NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0800 8.0544 114.0560 61.7418 32.4016 172.7673 2 H 4.3880 7.7641 117.3781 53.8137 32.2949 168.4264 3 L 3.4169 7.7212 128.3685 54.5470 42.1006 175.0538 4 T 4.1730 8.1794 114.1964 59.6985 71.2561 173.7373 5 P 4.3611 0.0000 0.0000 66.3995 30.6916 178.2325 6 E 3.9030 8.0185 117.1062 58.8256 29.6478 178.6607 7 E 3.8736 7.6620 119.0388 58.9559 29.5844 179.2469 8 K 3.7847 8.8613 119.9154 59.6830 32.0723 179.4679 9 S 4.1138 8.1137 114.1978 61.1942 62.9289 176.2077 10 A 4.1016 7.5347 124.0710 54.3512 18.3651 179.7245 11 V 3.1319 7.7534 116.9898 66.1601 31.5413 178.5657 12 T 3.9806 7.7485 114.7790 66.6989 68.2173 176.9105 13 A 4.1223 7.6541 120.7220 54.7655 18.4633 179.2168 14 L 3.9371 7.6671 116.9764 57.2851 41.4045 179.1606 15 W 4.3607 8.3422 128.4572 60.1192 30.3466 178.2536 16 G 3.7579 7.9487 104.8844 47.9577 0.0000 175.5930 17 K 4.3072 7.6388 120.0094 57.6724 32.2084 178.1311 18 V 3.5414 6.8495 118.8252 62.5725 31.7552 175.7906 19 N 4.3927 8.5379 125.6382 53.7904 38.3357 175.2467 20 V 3.6767 7.9407 127.7745 63.7386 32.0205 177.3631 21 D 4.5016 8.1216 119.0418 56.2249 40.8835 177.0251 22 E 4.5327 8.1101 115.9496 56.1075 30.4629 177.6540 23 V 3.6918 7.7877 119.6133 64.9805 31.9195 177.9734 24 G 4.2829 7.4558 106.5746 47.1517 0.0000 175.4859 25 G 3.6719 7.9134 107.0834 46.9673 0.0000 175.4786 26 E 3.9538 7.6882 121.0555 58.8305 29.7066 178.6125 27 A 4.0291 7.9971 121.0245 54.6405 18.4750 179.2857 28 L 4.0468 8.0002 118.3329 58.0371 42.3293 179.2789 29 G 3.6478 8.0384 105.9139 47.8399 0.0000 176.0762 30 R 3.8559 7.9197 120.7437 58.6933 29.9066 178.9537 31 L 4.1264 7.8205 119.9116 57.9172 41.9659 178.6785 32 L 4.1141 7.9309 119.8123 55.8533 41.4658 178.9999 33 V 3.6814 7.3225 117.0837 65.0549 31.9153 177.4744 34 V 3.6906 7.5913 117.4665 63.7955 32.4898 175.3168 35 Y 3.9989 7.3283 117.0613 54.5758 37.9477 174.1395 36 P 4.5831 0.0000 0.0000 64.0725 31.7018 177.8330 37 W 4.3429 7.8028 115.8689 59.7975 27.4286 178.1672 38 T 4.6223 7.3693 110.1591 64.3432 68.1782 176.1322 39 Q 4.3785 8.5927 121.1419 58.0223 28.4396 178.1694 40 R 3.7208 8.0335 120.2552 59.0788 30.1912 177.0561 41 F 4.3723 7.9898 114.7139 57.3064 39.9330 175.7064 42 F 4.6503 7.9812 118.4502 56.8873 39.9163 177.0039 43 E 4.1153 8.4450 122.1179 59.3141 29.5627 178.7878 44 S 4.4175 8.1321 111.4564 59.8902 63.2765 174.4770 45 F 4.7090 7.8535 118.7080 56.8343 39.7585 174.1853 46 G 3.7807 8.2457 104.9607 43.8192 0.0000 172.0462 47 D 4.5036 8.6582 119.3044 54.4954 40.1341 177.0449 48 L 4.8460 8.4117 128.3989 54.7392 42.7316 177.6428 49 S 4.5870 8.1788 112.7220 58.8602 63.3005 174.1723 50 T 4.7529 7.2675 108.4567 59.0745 73.0303 172.9500 51 P 4.3731 0.0000 0.0000 65.4410 31.3842 178.5363 52 D 4.3256 8.0034 118.9547 57.2336 40.7357 178.0158 53 A 4.1100 7.7081 119.2787 54.3215 18.3716 179.0858 54 V 3.8522 7.3839 115.6237 65.0352 31.9291 177.0561 55 M 4.4891 7.7276 115.7122 55.2048 32.3936 176.5987 56 G 4.1107 7.7385 108.3793 44.8552 0.0000 172.8178 57 N 4.7991 7.9792 117.7871 51.4715 41.2795 172.6560 58 P 4.3630 0.0000 0.0000 64.8879 31.7338 178.8081 59 K 3.7618 8.5422 118.2506 58.8926 31.8860 179.5453 60 V 3.7522 7.6259 118.5187 65.8339 31.3100 177.9915 61 K 4.0956 8.0874 117.9651 59.3798 32.4045 179.0093 62 A 3.9625 7.8512 122.4519 54.8822 18.2603 178.6577 63 H 4.6011 8.2645 116.6466 58.5687 30.2376 177.5241 64 G 3.7185 8.0752 106.7576 46.9664 0.0000 175.3229 65 K 4.0616 7.6404 121.7536 58.7764 32.3580 178.8606 66 K 3.9919 7.3942 116.3011 59.5605 31.7934 179.4068 67 V 3.8412 7.8749 118.1670 65.5580 31.4455 177.7377 68 L 4.4458 8.0068 118.1568 57.0275 41.6025 178.2567 69 G 3.8544 8.3253 105.8039 48.4987 0.0000 175.2576 70 A 3.9668 8.4016 122.7738 54.4376 18.3746 179.7882 71 F 4.1294 8.0670 116.1438 60.6628 38.6718 178.2269 72 S 4.2864 8.5562 115.0185 61.6245 62.4588 176.3093 73 D 4.3817 8.3408 121.0863 57.4888 40.8849 178.9264 74 G 3.6693 8.0818 106.1106 47.5413 0.0000 175.4878 75 L 3.9411 8.4625 122.2365 56.7847 43.0344 176.8883 76 A 4.7307 7.0594 119.8089 50.1351 19.0711 175.4143 77 H 4.6235 7.8990 110.8514 55.0485 32.1489 176.7352 78 L 4.2924 8.2715 118.6940 56.1173 