NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.1737 8.4293 118.7833 55.5241 31.0110 175.2401 8 S 4.2298 8.1007 114.6977 57.7499 64.7121 173.9446 9 L 4.3021 8.3724 122.0763 58.1305 41.8590 180.8168 10 E 4.0803 8.3136 117.1108 59.4053 29.3872 178.8111 11 S 3.9585 8.0033 113.6640 60.9819 62.4559 176.2500 12 W 4.3319 8.2021 121.4973 59.8404 28.8694 178.3704 13 L 3.6060 8.2486 120.2492 57.9965 41.0086 178.4921 14 N 4.2098 8.6989 116.8067 56.5006 38.2649 177.5056 15 K 3.7457 7.5212 118.0411 58.7134 32.1366 178.6335 16 A 4.3544 7.6962 119.3110 53.1745 18.4888 177.7233 17 T 4.1553 7.5031 105.9138 60.2979 70.0999 173.1862 18 N 4.3525 7.6497 121.3601 53.8009 39.1163 173.8919 19 P 4.4302 0.0000 0.0000 65.6138 31.6301 177.7603 20 S 4.4105 9.1601 113.9542 60.2584 63.1155 174.5449 21 N 4.4200 7.8913 117.7500 54.1210 38.6641 175.4377 22 R 4.2263 8.7852 121.4607 58.5306 30.7128 176.3019 23 Q 4.8780 7.7910 113.0725 54.5601 31.1541 173.7825 24 E 3.9919 9.0648 118.5892 57.1622 30.1444 177.8448 25 D 4.8970 8.1516 122.3933 51.8870 41.6172 176.9995 26 W 4.1096 8.5682 124.9595 58.8319 29.2038 177.4743 27 E 3.8897 8.1113 119.4437 59.6218 29.1429 178.2946 28 Y 4.6542 7.5090 116.1740 61.0465 37.9616 177.8513 29 I 3.6411 7.7204 120.7454 64.7087 37.1466 178.5634 30 I 3.8397 8.1435 120.6789 64.1682 36.8993 178.6033 31 G 2.1660 7.7924 106.6403 47.1486 0.0000 175.4634 32 F 3.9362 8.2672 123.1078 61.1060 39.4198 177.0084 33 C 3.7584 7.6423 116.0769 62.9188 27.4261 175.7881 34 D 4.1987 7.8969 120.5037 57.2919 40.2564 178.7155 35 Q 3.9040 7.5567 119.8916 59.2219 28.8308 178.3864 36 I 3.4988 6.9274 119.2829 64.4905 37.4417 178.0155 37 N 4.3774 8.0177 116.5814 55.3389 37.9963 177.1197 38 K 4.1121 7.1568 118.1427 57.1492 33.3733 177.3993 39 E 4.0815 7.9118 119.6759 55.9037 29.9967 177.7406 40 L 3.9579 8.6962 125.6000 57.6110 42.5551 177.4712 41 E 5.4287 7.4358 115.6939 55.3063 30.5084 177.8485 42 G 3.6964 7.8816 108.6342 47.5997 0.0000 174.3327 43 P 4.3045 0.0000 0.0000 65.3859 31.1829 178.6578 44 Q 3.9241 7.9357 116.1152 59.0470 28.6949 178.9331 45 I 3.7858 7.8226 120.4528 64.2030 37.1462 178.1149 46 A 4.2765 8.4702 121.9845 55.5268 18.2047 179.9747 47 V 3.2905 7.6925 110.5191 64.6954 31.4622 179.0421 48 R 4.0380 7.6542 116.2318 59.2475 30.0187 179.1865 49 L 4.0589 8.2197 118.7033 57.8563 41.6556 179.5739 50 L 4.0272 8.5720 119.0959 57.6481 41.3653 179.0878 51 A 4.1605 8.6997 120.0113 55.7279 18.7296 178.7387 52 H 4.2553 8.0756 116.1036 59.6615 29.8382 177.5116 53 K 3.8765 7.9572 119.6093 59.6090 31.6062 179.4339 54 I 3.8546 7.8792 119.2779 63.7175 36.9778 177.2632 55 Q 4.4565 7.3964 117.0161 54.8377 29.1660 175.4081 56 S 4.3593 7.1998 115.7820 57.0503 63.0026 172.8126 57 P 4.2799 0.0000 0.0000 65.2887 31.5472 176.9952 58 Q 4.2365 7.8576 118.4370 54.9662 29.0425 176.0970 59 E 3.9798 8.8813 126.8917 59.2635 29.7665 178.4986 60 W 4.8007 8.2871 127.7788 60.4091 30.8124 177.5045 61 E 3.9395 8.4458 120.2157 58.5411 29.1993 178.4822 62 A 4.1145 7.9750 120.9053 54.8539 18.4458 179.3645 63 L 3.8855 8.3671 119.2852 58.5225 42.1914 179.2150 64 Q 3.5750 7.5999 117.6532 58.7802 28.4809 178.7172 65 A 3.8342 7.8662 121.6566 55.1208 18.2563 179.7491 66 L 4.0421 7.8503 117.5535 58.2786 41.7118 179.8299 67 T 3.8888 7.9491 115.7748 66.5300 68.2764 176.9915 68 V 3.4982 7.9431 120.5706 65.5798 31.6179 177.8902 69 L 4.1026 8.0922 120.4146 58.1063 41.4545 178.5422 70 E 4.1602 8.6792 119.3413 59.3170 29.6158 178.6293 71 A 4.1449 8.1486 120.7988 55.4868 18.4077 179.3218 72 C 3.6762 8.1808 115.2263 63.1662 27.8120 176.3551 73 M 4.0793 7.7521 118.8224 57.9192 31.6132 178.2122 74 K 4.3139 7.5453 115.8385 57.3905 32.6976 177.6233 75 N 4.8764 