NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 M 4.4327 8.1627 120.6113 55.3211 34.3266 173.4749 102 L 5.0471 8.4411 127.8389 51.6076 44.4196 173.5099 103 I 5.2340 9.6559 120.9674 58.2095 41.9655 173.7201 104 K 4.9412 8.4561 120.8989 54.5089 35.1234 176.2163 105 V 4.6773 8.5308 123.5171 59.3430 33.6967 174.4078 106 K 4.2062 8.6810 129.0541 56.6841 33.4508 176.9385 107 T 4.5829 9.4441 123.4725 61.0883 68.3457 174.6121 108 L 4.0966 8.3874 124.1194 57.2403 42.1070 177.1625 109 T 4.2972 7.9832 106.3689 61.3568 69.2854 175.3693 110 G 3.9465 8.0266 111.4262 44.8595 0.0000 173.7447 111 K 4.1309 7.6842 121.4717 56.2819 33.2968 174.9799 112 E 5.1585 8.8138 128.5452 54.2949 31.7023 174.6298 113 I 4.5664 8.0418 120.4707 58.8317 40.1964 174.7520 114 E 4.7199 8.8330 127.4979 56.4564 30.6322 175.6244 115 I 4.7246 9.3882 125.5159 60.0279 42.3458 173.4237 116 D 5.3639 8.4268 124.6319 53.0734 42.2875 176.1097 117 I 4.3412 8.2644 122.0306 60.4188 42.0430 174.0173 118 E 4.2462 8.7152 127.9886 54.6953 30.5976 175.7925 119 P 4.2333 0.0000 0.0000 65.0268 31.8424 177.3217 120 T 4.2402 8.1215 112.1540 62.8874 67.8988 174.5369 121 D 4.6450 7.7668 121.1771 53.8491 41.9230 176.0051 122 K 4.7579 8.2530 120.7405 55.4124 33.2142 178.2772 123 V 3.5414 8.6150 120.8014 66.3911 30.9775 177.8256 124 E 3.8559 8.2259 118.4037 59.2028 29.2032 178.3557 125 R 4.5508 8.1325 119.3549 57.3043 30.7328 178.0982 126 I 3.8671 7.7311 119.6537 64.1523 36.9737 178.4232 127 K 4.0324 7.9370 119.0373 59.1913 31.6266 178.9064 128 E 3.9796 7.5665 119.0945 59.5840 29.3698 179.7195 129 R 3.9881 8.4711 118.5007 59.0250 30.0219 179.3274 130 V 3.5600 7.5480 117.6997 66.0536 31.1556 177.7122 131 E 3.8895 8.7600 119.3444 59.2549 29.1507 178.3241 132 E 3.9458 7.8535 118.2367 58.4384 29.6480 178.1094 133 K 4.3132 7.2868 116.3782 58.2234 33.2724 178.0616 134 E 4.3401 8.3427 116.9288 56.3597 29.7576 177.6288 135 G 3.7699 8.0957 106.3085 45.6863 0.0000 173.3452 136 I 4.0999 7.4857 120.4004 58.9313 35.8058 173.9254 137 P 4.5774 0.0000 0.0000 61.5678 31.9519 176.1733 138 P 4.5118 0.0000 0.0000 65.4893 31.6238 178.4772 139 Q 3.9857 8.2210 116.7924 59.4602 28.6057 178.6837 140 Q 4.3526 7.5369 113.1023 56.5612 28.4401 175.5712 141 Q 4.5810 7.7868 117.0041 55.2280 30.5452 176.1579 142 R 4.4823 8.0171 119.1977 54.7061 32.9788 173.6658 143 L 4.4317 8.3213 124.3240 53.9489 43.7028 176.1468 144 I 4.9138 8.5697 123.2194 59.8484 40.7128 173.6934 145 Y 4.7293 8.5896 129.5422 56.5239 40.7238 175.4292 146 S 3.5356 9.2783 118.1793 59.2048 61.5827 170.7173 147 G 4.2774 8.1668 120.6138 46.3885 0.0000 172.2273 148 K 4.1016 7.5491 120.7397 56.1527 32.4793 176.9267 149 Q 4.6024 8.7516 122.9042 55.0001 27.3427 173.3141 150 M 2.7600 7.8450 121.9986 54.5587 29.9326 176.4759 151 N 4.4933 10.0117 125.8332 53.3740 38.9817 175.8523 152 D 4.8269 8.7227 125.2566 53.7347 39.0943 176.4132 153 E 4.4237 8.7170 121.4356 58.3817 31.6151 176.3881 154 K 4.2551 7.4770 117.4857 56.5824 32.9029 175.2047 155 T 4.7701 8.3643 112.5736 60.0853 70.0142 174.7572 156 A 4.0566 8.8811 128.7059 55.5590 18.2029 180.1491 157 A 3.9413 7.9146 118.4346 55.6469 18.3335 179.5590 158 D 4.3520 8.0275 115.3873 56.6512 41.1060 177.5832 159 Y 4.5877 7.8010 116.0452 56.6272 38.1480 175.9908 160 K 4.1471 8.1459 118.0719 57.3657 30.0946 175.8991 161 I 3.4103 7.1165 118.0374 61.1779 36.8951 176.3363 162 L 4.3983 8.0569 125.2985 52.9271 42.4050 179.8696 163 G 4.2056 8.1988 108.9762 47.2594 0.0000 173.2744 164 G 3.8078 8.7638 112.0745 46.1992 0.0000 173.8662 165 S 4.4461 7.7851 115.7524 58.4344 64.4712 173.5639 166 V 4.7366 8.4976 121.8051 61.1554 33.3412 175.1122 167 L 4.5392 9.2094 128.8107 55.0063 43.5705 176.1552 168 H 5.2683 8.6732 116.8726 54.0968 32.3103 173.6108 169 L 4.5922 8.6975 123.7803 54.7716 42.4319 176.2724 170 V 4.4434 7.9562 119.5043 