NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9291 8.3549 109.7367 44.1985 0.0000 173.2352 2 P 4.2751 0.0000 0.0000 62.9407 31.5333 175.4348 3 L 4.7199 8.5228 119.6196 53.1470 44.8943 174.9931 4 G 4.0414 7.2682 108.8019 44.6044 0.0000 175.1008 5 S 4.7568 8.1810 121.4236 55.5322 66.5125 171.7574 6 P 4.5004 0.0000 0.0000 62.8483 31.1992 174.8520 7 L 4.7688 7.6966 121.2184 54.6652 47.4884 175.2977 8 I 5.1776 7.2151 119.9141 58.4991 40.2522 175.3763 9 G 4.4311 7.6512 115.2074 46.6191 0.0000 174.3879 10 E 4.8262 8.8302 122.4983 54.5386 31.0145 174.0877 11 I 4.2985 8.2472 125.4465 60.7278 38.3349 175.4518 12 G 4.5794 9.3959 115.9068 44.2034 0.0000 171.1999 13 P 4.4298 0.0000 0.0000 64.8880 31.6571 176.6956 14 E 4.4582 8.1464 114.6754 56.4173 30.3038 176.7047 15 T 3.9071 7.4360 110.5885 63.1915 69.9577 175.9918 16 Y 3.9161 7.7086 119.8668 61.3176 37.9926 178.7936 17 S 4.2588 8.1301 112.9532 60.9698 62.6352 175.4360 18 D 4.2714 7.6797 120.7441 57.3332 40.8445 177.3668 19 Y 4.4727 7.6710 116.2896 60.4476 38.0101 177.0052 20 M 4.2680 7.8194 118.6449 57.7374 32.6225 177.3064 21 S 4.4302 8.2879 111.4730 59.3951 62.8293 175.3660 22 A 4.2248 7.7198 122.9521 53.7396 18.1094 178.3931 23 G 3.9998 8.8388 103.6892 45.1149 0.0000 172.6605 24 I 4.8154 7.2670 110.6475 57.7348 40.9396 173.1202 25 P 4.5437 0.0000 0.0000 63.6031 32.7103 174.5526 26 L 4.4664 9.7557 126.3845 53.5522 44.0961 175.1852 27 A 4.7539 8.5847 129.6053 50.6986 19.2673 174.8961 28 Y 4.1152 8.6895 119.3795 58.2908 39.8628 175.1294 29 I 4.5831 8.1715 123.5443 59.1441 38.8400 174.4812 30 F 5.0615 9.7602 124.8477 57.0278 40.8614 174.4406 31 A 4.8259 8.2761 120.9828 51.5961 21.8547 177.1238 32 E 4.1036 9.2818 122.6987 58.0218 30.5277 176.6046 33 T 4.5292 7.7667 109.9640 60.3110 68.3663 174.1094 34 A 4.7301 8.4213 128.8903 52.1599 19.2077 176.7866 35 E 4.4022 8.2135 118.8511 58.3761 31.0834 177.0921 36 E 4.5187 7.9639 114.9898 56.3729 29.9246 177.2822 37 R 3.8777 7.3856 120.9964 60.0739 29.8417 178.2573 38 K 3.9437 8.1046 118.0517 60.1923 32.5768 178.3995 39 E 3.9524 8.7996 120.0059 59.2311 29.4210 179.1769 40 L 4.0306 7.8526 117.8509 58.3242 41.7638 179.8958 41 S 4.3319 8.1989 113.5919 61.4342 62.8632 176.1538 42 D 4.3852 8.2481 121.4365 57.2303 40.8586 178.1178 43 K 3.4087 8.0705 118.5326 59.6867 32.1310 179.1424 44 L 4.1477 8.1002 118.8530 56.8422 41.5993 178.9190 45 K 3.7034 8.7021 121.5848 59.0735 32.1083 176.7750 46 P 4.2319 0.0000 0.0000 65.6205 31.4947 178.0199 47 I 3.7605 7.3310 118.2338 63.4201 37.2735 176.9722 48 A 4.3148 7.2857 120.0472 52.4368 20.1631 177.9359 49 E 3.8818 7.7907 116.6916 58.6961 29.6495 178.0367 50 A 4.4265 7.7237 119.6163 52.7495 19.7836 177.1300 51 Q 4.7042 7.9645 116.3802 55.7193 29.1310 178.1603 52 R 3.8752 8.3416 117.0473 59.5142 29.9818 177.3216 53 G 4.1280 8.0630 104.7206 44.8815 0.0000 173.7125 54 V 4.4673 7.6462 118.7635 61.3649 33.7531 175.9717 55 I 4.9050 8.1560 120.3725 59.5197 41.1064 175.7335 56 N 4.4380 9.3792 124.4582 51.9832 38.9680 173.9623 57 F 4.3172 8.5559 123.6352 56.8210 40.3700 174.9565 58 G 4.2354 8.6564 111.9587 44.3882 0.0000 171.3645 59 T 4.7668 9.1642 116.1483 61.3402 70.9033 173.6087 60 I 4.6835 8.5719 122.8012 59.4947 42.6411 172.9190 61 D 5.1190 8.5170 124.9801 53.5121 42.1461 176.1373 62 A 4.5672 8.6578 126.8131 52.5725 18.9885 178.3495 63 K 4.2199 8.4011 116.0236 55.9707 33.4098 176.8637 64 A 4.5111 8.3310 120.1114 52.3306 20.7232 176.7149 65 F 4.6881 8.3227 116.6530 58.8714 40.6106 178.3651 66 G 4.2293 8.3978 108.7943 49.4001 0.0000 175.4801 67 A 3.5330 8.4413 122.8817 55.1858 18.3907 178.5410 68 H 4.2680 10.1577 110.9620 57.1914 29.4206 176.7133 69 A 2.5800 8.6337 123.9460 53.9018 18.0848 178.5862 70 G 4.4350 7.4894 101.3238 44.8094 0.0000 174.7199 71 N 4.3631 7.3899 117.5833 54.8202 38.5543 175.4226 72 L 4.4863 7.1057 116.1508 55.4404 41.7499 175.1059 73 N 