7.8184 114.7963 53.1757 40.4179 174.8977 76 C 5.0715 7.6730 116.2707 57.6066 28.7422 175.1384 77 G 3.6046 7.8321 109.4412 46.0633 0.0000 173.3519 78 R 3.8367 8.5771 116.2992 59.8620 29.5472 179.4998 79 R 3.9544 7.8283 113.7327 58.5463 29.7267 178.1465 80 F 4.1828 8.1023 121.7405 61.3148 39.6267 176.8526 81 H 3.9974 8.0939 115.2972 59.2766 28.1937 177.1875 82 N 4.2620 7.8522 117.0727 56.2771 38.4755 177.0426 83 E 3.9205 7.8628 120.0145 59.2560 29.3316 179.5015 84 V 3.3565 7.0466 116.6050 65.0114 31.6280 177.1764 85 G 4.1810 7.4304 104.5820 43.5739 0.0000 173.2354 86 K 4.4097 7.0868 121.1291 54.2831 34.2486 177.6115 87 F 4.3640 8.2606 120.8425 60.7936 38.5442 177.7254 88 R 3.8834 8.2223 117.2809 59.0756 30.0300 177.1942 89 F 4.6117 7.9438 118.9037 60.1144 40.2282 177.3387 90 L 3.9554 8.2415 118.8164 58.0812 41.3583 179.3414 91 N 4.3197 8.8749 116.6819 56.2765 38.1895 177.2595 92 E 3.8995 7.5946 119.0288 59.2491 29.7744 179.0369 93 L 4.0665 7.3262 118.5648 57.3445 41.8638 179.1677 94 I 3.6396 7.6075 119.8359 64.4974 37.0536 178.4755 95 K 3.5702 7.9347 119.2056 59.5175 31.5187 179.4922 96 V 3.6179 7.3916 117.2872 65.0652 31.5466 176.9128 97 V 4.1933 7.6251 109.1533 61.0393 32.7550 175.5779 98 S 4.7019 7.7754 117.5969 56.2971 63.7343 173.1769 99 P 4.4273 0.0000 0.0000 65.4855 31.1921 177.5675 100 K 4.1184 8.1109 117.3741 58.1422 33.9852 176.1836 101 Y 4.5527 8.7071 112.0818 58.7874 37.9151 177.1774 102 L 4.2635 7.1196 134.1315 58.1349 42.9391 180.0261 103 G 4.0579 7.7683 107.4366 48.7310 0.0000 175.6179 104 D 4.5211 8.0791 119.4828 55.5511 40.9721 177.3291 105 R 4.5271 8.5405 117.3218 55.5567 30.7770 175.6871 106 V 4.4349 7.3768 118.1397 60.5397 33.8512 176.1747 107 S 4.4271 8.3199 120.8529 58.0666 64.9957 175.3642 108 E 3.9229 8.6007 122.2586 59.3985 29.3423 179.1589 109 K 3.8332 8.1735 119.2768 59.7641 32.0853 178.6009 110 V 3.5841 7.4131 116.6730 65.9180 31.4571 178.0333 111 K 3.9476 8.0326 118.4374 59.8297 31.9839 179.4739 112 T 3.8698 8.6979 110.5974 64.5928 68.4634 176.3535 113 K 3.9188 8.0445 122.4373 59.2092 32.1529 178.9133 114 V 3.4915 7.7751 118.4892 66.1239 31.4880 178.0466 115 I 3.7366 7.8951 119.5667 64.2296 36.8720 177.9746 116 E 3.9119 8.6103 120.4583 59.2876 29.4137 178.8602 117 L 3.4211 7.7966 118.9986 57.4657 41.4740 179.4149 118 L 3.5577 7.4764 119.0230 57.8742 41.2824 178.9273 119 Y 3.3328 8.0359 119.5143 60.6637 38.5763 178.3033 120 S 3.7976 8.0540 116.2948 61.4707 62.9053 176.8831 121 W 4.3956 8.1121 121.9943 59.7825 28.5163 178.6776 122 T 4.1005 7.5648 108.9482 64.4194 68.0916 176.0577 123 M 4.1526 7.1113 120.2637 57.6916 32.6027 178.0000 124 A 4.1629 8.0128 119.5337 53.8378 20.1864 178.1006 125 L 4.6343 8.1400 117.6467 52.6883 41.0702 175.7516 126 P 4.3940 0.0000 0.0000 64.8744 32.1477 178.3056 127 E 4.0765 8.1143 115.8138 58.9955 30.1136 177.2735 128 E 4.2064 7.9345 120.6511 54.4788 28.1898 176.5729 129 A 4.0563 8.1758 125.5196 54.9300 18.7826 179.2623 130 K 3.9238 7.8713 116.3583 59.2986 32.0002 179.4359 131 I 3.9136 7.6558 120.2331 64.0782 36.9500 178.5248 132 K 4.0628 8.0210 118.9873 59.5729 31.9239 178.8917 133 D 4.4474 8.0983 118.4887 57.3535 40.6500 178.6976 134 A 4.1219 8.2118 121.0071 55.4426 18.1779 179.1290 135 Y 4.1697 8.2535 117.9678 61.1503 38.8934 177.7475 136 H 4.1426 8.6894 117.5882 59.2023 28.9477 177.1933 137 M 3.9664 8.3281 120.0999 58.8501 31.8123 178.3639 138 L 3.9292 7.5362 118.9486 57.6579 41.8186 179.6219 139 K 4.0399 7.5350 119.4744 58.9482 31.7660 179.1962 140 R 3.9138 8.2411 117.9339 59.5204 29.9837 177.5762 141 Q 4.3645 7.7801 114.3938 55.4497 28.8899 176.6779 142 G 3.9152 8.1423 108.4885 46.0047 0.0000 175.1418 143 I 3.7595 7.8939 