NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9591 8.0544 120.3931 62.8835 32.5805 174.1873 2 H 4.6065 8.8300 126.8083 53.8895 31.1591 171.2187 3 L 4.8067 7.8818 127.1682 52.8240 45.0537 176.8505 4 T 4.1780 9.0012 114.0640 60.5488 71.1235 174.1140 5 P 4.3110 0.0000 0.0000 65.7405 31.2668 178.8857 6 E 4.0089 8.0564 117.0892 59.1112 29.3491 179.0415 7 E 3.8363 7.9450 118.3810 59.2790 29.5514 179.0304 8 K 3.7606 8.3185 120.2978 59.5635 32.1932 178.8038 9 S 4.0645 8.0875 114.0981 61.5142 62.9219 176.4149 10 A 3.9866 7.9066 124.6379 54.4997 18.1309 179.6984 11 V 3.5955 8.0149 117.3586 66.4853 31.4524 178.4615 12 T 4.0225 8.1661 109.4227 64.6982 68.4078 176.4389 13 A 4.0265 7.9613 122.9002 54.8197 18.6941 179.0737 14 L 3.8388 8.0941 118.9564 57.9610 42.1801 178.9055 15 W 4.3703 8.6371 128.5554 60.4615 30.4194 177.8323 16 G 3.8213 8.0120 104.0896 46.3813 0.0000 174.6904 17 K 4.4105 7.6225 118.9962 55.5364 33.0065 176.8459 18 V 3.6242 6.9084 120.0562 62.4254 32.0593 175.6586 19 N 4.5621 8.4110 125.2776 52.4612 38.9196 175.8389 20 V 3.5327 8.1214 122.7427 64.6145 31.5833 178.1476 21 D 4.2245 8.1312 116.8853 56.3194 40.8796 177.0717 22 E 4.4057 7.3868 117.8596 57.9110 30.9661 178.0271 23 V 3.6294 7.8500 118.3138 65.8149 31.3730 178.2437 24 G 3.6947 8.0565 105.3467 47.6151 0.0000 175.8300 25 G 3.5759 7.9928 107.7999 47.4120 0.0000 175.1778 26 E 3.8728 8.0097 121.2011 58.8769 29.6477 178.8809 27 A 3.8993 8.1819 120.9123 55.1374 18.6619 179.3402 28 L 4.0050 8.2153 119.2815 58.2222 42.2301 179.4615 29 G 3.5437 8.4230 106.0490 47.9378 0.0000 175.9933 30 R 3.9117 8.1315 120.7320 58.4741 29.8917 178.7695 31 L 4.0527 7.9120 120.3875 58.4591 41.8318 179.2342 32 L 3.9821 7.6720 119.5342 56.8875 41.2172 179.7861 33 V 3.5496 7.2669 117.0597 65.9258 31.7145 178.0913 34 V 3.5443 7.7479 116.9139 64.2597 32.6789 175.4590 35 Y 3.8653 7.4281 116.8177 54.0244 37.9921 174.0296 36 P 4.5089 0.0000 0.0000 64.3729 31.5653 178.3677 37 W 4.4036 7.7581 116.4043 59.2425 27.5572 177.8783 38 T 4.4031 7.5238 110.7298 64.3759 68.1659 176.3909 39 Q 4.2466 8.1806 121.6455 58.9745 28.4356 178.3793 40 R 3.8802 7.6930 118.9557 59.4174 30.0303 178.2128 41 F 4.0761 7.9505 116.0858 58.6784 40.3326 176.2567 42 F 4.0994 7.7520 120.0971 55.4683 37.2741 176.1001 43 E 3.9476 7.9508 122.6096 58.8960 29.8994 178.6269 44 S 4.7851 7.9975 109.6308 58.1477 63.4859 174.6904 45 F 4.5506 8.2079 120.1724 58.9318 39.8609 176.8540 46 G 4.0126 8.1756 106.3133 44.4683 0.0000 173.4608 47 D 4.5517 8.5524 124.1864 54.2982 41.5189 176.1017 48 L 4.9404 8.3002 127.0028 54.5822 43.1835 177.9153 49 S 4.3472 8.2734 116.1389 60.4833 63.6638 174.5459 50 T 4.7339 7.4422 110.1248 58.2340 73.0342 172.6411 51 P 4.2003 0.0000 0.0000 66.2001 31.5285 178.7924 52 D 4.4250 8.0751 116.6020 56.9046 40.5562 178.4633 53 A 4.0090 7.9884 121.3768 54.9956 18.7154 179.6777 54 V 3.6687 8.2547 116.9934 66.5352 31.5242 178.2274 55 M 3.9945 8.5334 117.5066 58.1397 31.8691 177.7252 56 G 3.8448 7.7184 104.0827 45.2247 0.0000 173.5781 57 N 4.2754 7.8086 119.4534 53.1733 39.7328 173.4727 58 P 4.2245 0.0000 0.0000 65.7900 31.4203 178.7352 59 K 3.7540 8.3982 117.4049 58.8670 31.7239 179.6570 60 V 3.6323 7.6289 118.2877 65.9122 31.4273 178.1067 61 K 3.9459 8.0825 118.0377 59.3745 31.6535 179.2960 62 A 3.9891 7.8059 120.0783 55.3652 18.6569 178.8848 63 H 4.4107 8.5358 117.1332 59.3264 29.9695 177.6570 64 G 3.7302 8.5417 108.0372 47.8136 0.0000 175.5439 65 K 4.0818 7.9461 121.7847 59.0175 32.2569 179.1721 66 K 4.0941 8.0043 119.0953 