3.9584 7.6605 125.2541 53.4864 44.5506 175.2266 74 L 3.8906 6.9605 116.7735 54.7230 42.5420 177.7570 75 K 4.4853 8.1588 115.5574 56.0182 33.0701 175.9656 76 T 3.5690 7.7446 107.9591 62.9604 67.3571 172.9339 77 D 4.3782 7.9433 123.0646 56.3396 40.1187 175.7664 78 K 4.0319 6.6121 117.5982 54.9698 35.2401 173.9305 79 F 4.9510 7.9206 119.7696 55.5538 42.8840 172.2636 80 P 4.6976 0.0000 0.0000 63.2900 31.7060 174.8978 81 A 5.0640 9.1520 120.4799 50.2688 23.2531 174.7488 82 F 5.1988 8.7027 119.6638 56.5946 42.9966 173.1149 83 A 4.9975 8.9716 127.5778 50.3671 22.4625 174.9994 84 I 4.8808 7.9439 120.4486 59.3719 38.4527 172.9610 85 Q 4.6559 9.2162 127.7188 55.4372 30.6621 173.8970 86 E 5.1589 9.7967 127.9040 55.2531 30.8304 177.1420 87 V 4.1421 8.7479 117.1545 61.7279 32.1499 176.4510 88 A 4.5251 8.0629 123.1024 52.9645 20.1379 177.9361 89 K 4.3796 8.0167 113.3581 55.5468 33.8424 175.2714 90 N 4.4124 8.3812 115.6908 54.7977 37.4497 173.4534 91 Q 4.2763 7.8365 116.4850 54.5479 31.7702 174.5391 92 K 4.4329 7.5114 120.5174 54.9558 33.0933 176.3677 93 F 4.8827 8.7908 127.7619 55.5064 37.7899 173.8336 94 P 5.0129 0.0000 0.0000 62.3627 33.6883 175.5731 95 F 4.1460 9.2139 123.2198 56.2652 41.5742 175.1947 96 D 4.5034 6.5232 120.7940 54.1911 41.2382 176.3251 97 Q 4.7492 8.1732 118.3340 55.3964 29.3859 176.9976 98 E 4.6036 7.9839 112.3915 56.8180 29.6616 174.7253 99 K 4.2889 8.7117 117.5151 55.9080 34.6632 174.8274 100 E 5.8196 7.6456 130.7935 56.3892 31.8649 177.3714 101 I 3.9610 8.0091 129.1118 59.7546 36.9697 175.2366 102 T 4.8213 7.4992 118.4672 60.3361 70.3016 173.4477 103 F 4.5292 8.1749 118.8639 59.7448 39.5546 177.7871 104 E 2.6062 7.8022 117.9989 59.3412 29.7703 179.5155 105 A 4.0485 7.7499 120.0977 54.6557 18.6082 179.3475 106 I 3.4472 6.8965 117.4748 63.6235 37.5482 178.3267 107 K 3.8285 8.3973 120.4502 60.0934 32.0730 178.9745 108 A 3.8469 7.6609 121.8791 55.0501 18.3479 178.6665 109 F 4.5858 8.0470 119.9035 61.2283 39.3354 177.3237 110 V 4.0893 9.0393 111.7572 65.0112 31.6309 178.1441 111 D 4.3345 8.1474 117.6549 57.4150 41.0775 177.8926 112 D 4.3656 8.3945 118.9660 55.3226 39.5418 178.0212 113 F 3.9372 7.8626 123.2166 60.9437 39.3120 177.1423 114 V 2.4266 7.4006 117.1192 65.6686 31.3677 177.4478 115 A 4.0626 7.4860 119.1220 55.2578 18.1771 177.8317 116 G 3.9713 6.9246 105.4630 46.0155 0.0000 174.7987 117 K 4.1685 8.4985 123.4015 57.1337 33.2843 176.9558 118 I 4.0702 7.0565 117.5323 60.7149 37.9888 174.2894 119 E 5.0837 8.2422 121.0536 54.1132 33.7480 173.2025 120 P 4.3167 0.0000 0.0000 63.6335 31.8637 176.1195 121 S 4.6358 8.7477 115.2052 59.1203 63.9482 174.8622 122 I 4.3050 7.4849 110.0228 61.1195 39.3143 175.1252 123 K 3.5721 7.8172 120.5826 57.0129 32.0302 171.6830 124 S 3.8310 9.4415 120.0751 58.0862 59.8275 168.8181 125 E 4.5454 8.0632 128.0977 54.2683 30.0649 172.7862 126 P 4.5470 0.0000 0.0000 61.9988 32.5560 177.3236 127 I 4.3312 7.7570 120.5761 58.4135 37.1572 175.5821 128 P 4.4438 0.0000 0.0000 62.9673 31.1781 175.1435 129 E 3.8113 8.6876 119.9506 55.8098 28.6314 175.2129 130 K 3.8077 8.7012 115.2897 59.9867 32.3145 176.7813 131 Q 4.2631 7.4728 116.8686 55.0519 29.9359 174.2599 132 E 3.5659 9.1895 123.9931 55.8298 30.0725 174.6071 133 G 4.2941 8.5637 108.6108 46.1144 0.0000 173.6225 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 G 8.35 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 2 P 0.00 4.28 0.00 2.13 2.02 0.00 3.67 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 2.03 2.17 0.00 3 L 8.52 4.72 0.00 1.56 1.60 0.96 0.92 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 4 G 7.27 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 0.00 0.00 0.00 0.00 5 S 8.18 4.76 0.00 3.83 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 6 P 0.00 4.50 0.00 2.21 2.08 0.00 3.75 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 7 L 7.70 4.77 0.00 1.64 1.59 