122.2143 62.7534 37.2325 176.0252 144 V 4.1808 7.3038 119.7356 60.7470 32.1617 175.7773 145 Q 4.0312 8.7497 126.5164 58.2734 28.8276 177.1698 146 S 4.6927 7.4218 109.2221 55.8194 66.2597 173.2646 147 D 4.1360 8.7348 120.8562 53.4420 40.9366 174.9462 148 P 4.6430 0.0000 0.0000 60.7466 32.9877 173.7175 149 P 4.6607 0.0000 0.0000 62.4332 32.2085 175.5694 150 I 4.7481 7.8567 112.0572 58.1600 40.7099 173.2846 151 P 4.2876 0.0000 0.0000 62.8211 31.7142 176.3630 152 V 3.7138 8.1734 121.1703 62.6139 31.9517 175.4633 153 D 4.4875 8.3531 126.6397 52.8038 42.1253 175.4428 154 R 4.1671 8.5654 125.3251 57.7878 30.2767 177.7620 155 T 4.3141 8.4666 108.7300 62.1821 69.3927 176.0927 156 L 4.4318 7.7690 121.9368 55.1261 41.2959 177.0446 157 I 3.6287 7.7485 125.9670 61.9853 37.8228 173.9453 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 7 E 8.43 4.17 0.00 1.77 1.72 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 1.47 1.47 0.00 8 S 8.10 4.23 0.00 4.41 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 9 L 8.37 4.30 0.00 1.85 2.02 0.94 0.57 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 10 E 8.31 4.08 0.00 2.18 2.26 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 2.39 2.33 0.00 11 S 8.00 3.96 0.00 3.84 3.99 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 12 W 8.20 4.33 0.00 3.95 3.37 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 13 L 8.25 3.61 0.00 1.04 1.48 -0.04 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.70 4.21 0.00 2.80 2.77 0.00 0.00 7.06 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 7.52 3.75 0.00 1.21 0.74 0.00 1.30 0.00 0.00 0.90 0.00 0.00 2.81 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.05 1.26 7.81 16 A 7.70 4.35 1.24 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 0.00 0.00 0.00 17 T 7.50 4.16 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 1.03 0.00 0.00 18 N 7.65 4.35 0.00 2.81 2.93 0.00 0.00 7.19 7.59 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 19 P 0.00 4.43 0.00 2.13 2.18 0.00 3.72 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 2.10 0.00 20 S 9.16 4.41 0.00 4.05 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 21 N 7.89 4.42 0.00 2.98 3.19 0.00 0.00 7.02 7.18 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 22 R 8.79 4.23 0.00 1.88 2.03 0.00 3.27 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 23 Q 7.79 4.88 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 24 E 9.06 3.99 0.00 2.06 1.63 0.00 0.00 0.00 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 2.66 0.00 25 D 8.15 4.90 0.00 2.93 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 W 8.57 4.11 0.00 3.40 3.30 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 27 E 8.11 3.89 0.00 1.89 1.44 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 2.26 2.36 0.00 28 Y 7.51 4.65 0.00 3.14 3.33 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 29 I 7.72 3.64 1.81 0.00 0.00 -0.50 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 1.34 0.62 0.00 0.00 30 I 8.14 3.84 1.90 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.98 0.88 0.00 0.00 31 G 7.79 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 0.00 0.00 0.00 0.00 0.00 0.00 32 F 8.27 3.94 0.00 3.14 3.18 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 0.00 0.00 0.00 33 C 7.64 3.76 0.00 2.97 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 34 D 7.90 4.20 0.00 2.39 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.56 3.90 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 36 I 6.93 3.50 1.70 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.03 0.85 0.00 0.00 37 N 8.02 4.38 0.00 2.80 2.78 0.00 0.00 7.01 7.16 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 