NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9622 8.3549 109.7379 45.4700 0.0000 172.7889 2 L 4.2057 8.1420 118.7395 51.6034 42.8210 175.7601 3 S 4.4698 9.7405 119.0890 57.8785 66.0999 174.9618 4 D 4.6544 8.7914 122.1035 57.7324 40.5818 179.3882 5 G 3.6984 8.1295 105.4615 47.8873 0.0000 175.3793 6 E 3.9162 8.3113 121.0806 58.9435 29.4112 179.3559 7 W 4.4279 8.2611 119.2382 60.0206 29.0828 178.3143 8 Q 4.0622 8.4403 119.3806 59.2146 28.4048 178.3725 9 Q 4.0231 8.2417 119.0854 58.9353 28.7605 178.7417 10 V 3.6954 8.0825 119.4315 66.3824 31.3844 178.1378 11 L 4.2332 8.1903 116.8784 57.1967 41.7150 178.8311 12 N 4.4825 8.3709 117.6617 56.7148 38.9283 176.8145 13 V 3.5828 8.2114 120.1124 66.0576 31.5659 177.7678 14 W 4.1775 8.6026 127.9693 60.2254 30.2278 177.8968 15 G 3.7137 7.7035 104.8331 47.7707 0.0000 175.4398 16 K 3.9633 7.9620 120.6120 59.1944 32.0272 179.5582 17 V 2.6893 6.9264 117.8613 65.7439 31.0876 177.7798 18 E 3.8309 7.4703 116.4885 58.7859 29.2673 178.8230 19 A 4.1791 7.2710 119.4587 53.9710 19.8367 177.6646 20 D 4.6599 7.7498 116.4890 52.2621 42.6673 175.2253 21 I 3.5977 7.8292 123.6136 63.7290 38.5989 176.6423 22 A 4.0637 7.9748 121.3157 55.0161 18.2686 179.7452 23 G 3.6054 8.2684 105.5055 47.7397 0.0000 175.6793 24 H 4.1208 8.3543 119.2859 58.2980 28.6653 178.1550 25 G 3.5273 8.3313 107.7802 47.7729 0.0000 175.1254 26 Q 3.8542 8.3464 123.0196 59.1754 28.9528 178.7768 27 E 3.9020 8.1801 119.1853 59.1448 29.3548 179.6233 28 V 3.5103 7.9553 118.6467 65.9698 31.5533 178.1733 29 L 3.3882 7.8067 118.7258 57.5375 41.2698 179.4765 30 I 3.5642 7.7618 120.1364 64.2251 37.0407 178.3060 31 R 3.7854 7.9792 119.5539 59.2940 29.8945 178.1082 32 L 3.9415 7.7998 119.9733 58.4513 41.8850 179.0883 33 F 4.5660 8.1476 118.2142 60.7787 38.5991 177.8737 34 T 4.0753 8.2178 109.1815 64.6002 68.8614 176.9059 35 G 3.6319 7.9768 107.6144 46.3475 0.0000 173.7340 36 H 4.7727 8.0939 117.6882 52.1020 30.0990 171.8784 37 P 4.5044 0.0000 0.0000 64.4936 31.3259 177.5045 38 E 4.0983 8.2734 116.3953 59.5223 29.3250 179.1663 39 T 3.8111 8.0734 111.0610 64.5859 68.7541 176.2069 40 L 3.5346 7.8189 122.8381 57.8410 41.8036 178.6922 41 E 4.1317 7.7788 117.3305 58.5714 29.4470 178.6937 42 K 4.4516 8.0555 117.4487 56.8246 32.6819 177.2578 43 F 4.6045 8.2114 119.0690 55.4166 40.1995 175.5294 44 D 4.4140 8.5776 125.2883 57.1872 40.8614 179.1371 45 K 4.2065 7.8358 115.3425 58.1315 33.0188 177.0594 46 F 5.0764 7.8901 117.6992 56.8968 40.3799 177.0701 47 K 3.9425 7.6817 119.3866 59.7466 32.2638 177.8829 48 H 4.3499 8.0906 113.5301 57.2007 28.8454 175.7287 49 L 4.1715 7.3550 120.5360 54.4155 39.7273 176.6264 50 K 4.2340 9.2738 124.0823 57.6989 32.8746 178.0432 51 T 4.7346 7.4909 108.4196 58.8068 73.2113 174.1004 52 E 3.8833 8.7492 121.8473 59.2808 29.6124 178.9110 53 A 3.9547 7.9546 120.3732 55.3158 18.2935 179.1989 54 E 3.9358 7.9224 115.5103 59.7831 29.8094 179.2980 55 M 4.1305 8.0670 118.6038 58.4150 31.8794 178.7625 56 K 3.8911 8.4879 118.2624 59.1006 32.4043 177.7912 57 A 4.4397 7.7120 118.6667 51.6548 19.0265 176.9396 58 S 4.4016 7.5749 113.9420 57.3390 62.7850 174.7550 59 E 4.0447 8.7893 128.3446 59.2127 29.2615 178.6074 60 D 4.4617 8.1615 117.9941 56.9183 41.3164 177.8329 61 L 3.6608 8.0629 121.2524 57.7939 42.0599 178.8326 62 K 3.8608 7.7803 119.7008 59.2110 32.1188 178.4780 63 K 3.9010 8.2387 119.9786 60.0482 32.0897 178.1169 64 H 4.3579 8.9238 118.8962 59.2334 29.6874 177.2899 65 G 3.6370 8.3043 107.6953 48.1161 0.0000 175.7057 66 T 3.8661 8.0191 118.1649 66.2952 68.4845 176.7776 67 V 3.5878 7.7817 120.0602 66.0321 31.5771 177.9575 68 V 3.6284 8.0418 