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.22 5.18 1.88 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 1.43 0.09 1.05 0.00 0.00 9 G 7.65 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 0.00 0.00 0.00 0.00 10 E 8.83 4.83 0.00 1.89 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 2.25 2.34 0.00 11 I 8.25 4.30 1.87 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.46 1.02 0.00 0.00 12 G 9.40 4.58 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 0.00 0.00 0.00 13 P 0.00 4.43 0.00 2.20 2.20 0.00 3.80 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 14 E 8.15 4.46 0.00 2.06 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 2.19 2.19 0.00 15 T 7.44 3.91 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 1.19 0.00 0.00 16 Y 7.71 3.92 0.00 3.05 3.14 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 17 S 8.13 4.26 0.00 3.94 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 18 D 7.68 4.27 0.00 2.68 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 0.00 0.00 0.00 0.00 19 Y 7.67 4.47 0.00 2.84 2.76 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 20 M 7.82 4.27 0.00 2.09 2.38 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 2.67 2.67 0.00 21 S 8.29 4.43 0.00 4.01 3.86 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 22 A 7.72 4.22 1.49 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 0.00 0.00 0.00 23 G 8.84 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 0.00 0.00 0.00 24 I 7.27 4.82 2.17 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.88 0.97 0.00 0.00 25 P 0.00 4.54 0.00 2.36 2.46 0.00 3.92 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 2.30 2.36 0.00 26 L 9.76 4.47 0.00 1.52 1.42 0.74 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.58 4.75 0.73 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 0.00 0.00 28 Y 8.69 4.12 0.00 2.86 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 29 I 8.17 4.58 1.72 0.00 0.00 0.38 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 -0.36 1.02 0.00 0.00 30 F 9.76 5.06 0.00 3.18 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 31 A 8.28 4.83 1.28 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 32 E 9.28 4.10 0.00 2.14 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 0.00 2.08 1.75 0.00 33 T 7.77 4.53 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 1.34 0.00 0.00 34 A 8.42 4.73 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 35 E 8.21 4.40 0.00 1.93 1.97 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 2.21 2.22 0.00 36 E 7.96 4.52 0.00 2.25 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 0.00 2.33 2.38 0.00 37 R 7.39 3.88 0.00 1.97 2.04 0.00 3.12 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 38 K 8.10 3.94 0.00 2.02 2.07 0.00 1.58 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.55 7.81 39 E 8.80 3.95 0.00 2.20 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 2.35 2.38 0.00 40 L 7.85 4.03 0.00 1.73 1.81 0.97 1.01 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 41 S 8.20 4.33 0.00 3.90 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 42 D 8.25 4.39 0.00 2.80 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 43 K 8.07 3.41 0.00 2.15 2.15 0.00 1.63 0.00 0.00 1.86 0.00 0.00 3.18 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.68 7.81 44 L 8.10 4.15 0.00 1.99 1.99 1.28 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.70 3.70 0.00 1.82 1.72 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.40 7.81 46 P 0.00 4.23 0.00 2.37 2.00 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 1.32 0.00 47 I 7.33 3.76 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.02 1.14 0.00 0.00 48 A 7.29 4.31 0.43 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 0.00 0.00 49 E 7.79 3.88 0.00 2.17 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 2.27 2.41 0.00 50 A 7.72 