NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 62 A 4.2496 8.1233 122.4579 51.9419 20.5636 175.3044 63 M 4.8568 8.0179 119.8750 52.9218 35.2871 174.2787 64 F 4.7946 9.4459 121.7882 55.6021 42.9485 173.8550 65 Q 4.2333 8.9997 125.9300 55.5722 29.5223 175.4753 66 I 4.4055 8.5627 117.7671 59.5550 38.9526 175.1026 67 G 3.7883 6.9392 108.7481 45.5749 0.0000 171.8956 68 K 4.0965 8.4642 119.1479 57.8917 32.2439 176.9739 69 M 3.3809 8.9613 121.9663 56.0638 29.5620 175.9034 70 R 5.2065 7.5189 117.1231 54.9874 34.4851 173.9536 71 Y 5.1703 9.1329 120.8821 56.2567 42.8114 174.3823 72 V 4.7177 9.1393 123.5088 61.9173 33.6508 174.4245 73 S 5.2503 9.3787 122.6928 56.4656 65.0829 172.5139 74 V 4.9776 8.9982 127.7819 61.1865 32.9868 174.7102 75 R 4.6949 8.7525 123.4446 54.8925 33.6502 173.9422 76 D 4.9266 8.7221 120.1412 53.2134 41.4883 175.6615 77 F 4.5931 9.4293 130.4558 57.0390 38.7423 175.7446 78 K 3.3502 9.3114 129.5926 57.1901 29.2711 176.9968 79 G 3.9834 8.6411 107.3149 44.8541 0.0000 174.2821 80 K 4.6034 7.7446 119.5839 54.2228 34.6590 175.4132 81 V 4.4288 8.3233 123.5508 62.7819 32.5170 175.0784 82 L 4.9659 9.0358 126.8310 53.0580 45.8792 175.6277 83 I 4.2021 8.9397 124.7146 59.8867 38.8679 173.8752 84 D 5.2474 9.1396 128.5572 52.4566 43.3762 174.8297 85 I 4.8587 8.5510 127.4133 59.7710 39.4768 174.7830 86 R 5.0320 8.7827 125.7853 55.4175 34.2111 173.4838 87 E 5.0591 9.0131 122.9460 55.9863 31.2256 175.2003 88 Y 5.2237 9.0318 119.7173 56.2106 41.8308 174.8460 89 W 4.8523 9.6451 121.1393 55.2970 33.1209 174.1259 90 M 5.2134 8.6813 121.1624 54.0200 33.4545 175.5488 91 D 4.8393 9.1136 126.4317 51.6239 41.0631 175.4712 92 P 4.2724 0.0000 0.0000 65.0528 31.2419 177.3573 93 E 4.2417 8.3781 115.9071 56.1793 29.6655 176.9807 94 G 3.9392 8.4400 107.5895 45.4338 0.0000 173.2686 95 E 4.5219 8.3426 119.4354 55.2977 31.3043 175.6263 96 M 4.9035 8.5411 123.2525 55.2883 33.1035 175.9440 97 K 4.9188 9.5261 122.6784 53.6939 36.6709 173.9324 98 P 3.6358 0.0000 0.0000 62.6595 31.9857 176.4880 99 G 4.1069 8.5724 111.9387 44.9434 0.0000 173.9310 100 R 4.1318 8.6133 117.7325 58.2635 30.4233 177.7937 101 K 4.3689 7.8936 118.3854 54.9313 31.4406 175.8319 102 G 4.4369 7.8815 109.5617 45.3572 0.0000 169.4733 103 I 4.7891 8.6473 119.8771 59.2417 41.9044 173.8736 104 S 5.0464 8.7315 124.5994 57.1479 64.2423 173.3754 105 L 5.0716 8.8845 125.7485 52.9876 44.4374 176.5567 106 N 5.0155 9.1839 120.4198 51.0994 39.2635 174.4391 107 P 4.3953 0.0000 0.0000 65.4520 31.1971 178.6822 108 E 3.9778 8.2823 118.0207 59.4112 29.6003 178.7506 109 Q 4.0487 8.7257 118.3183 58.6721 28.7306 178.3939 110 W 4.3481 8.5867 129.6567 60.6701 30.7211 178.0032 111 S 3.8858 8.4391 113.1427 61.3066 61.8782 176.1917 112 Q 3.9490 8.1630 120.9991 58.5192 28.1894 178.2090 113 L 3.8607 7.8859 120.9708 58.1539 42.5272 178.8954 114 K 3.7801 7.6580 118.3740 59.4453 31.6761 179.2350 115 E 3.9870 7.9933 117.8014 58.8859 29.5638 178.4067 116 Q 4.2873 7.6579 115.8684 56.2876 28.9801 177.7745 117 I 3.6430 7.5103 122.6328 64.3848 37.1475 178.3049 118 S 4.0841 7.9434 115.4257 61.8105 62.8855 176.3628 119 D 4.3678 8.0058 120.9453 57.3449 40.5038 178.7869 120 I 3.7027 8.0537 120.6124 64.5905 37.1277 178.2681 121 D 4.3265 8.5510 120.1028 57.3221 40.4669 178.3669 122 D 4.2929 8.2651 118.4773 57.2010 41.1333 178.2256 123 A 3.9927 7.9534 121.0721 54.9450 18.1612 179.6886 124 V 3.5254 7.8730 116.4963 66.1830 31.7172 178.2393 125 R 4.0828 8.0478 114.0899 58.3471 29.5098 177.9837 126 K 4.2807 7.5479 117.8098 57.3804 32.7629 176.4222 127 L 4.2175 7.9680 123.3226 54.8602 41.6772 176.3881 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 62 A 8.12 4.25 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 63 M 8.02 4.86 0.00 1.71 1.68 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.39 0.00 64 F 9.45 4.79 0.00 2.94 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 9.00 4.23 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.88 0.00 0.00 0.00 0.00 0.00 2.11 1.61 0.00 66 I 8.56 4.41 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.81 0.96 0.00 0.00 67 G 6.94 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.46 4.10 0.00 1.72 1.75 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.43 7.81 69 M 8.96 3.38 0.00 2.50 2.16 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 70 R 7.52 5.21 0.00 1.63 1.75 0.00 3.15 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 71 Y 9.13 5.17 0.00 2.71 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 72 V 9.14 4.72 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 0.88 0.00 0.00 0.98 0.00 0.00 73 S 9.38 5.25 0.00 3.93 3.74 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 74 V 9.00 4.98 2.23 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 0.84 0.00 0.00 0.89 0.00 0.00 75 R 8.75 4.69 