59.0884 31.9198 179.4596 67 V 3.7131 7.7991 118.2899 65.9652 31.5743 177.6429 68 L 4.4648 8.4127 120.3352 58.2229 41.9466 179.0575 69 G 3.7955 8.4884 105.5164 47.9464 0.0000 175.4971 70 A 4.1322 8.1152 122.7649 54.8588 18.3167 179.6798 71 F 3.9346 8.5912 116.3600 60.8091 39.0458 177.9036 72 S 4.1187 8.6426 114.7334 61.8724 62.4928 176.3624 73 D 4.5035 8.1563 120.2773 57.3916 40.8225 178.9557 74 G 3.8694 8.1038 105.8490 48.0683 0.0000 175.7013 75 L 3.8648 7.8652 120.5808 57.0459 41.6630 178.9240 76 A 4.1709 7.7397 118.3491 53.2697 19.5844 176.8556 77 H 4.8966 8.1318 114.7761 54.5746 29.6731 175.1851 78 L 4.0163 7.8587 119.8752 57.5902 42.0621 178.8334 79 D 4.5229 7.9355 116.0510 54.7178 40.6320 175.6755 80 N 5.0048 8.2660 119.3092 51.8049 39.2908 175.1302 81 L 4.0514 7.8208 122.0331 57.8494 42.1148 179.3655 82 K 4.0374 8.0289 117.2895 59.3769 32.4378 179.1897 83 G 3.6304 7.8833 105.3881 48.0959 0.0000 175.5899 84 T 3.6570 7.4851 117.2481 65.6807 68.6258 175.7194 85 F 4.7876 7.7176 117.1947 57.1258 39.3617 177.5039 86 A 3.9619 7.6152 123.1694 55.8559 18.1765 180.8567 87 T 3.9277 7.8023 107.4358 64.7751 68.9584 176.6989 88 L 4.0849 7.9114 121.4778 57.4062 41.6469 179.1585 89 S 4.1178 8.5614 115.0351 60.8092 62.3639 175.8583 90 E 3.9819 8.0911 122.0032 58.9359 29.2651 178.3037 91 L 3.8707 7.9986 120.4243 58.8184 42.1128 178.9093 92 H 4.2384 8.5973 116.2178 58.7301 28.4608 177.4142 93 C 4.1319 8.2993 120.3404 61.6394 27.9801 175.8451 94 D 4.2762 7.7669 119.4019 57.2554 40.8026 178.2124 95 K 4.1931 7.9499 116.4016 58.6474 32.6667 178.0254 96 L 4.2604 8.0696 116.7903 55.0486 42.2091 176.5059 97 H 4.4015 7.7382 114.5534 56.7262 26.4862 175.3659 98 V 3.6531 8.1067 119.0347 62.3410 32.2327 175.3372 99 D 4.4101 8.6336 127.1699 53.4336 41.7461 175.6031 100 P 4.1554 0.0000 0.0000 66.0897 31.1454 178.3820 101 E 3.9619 8.1162 118.4311 59.2140 29.4590 178.4306 102 N 4.3860 8.0915 116.6098 56.0350 38.5872 177.3926 103 F 4.4475 7.7074 119.1456 60.5552 39.0028 177.8962 104 R 4.0020 8.0422 117.2211 59.2684 29.9874 178.7932 105 L 3.8381 7.9715 118.7565 57.7577 41.5022 179.4126 106 L 4.1461 8.0836 120.3033 58.0383 42.0614 179.1276 107 G 3.7582 8.1568 105.4436 48.1119 0.0000 175.4054 108 N 4.4491 8.2371 119.1481 55.9806 38.5327 177.7690 109 V 3.6603 8.3866 120.1858 65.7596 31.5288 177.8278 110 L 3.8387 8.1869 120.4323 58.0536 41.9197 179.0592 111 V 3.5088 7.8331 118.1718 66.2225 31.4483 177.5561 112 C 4.0521 7.9847 118.1392 62.3377 31.3665 175.7224 113 V 3.4221 7.7215 119.9115 65.9190 31.0242 178.0404 114 L 3.8852 7.8685 118.6706 57.5103 41.3562 179.2915 115 A 3.4036 7.2287 120.6269 55.2683 18.0749 179.1551 116 H 4.0729 7.9468 115.4762 59.7364 29.9831 176.8790 117 H 4.0955 8.0612 117.0537 58.0310 28.9498 176.9254 118 F 4.5256 8.6091 118.4245 55.6409 39.7727 177.7062 119 G 3.8031 8.7995 107.7947 46.0349 0.0000 176.9340 120 K 3.9711 9.0271 124.5633 59.0989 31.9106 177.1897 121 E 4.2138 8.3368 116.8603 58.0598 29.7592 177.4809 122 F 4.5634 8.0328 123.3671 57.0943 37.9017 175.3135 123 T 4.2398 7.4102 116.2481 59.7897 71.3760 173.6557 124 P 4.1415 0.0000 0.0000 65.4174 31.3627 177.2714 125 P 4.2263 0.0000 0.0000 65.6621 31.0837 178.6247 126 V 3.4969 7.2446 116.9373 65.6961 31.3723 177.6571 127 Q 3.6115 8.0503 119.3846 59.0526 28.9127 178.2298 128 A 3.9609 8.2789 121.8104 55.0653 18.4410 179.4331 129 A 3.8530 7.9436 119.1680 55.6780 18.5028 179.5049 130 Y 3.8050 8.2687 115.4961 61.0075 37.8977 178.7320 131 Q 4.0525 8.4650 120.7281 59.2129 29.2078 178.5088 132 