4.43 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 51 Q 7.96 4.70 0.00 2.32 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.94 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 52 R 8.34 3.88 0.00 1.93 2.20 0.00 2.99 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 53 G 8.06 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.65 4.47 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 0.85 0.00 0.00 0.94 0.00 0.00 55 I 8.16 4.90 2.20 0.00 0.00 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 1.49 0.80 1.15 0.00 0.00 56 N 9.38 4.44 0.00 1.92 1.63 0.00 0.00 6.93 8.68 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 57 F 8.56 4.32 0.00 2.96 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 58 G 8.66 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 0.00 0.00 0.00 0.00 59 T 9.16 4.77 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 1.24 0.00 0.00 60 I 8.57 4.68 1.39 0.00 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.97 -0.53 0.00 0.00 61 D 8.52 5.12 0.00 2.86 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 62 A 8.66 4.57 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 K 8.40 4.22 0.00 1.61 2.10 0.00 1.43 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.31 7.81 64 A 8.33 4.51 1.21 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 65 F 8.32 4.69 0.00 3.03 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 66 G 8.40 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 8.44 3.53 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 0.00 0.00 68 H 10.16 4.27 0.00 3.77 3.60 0.00 5.86 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.63 2.58 0.16 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 0.00 0.00 70 G 7.49 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 71 N 7.39 4.36 0.00 2.61 2.81 0.00 0.00 6.77 7.63 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 72 L 7.11 4.49 0.00 1.59 1.66 0.82 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 73 N 7.66 3.96 0.00 2.55 2.64 0.00 0.00 7.05 8.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 6.96 3.89 0.00 1.69 1.53 0.82 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.16 4.49 0.00 1.77 1.80 0.00 1.67 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.32 7.81 76 T 7.74 3.57 4.56 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 1.31 0.00 0.00 77 D 7.94 4.38 0.00 2.69 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 78 K 6.61 4.03 0.00 1.48 1.47 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.24 1.37 7.81 79 F 7.92 4.95 0.00 3.05 3.02 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 0.00 80 P 0.00 4.70 0.00 2.34 2.18 0.00 3.81 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 2.09 2.07 0.00 81 A 9.15 5.06 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 82 F 8.70 5.20 0.00 3.05 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 83 A 8.97 5.00 1.19 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 0.00 0.00 84 I 7.94 4.88 1.78 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.08 0.16 0.00 0.00 85 Q 9.22 4.66 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 86 E 9.80 5.16 0.00 2.11 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 2.93 2.82 0.00 87 V 8.75 4.14 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 0.92 0.00 0.00 1.03 0.00 0.00 88 A 8.06 4.53 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 89 K 8.02 4.38 0.00 1.79 1.92 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.50 7.81 90 N 8.38 4.41 0.00 2.93 2.96 0.00 0.00 7.06 6.83 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 91 Q 7.84 4.28 0.00 2.22 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.47 6.57 0.00 0.00 0.00 0.00 0.00 2.40 1.73 0.00 92 K 7.51 4.43 0.00 1.53 1.56 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.18 1.43 7.81 93 F 8.79 4.88 0.00 2.62 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 