NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 79 T 4.3028 8.1749 117.3738 63.4001 68.9979 173.4290 80 D 4.5038 8.3560 126.5595 51.3867 42.1845 175.5379 81 S 4.4220 10.7700 117.2232 58.2204 65.9167 174.7811 82 E 4.0629 8.6252 121.6734 59.2217 29.1387 178.2147 83 E 4.1233 8.1846 117.2928 59.1699 29.6352 178.8360 84 E 4.0519 8.2370 119.9085 59.4060 29.5627 179.2604 85 I 4.0834 7.8913 119.5468 64.1996 37.1508 178.4825 86 R 4.2006 8.1364 119.6520 59.2385 29.6533 178.3362 87 E 4.0052 7.8825 117.3973 59.5709 29.7338 178.9427 88 A 4.2969 7.8757 119.2945 55.1689 18.4434 179.4621 89 F 3.3691 8.3444 119.2937 61.2790 39.1907 177.6451 90 R 3.9153 8.0960 116.7962 58.7455 29.8284 178.7581 91 V 3.6986 7.2446 117.9871 66.0110 31.5505 177.8019 92 F 4.1575 8.0749 115.9226 59.8460 40.5638 176.6534 93 D 4.5112 7.5729 119.0481 52.2532 37.1295 176.1818 94 K 3.7292 7.7748 123.6677 59.4032 32.8821 177.2467 95 D 4.7168 7.3631 114.9286 51.7610 41.3748 175.0036 96 G 3.5189 8.4380 106.4865 48.0060 0.0000 172.8730 97 N 3.9282 7.9123 117.4662 51.3830 39.5779 175.9898 98 G 4.4115 7.8386 109.9710 44.7625 0.0000 172.7532 99 Y 5.5189 7.3999 113.8716 56.5370 43.1926 176.5511 100 I 4.3883 8.7356 123.1084 59.9135 39.4858 175.9383 101 S 4.7251 8.5018 121.2510 57.2703 63.9133 174.8006 102 A 4.1092 8.6086 122.8465 54.8317 18.0075 179.6029 103 A 3.9461 7.9327 119.0913 54.9696 18.5827 179.3265 104 E 3.9215 8.1267 117.6679 59.3157 29.7445 178.6854 105 L 4.0199 7.8765 119.9896 58.2040 42.1196 178.8336 106 R 3.8527 8.3326 118.8679 59.5744 29.7698 178.2385 107 H 4.2409 8.0130 115.9538 58.5263 28.9174 177.7090 108 V 3.4524 7.6956 120.0335 66.2429 31.2183 178.0836 109 M 4.0445 8.3314 118.6399 58.5686 31.7769 178.7746 110 T 4.1128 7.5263 116.9831 66.3706 68.4853 176.3142 111 N 4.3340 8.1342 116.8683 55.9466 38.5155 176.3275 112 L 4.5515 7.4429 118.0951 54.3985 42.0001 177.4475 113 G 3.9194 8.3796 106.8428 45.1159 0.0000 173.5180 114 E 4.4979 8.6029 119.8463 54.1549 31.5786 175.2477 115 K 4.4248 8.6352 124.2924 55.2122 32.7328 176.3142 116 L 4.9698 8.1441 123.5557 52.4562 45.1241 177.1381 117 T 4.2601 8.5844 112.2895 61.2895 71.0453 175.5835 118 D 4.3646 8.5702 121.2102 57.4203 40.7211 178.5472 119 E 3.8841 8.1603 119.2484 59.6975 29.8064 178.8112 120 E 4.0419 8.2877 118.3085 58.9789 29.4199 179.6419 121 V 3.5646 8.0761 119.0189 66.1773 31.6706 177.6812 122 D 4.4137 8.5884 117.8915 57.2398 40.9478 178.0492 123 E 4.0822 7.9761 119.0081 59.4161 28.9562 179.0798 124 M 4.1193 8.0125 118.5065 58.1883 32.0103 178.7865 125 I 3.7440 7.6128 119.5831 64.5109 37.1448 178.1971 126 R 3.8864 8.0990 118.4235 59.7510 29.8969 177.8540 127 E 4.0427 8.1840 117.3357 58.2272 29.6716 177.5430 128 A 4.6448 7.2588 117.7417 52.1057 21.5382 177.8883 129 D 4.6457 8.3304 117.5363 53.8946 37.9499 175.3874 130 I 3.8360 7.7645 124.2128 63.9058 37.6675 177.3196 131 D 4.3897 8.7316 117.8356 53.7992 39.7076 177.3961 132 G 3.8746 8.2858 108.1995 46.0691 0.0000 173.5442 133 D 4.4932 9.3775 118.0751 53.0677 39.3019 177.6410 134 G 3.9719 9.7668 108.6667 45.8009 0.0000 173.3930 135 Q 4.5640 8.0296 115.9847 54.4107 31.9213 174.5794 136 V 4.3766 8.3576 119.1114 61.3478 31.8835 175.4929 137 N 5.6283 8.3739 126.1504 52.2253 40.5920 174.5444 138 Y 3.4946 8.5311 119.5397 61.0465 38.8571 177.7482 139 E 3.6995 8.2177 119.6016 59.5184 29.5200 178.4760 140 E 4.0969 8.0858 116.0473 58.4078 29.4127 178.5678 141 F 4.3079 7.6637 120.1511 61.2555 39.4007 177.8417 142 V 3.4502 7.3197 110.7469 64.1324 31.4904 177.8470 143 Q 4.0570 8.0033 118.2955 57.8043 28.8049 176.9752 144 M 3.9952 7.1855 117.8140 58.1521 32.1886 175.6075 145 M 4.1151 7.4458 122.4154 55.6823 32.3446 175.6224 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 79 T 8.17 4.30 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 1.20 0.00 0.00 80 D 8.36 4.50 0.00 2.79 2.80 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 0.00 0.00 0.00 81 S 10.77 4.42 0.00 4.08 4.05 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 0.00 0.00 0.00 82 E 8.63 4.06 0.00 2.06 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 0.00 2.43 2.36 0.00 83 E 8.18 4.12 0.00 2.26 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 0.00 2.39 2.43 0.00 84 E 8.24 4.05 0.00 2.31 2.10 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 2.37 2.39 0.00 85 I 7.89 4.08 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.09 1.13 0.00 0.00 86 R 8.14 4.20 0.00 1.86 1.96 0.00 2.95 0.00 0.00 2.84 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 87 E 7.88 4.01 0.00 2.18 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 2.39 2.57 0.00 88 A 7.88 4.30 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.34 3.37 0.00 2.96 3.15 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 90 R 8.10 3.92 0.00 2.06 1.98 0.00 3.27 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 91 V 7.24 