NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4469 8.1927 115.4145 57.7545 64.7049 174.2350 3 V 3.3382 8.3034 120.1460 65.4862 31.1254 176.0331 4 Y 4.0063 8.8478 120.1132 60.7902 39.0773 177.2353 5 D 4.3201 8.2683 119.4660 57.3884 40.7551 178.6503 6 A 3.9172 7.7098 119.5386 55.2365 18.5908 179.1706 7 A 3.8227 8.2896 119.4536 55.1149 18.2724 179.4639 8 A 3.6372 8.2571 119.7518 55.2579 18.3666 179.5621 9 Q 4.0988 7.5748 114.9263 57.8830 28.8379 176.9104 10 L 3.7608 7.4202 121.1702 55.4224 42.0115 177.8209 11 T 4.3268 8.1639 114.3519 60.2134 71.9309 175.2962 12 A 3.9915 8.3550 122.1724 55.3543 18.2268 179.4658 13 D 4.2582 7.9347 117.1768 56.4990 39.6420 178.8225 14 V 3.4705 7.4873 119.8112 65.6237 31.4447 178.1262 15 K 3.8499 8.3494 118.6642 59.1563 31.8260 179.1399 16 K 3.9056 8.1298 119.8589 59.8128 32.1797 178.6446 17 D 4.6387 8.1961 119.0528 57.1975 40.5644 178.7522 18 L 3.7396 8.2207 119.9869 57.8351 41.6118 179.8308 19 R 4.0354 8.2358 118.1496 59.3359 28.5336 178.8313 20 D 4.4821 8.6814 119.3764 57.5645 40.8165 179.1309 21 S 3.2244 8.3033 114.6819 60.6715 63.0576 176.2564 22 W 4.3369 8.8223 132.3418 60.1416 30.1794 177.8390 23 K 3.8847 8.0597 118.0208 59.2812 31.7216 178.8773 24 V 3.7993 7.1316 116.2886 65.4725 31.9464 178.2423 25 I 3.4768 7.7779 112.6563 63.5172 37.5347 177.6477 26 G 2.0379 7.0025 107.9678 45.3310 0.0000 174.3126 27 S 4.1518 7.1689 114.1743 59.4597 63.7561 174.3062 28 D 4.6319 7.1730 119.6072 51.3010 41.0690 175.5151 29 K 3.7969 8.0419 123.3085 58.5145 32.4584 178.2655 30 K 3.9891 7.9963 119.5587 59.4788 32.2270 178.9967 31 G 3.5033 8.2177 105.8236 48.0324 0.0000 175.5547 32 N 4.4306 8.4214 119.9891 55.4732 38.5087 177.9087 33 G 3.5200 8.3212 107.6806 47.8514 0.0000 175.9881 34 V 3.5642 7.8753 120.9053 65.4324 31.4389 177.8902 35 A 4.0471 7.8563 121.9355 54.4822 18.1243 179.5195 36 L 3.7723 7.9063 117.4325 58.2115 41.7122 179.8181 37 M 3.5177 7.7617 118.6733 58.3857 31.8424 179.0122 38 T 3.9815 8.1818 110.3324 64.9928 68.9079 176.7863 39 T 3.8836 8.0079 118.8279 66.1470 68.3672 176.1528 40 L 3.8115 7.6997 122.3745 58.4271 41.7937 179.2570 41 F 4.5634 7.4284 115.8381 60.4026 38.8384 177.3487 42 A 4.1853 7.9790 120.0290 55.0849 18.3152 178.8761 43 D 4.6302 8.0789 115.8260 55.2624 42.7770 176.8315 44 N 5.2556 8.2869 115.8393 49.4589 39.1096 174.9429 45 Q 4.2307 8.1114 120.1716 58.6430 28.7842 177.9354 46 E 4.1628 8.2893 117.9109 58.4402 29.7035 178.0965 47 T 4.4953 8.2685 110.5415 62.9427 69.3970 176.5414 48 I 3.7032 7.8251 123.9149 64.7523 36.9312 178.1073 49 G 3.6187 8.0572 104.5096 48.1154 0.0000 174.8033 50 Y 4.4226 7.8148 117.7696 59.8928 37.9506 176.6652 51 F 4.9034 8.1926 118.9399 56.8215 39.8398 178.1086 52 K 3.9384 8.1903 123.0782 59.8229 32.5222 178.7167 53 R 3.9369 8.1036 118.7913 59.1231 29.9499 176.9433 54 L 4.2642 8.1524 115.8739 54.9619 42.7634 178.9644 55 G 3.7692 7.8468 106.4178 45.8320 0.0000 175.2526 56 N 4.5280 8.4397 122.2933 52.4263 37.9569 176.2178 57 V 3.8414 7.9590 119.5248 62.8591 31.8738 178.4892 58 S 4.2954 8.4143 114.6296 60.1981 63.2021 175.4155 59 Q 4.1032 8.2662 120.6503 56.4755 29.7495 177.4268 60 G 3.8034 7.7417 108.0752 46.2520 0.0000 176.1877 61 M 3.9266 8.9211 120.4815 58.3996 32.2012 177.4637 62 A 4.0127 7.6115 120.7650 54.1535 18.8518 177.3065 63 N 4.6151 8.2316 115.7309 52.7556 39.4297 175.2107 64 D 4.3620 8.6609 129.4223 56.6138 39.5909 178.5830 65 K 4.0073 8.1189 119.4836 59.0018 32.0548 178.9461 66 L 4.0311 8.4825 120.8106 58.1061 41.9914 179.0526 67 R 4.0067 8.3995 119.0663 59.3559 30.0440 178.7504 68 G 3.6263 8.4560 105.9200 47.9493 0.0000 175.1518 69 H 4.1853 8.4778 120.7351 59.2696 29.9661 177.6143 70 S 4.0950 8.4844 117.2725 61.5215 62.4925 176.7097 71 I 3.7584 7.9857 122.5775 64.8565 36.9819 178.6230 72 T 4.0589 7.9862 116.5268 66.5432 68.2465 176.3597 73 L 3.8499 8.2714 122.6874 58.5307 41.9784 179.0552 74 M 4.2151 7.8767 117.9379 58.4127 31.8255 178.1691 75 Y 4.0081 7.8842 116.5597 60.2653 38.0705 177.8410 76 A 3.5572 7.6714 122.1008 54.8652 18.2014 179.6593 77 L 3.4213 7.4065 117.4708 57.5183 41.4980 179.3009 78 Q 3.6653 8.0179 119.8258 59.1205 29.0611 178.1012 79 N 