.1043 121.0823 52.9792 46.5445 175.6363 41 V 4.8637 8.3885 119.6187 61.2545 34.6156 174.0914 42 L 5.1873 8.8632 127.9702 53.0565 44.4016 175.8748 43 L 4.9049 9.4335 124.6349 53.1897 44.3018 176.0945 44 D 4.3234 7.9144 119.1562 55.6740 38.7868 173.9222 45 A 5.2098 7.9963 121.5630 50.1030 22.9939 176.4444 46 E 4.6811 8.8997 119.7147 54.3515 32.7329 174.6933 47 E 3.8495 8.2746 124.0574 55.4197 31.0860 175.0706 48 I 4.5001 8.3635 129.2222 60.2484 38.5639 174.8397 49 Q 4.6624 9.1664 131.4580 54.7207 27.5716 174.3812 50 N 4.0250 9.4095 123.2225 52.5267 36.1402 173.2882 51 G 4.3346 8.3491 113.4148 46.3008 0.0000 172.1922 52 E 4.2632 7.7415 118.0940 54.8873 30.8950 175.3697 53 V 4.4410 8.0656 120.7720 62.2766 32.4884 176.0349 54 V 4.2952 7.7493 118.4042 60.5582 32.8403 175.3023 55 R 4.3651 7.2088 117.9390 56.4712 33.4732 173.8981 56 K 4.6357 8.1198 119.4062 55.6860 33.0020 175.5551 57 V 3.9678 8.2114 116.8473 60.6201 33.1936 177.8874 58 G 3.8854 8.7996 110.1147 49.0328 0.0000 173.5604 59 S 5.8460 7.7397 111.9454 57.8493 66.2064 174.6065 60 V 4.4402 8.1977 113.6419 60.3163 36.0649 173.2578 61 V 4.6010 8.4202 125.6665 61.4499 32.9794 174.6572 62 I 4.3751 8.4129 129.3982 59.0890 39.5834 175.7175 63 R 4.3876 8.5831 126.5701 55.9734 30.8560 177.9197 64 G 3.8976 9.4395 111.8105 47.5176 0.0000 174.9375 65 D 4.3349 8.3579 118.7584 57.5204 41.0982 177.5214 66 T 4.1265 7.6991 106.9554 62.4410 69.3329 174.3647 67 V 3.9446 7.4717 123.2801 62.8776 32.2412 174.9344 68 V 4.2641 8.2999 127.5904 64.1526 32.2923 175.5174 69 F 5.0892 7.2046 113.5554 55.5696 41.2576 172.3322 70 V 5.0536 8.5651 119.4836 61.3794 34.3272 174.7062 71 S 4.7631 9.2828 121.8472 55.8154 65.8275 171.2288 72 P 4.7829 0.0000 0.0000 62.5723 31.9596 176.1109 73 A 4.2670 8.6700 124.3334 52.3182 17.9007 177.2085 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 2 P 0.00 4.34 0.00 2.06 2.17 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 P 0.00 3.97 0.00 2.10 2.04 0.00 3.67 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 2.03 2.13 0.00 4 R 9.45 4.21 0.00 1.99 2.05 0.00 3.01 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.71 0.00 5 P 0.00 4.19 0.00 2.15 2.15 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 6 L 7.91 3.89 0.00 1.67 1.78 0.90 1.09 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 7 D 8.05 4.35 0.00 2.92 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 8 V 7.67 3.63 2.16 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 0.84 0.00 0.00 0.98 0.00 0.00 9 L 7.21 3.90 0.00 1.22 0.66 0.43 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.00 4.72 0.00 3.03 3.12 0.00 0.00 7.33 7.22 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 11 R 7.98 4.19 0.00 1.79 1.96 0.00 3.17 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 12 S 8.22 4.70 0.00 3.92 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 13 L 7.93 4.28 0.00 1.69 1.66 1.05 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 14 K 9.23 3.97 0.00 1.90 1.96 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.42 7.81 15 S 7.67 4.99 0.00 3.91 3.71 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 16 P 0.00 5.02 0.00 2.14 2.19 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 17 V 8.87 5.11 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 0.90 0.00 0.00 1.02 0.00 0.00 18 I 9.10 4.88 2.07 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.96 1.03 0.00 0.00 19 V 8.85 4.58 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 0.87 0.00 0.00 0.95 0.00 0.00 20 R 7.81 4.42 0.00 0.77 0.66 0.00 3.12 0.00 0.00 3.