38 K 7.16 4.11 0.00 1.89 1.84 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.50 1.58 7.81 39 E 7.91 4.08 0.00 1.98 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 2.53 2.36 0.00 40 L 8.70 3.96 0.00 1.57 1.69 0.90 0.90 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 41 E 7.44 5.43 0.00 2.03 1.90 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 2.39 2.21 0.00 42 G 7.88 3.70 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 0.00 0.00 0.00 43 P 0.00 4.30 0.00 2.10 2.20 0.00 3.52 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.20 0.00 44 Q 7.94 3.92 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 45 I 7.82 3.79 1.96 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.76 0.98 0.00 0.00 46 A 8.47 4.28 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.69 3.29 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.89 0.00 0.00 48 R 7.65 4.04 0.00 2.09 2.04 0.00 3.15 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.83 0.00 49 L 8.22 4.06 0.00 2.05 1.80 1.11 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.57 4.03 0.00 2.04 1.92 1.25 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.70 4.16 1.51 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 52 H 8.08 4.26 0.00 3.24 3.57 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 7.96 3.88 0.00 1.95 1.77 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.64 1.54 7.81 54 I 7.88 3.85 2.15 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.63 0.94 0.00 0.00 55 Q 7.40 4.46 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 56 S 7.20 4.36 0.00 3.71 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.28 0.00 2.09 2.12 0.00 3.72 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 58 Q 7.86 4.24 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 59 E 8.88 3.98 0.00 2.09 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 2.49 2.44 0.00 60 W 8.29 4.80 0.00 3.33 3.05 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 61 E 8.45 3.94 0.00 2.03 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 2.28 2.32 0.00 62 A 7.98 4.11 1.45 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 0.00 0.00 63 L 8.37 3.89 0.00 2.16 1.79 1.00 0.95 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 64 Q 7.60 3.58 0.00 1.80 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 1.31 1.16 0.00 65 A 7.87 3.83 1.33 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 66 L 7.85 4.04 0.00 1.93 1.77 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 67 T 7.95 3.89 4.18 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 0.00 0.00 0.98 0.00 0.00 68 V 7.94 3.50 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 0.86 0.00 0.00 0.68 0.00 0.00 69 L 8.09 4.10 0.00 2.08 2.01 1.23 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.68 4.16 0.00 2.35 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 2.45 2.50 0.00 71 A 8.15 4.14 1.52 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 72 C 8.18 3.68 0.00 2.68 1.18 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 0.00 0.00 0.00 73 M 7.75 4.08 0.00 2.09 2.42 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 3.11 0.00 74 K 7.55 4.31 0.00 1.90 1.87 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.54 7.81 75 N 7.82 4.88 0.00 2.64 2.72 0.00 0.00 6.90 7.69 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 76 C 7.67 5.07 0.00 2.42 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 77 G 7.83 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.58 3.84 0.00 1.86 1.92 0.00 3.17 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 79 R 7.83 3.95 0.00 1.96 2.01 0.00 3.04 0.00 0.00 3.10 