118.1823 66.3987 31.3540 178.1044 69 L 4.2741 8.3263 118.6368 57.8467 41.4581 179.6480 70 T 3.9926 8.3179 115.9919 66.5589 68.3861 176.3943 71 A 3.9946 8.1878 122.6048 55.1252 18.3762 179.4219 72 L 3.6917 8.1039 119.0071 58.0858 42.1204 179.3953 73 G 3.0525 8.5254 106.2134 47.3473 0.0000 175.7109 74 G 3.6695 7.7701 107.1505 47.6480 0.0000 175.4282 75 I 3.8286 7.4934 122.4710 64.0731 37.1176 178.5345 76 L 3.9471 7.7719 119.9900 57.7124 41.1881 179.5900 77 K 3.9436 7.6597 116.5720 58.2239 32.2789 178.6199 78 K 3.9616 7.8713 118.2936 55.7842 32.7228 176.4591 79 K 2.0000 8.2895 118.3745 56.3770 29.7253 175.6812 80 G 3.9342 7.7776 106.0869 45.8453 0.0000 173.5947 81 H 4.5341 7.3178 118.7853 55.6883 27.7012 175.0699 82 H 5.3822 7.3502 110.5142 54.3427 29.7196 175.7750 83 E 3.9198 8.6555 122.0372 60.3189 28.9649 178.7626 84 A 3.9921 7.9254 118.3529 55.2145 18.8160 178.9589 85 E 4.0936 8.1044 116.6946 59.0930 29.6426 178.8746 86 L 4.0699 8.3566 120.6650 57.3704 42.2348 178.2184 87 K 3.8133 8.2080 120.2213 59.3982 31.9697 176.6980 88 P 4.2577 0.0000 0.0000 65.8051 31.0465 178.3372 89 L 4.0073 7.8919 117.9598 57.5081 41.6548 178.7446 90 A 4.0815 8.2613 121.1383 55.6963 18.2344 179.8210 91 Q 3.9087 8.4589 116.8592 59.0208 28.6945 179.0997 92 S 4.0797 8.5071 115.8013 61.6487 63.1207 176.3292 93 H 4.1314 8.6952 119.8756 58.2818 28.1334 177.7134 94 A 2.0000 7.9459 122.6549 54.8078 17.9315 179.6791 95 T 3.9010 7.5933 112.7315 65.2512 68.9274 176.2556 96 K 4.0829 7.4357 119.9013 58.7861 32.8204 177.2066 97 H 4.3364 8.0079 114.0449 55.9878 29.5015 175.4394 98 K 3.5496 6.7871 118.2118 57.2558 29.5076 176.4404 99 I 4.3030 7.9388 118.8892 58.9688 38.0062 175.0967 100 P 4.5109 0.0000 0.0000 62.2018 32.0322 177.6160 101 I 3.6080 8.6079 120.6527 64.0990 37.6654 177.9093 102 K 3.5538 8.0463 120.0962 59.9826 31.7013 178.0668 103 Y 4.3095 8.0052 116.6233 60.9507 37.7631 178.3161 104 L 4.1657 7.8880 119.7376 57.3441 41.7652 178.8286 105 E 3.9429 8.1634 119.5349 59.2860 29.5244 178.5968 106 F 4.5420 8.1515 118.1597 61.0999 39.0713 177.7150 107 I 3.7991 8.3361 118.0454 63.9325 37.8675 177.9515 108 S 4.2308 8.3104 116.3058 61.8981 62.7130 176.4374 109 D 4.4676 8.4467 121.1493 57.3576 40.5197 178.6741 110 A 4.0578 8.4333 121.5017 55.2345 18.3125 179.7366 111 I 3.6775 8.0056 118.2237 64.5990 37.2592 178.6626 112 I 3.8652 7.7403 120.1812 64.6798 36.9011 177.9520 113 H 4.1714 8.5008 119.0280 59.3915 29.6703 177.3617 114 V 3.5102 8.2036 120.4048 65.9609 31.2773 177.9639 115 L 3.8383 8.0159 118.6863 58.0671 40.9166 179.1402 116 H 4.3236 8.1562 116.0235 59.0806 28.4427 177.8518 117 S 4.0983 8.0811 114.1636 61.0578 62.3012 175.7685 118 K 4.1228 8.0816 119.8360 57.4566 33.2267 176.5970 119 H 4.9770 8.0117 116.2815 53.7704 29.4194 171.9845 120 P 4.5498 0.0000 0.0000 63.6347 31.8696 177.4479 121 G 3.9654 9.1350 110.4675 45.7628 0.0000 172.9342 122 D 4.9331 8.4158 117.6698 53.6370 41.5746 175.9797 123 F 4.9556 7.9987 120.0725 55.1668 39.5909 174.9755 124 G 3.8147 8.1442 112.8072 43.2208 0.0000 170.8416 125 A 3.8926 8.4379 122.1538 55.2005 18.2263 179.7169 126 D 4.2276 8.0127 116.7298 56.5069 39.3880 178.4789 127 A 3.9915 7.8231 121.7743 54.8862 18.4300 179.1287 128 Q 3.6384 7.9719 118.5636 59.0044 28.9093 178.6779 129 G 3.5687 8.0714 106.4533 47.7502 0.0000 175.4686 130 A 3.8366 8.0282 123.6392 54.9811 18.4045 179.3052 131 M 4.0026 8.4154 117.0929 59.0750 32.2270 178.4785 132 T 3.8834 8.2265 116.0069 66.7214 68.6196 176.4623 133 K 3.9398 8.2289 120.3097 59.6218 32.0778 179.1956 134 A 3.8259 8.0224 120.7614 55.1565 18.2372 179.7574 135 L 4.0716 8.1980 117.7021 57.8875 41.6476 