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.57 0.00 21 L 9.00 5.09 0.00 1.65 1.53 1.07 0.69 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 22 K 8.48 4.05 0.00 1.61 1.74 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.51 7.81 23 G 8.48 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 24 G 7.50 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.08 4.26 0.00 1.83 1.90 0.00 3.07 0.00 0.00 3.55 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 26 E 9.06 5.34 0.00 1.87 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.36 0.00 27 F 9.08 4.94 0.00 2.94 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 28 R 7.78 5.23 0.00 1.91 2.05 0.00 3.07 0.00 0.00 3.36 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.38 0.00 29 G 8.23 4.51 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 0.00 30 T 8.72 4.99 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 1.30 0.00 0.00 31 L 8.83 4.43 0.00 1.81 1.79 1.00 0.87 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 32 D 9.08 4.47 0.00 2.75 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.49 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 7.86 5.47 0.00 3.03 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 35 D 8.10 4.88 0.00 2.83 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.51 3.70 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.27 0.90 0.00 0.00 37 H 8.09 4.34 0.00 3.39 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 M 8.55 3.27 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 39 N 8.08 4.85 0.00 2.94 2.74 0.00 0.00 6.81 6.91 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 40 L 9.10 5.21 0.00 1.43 1.50 0.88 0.73 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 41 V 8.39 4.86 2.09 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 1.06 0.00 0.00 0.92 0.00 0.00 42 L 8.86 5.19 0.00 1.64 1.61 0.99 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 43 L 9.43 4.90 0.00 1.64 1.59 1.05 1.00 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 44 D 7.91 4.32 0.00 2.75 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 45 A 8.00 5.21 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 46 E 8.90 4.68 0.00 2.04 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 2.16 2.15 0.00 47 E 8.27 3.85 0.00 1.21 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.61 0.00 48 I 8.36 4.50 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.47 0.94 0.00 0.00 49 Q 9.17 4.66 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.55 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 50 N 9.41 4.02 0.00 2.97 2.87 0.00 0.00 6.61 7.00 0.00 0.00 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 G 8.35 4.33 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 0.00 52 E 7.74 4.26 0.00 2.14 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 0.00 2.54 2.26 0.00 53 V 8.07 4.44 2.04 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 0.81 0.00 0.00 0.92 0.00 0.00 54 V 7.75 4.30 2.04 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 0.73 0.00 0.00 0.95 0.00 0.00 55 R 7.21 4.37 0.00 1.75 1.72 0.00 3.15 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.43 0.00 56 K 8.12 4.64 0.00 1.64 1.65 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.43 7.81 57 V 8.21 3.97 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 0.83 0.00 0.00 1.12 0.00 0.00 58 G 8.80 3.89 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 59 S 7.74 5.85 0.00 3.85 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 60 V 8.20 4.44 1.89 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 0.84 0.00 0.00 1.04 0.00 0.00 61 V 8.42 4.60 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 0.81 0.00 0.00 0.91 0.00 0.00 62 I 8.41 4.38 1.69 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.21 0.70 0.00 0.00 63 R 8.58 4.39 0.00 1.80 1.82 0.00 3.27 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.55 0.00 64 G 9.44 3.90 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 0.00 0.00 0.00 65 D 8.36 4.33 0.00 2.62 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 66 T 7.70 4.13 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 1.19 0.00 0.00 67 V 7.47 3.94 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 0.71 0.00 0.00 0.90 0.00 0.00 68 V 8.30 4.26 1.93 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 0.94 0.00 0.00 0.84 0.00 0.00 69 F 7.20 5.09 0.00 3.07 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 70 V 8.57 5.05 2.11 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 0.83 0.00 0.00 0.93 0.00 0.00 71 S 9.28 4.76 0.00 3.84 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.78 0.00 2.12 2.05 0.00 3.82 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 73 A 8.67 4.27 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