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 80 F 8.10 4.18 0.00 3.11 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 81 H 8.09 4.00 0.00 3.25 3.20 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 N 7.85 4.26 0.00 2.61 2.79 0.00 0.00 7.09 7.73 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 83 E 7.86 3.92 0.00 1.60 1.61 0.00 0.00 0.00 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 2.36 0.00 84 V 7.05 3.36 1.52 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 0.25 0.00 0.00 -0.10 0.00 0.00 85 G 7.43 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.09 4.41 0.00 1.73 1.67 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.27 1.51 7.81 87 F 8.26 4.36 0.00 3.11 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 88 R 8.22 3.88 0.00 1.86 2.04 0.00 3.25 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 89 F 7.94 4.61 0.00 3.11 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 90 L 8.24 3.96 0.00 1.93 1.88 0.98 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 91 N 8.87 4.32 0.00 2.69 2.76 0.00 0.00 7.00 8.33 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 92 E 7.59 3.90 0.00 1.77 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 2.40 2.49 0.00 93 L 7.33 4.07 0.00 1.74 1.66 1.20 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.61 3.64 1.90 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 1.53 1.12 0.83 0.00 0.00 95 K 7.93 3.57 0.00 1.77 1.72 0.00 1.52 0.00 0.00 1.43 0.00 0.00 2.66 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.43 1.39 7.81 96 V 7.39 3.62 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 1.00 0.00 0.00 97 V 7.63 4.19 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 0.76 0.00 0.00 0.98 0.00 0.00 98 S 7.78 4.70 0.00 4.08 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 99 P 0.00 4.43 0.00 2.04 2.31 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 100 K 8.11 4.12 0.00 1.66 1.85 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.64 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.55 1.18 7.81 101 Y 8.71 4.55 0.00 3.07 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 0.00 102 L 7.12 4.26 0.00 1.84 1.74 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 7.77 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.08 4.52 0.00 2.68 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 0.00 105 R 8.54 4.53 0.00 1.86 1.93 0.00 3.17 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 106 V 7.38 4.43 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 0.83 0.00 0.00 1.03 0.00 0.00 107 S 8.32 4.43 0.00 4.11 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 E 8.60 3.92 0.00 2.01 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 2.41 2.31 0.00 109 K 8.17 3.83 0.00 1.84 1.87 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.56 7.81 110 V 7.41 3.58 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 1.00 0.00 0.00 0.98 0.00 0.00 111 K 8.03 3.95 0.00 2.01 1.85 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 112 T 8.70 3.87 4.25 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 0.00 0.00 0.00 1.27 0.00 0.00 113 K 8.04 3.92 0.00 2.05 2.03 0.00 1.54 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.50 7.81 114 V 7.78 3.49 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 1.04 0.00 0.00 0.99 0.00 0.00 115 I 7.90 3.74 2.02 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 1.71 0.64 1.01 0.00 0.00 116 E 8.61 3.91 0.00 2.08 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 2.27 2.38 0.00 117 L 7.80 3.42 0.00 1.18 0.24 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 118 L 7.48 3.56 0.00 1.83 1.75 1.01 0.94 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 