K 3.9872 7.9035 118.9980 59.3436 31.9813 179.4235 133 V 3.5415 7.7994 118.3669 66.3171 31.4932 178.5973 134 V 3.8141 8.4435 112.2271 64.2621 31.3364 178.5666 135 A 4.1332 8.2903 120.8847 55.0851 18.2338 179.8867 136 G 3.5699 8.1843 104.3544 47.9184 0.0000 176.0929 137 V 3.3025 8.1163 120.7099 65.5497 31.5149 177.9664 138 A 3.8186 8.1041 120.5956 55.0740 17.9854 179.1221 139 N 4.2871 7.9741 114.4056 56.8055 39.4712 176.7115 140 A 4.1003 8.0455 122.2243 55.1576 18.5052 179.6572 141 L 3.5274 7.7744 117.5947 57.1216 41.3613 178.5517 142 A 4.6157 7.5439 118.7510 52.2181 18.6426 178.0904 143 H 3.8349 7.6412 119.2167 59.6351 29.6561 177.1639 144 K 3.8788 7.4844 117.0769 58.6761 31.8868 177.2924 145 Y 4.6438 7.8707 116.3002 58.7737 38.5829 175.4815 146 H 4.6348 8.0466 122.3172 55.9495 28.8864 174.9270 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 3.96 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 0.91 0.00 0.00 0.95 0.00 0.00 2 H 8.83 4.61 0.00 3.15 3.17 0.00 5.93 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.88 4.81 0.00 1.51 1.41 0.76 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.00 4.18 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 1.25 0.00 0.00 5 P 0.00 4.31 0.00 2.16 2.12 0.00 3.57 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 2.10 2.16 0.00 6 E 8.06 4.01 0.00 2.03 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 2.38 2.44 0.00 7 E 7.94 3.84 0.00 2.17 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 2.26 2.26 0.00 8 K 8.32 3.76 0.00 1.70 1.76 0.00 1.56 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.39 7.81 9 S 8.09 4.06 0.00 4.10 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 10 A 7.91 3.99 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 11 V 8.01 3.60 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 0.59 0.00 0.00 0.56 0.00 0.00 12 T 8.17 4.02 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 1.27 0.00 0.00 13 A 7.96 4.03 1.42 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 0.00 0.00 0.00 14 L 8.09 3.84 0.00 1.78 1.81 0.59 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.64 4.37 0.00 3.76 3.22 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 16 G 8.01 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 0.00 0.00 0.00 17 K 7.62 4.41 0.00 2.09 2.07 0.00 1.71 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.65 7.81 18 V 6.91 3.62 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 0.14 0.00 0.00 0.66 0.00 0.00 19 N 8.41 4.56 0.00 2.80 2.63 0.00 0.00 7.22 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 8.12 3.53 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 0.78 0.00 0.00 0.91 0.00 0.00 21 D 8.13 4.22 0.00 2.82 2.72 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 22 E 7.39 4.41 0.00 2.04 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 2.18 2.24 0.00 23 V 7.85 3.63 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 0.88 0.00 0.00 0.76 0.00 0.00 24 G 8.06 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.99 3.58 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 26 E 8.01 3.87 0.00 2.15 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 0.00 2.23 2.28 0.00 27 A 8.18 3.90 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 28 L 8.22 4.01 0.00 1.79 1.67 0.80 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.42 3.54 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 0.00 30 R 8.13 3.91 0.00 1.89 1.93 0.00 3.04 0.00 0.00 2.99 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 31 L 