179.5323 136 E 3.9786 8.6380 119.0685 59.2401 29.3218 179.0164 137 L 3.9514 8.1896 120.5330 58.2670 42.1405 178.4149 138 F 4.1373 8.3822 120.3678 61.5432 39.2268 176.7099 139 R 3.5565 8.3984 118.0837 59.6343 29.8714 177.9758 140 N 4.2512 8.7350 116.7667 56.8256 38.8129 176.6067 141 D 4.3473 8.3339 120.5496 57.2046 40.8263 178.7672 142 I 3.4197 7.5618 120.1877 64.2420 36.9451 178.2705 143 A 3.7551 8.1095 121.7081 54.8760 18.1283 179.4205 144 A 3.9341 8.0047 119.2507 55.4811 18.4775 180.0877 145 K 4.0244 7.8580 116.7661 59.7170 31.9850 179.2070 146 Y 4.2801 8.5802 117.5997 60.9924 37.8215 178.6082 147 K 3.9461 8.5323 120.8369 59.4372 32.1143 178.0777 148 E 3.9432 7.9672 118.3706 59.6240 29.6158 178.5377 149 L 4.2963 7.9162 115.6638 54.5816 41.9492 177.2216 150 G 3.8810 7.8666 106.8458 46.3508 0.0000 173.2958 151 F 4.3691 8.3747 122.0511 57.6851 40.2581 175.5068 152 Q 3.4275 7.5641 125.3301 56.3145 28.3548 173.3103 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 3.96 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 0.00 0.00 0.00 2 L 8.14 4.21 0.00 0.53 0.66 0.52 -0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.74 4.47 0.00 4.02 3.98 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 4 D 8.79 4.65 0.00 2.77 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 5 G 8.13 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 6 E 8.31 3.92 0.00 2.05 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 2.23 2.27 0.00 7 W 8.26 4.43 0.00 3.53 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 8 Q 8.44 4.06 0.00 2.22 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 9 Q 8.24 4.02 0.00 2.32 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.54 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 10 V 8.08 3.70 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.85 0.00 0.00 11 L 8.19 4.23 0.00 1.76 1.81 0.91 1.24 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 12 N 8.37 4.48 0.00 2.93 3.01 0.00 0.00 6.65 7.23 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 13 V 8.21 3.58 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 0.88 0.00 0.00 1.17 0.00 0.00 14 W 8.60 4.18 0.00 3.63 3.26 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 15 G 7.70 3.71 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 0.00 0.00 0.00 16 K 7.96 3.96 0.00 1.63 1.47 0.00 1.44 0.00 0.00 0.99 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.25 1.29 7.81 17 V 6.93 2.69 0.67 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 0.06 0.00 0.00 0.22 0.00 0.00 18 E 7.47 3.83 0.00 1.84 1.92 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 2.21 2.10 0.00 19 A 7.27 4.18 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 20 D 7.75 4.66 0.00 2.71 2.52 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 21 I 7.83 3.60 1.78 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 1.57 1.28 0.88 0.00 0.00 22 A 7.97 4.06 1.30 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 0.00 0.00 23 G 8.27 3.61 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 0.00 0.00 0.00 24 H 8.35 4.12 0.00 3.16 3.23 0.00 5.82 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 25 G 8.33 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.35 3.85 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 E 8.18 3.90 0.00 1.96 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 2.25 2.41 0.00 28 V 7.96 3.51 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 1.09 0.00 0.00 0.95 0.00 0.00 29 L 7.81 3.39 0.00 1.45 0.73 0.81 0.42 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 30 I 7.76 3.56 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.73 