41.7358 177.6924 79 D 4.5108 7.8136 118.3778 55.7765 41.6270 175.6889 80 N 4.8722 7.6125 117.0922 50.0275 39.2650 173.5697 81 L 4.0087 8.1807 124.7068 57.2535 42.0775 177.9249 82 K 4.3023 7.9944 117.0946 58.4832 32.7281 178.7773 83 G 3.7014 8.0524 105.4357 48.3061 0.0000 175.6901 84 T 3.6808 7.3238 117.5320 65.3936 68.6775 175.6860 85 F 4.6288 7.5536 115.8698 57.2005 39.3208 177.4624 86 A 4.0711 7.7120 122.9191 55.6500 18.1551 180.1886 87 T 3.8671 7.8055 113.7002 66.5748 68.5557 176.9281 88 L 4.0442 7.8293 120.5262 57.7606 41.8400 178.9539 89 S 4.2049 8.4849 114.8611 60.8072 62.1376 175.9844 90 E 3.8529 8.0872 121.8523 59.1495 29.4206 178.5174 91 L 3.9349 7.9461 120.4734 57.9803 42.1831 178.0034 92 H 4.6654 8.3481 114.8695 57.5545 29.3775 175.9590 93 C 4.3322 8.3520 121.3144 59.2056 27.9657 174.2988 94 D 5.2142 7.8379 122.1458 53.8301 41.4835 177.7212 95 K 4.5988 7.7452 116.4860 57.1345 38.7320 177.2554 96 L 4.5914 7.8254 115.2752 53.7341 43.4727 175.6561 97 H 4.6417 7.8597 113.9145 55.7877 25.9078 175.2565 98 V 4.1310 8.4805 118.6230 61.1217 32.4887 174.7799 99 D 4.0007 8.6812 127.4042 53.5953 41.4566 175.0156 100 P 2.9700 0.0000 0.0000 65.0047 31.2203 177.6040 101 E 3.9522 7.7946 117.8008 58.4209 29.5408 177.7688 102 N 4.4662 8.1159 116.1427 55.2732 38.6530 177.1357 103 F 4.5493 7.4821 120.2375 60.4625 38.9396 177.8619 104 R 4.0418 7.8936 117.4463 58.9947 29.9347 178.5579 105 L 3.8782 8.0612 118.9970 57.7832 41.6238 179.0475 106 L 4.1021 8.2146 120.1561 58.4403 41.9784 178.8870 107 G 4.0932 7.9992 104.8503 48.5974 0.0000 175.3381 108 N 4.5231 8.9909 119.6052 55.5534 38.4651 177.9772 109 V 3.7540 8.2125 114.3241 63.8262 31.6891 178.2807 110 L 3.8593 8.4943 120.8554 57.9487 41.7858 179.1355 111 V 3.5563 7.7545 118.3960 65.7028 31.4269 177.8254 112 C 4.0344 8.1208 116.8248 62.8073 27.7755 176.1956 113 V 3.4486 7.6868 118.7195 65.8185 31.2896 177.8450 114 L 3.9893 7.6999 118.3880 57.7164 41.3108 179.0987 115 A 3.6567 7.2688 120.7543 55.5422 18.0030 179.1625 116 H 4.2229 8.1516 115.3626 58.9936 29.9616 176.4151 117 H 4.3193 7.9821 116.8102 56.6340 29.3851 176.3120 118 F 4.7740 8.0838 117.3083 54.4389 40.2069 178.7620 119 G 3.9423 8.4319 107.1509 46.4601 0.0000 177.2164 120 K 4.1186 9.1708 124.6243 58.6860 32.2612 177.5334 121 E 4.2235 8.2910 117.1634 57.7435 29.7146 177.4776 122 F 4.5703 7.9759 123.4425 56.9292 37.9252 175.5706 123 T 4.2689 7.3663 115.8694 59.9620 71.3807 173.6452 124 P 4.1837 0.0000 0.0000 65.5095 31.2227 177.2787 125 P 4.1942 0.0000 0.0000 65.0272 31.2409 178.4908 126 V 3.6654 7.0838 115.7370 64.9834 31.5758 177.7904 127 Q 3.6963 7.8906 119.6460 59.0216 28.9991 177.8883 128 A 4.0151 8.2859 121.9087 55.3796 17.9823 179.5266 129 A 3.9502 7.6795 119.0546 55.4134 18.3909 179.4519 130 Y 3.8595 7.9151 115.0660 60.9102 37.9550 178.3168 131 Q 4.1306 8.3387 119.4117 58.8119 28.6789 178.6876 132 K 4.0898 7.7790 118.8001 58.9848 31.9387 179.5548 133 V 3.7108 7.2663 118.8687 65.6199 31.5914 178.4838 134 V 3.8833 8.2539 118.9750 64.8066 31.2456 178.0992 135 A 4.1680 8.2244 121.6479 55.0322 18.2293 179.8679 136 G 3.5588 7.7995 104.2767 47.6153 0.0000 176.3606 137 V 3.2442 7.9444 120.4965 65.6916 31.4014 178.0865 138 A 3.9177 8.3936 120.8913 55.1156 17.9606 179.2370 139 N 4.4335 8.1308 113.9238 55.7770 38.7508 177.2029 140 A 4.1300 7.5880 122.5651 54.9300 18.6733 179.6584 141 L 3.7628 7.3977 116.9722 57.1303 41.2229 178.4178 142 A 5.1680 7.3225 118.8198 52.7260 18.9312 177.9075 143 H 4.2165 7.8740 118.4944 57.7611 30.0754 175.2744 144 K 4.4400 7.5132 120.6588 57.3478 32.4421 176.0934 145 Y 4.5719 8.1204 113.2087 57.6616 38.7451 175.7428 146 H 4.5496 8.1776 122.4222 55.8640 29.0969 174.4891 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 1 V 8.05 4.08 2.07 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 0.95 0.00 0.00 0.96 0.00 0.00 2 H 7.76 4.39 0.00 3.10 3.11 0.00 5.90 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.72 3.42 0.00 1.78 1.60 0.78 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.18 4.17 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 5 P 0.00 4.36 0.00 2.24 2.36 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 