7.91 4.05 0.00 1.83 1.88 0.99 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 32 L 7.67 3.98 0.00 1.86 1.65 0.66 0.39 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 33 V 7.27 3.55 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 0.70 0.00 0.00 0.89 0.00 0.00 34 V 7.75 3.54 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 -0.12 0.00 0.00 0.79 0.00 0.00 35 Y 7.43 3.87 0.00 2.72 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 0.00 0.00 0.00 36 P 0.00 4.51 0.00 2.27 2.24 0.00 3.51 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 2.16 1.86 0.00 37 W 7.76 4.40 0.00 3.64 3.62 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 38 T 7.52 4.40 4.46 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 1.15 0.00 0.00 39 Q 8.18 4.25 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 40 R 7.69 3.88 0.00 1.70 1.90 0.00 3.17 0.00 0.00 3.08 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.53 0.00 41 F 7.95 4.08 0.00 2.68 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 42 F 7.75 4.10 0.00 2.84 1.81 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 43 E 7.95 3.95 0.00 1.93 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 2.25 2.17 0.00 44 S 8.00 4.79 0.00 4.13 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 45 F 8.21 4.55 0.00 3.09 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 46 G 8.18 4.01 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 0.00 0.00 0.00 47 D 8.55 4.55 0.00 2.65 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 8.30 4.94 0.00 1.65 1.61 1.01 1.05 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 49 S 8.27 4.35 0.00 4.03 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 50 T 7.44 4.73 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.57 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 2.09 2.15 0.00 52 D 8.08 4.43 0.00 2.67 2.70 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 53 A 7.99 4.01 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.25 3.67 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 1.05 0.00 0.00 0.98 0.00 0.00 55 M 8.53 3.99 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.84 0.00 56 G 7.72 3.84 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 0.00 0.00 0.00 57 N 7.81 4.28 0.00 3.08 2.83 0.00 0.00 7.17 7.62 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 58 P 0.00 4.22 0.00 2.13 2.05 0.00 3.60 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 2.08 2.15 0.00 59 K 8.40 3.75 0.00 1.31 0.74 0.00 1.51 0.00 0.00 1.12 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.21 1.24 7.81 60 V 7.63 3.63 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 1.18 0.00 0.00 1.06 0.00 0.00 61 K 8.08 3.95 0.00 1.82 1.82 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.20 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.65 7.81 62 A 7.81 3.99 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 63 H 8.54 4.41 0.00 3.52 3.56 0.00 5.80 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 8.54 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 0.00 0.00 0.00 65 K 7.95 4.08 0.00 1.99 1.99 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.51 7.81 66 K 8.00 4.09 0.00 1.97 1.87 0.00 1.90 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.47 7.81 67 V 7.80 3.71 2.39 0.00 0.00 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 1.10 0.00 0.00 68 L 8.41 4.46 0.00 2.03 1.97 1.13 0.90 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 69 G 8.49 3.80 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 