4.3199 8.0691 117.7660 56.7780 38.8170 176.7514 80 F 4.4497 7.5867 117.5419 60.8158 39.2066 177.2856 81 I 3.6734 7.7382 119.5049 64.6529 36.6468 178.3201 82 D 4.4607 8.2926 118.5893 56.8055 40.8813 177.8023 83 Q 4.4152 7.7724 116.5022 55.9590 28.7269 177.3863 84 L 3.9211 7.4849 121.5783 57.6537 41.7358 177.6828 85 D 4.5461 7.8545 115.3596 54.8464 41.4517 176.6011 86 N 4.8225 8.1588 118.0952 49.9859 39.8785 171.8957 87 P 4.2193 0.0000 0.0000 65.6443 31.4077 177.6969 88 D 4.5536 8.4228 117.4492 57.5004 40.8695 178.6009 89 D 4.3655 8.2468 118.9615 57.0386 40.9251 178.1295 90 L 3.9363 8.3229 121.3651 58.3021 41.9921 179.1328 91 V 3.5718 8.2745 118.5348 66.3086 31.4444 177.8041 92 C 4.2684 7.9854 113.7534 61.1486 29.4955 176.1791 93 V 3.7635 7.8059 114.7355 63.8975 31.2913 178.5231 94 V 3.7302 8.2282 118.5363 66.2035 31.3299 177.9083 95 E 4.0141 8.5945 118.6656 59.1219 28.7293 179.2728 96 K 3.7826 7.8476 119.1937 59.7163 31.9608 178.9996 97 F 4.6451 8.5091 119.0371 59.7558 38.7731 177.3821 98 A 3.9762 8.7287 121.0398 55.3977 18.1843 179.7047 99 V 3.5743 7.7804 116.4966 66.4156 31.4500 177.9088 100 N 4.3723 8.0157 114.9405 56.3213 38.3248 176.7228 101 H 4.5057 7.9093 116.7717 58.0217 29.2976 177.4953 102 I 3.7286 8.3647 122.2583 64.6659 36.7598 178.5362 103 T 3.8908 7.9239 108.3846 64.0220 68.7327 175.1319 104 R 4.2975 7.7592 119.0050 55.3310 30.3108 175.9902 105 K 3.8216 7.8542 116.3050 57.4871 29.7987 175.7666 106 I 4.0241 7.5942 120.6368 60.1916 37.5400 177.1375 107 S 4.4720 8.7460 120.7395 57.4530 65.3589 174.8070 108 A 4.0093 8.5400 123.5905 55.4320 17.8398 179.8219 109 A 4.0077 7.9438 117.5501 55.4587 18.8739 179.2860 110 E 4.1396 8.4768 117.1727 59.3382 29.6072 179.2017 111 F 4.1427 8.8351 121.4676 61.2445 39.5337 177.1942 112 G 3.8929 8.3170 104.4444 46.7811 0.0000 175.2385 113 K 4.1384 8.0559 120.7467 58.7730 31.9882 178.5979 114 I 3.6036 7.5657 118.8470 63.3330 37.2985 177.3086 115 N 4.4374 8.2610 118.0116 56.2058 38.3223 177.2928 116 G 3.6301 7.6306 106.5181 47.5238 0.0000 173.9120 117 P 4.2239 0.0000 0.0000 65.0821 31.2290 178.8311 118 I 3.5050 7.8154 118.6318 64.1259 36.9979 178.2673 119 K 3.9077 8.3010 120.8042 59.5569 31.9893 179.0016 120 K 3.9781 8.0932 118.7181 59.3233 31.7429 179.5836 121 V 3.5295 7.7720 117.8565 65.8627 31.6707 177.6858 122 L 4.1358 8.1509 118.8489 57.9471 41.4874 179.4788 123 A 4.2459 8.4846 122.1088 54.4754 18.0520 179.6827 124 S 4.1723 8.0015 111.8761 60.4249 62.9403 175.3268 125 K 4.3715 7.7176 120.5604 55.7233 32.1710 175.6722 126 N 4.1147 7.9833 114.2568 54.1802 36.6410 173.9248 127 F 4.3273 7.9052 117.5641 56.4766 40.3009 175.9631 128 G 4.2430 8.6400 114.8285 44.2738 0.0000 173.0060 129 D 4.4917 8.8214 118.7234 57.4204 40.8491 178.3276 130 K 3.8219 8.1858 119.6081 59.9073 32.0475 178.2778 131 Y 4.0575 8.0707 116.1201 60.9775 37.9078 177.8110 132 A 4.2213 8.3895 121.8005 55.2535 18.5462 179.4454 133 N 4.3029 8.7336 115.3002 56.3183 38.4786 177.4569 134 A 3.9142 8.0357 122.1583 55.0496 18.4143 179.7396 135 W 3.8955 8.5338 117.3147 59.8260 29.1211 178.6233 136 A 4.3399 8.4424 122.2659 54.5961 17.5352 179.8616 137 K 3.9837 7.7353 116.2702 59.2208 32.3620 179.0905 138 L 3.9445 7.5947 120.7682 58.0327 41.9462 179.0098 139 V 3.7935 8.2340 118.2872 66.1330 31.4053 177.8600 140 A 4.5055 8.0396 121.6926 54.2289 17.8841 179.8249 141 V 3.4041 7.2868 116.5196 66.1466 31.8496 178.0734 142 V 3.5146 7.5511 117.4378 66.0751 31.4038 177.7139 143 Q 3.9522 8.3208 117.7073 58.9245 28.2943 178.7793 144 A 4.0634 7.8278 120.4534 54.0346 18.4505 178.3540 145 A 4.4086 7.8819 117.5941 52.0269 19.5730 177.0300 146 L 4.2010 7.5503 122.8952 54.6465 41.9786 176.3185 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 2 S 8.19 4.45 0.00 4.05 4.10 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 0.00 0.00 0.00 3 V 8.30 3.34 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 1.04 0.00 0.00 0.94 0.00 0.00 4 Y 8.85 4.01 0.00 3.11 2.94 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 5 D 8.27 4.32 0.00 2.95 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 6 A 7.71 3.92 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 