0.00 1.93 1.98 0.00 2.87 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 76 D 8.72 4.93 0.00 2.73 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.43 4.59 0.00 3.07 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 9.31 3.35 0.00 1.24 1.57 0.00 0.61 0.00 0.00 1.27 0.00 0.00 2.65 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.02 0.83 7.81 79 G 8.64 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.74 4.60 0.00 1.87 1.74 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.52 7.81 81 V 8.32 4.43 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 0.77 0.00 0.00 0.96 0.00 0.00 82 L 9.04 4.97 0.00 1.58 1.46 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.94 4.20 1.59 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.29 -0.04 0.00 0.00 84 D 9.14 5.25 0.00 2.62 2.52 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 85 I 8.55 4.86 1.94 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.54 0.99 0.00 0.00 86 R 8.78 5.03 0.00 2.07 1.80 0.00 2.75 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.63 0.00 87 E 9.01 5.06 0.00 2.02 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 0.00 2.33 2.43 0.00 88 Y 9.03 5.22 0.00 3.07 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 89 W 9.65 4.85 0.00 3.18 3.16 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 0.00 0.00 0.00 0.00 90 M 8.68 5.21 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 91 D 9.11 4.84 0.00 2.94 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.27 0.00 2.08 2.18 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 93 E 8.38 4.24 0.00 2.21 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 94 G 8.44 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 95 E 8.34 4.52 0.00 1.97 1.88 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 2.29 2.38 0.00 96 M 8.54 4.90 0.00 1.87 1.91 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 97 K 9.53 4.92 0.00 1.64 1.64 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.51 7.81 98 P 0.00 3.64 0.00 1.81 1.69 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.93 0.00 99 G 8.57 4.11 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 0.00 0.00 0.00 100 R 8.61 4.13 0.00 1.84 1.99 0.00 3.13 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 101 K 7.89 4.37 0.00 1.91 1.79 0.00 1.95 0.00 0.00 1.85 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.51 7.81 102 G 7.88 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.65 4.79 1.89 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 1.26 1.71 0.96 0.00 0.00 104 S 8.73 5.05 0.00 3.75 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.88 5.07 0.00 1.74 1.69 1.17 0.46 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 0.00 106 N 9.18 5.02 0.00 2.98 3.01 0.00 0.00 7.00 8.42 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 0.00 107 P 0.00 4.40 0.00 2.25 2.23 0.00 3.65 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 108 E 8.28 3.98 0.00 2.07 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 0.00 2.40 2.42 0.00 109 Q 8.73 4.05 0.00 2.34 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 110 W 8.59 4.35 0.00 3.37 3.32 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 0.00 111 S 8.44 3.89 0.00 3.99 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 0.00 112 Q 8.16 3.95 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.57 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 113 L 7.89 3.86 0.00 1.67 1.62 0.88 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 114 K 7.66 3.78 0.00 1.61 1.57 0.00 1.44 0.00 0.00 1.15 0.00 0.00 2.34 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.73 0.46 7.81 115 E 7.99 3.99 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.48 0.00 116 Q 7.66 4.29 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 117 I 7.51 3.64 1.88 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.60 0.88 0.00 0.00 118 S 7.94 4.08 0.00 3.83 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 0.00 119 D 8.01 4.37 0.00 2.79 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 0.00 120 I 8.05 3.70 1.98 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 1.50 0.80 0.90 0.00 0.00 121 D 8.55 4.33 0.00 2.82 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 0.00 122 D 8.27 4.29 0.00 2.85 2.83 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 0.00 0.00 0.00 0.00 123 A 7.95 3.99 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.87 3.53 2.22 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 0.88 0.00 0.00 0.97 0.00 0.00 125 R 8.05 4.08 0.00 2.00 2.04 0.00 3.10 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 126 K 7.55 4.28 0.00 1.78 1.89 0.00 1.91 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.58 7.81 127 L 7.97 4.22 0.00 1.72 1.57 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00