0.86 0.00 0.00 31 R 7.98 3.79 0.00 1.95 2.11 0.00 3.05 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 32 L 7.80 3.94 0.00 1.79 1.49 1.09 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.15 4.57 0.00 2.99 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 34 T 8.22 4.08 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 1.23 0.00 0.00 35 G 7.98 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 36 H 8.09 4.77 0.00 3.01 2.91 0.00 5.64 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.50 0.00 2.15 2.10 0.00 3.84 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 38 E 8.27 4.10 0.00 2.29 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 0.00 2.27 2.58 0.00 39 T 8.07 3.81 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 0.68 0.00 0.00 40 L 7.82 3.53 0.00 1.47 1.72 -0.11 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.78 4.13 0.00 2.16 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 2.38 2.53 0.00 42 K 8.06 4.45 0.00 1.87 1.72 0.00 1.92 0.00 0.00 1.78 0.00 0.00 3.20 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.75 1.97 7.81 43 F 8.21 4.60 0.00 3.22 2.82 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 44 D 8.58 4.41 0.00 2.67 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 45 K 7.84 4.21 0.00 1.60 1.74 0.00 1.34 0.00 0.00 1.48 0.00 0.00 2.77 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.83 0.21 7.81 46 F 7.89 5.08 0.00 2.81 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 47 K 7.68 3.94 0.00 1.95 2.11 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.64 1.42 7.81 48 H 8.09 4.35 0.00 3.28 3.50 0.00 5.72 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 49 L 7.36 4.17 0.00 1.63 1.61 0.78 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.27 4.23 0.00 1.85 1.86 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.64 1.52 7.81 51 T 7.49 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 52 E 8.75 3.88 0.00 2.04 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 2.35 2.36 0.00 53 A 7.95 3.95 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 54 E 7.92 3.94 0.00 2.15 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 2.37 2.36 0.00 55 M 8.07 4.13 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.52 0.00 56 K 8.49 3.89 0.00 1.70 2.03 0.00 1.64 0.00 0.00 1.67 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.48 7.81 57 A 7.71 4.44 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 58 S 7.57 4.40 0.00 4.02 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.79 4.04 0.00 2.05 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 2.42 2.32 0.00 60 D 8.16 4.46 0.00 2.92 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 61 L 8.06 3.66 0.00 1.37 1.65 0.71 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.78 3.86 0.00 1.80 1.96 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.43 7.81 63 K 8.24 3.90 0.00 2.04 2.12 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.51 7.81 64 H 8.92 4.36 0.00 3.64 3.71 0.00 5.84 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 65 G 8.30 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 T 8.02 3.87 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 1.23 0.00 0.00 67 V 7.78 3.59 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 1.05 0.00 0.00 0.99 0.00 0.00 68 V 8.04 3.63 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 1.06 0.00 0.00 0.97 0.00 0.00 69 L 8.33 4.27 0.00 1.77 1.86 0.84 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.32 3.99 4.47 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 1.26 0.00 0.00 71 A 8.19 3.99 