7 A 8.29 3.82 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 8 A 8.26 3.64 0.89 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 0.00 0.00 9 Q 7.57 4.10 0.00 2.15 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 10 L 7.42 3.76 0.00 1.53 1.57 0.75 0.64 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 11 T 8.16 4.33 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 1.20 0.00 0.00 12 A 8.35 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 13 D 7.93 4.26 0.00 2.83 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 14 V 7.49 3.47 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 0.91 0.00 0.00 0.85 0.00 0.00 15 K 8.35 3.85 0.00 1.87 1.78 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.54 7.81 16 K 8.13 3.91 0.00 1.95 2.01 0.00 1.58 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.59 7.81 17 D 8.20 4.64 0.00 2.76 2.54 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 18 L 8.22 3.74 0.00 1.57 1.22 0.54 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.24 4.04 0.00 1.97 2.04 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 20 D 8.68 4.48 0.00 2.95 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 21 S 8.30 3.22 0.00 3.23 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 W 8.82 4.34 0.00 3.75 3.24 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 23 K 8.06 3.88 0.00 2.03 1.89 0.00 1.80 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.72 7.81 24 V 7.13 3.80 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 1.13 0.00 0.00 1.09 0.00 0.00 25 I 7.78 3.48 1.62 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.36 0.74 0.00 0.00 26 G 7.00 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 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.17 4.15 0.00 3.89 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 28 D 7.17 4.63 0.00 2.68 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 0.00 0.00 0.00 0.00 29 K 8.04 3.80 0.00 1.73 1.70 0.00 1.15 0.00 0.00 0.79 0.00 0.00 2.13 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.23 1.36 7.81 30 K 8.00 3.99 0.00 1.82 1.78 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.51 7.81 31 G 8.22 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.42 4.43 0.00 2.69 2.72 0.00 0.00 6.97 8.19 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 33 G 8.32 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.88 3.56 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 0.94 0.00 0.00 0.95 0.00 0.00 35 A 7.86 4.05 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 36 L 7.91 3.77 0.00 1.80 1.56 0.78 0.64 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 37 M 7.76 3.52 0.00 1.61 1.94 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.69 0.00 38 T 8.18 3.98 4.27 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 1.30 0.00 0.00 39 T 8.01 3.88 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 40 L 7.70 3.81 0.00 1.51 1.19 0.86 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.43 4.56 0.00 3.19 2.93 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 42 A 7.98 4.19 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 43 D 8.08 4.63 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 44 N 8.29 5.26 0.00 2.97 2.91 0.00 0.00 7.02 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 45 Q 8.11 4.23 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.93 0.00 0.00 0.00 0.00 0.00 2.48 2.76 0.00 46 E 8.29 4.16 0.00 2.16 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 2.45 2.37 0.00 47 T 8.27 4.50 4.81 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 1.45 0.00 0.00 48 I 7.83 3.70 1.91 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 1.06 0.65 0.74 0.00 0.00 49 G 8.06 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 0.00 0.00 0.00 50 Y 7.81 4.42 0.00 2.98 2.43 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 51 F 8.19 4.90 0.00 3.19 3.06 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 52 K 8.19 3.94 0.00 1.93 2.27 0.00 1.52 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.44 7.81 53 R 8.10 3.94 0.00 1.82 2.07 0.00 3.27 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 54 L 