62.8159 34.7564 172.1897 171 L 4.4855 8.0916 122.2467 53.8844 44.5942 173.7205 172 R 4.6486 8.4211 123.4770 54.3162 32.6422 174.6045 173 L 4.8071 8.1877 123.9221 52.8718 44.1875 176.9162 174 R 3.9847 8.7548 122.4722 59.2462 30.2398 177.6446 175 G 3.8759 7.9042 104.8642 45.0620 0.0000 173.5804 176 G 3.7498 8.2221 107.0827 46.3122 0.0000 173.5448 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 101 M 8.16 4.43 0.00 2.36 1.99 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 102 L 8.44 5.05 0.00 1.85 1.48 1.05 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 103 I 9.66 5.23 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.82 0.89 0.00 0.00 104 K 8.46 4.94 0.00 1.70 1.69 0.00 1.60 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.33 7.81 105 V 8.53 4.68 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 0.89 0.00 0.00 0.90 0.00 0.00 106 K 8.68 4.21 0.00 1.73 1.69 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.38 7.81 107 T 9.44 4.58 4.36 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 1.30 0.00 0.00 108 L 8.39 4.10 0.00 1.63 1.68 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 109 T 7.98 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 1.21 0.00 0.00 110 G 8.03 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 111 K 7.68 4.13 0.00 1.90 1.69 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.38 7.81 112 E 8.81 5.16 0.00 1.98 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 2.18 2.25 0.00 113 I 8.04 4.57 1.86 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 1.23 0.75 0.93 0.00 0.00 114 E 8.83 4.72 0.00 1.99 1.87 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 2.28 2.46 0.00 115 I 9.39 4.72 1.84 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 1.21 0.33 0.89 0.00 0.00 116 D 8.43 5.36 0.00 2.53 2.58 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 0.00 117 I 8.26 4.34 1.84 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 1.10 0.19 0.95 0.00 0.00 118 E 8.72 4.25 0.00 1.94 1.79 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 2.28 2.27 0.00 119 P 0.00 4.23 0.00 2.20 2.12 0.00 3.63 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 2.12 2.10 0.00 120 T 8.12 4.24 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 0.00 121 D 7.77 4.65 0.00 2.82 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 0.00 122 K 8.25 4.76 0.00 1.83 1.75 0.00 1.97 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.64 1.40 7.81 123 V 8.61 3.54 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 0.96 0.00 0.00 0.95 0.00 0.00 124 E 8.23 3.86 0.00 2.38 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 2.39 2.41 0.00 125 R 8.13 4.55 0.00 1.88 1.88 0.00 3.29 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.81 0.00 126 I 7.73 3.87 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.17 0.86 0.00 0.00 127 K 7.94 4.03 0.00 1.94 1.83 0.00 1.66 0.00 0.00 1.96 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.66 1.50 7.81 128 E 7.57 3.98 0.00 2.25 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 2.53 0.00 129 R 8.47 3.99 0.00 1.76 1.96 0.00 3.28 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 130 V 7.55 3.56 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 1.05 0.00 0.00 0.94 0.00 0.00 131 E 8.76 3.89 0.00 2.14 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 2.30 2.41 0.00 132 E 7.85 3.95 0.00 2.19 2.17 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 2.32 2.35 0.00 133 K 7.29 4.31 0.00 1.88 1.82 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.59 7.81 134 E 8.34 4.34 0.00 2.04 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 2.30 2.45 0.00 135 G 8.10 3.77 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 0.00 0.00 0.00 136 I 7.49 4.10 1.86 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 1.41 0.60 0.91 0.00 0.00 