6 E 8.02 3.90 0.00 2.17 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 0.00 2.31 2.34 0.00 7 E 7.66 3.87 0.00 2.31 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 0.00 2.25 2.28 0.00 8 K 8.86 3.78 0.00 1.78 1.84 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.56 7.81 9 S 8.11 4.11 0.00 4.01 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 10 A 7.53 4.10 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 11 V 7.75 3.13 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 0.69 0.00 0.00 0.28 0.00 0.00 12 T 7.75 3.98 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 13 A 7.65 4.12 1.41 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 14 L 7.67 3.94 0.00 2.07 1.65 1.05 -0.31 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 15 W 8.34 4.36 0.00 3.69 3.17 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 16 G 7.95 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.64 4.31 0.00 2.22 2.28 0.00 2.04 0.00 0.00 1.87 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.58 1.68 7.81 18 V 6.85 3.54 1.73 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 0.10 0.00 0.00 1.05 0.00 0.00 19 N 8.54 4.39 0.00 2.70 2.63 0.00 0.00 6.96 7.71 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 20 V 7.94 3.68 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.92 0.00 0.00 21 D 8.12 4.50 0.00 2.78 2.73 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 22 E 8.11 4.53 0.00 1.90 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 2.18 2.47 0.00 23 V 7.79 3.69 1.94 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 0.83 0.00 0.00 0.85 0.00 0.00 24 G 7.46 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 25 G 7.91 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 7.69 3.95 0.00 2.27 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 2.29 2.49 0.00 27 A 8.00 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.00 4.05 0.00 1.82 1.65 0.46 0.97 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 29 G 8.04 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 30 R 7.92 3.86 0.00 1.98 1.92 0.00 3.19 0.00 0.00 2.99 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 31 L 7.82 4.13 0.00 1.99 1.86 1.11 0.57 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 32 L 7.93 4.11 0.00 1.67 1.68 0.67 0.49 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 33 V 7.32 3.68 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 0.75 0.00 0.00 0.87 0.00 0.00 34 V 7.59 3.69 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 -0.23 0.00 0.00 0.74 0.00 0.00 35 Y 7.33 4.00 0.00 2.63 1.43 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 0.00 36 P 0.00 4.58 0.00 2.22 2.09 0.00 3.84 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 2.14 1.92 0.00 37 W 7.80 4.34 0.00 3.62 3.55 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.37 4.62 4.42 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 0.00 0.00 0.00 1.09 0.00 0.00 39 Q 8.59 4.38 0.00 2.27 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.61 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 40 R 8.03 3.72 0.00 1.84 1.12 0.00 2.95 0.00 0.00 2.68 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.59 0.00 41 F 7.99 4.37 0.00 2.68 2.24 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 42 F 7.98 4.65 0.00 2.91 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 0.00 0.00 0.00 0.00 43 E 8.44 4.12 0.00 1.95 2.03 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 2.32 2.45 0.00 44 S 8.13 4.42 0.00 4.11 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 45 F 7.85 4.71 0.00 3.36 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 46 G 8.25 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 0.00 0.00 0.00 47 D 8.66 4.50 0.00 2.67 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 48 L 8.41 4.85 0.00 1.74 1.62 1.06 0.89 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 49 S 8.18 4.59 0.00 3.86 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 50 T 7.27 4.75 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 51 P 0.00 4.37 0.00 2.25 2.30 0.00 3.67 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 2.04 2.02 0.00 52 D 8.00 4.33 0.00 