8.15 4.26 0.00 1.81 1.75 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.85 3.77 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 0.00 0.00 0.00 56 N 8.44 4.53 0.00 2.71 2.73 0.00 0.00 6.95 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 57 V 7.96 3.84 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 0.52 0.00 0.00 0.19 0.00 0.00 58 S 8.41 4.30 0.00 3.94 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 59 Q 8.27 4.10 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.85 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 60 G 7.74 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 61 M 8.92 3.93 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.61 0.00 62 A 7.61 4.01 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 63 N 8.23 4.62 0.00 2.78 2.90 0.00 0.00 6.77 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.66 4.36 0.00 2.93 2.93 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 65 K 8.12 4.01 0.00 1.99 1.95 0.00 1.70 0.00 0.00 1.88 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 8.48 4.03 0.00 1.81 1.87 1.06 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.40 4.01 0.00 2.05 2.05 0.00 3.16 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.46 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 69 H 8.48 4.19 0.00 3.38 3.63 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 70 S 8.48 4.09 0.00 4.06 3.95 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 71 I 7.99 3.76 1.96 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 1.58 1.46 1.17 0.00 0.00 72 T 7.99 4.06 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 1.29 0.00 0.00 73 L 8.27 3.85 0.00 1.59 1.73 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.88 4.22 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.90 0.00 75 Y 7.88 4.01 0.00 3.14 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 76 A 7.67 3.56 0.11 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 77 L 7.41 3.42 0.00 1.44 1.12 0.87 1.05 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 78 Q 8.02 3.67 0.00 2.37 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.54 2.67 0.00 79 N 8.07 4.32 0.00 3.02 2.95 0.00 0.00 7.25 7.25 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 80 F 7.59 4.45 0.00 3.01 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 81 I 7.74 3.67 1.58 0.00 0.00 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 1.10 0.70 0.86 0.00 0.00 82 D 8.29 4.46 0.00 2.79 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 83 Q 7.77 4.42 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 2.68 2.62 0.00 84 L 7.48 3.92 0.00 1.51 1.66 0.77 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.85 4.55 0.00 2.65 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 86 N 8.16 4.82 0.00 2.71 2.66 0.00 0.00 7.09 7.25 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 87 P 0.00 4.22 0.00 2.07 1.70 0.00 3.64 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 1.97 2.06 0.00 88 D 8.42 4.55 0.00 2.92 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 89 D 8.25 4.37 0.00 2.84 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 90 L 8.32 3.94 0.00 1.84 1.75 0.80 0.69 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 91 V 8.27 3.57 2.35 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 1.09 0.00 0.00 1.03 0.00 0.00 92 C 7.99 4.27 0.00 3.15 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 93 V 7.81 3.76 2.36 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 0.95 0.00 0.00 1.30 0.00 0.00 94 V 8.23 3.73 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 0.40 0.00 0.00 95 E 8.59 4.01 0.00 2.01 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 2.31 2.58 0.00 96 K 7.85 3.78 0.00 1.77 1.69 0.00 0.63 0.00 0.00 0.99 0.00 0.00 2.67 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.24 1.40 7.81 97 F 8.51 4.65 0.00 3.42 3.24 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 98 A 8.73 3.98 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 99 V 7.78 3.57 2.22 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 1.01 0.00 0.00 0.99 0.00 0.00 100 N 8.02 4.37 0.00 3.21 2.90 0.00 0.00 6.97 8.04 