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 72 L 8.10 3.69 0.00 1.61 1.79 0.04 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.53 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 0.00 0.00 0.00 74 G 7.77 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 I 7.49 3.83 1.87 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.93 0.93 0.00 0.00 76 L 7.77 3.95 0.00 1.18 1.50 0.04 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.66 3.94 0.00 1.62 1.77 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.21 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.49 7.81 78 K 7.87 3.96 0.00 1.86 1.78 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.57 1.83 7.81 79 K 8.29 2.00 0.00 1.17 0.74 0.00 1.40 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.52 1.02 7.81 80 G 7.78 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 81 H 7.32 4.53 0.00 3.18 3.23 0.00 5.80 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 82 H 7.35 5.38 0.00 3.27 3.43 0.00 5.67 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.66 3.92 0.00 2.12 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 2.40 2.48 0.00 84 A 7.93 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 85 E 8.10 4.09 0.00 2.24 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 2.39 2.42 0.00 86 L 8.36 4.07 0.00 1.73 1.72 0.72 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.21 3.81 0.00 1.99 1.83 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.49 7.81 88 P 0.00 4.26 0.00 2.33 2.31 0.00 3.77 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 2.25 2.15 0.00 89 L 7.89 4.01 0.00 1.90 1.75 1.02 0.92 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 90 A 8.26 4.08 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 91 Q 8.46 3.91 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 92 S 8.51 4.08 0.00 3.91 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 93 H 8.70 4.13 0.00 3.50 3.57 0.00 5.81 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 94 A 7.95 2.00 0.37 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 95 T 7.59 3.90 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 1.11 0.00 0.00 96 K 7.44 4.08 0.00 1.52 1.55 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.24 1.35 7.81 97 H 8.01 4.34 0.00 3.01 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 6.79 3.55 0.00 2.01 2.00 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.54 7.81 99 I 7.94 4.30 2.09 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 1.33 0.93 1.19 0.00 0.00 100 P 0.00 4.51 0.00 1.73 1.70 0.00 2.53 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.73 0.00 101 I 8.61 3.61 1.85 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.10 0.89 0.00 0.00 102 K 8.05 3.55 0.00 1.74 1.63 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 0.52 7.81 103 Y 8.01 4.31 0.00 3.25 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 0.00 104 L 7.89 4.17 0.00 1.78 1.77 0.69 1.02 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 0.00 105 E 8.16 3.94 0.00 1.98 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 2.38 0.00 106 F 8.15 4.54 0.00 3.30 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 0.00 107 I 8.34 3.80 2.05 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 1.60 1.41 1.15 0.00 0.00 108 S 8.31 4.23 0.00 4.22 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 0.00 109 D 8.45 4.47 0.00 3.02 2.83 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 0.00 0.00 0.00 0.00 110 A 8.43 4.06 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 0.00 111 I 8.01 3.68 2.11 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.74 0.99 0.00 0.00 112 