94 P 0.00 5.01 0.00 2.10 2.10 0.00 3.78 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 95 F 9.21 4.15 0.00 2.49 2.87 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 96 D 6.52 4.50 0.00 2.22 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 97 Q 8.17 4.75 0.00 1.85 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 7.29 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 98 E 7.98 4.60 0.00 2.00 1.91 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 2.12 2.23 0.00 99 K 8.71 4.29 0.00 1.58 1.80 0.00 2.03 0.00 0.00 1.64 0.00 0.00 2.31 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.32 1.32 7.81 100 E 7.65 5.82 0.00 2.15 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 0.00 2.11 2.10 0.00 101 I 8.01 3.96 1.89 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.87 0.86 0.00 0.00 102 T 7.50 4.82 4.29 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 1.31 0.00 0.00 103 F 8.17 4.53 0.00 3.11 2.95 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 0.00 104 E 7.80 2.61 0.00 1.96 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 2.09 2.36 0.00 105 A 7.75 4.05 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 0.00 106 I 6.90 3.45 1.71 0.00 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.37 0.26 0.00 0.00 107 K 8.40 3.83 0.00 1.79 1.90 0.00 0.96 0.00 0.00 1.35 0.00 0.00 2.13 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.30 1.05 7.81 108 A 7.66 3.85 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 0.00 109 F 8.05 4.59 0.00 3.55 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 0.00 110 V 9.04 4.09 2.46 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 0.81 0.00 0.00 1.16 0.00 0.00 111 D 8.15 4.33 0.00 3.09 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 0.00 112 D 8.39 4.37 0.00 2.74 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 0.00 113 F 7.86 3.94 0.00 2.90 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 0.00 114 V 7.40 2.43 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 0.57 0.00 0.00 0.57 0.00 0.00 115 A 7.49 4.06 1.28 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 0.00 116 G 6.92 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 0.00 117 K 8.50 4.17 0.00 1.62 1.92 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.31 7.81 118 I 7.06 4.07 1.58 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.55 0.83 0.00 0.00 119 E 8.24 5.08 0.00 1.95 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 2.35 2.36 0.00 120 P 0.00 4.32 0.00 2.07 1.99 0.00 3.79 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 2.11 2.14 0.00 121 S 8.75 4.64 0.00 3.84 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 0.00 122 I 7.48 4.31 1.84 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 1.27 0.92 0.89 0.00 0.00 123 K 7.82 3.57 0.00 1.63 1.77 0.00 1.73 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.47 7.81 124 S 9.44 3.83 0.00 4.06 3.96 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 0.00 125 E 8.06 4.55 0.00 1.90 1.78 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 2.18 2.29 0.00 126 P 0.00 4.55 0.00 2.22 2.03 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 127 I 7.76 4.33 1.87 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 0.93 0.91 0.00 0.00 128 P 0.00 4.44 0.00 2.03 2.04 0.00 3.73 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 2.08 0.00 129 E 8.69 3.81 0.00 2.19 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 2.24 2.28 0.00 130 K 8.70 3.81 0.00 1.90 1.97 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.50 7.81 131 Q 7.47 4.26 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.14 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 132 E 9.19 3.57 0.00 2.16 1.91 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 2.19 2.35 0.00 133 G 8.56 4.29 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 0.00