2.70 2.73 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 53 A 7.71 4.11 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.38 3.85 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 0.89 0.00 0.00 0.99 0.00 0.00 55 M 7.73 4.49 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.76 0.00 56 G 7.74 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 57 N 7.98 4.80 0.00 3.00 2.81 0.00 0.00 7.09 7.71 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 58 P 0.00 4.36 0.00 2.13 2.02 0.00 3.58 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 59 K 8.54 3.76 0.00 1.27 0.74 0.00 1.17 0.00 0.00 1.19 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.21 1.19 7.81 60 V 7.63 3.75 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 1.07 0.00 0.00 1.09 0.00 0.00 61 K 8.09 4.10 0.00 2.03 2.02 0.00 1.33 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.57 1.54 7.81 62 A 7.85 3.96 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 63 H 8.26 4.60 0.00 3.67 3.55 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.08 3.72 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 0.00 0.00 0.00 65 K 7.64 4.06 0.00 1.71 1.82 0.00 1.81 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.49 7.81 66 K 7.39 3.99 0.00 2.10 1.87 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.66 7.81 67 V 7.87 3.84 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 1.25 0.00 0.00 0.99 0.00 0.00 68 L 8.01 4.45 0.00 1.82 1.87 0.79 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.33 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.40 3.97 1.48 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 0.00 0.00 71 F 8.07 4.13 0.00 3.71 3.25 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 0.00 72 S 8.56 4.29 0.00 4.19 4.22 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 0.00 0.00 0.00 73 D 8.34 4.38 0.00 2.55 2.45 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 74 G 8.08 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.46 3.94 0.00 1.42 1.39 0.64 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.06 4.73 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 77 H 7.90 4.62 0.00 3.46 3.12 0.00 5.62 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.27 4.29 0.00 1.61 1.70 0.86 1.06 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 79 D 7.81 4.51 0.00 2.64 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 80 N 7.61 4.87 0.00 2.76 2.58 0.00 0.00 6.85 6.66 0.00 0.00 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 L 8.18 4.01 0.00 1.81 1.70 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 82 K 7.99 4.30 0.00 1.92 1.75 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.27 1.48 7.81 83 G 8.05 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 84 T 7.32 3.68 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 85 F 7.55 4.63 0.00 3.31 2.85 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 0.00 0.00 0.00 0.00 86 A 7.71 4.07 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.81 3.87 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 88 L 7.83 4.04 0.00 2.08 1.84 1.07 0.93 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 89 S 8.48 4.20 0.00 3.84 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.09 3.85 0.00 2.30 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 2.27 2.41 0.00 91 L 7.95 3.93 0.00 1.80 1.88 0.88 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.35 4.67 0.00 3.37 3.55 0.00 5.85 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.35 4.33 0.00 2.73 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 7.84 5.21 0.00 2.55 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 95 K 7.75 4.60 0.00 1.81 1.71 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.37 7.81 96 L 7.83 4.59 0.00 1.67 1.79 0.81 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.86 4.64 0.00 3.47 3.49 0.00 5.74 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.48 4.13 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.31 0.00 0.00 99 D 8.68 4.00 0.00 2.70 2.41 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 0.00 100 P 0.00 2.97 0.00 1.89 2.05 0.00 3.14 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.25 