I 7.74 3.87 2.17 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.33 1.16 0.00 0.00 113 H 8.50 4.17 0.00 3.32 3.52 0.00 5.79 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 0.00 114 V 8.20 3.51 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 0.98 0.00 0.00 1.04 0.00 0.00 115 L 8.02 3.84 0.00 1.22 0.61 0.45 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.16 4.32 0.00 3.42 3.39 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.08 4.10 0.00 3.68 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 0.00 118 K 8.08 4.12 0.00 1.47 1.45 0.00 1.62 0.00 0.00 1.23 0.00 0.00 2.53 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.25 1.43 7.81 119 H 8.01 4.98 0.00 3.23 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.55 0.00 2.19 2.09 0.00 3.48 0.00 0.00 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 121 G 9.13 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 0.00 122 D 8.42 4.93 0.00 2.63 2.80 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 0.00 123 F 8.00 4.96 0.00 2.76 2.82 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 0.00 124 G 8.14 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.44 3.89 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.01 4.23 0.00 3.08 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 0.00 127 A 7.82 3.99 1.53 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 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.97 3.64 0.00 1.16 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 129 G 8.07 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 0.00 130 A 8.03 3.84 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 0.00 131 M 8.42 4.00 0.00 2.41 2.31 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.78 0.00 132 T 8.23 3.88 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 1.23 0.00 0.00 133 K 8.23 3.94 0.00 1.77 1.68 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.50 7.81 134 A 8.02 3.83 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 0.00 135 L 8.20 4.07 0.00 1.91 1.83 1.00 0.92 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 0.00 136 E 8.64 3.98 0.00 2.13 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 2.35 2.49 0.00 137 L 8.19 3.95 0.00 1.89 2.00 0.99 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.38 4.14 0.00 3.11 3.27 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 0.00 0.00 0.00 0.00 139 R 8.40 3.56 0.00 2.11 2.04 0.00 3.21 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 140 N 8.73 4.25 0.00 2.92 2.78 0.00 0.00 7.30 8.94 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 0.00 141 D 8.33 4.35 0.00 2.76 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 0.00 142 I 7.56 3.42 1.43 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.14 0.12 0.00 0.00 143 A 8.11 3.76 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 144 A 8.00 3.93 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.86 4.02 0.00 1.94 1.94 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.62 7.81 146 Y 8.58 4.28 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 0.00 147 K 8.53 3.95 0.00 1.84 1.99 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.97 3.94 0.00 2.04 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 0.00 2.35 2.39 0.00 149 L 7.92 4.30 0.00 1.82 1.68 0.86 0.95 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 0.00 150 G 7.87 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 F 8.37 4.37 0.00 2.70 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 0.00 152 Q 7.56 3.43 0.00 1.84 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.42 0.00 0.00 0.00 0.00 0.00 1.16 1.84 0.00