137 P 0.00 4.58 0.00 2.17 2.00 0.00 3.87 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 138 P 0.00 4.51 0.00 2.17 2.09 0.00 3.62 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 139 Q 8.22 3.99 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.71 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 140 Q 7.54 4.35 0.00 2.31 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.67 0.00 0.00 0.00 0.00 0.00 2.45 2.32 0.00 141 Q 7.79 4.58 0.00 2.27 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.99 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.56 0.00 142 R 8.02 4.48 0.00 1.78 1.80 0.00 3.28 0.00 0.00 3.33 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 143 L 8.32 4.43 0.00 1.52 1.50 0.87 0.72 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 0.00 144 I 8.57 4.91 2.03 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 1.11 1.56 0.91 0.00 0.00 145 Y 8.59 4.73 0.00 3.00 2.81 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 0.00 146 S 9.28 3.54 0.00 3.86 3.45 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 0.00 0.00 0.00 0.00 147 G 8.17 4.28 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 0.00 0.00 0.00 148 K 7.55 4.10 0.00 2.12 2.06 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.57 1.76 7.81 149 Q 8.75 4.60 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 150 M 7.85 2.76 0.00 1.72 1.93 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.30 0.00 151 N 10.01 4.49 0.00 2.85 2.93 0.00 0.00 6.61 6.71 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 0.00 152 D 8.72 4.83 0.00 2.83 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 0.00 153 E 8.72 4.42 0.00 1.90 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 2.22 2.29 0.00 154 K 7.48 4.26 0.00 2.28 1.90 0.00 1.50 0.00 0.00 1.24 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.43 7.81 155 T 8.36 4.77 4.26 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 1.37 0.00 0.00 156 A 8.88 4.06 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 0.00 157 A 7.91 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 D 8.03 4.35 0.00 2.54 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 Y 7.80 4.59 0.00 3.21 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 0.00 160 K 8.15 4.15 0.00 2.14 2.05 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.45 7.81 161 I 7.12 3.41 1.76 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 0.51 0.28 0.69 0.00 0.00 162 L 8.06 4.40 0.00 1.76 1.57 0.95 0.78 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 0.00 163 G 8.20 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 0.00 0.00 0.00 0.00 164 G 8.76 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 0.00 0.00 0.00 165 S 7.79 4.45 0.00 3.58 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 0.00 166 V 8.50 4.74 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 0.76 0.00 0.00 1.01 0.00 0.00 167 L 9.21 4.54 0.00 1.57 1.55 0.84 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 168 H 8.67 5.27 0.00 3.24 3.15 0.00 5.81 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 L 8.70 4.59 0.00 1.65 1.60 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 170 V 7.96 4.44 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 0.66 0.00 0.00 0.93 0.00 0.00 171 L 8.09 4.49 0.00 1.58 1.46 0.92 0.80 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 0.00 172 R 8.42 4.65 0.00 1.76 1.74 0.00 3.24 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 173 L 8.19 4.81 0.00 1.64 1.54 0.92 0.94 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 0.00 174 R 8.75 3.98 0.00 1.80 1.99 0.00 3.20 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 175 G 7.90 3.88 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 0.00 0.00 0.00 176 G 8.22 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 0.00 0.00 0.00