0.00 101 E 7.79 3.95 0.00 1.90 1.94 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 2.23 2.33 0.00 102 N 8.12 4.47 0.00 2.80 2.88 0.00 0.00 6.85 8.96 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 0.00 103 F 7.48 4.55 0.00 3.09 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 0.00 104 R 7.89 4.04 0.00 1.96 2.00 0.00 3.15 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 1.77 1.79 0.00 105 L 8.06 3.88 0.00 1.71 1.21 0.52 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.21 4.10 0.00 2.02 1.85 1.00 1.20 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 0.00 107 G 8.00 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 0.00 108 N 8.99 4.52 0.00 3.02 2.96 0.00 0.00 7.16 7.78 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 0.00 109 V 8.21 3.75 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 1.05 0.00 0.00 1.04 0.00 0.00 110 L 8.49 3.86 0.00 1.74 1.66 0.31 0.83 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 0.00 111 V 7.75 3.56 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 1.38 0.00 0.00 1.11 0.00 0.00 112 C 8.12 4.03 0.00 3.11 2.91 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 0.00 0.00 0.00 0.00 113 V 7.69 3.45 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 0.60 0.00 0.00 0.90 0.00 0.00 114 L 7.70 3.99 0.00 1.12 1.14 0.53 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.27 3.66 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 0.00 116 H 8.15 4.22 0.00 3.20 3.50 0.00 5.76 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.98 4.32 0.00 2.75 2.65 0.00 5.69 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.08 4.77 0.00 3.34 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 0.00 119 G 8.43 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 0.00 120 K 9.17 4.12 0.00 1.81 1.94 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.51 7.81 121 E 8.29 4.22 0.00 2.35 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 2.41 2.34 0.00 122 F 7.98 4.57 0.00 3.04 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 0.00 123 T 7.37 4.27 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 1.28 0.00 0.00 124 P 0.00 4.18 0.00 2.16 2.15 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.19 0.00 2.09 2.05 0.00 3.46 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 126 V 7.08 3.67 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 1.00 0.00 0.00 0.84 0.00 0.00 127 Q 7.89 3.70 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 128 A 8.29 4.02 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 0.00 129 A 7.68 3.95 1.22 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 0.00 0.00 0.00 0.00 0.00 130 Y 7.92 3.86 0.00 3.50 3.19 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 0.00 0.00 0.00 131 Q 8.34 4.13 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.74 2.61 0.00 132 K 7.78 4.09 0.00 2.05 1.86 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.74 7.81 133 V 7.27 3.71 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 1.12 0.00 0.00 0.81 0.00 0.00 134 V 8.25 3.88 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 0.98 0.00 0.00 1.13 0.00 0.00 135 A 8.22 4.17 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 0.00 136 G 7.80 3.56 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 0.00 0.00 0.00 137 V 7.94 3.24 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 -0.09 0.00 0.00 0.96 0.00 0.00 138 A 8.39 3.92 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 0.00 139 N 8.13 4.43 0.00 2.96 2.91 0.00 0.00 7.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.59 4.13 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 0.00 141 L 7.40 3.76 0.00 1.06 0.81 -0.02 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.32 5.17 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 0.00 143 H 7.87 4.22 0.00 3.30 3.35 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.51 4.44 0.00 1.67 1.64 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.49 7.81 145 Y 8.12 4.57 0.00 3.43 2.92 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 0.00 146 H 8.18 4.55 0.00 3.01 3.17 0.00 5.93 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00