0.00 0.00 0.00 70 A 8.12 4.13 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 71 F 8.59 3.93 0.00 3.53 3.09 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 72 S 8.64 4.12 0.00 4.25 4.19 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 73 D 8.16 4.50 0.00 2.73 2.49 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 74 G 8.10 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 75 L 7.87 3.86 0.00 1.50 1.52 -0.42 0.81 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 76 A 7.74 4.17 1.16 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 77 H 8.13 4.90 0.00 3.08 3.11 0.00 5.82 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 78 L 7.86 4.02 0.00 1.58 1.70 0.82 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.94 4.52 0.00 2.75 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 80 N 8.27 5.00 0.00 2.69 2.62 0.00 0.00 7.07 6.29 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 81 L 7.82 4.05 0.00 1.77 1.86 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.03 4.04 0.00 1.62 1.66 0.00 1.46 0.00 0.00 1.59 0.00 0.00 3.10 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.40 1.35 7.81 83 G 7.88 3.63 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 0.00 84 T 7.49 3.66 3.79 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 0.52 0.00 0.00 85 F 7.72 4.79 0.00 3.10 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 86 A 7.62 3.96 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 87 T 7.80 3.93 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 1.19 0.00 0.00 88 L 7.91 4.08 0.00 1.96 1.78 1.10 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.56 4.12 0.00 3.91 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 90 E 8.09 3.98 0.00 2.07 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 2.27 2.38 0.00 91 L 8.00 3.87 0.00 1.80 1.83 0.90 0.90 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 92 H 8.60 4.24 0.00 3.29 3.65 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.30 4.13 0.00 2.62 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 0.00 0.00 0.00 94 D 7.77 4.28 0.00 2.88 2.69 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 0.00 0.00 0.00 0.00 95 K 7.95 4.19 0.00 1.80 1.84 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.43 7.81 96 L 8.07 4.26 0.00 1.78 1.76 0.76 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.74 4.40 0.00 3.40 3.53 0.00 5.67 0.00 0.00 0.00 0.00 8.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.11 3.65 1.60 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 -0.03 0.00 0.00 0.53 0.00 0.00 99 D 8.63 4.41 0.00 2.76 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 0.00 100 P 0.00 4.16 0.00 2.35 2.59 0.00 3.49 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.91 0.00 101 E 8.12 3.96 0.00 2.06 1.96 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 2.36 2.48 0.00 102 N 8.09 4.39 0.00 2.64 2.73 0.00 0.00 6.93 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 0.00 103 F 7.71 4.45 0.00 3.19 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 0.00 104 R 8.04 4.00 0.00 2.05 2.02 0.00 3.18 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.97 0.00 105 L 7.97 3.84 0.00 1.72 1.28 0.87 -0.13 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 0.00 106 L 8.08 4.15 0.00 1.88 1.82 1.01 1.29 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 8.16 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 0.00 108 N 8.24 4.45 0.00 2.94 2.95 0.00 0.00 6.71 6.97 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 