3.70 2.34 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 0.69 0.00 0.00 1.03 0.00 0.00 92 F 8.07 4.16 0.00 2.61 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 93 D 7.57 4.51 0.00 2.06 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.77 3.73 0.00 1.89 1.86 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.41 7.81 95 D 7.36 4.72 0.00 2.86 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 96 G 8.44 3.52 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 0.00 0.00 0.00 97 N 7.91 3.93 0.00 2.75 2.84 0.00 0.00 5.89 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 98 G 7.84 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 99 Y 7.40 5.52 0.00 2.91 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 0.00 100 I 8.74 4.39 1.95 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.70 1.00 0.00 0.00 101 S 8.50 4.73 0.00 4.04 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 0.00 102 A 8.61 4.11 1.34 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 0.00 0.00 103 A 7.93 3.95 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 0.00 104 E 8.13 3.92 0.00 2.14 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 2.77 2.37 0.00 105 L 7.88 4.02 0.00 2.03 1.70 1.01 1.06 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 0.00 106 R 8.33 3.85 0.00 1.94 1.89 0.00 3.08 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 107 H 8.01 4.24 0.00 3.34 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.70 3.45 2.13 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 0.59 0.00 0.00 0.72 0.00 0.00 109 M 8.33 4.04 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.94 0.00 110 T 7.53 4.11 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 111 N 8.13 4.33 0.00 2.86 2.85 0.00 0.00 7.12 8.58 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 0.00 112 L 7.44 4.55 0.00 1.61 1.65 0.84 0.92 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 0.00 113 G 8.38 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.60 4.50 0.00 1.94 1.84 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 2.21 2.38 0.00 115 K 8.64 4.42 0.00 1.72 1.75 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.50 7.81 116 L 8.14 4.97 0.00 1.58 1.53 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.58 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 1.21 0.00 0.00 118 D 8.57 4.36 0.00 2.74 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.16 3.88 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.41 0.00 120 E 8.29 4.04 0.00 2.07 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 2.33 2.32 0.00 121 V 8.08 3.56 2.27 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 1.04 0.00 0.00 0.95 0.00 0.00 122 D 8.59 4.41 0.00 2.74 2.79 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 0.00 123 E 7.98 4.08 0.00 2.18 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 2.33 2.46 0.00 124 M 8.01 4.12 0.00 2.14 2.27 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 2.81 2.61 0.00 125 I 7.61 3.74 2.06 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 1.63 1.00 0.98 0.00 0.00 126 R 8.10 3.89 0.00 1.94 2.15 0.00 3.27 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 127 E 8.18 4.04 0.00 2.26 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 2.32 2.47 0.00 128 A 7.26 4.64 1.32 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 0.00 0.00 129 D 8.33 4.65 0.00 2.76 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.76 3.84 2.03 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.84 0.90 0.00 0.00 131 D 8.73 4.39 0.00 2.71 2.78 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 0.00 132 G 8.29 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 D 9.38 4.49 0.00 2.65 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 0.00 134 G 9.77 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 0.00 0.00 0.00 0.00 135 Q 8.03 4.56 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.67 0.00 0.00 0.00 0.00 0.00 2.31 1.96 0.00 136 V 8.36 4.38 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 1.27 0.00 0.00 1.00 0.00 0.00 137 N 8.37 5.63 0.00 3.51 3.24 0.00 0.00 6.23 7.45 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 0.00 138 Y 8.53 3.49 0.00 2.74 2.88 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 0.00 139 E 8.22 3.70 0.00 2.07 1.95 0.00 0.00 0.00 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 2.37 0.00 140 E 8.09 4.10 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 141 F 7.66 4.31 0.00 3.42 3.10 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 0.00 142 V 7.32 3.45 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.00 0.73 0.00 0.00 143 Q 8.00 4.06 0.00 2.25 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 144 M 7.19 4.00 0.00 1.92 2.08 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 145 M 7.45 4.12 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00