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 0.00 101 H 7.91 4.51 0.00 3.36 3.43 0.00 5.83 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.36 3.73 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.70 0.91 0.00 0.00 103 T 7.92 3.89 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 1.30 0.00 0.00 104 R 7.76 4.30 0.00 1.81 1.82 0.00 3.34 0.00 0.00 3.32 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.64 0.00 105 K 7.85 3.82 0.00 1.94 1.96 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.58 7.81 106 I 7.59 4.02 1.94 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.73 1.02 0.00 0.00 107 S 8.75 4.47 0.00 4.08 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 0.00 108 A 8.54 4.01 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.94 4.01 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 0.00 110 E 8.48 4.14 0.00 2.23 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 2.44 2.39 0.00 111 F 8.84 4.14 0.00 3.16 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 0.00 112 G 8.32 3.89 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 0.00 0.00 0.00 113 K 8.06 4.14 0.00 1.96 1.89 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.57 7.81 114 I 7.57 3.60 1.53 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.07 0.73 0.00 0.00 115 N 8.26 4.44 0.00 2.92 2.89 0.00 0.00 6.70 7.24 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 0.00 116 G 7.63 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 0.00 117 P 0.00 4.22 0.00 2.04 2.12 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 118 I 7.82 3.50 1.93 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 1.16 0.74 0.58 0.00 0.00 119 K 8.30 3.91 0.00 1.90 1.99 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.46 1.54 7.81 120 K 8.09 3.98 0.00 1.93 1.80 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.59 7.81 121 V 7.77 3.53 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 0.70 0.00 0.00 0.87 0.00 0.00 122 L 8.15 4.14 0.00 1.92 1.98 0.95 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.48 4.25 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 0.00 124 S 8.00 4.17 0.00 4.02 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 0.00 125 K 7.72 4.37 0.00 2.09 1.92 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.54 7.81 126 N 7.98 4.11 0.00 2.58 2.73 0.00 0.00 6.85 6.96 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 0.00 127 F 7.91 4.33 0.00 3.14 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 0.00 128 G 8.64 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 0.00 129 D 8.82 4.49 0.00 2.75 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 K 8.19 3.82 0.00 1.76 1.57 0.00 1.60 0.00 0.00 1.53 0.00 0.00 3.22 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.42 7.81 131 Y 8.07 4.06 0.00 3.46 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 0.00 132 A 8.39 4.22 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 0.00 133 N 8.73 4.30 0.00 2.91 2.89 0.00 0.00 6.86 7.85 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 0.00 134 A 8.04 3.91 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 0.00 135 W 8.53 3.90 0.00 3.59 3.36 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 0.00 136 A 8.44 4.34 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 0.00 137 K 7.74 3.98 0.00 1.87 1.81 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.57 7.81 138 L 7.59 3.94 0.00 1.41 1.63 0.66 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.23 3.79 2.33 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 1.24 0.00 0.00 1.19 0.00 0.00 140 A 8.04 4.51 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.29 3.40 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.81 0.00 0.00 142 V 7.55 3.51 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 0.40 0.00 0.00 0.84 0.00 0.00 143 Q 8.32 3.95 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.66 2.70 0.00 144 A 7.83 4.06 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 0.00 145 A 7.88 4.41 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 0.00 146 L 7.55 4.20 0.00 1.68 1.51 0.52 0.69 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