0.00 119 Y 8.04 3.33 0.00 2.63 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 0.00 120 S 8.05 3.80 0.00 3.74 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 0.00 121 W 8.11 4.40 0.00 3.50 3.05 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 0.00 122 T 7.56 4.10 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 1.15 0.00 0.00 123 M 7.11 4.15 0.00 1.75 1.99 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.21 0.00 124 A 8.01 4.16 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 0.00 125 L 8.14 4.63 0.00 1.75 1.54 0.62 0.88 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 0.00 126 P 0.00 4.39 0.00 2.03 2.12 0.00 3.66 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.23 0.00 127 E 8.11 4.08 0.00 2.05 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 2.24 2.30 0.00 128 E 7.93 4.21 0.00 2.00 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 2.24 2.28 0.00 129 A 8.18 4.06 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 0.00 130 K 7.87 3.92 0.00 1.64 0.76 0.00 1.45 0.00 0.00 0.98 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.09 1.29 7.81 131 I 7.66 3.91 2.04 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 1.19 0.00 0.00 132 K 8.02 4.06 0.00 1.97 1.80 0.00 1.70 0.00 0.00 1.86 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.56 7.81 133 D 8.10 4.45 0.00 3.13 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 0.00 134 A 8.21 4.12 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.25 4.17 0.00 3.23 3.20 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 0.00 0.00 0.00 136 H 8.69 4.14 0.00 3.24 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 M 8.33 3.97 0.00 2.19 2.19 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 2.58 2.74 0.00 138 L 7.54 3.93 0.00 1.73 1.60 1.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 139 K 7.53 4.04 0.00 1.77 1.69 0.00 1.08 0.00 0.00 1.38 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.19 0.75 7.81 140 R 8.24 3.91 0.00 1.83 2.11 0.00 3.24 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 141 Q 7.78 4.36 0.00 2.25 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.87 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 142 G 8.14 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 0.00 143 I 7.89 3.76 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.56 0.95 0.00 0.00 144 V 7.30 4.18 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 1.01 0.00 0.00 0.85 0.00 0.00 145 Q 8.75 4.03 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 146 S 7.42 4.69 0.00 3.86 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 0.00 147 D 8.73 4.14 0.00 2.50 1.74 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 0.00 148 P 0.00 4.64 0.00 2.17 2.01 0.00 2.88 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 149 P 0.00 4.66 0.00 2.23 2.11 0.00 3.71 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 2.01 1.96 0.00 150 I 7.86 4.75 1.89 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.74 1.11 0.00 0.00 151 P 0.00 4.29 0.00 2.08 2.06 0.00 3.69 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 152 V 8.17 3.71 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 0.76 0.00 0.00 0.94 0.00 0.00 153 D 8.35 4.49 0.00 2.66 2.48 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 0.00 0.00 0.00 0.00 154 R 8.57 4.17 0.00 1.83 1.96 0.00 3.24 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 155 T 8.47 4.31 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 0.00 156 L 7.77 4.43 0.00 1.75 1.69 0.87 0.94 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 0.00 157 I 7.75 3.63 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 1.15 0.51 0.90 0.00 0.00