0.00 109 V 8.39 3.66 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 1.18 0.00 0.00 110 L 8.19 3.84 0.00 1.60 1.68 0.83 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.83 3.51 2.30 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 1.17 0.00 0.00 1.14 0.00 0.00 112 C 7.98 4.05 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 3.42 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 0.71 0.00 0.00 0.84 0.00 0.00 114 L 7.87 3.89 0.00 1.18 1.26 0.43 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.23 3.40 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 0.00 116 H 7.95 4.07 0.00 3.19 3.53 0.00 5.75 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.06 4.10 0.00 2.85 2.67 0.00 5.71 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.61 4.53 0.00 3.32 3.22 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 0.00 119 G 8.80 3.80 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 0.00 0.00 0.00 120 K 9.03 3.97 0.00 1.77 1.92 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.52 7.81 121 E 8.34 4.21 0.00 2.21 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 2.44 2.39 0.00 122 F 8.03 4.56 0.00 3.04 3.22 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 0.00 123 T 7.41 4.24 4.20 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 1.27 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.14 0.00 3.57 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 2.11 2.15 0.00 125 P 0.00 4.23 0.00 2.21 2.27 0.00 3.54 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 2.03 1.99 0.00 126 V 7.24 3.50 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 1.05 0.00 0.00 0.90 0.00 0.00 127 Q 8.05 3.61 0.00 1.61 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.63 0.00 128 A 8.28 3.96 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 0.00 129 A 7.94 3.85 1.26 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 0.00 0.00 0.00 130 Y 8.27 3.81 0.00 3.32 3.23 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 0.00 131 Q 8.47 4.05 0.00 2.38 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 132 K 7.90 3.99 0.00 1.99 1.83 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.62 7.81 133 V 7.80 3.54 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 1.07 0.00 0.00 0.76 0.00 0.00 134 V 8.44 3.81 2.20 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 0.88 0.00 0.00 1.17 0.00 0.00 135 A 8.29 4.13 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 0.00 0.00 0.00 0.00 0.00 136 G 8.18 3.57 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 0.00 0.00 0.00 137 V 8.12 3.30 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 0.21 0.00 0.00 0.96 0.00 0.00 138 A 8.10 3.82 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 0.00 139 N 7.97 4.29 0.00 2.90 2.94 0.00 0.00 7.23 8.03 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 0.00 140 A 8.05 4.10 1.42 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 0.00 0.00 0.00 141 L 7.77 3.53 0.00 0.90 0.13 0.43 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.54 4.62 1.59 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 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.64 3.83 0.00 3.36 3.29 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 0.00 144 K 7.48 3.88 0.00 1.47 1.67 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.63 7.81 145 Y 7.87 4.64 0.00 3.14 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 0.00 146 H 8.05 4.63 0.00 3.19 3.19 0.00 5.70 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