NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2750 8.1627 120.6031 55.2140 33.2641 173.4971 2 K 4.3410 8.0496 127.0626 55.1677 30.5540 168.2293 3 V 4.1622 9.4145 123.8854 61.9111 33.2257 173.9708 4 I 4.5706 8.7782 130.5115 60.2044 38.9641 174.9380 5 L 4.6653 8.7573 127.1458 53.5403 43.2952 175.9918 6 L 4.2270 9.1125 126.0375 56.4418 43.1108 177.1177 7 E 5.6015 7.7924 115.2675 55.4951 30.9139 173.0385 8 P 5.5033 0.0000 0.0000 60.7784 33.9699 175.5875 9 L 5.7792 9.4233 121.6229 53.0395 43.6279 175.0826 10 E 5.0644 7.5886 123.3078 56.0554 26.7956 176.4478 11 N 5.0931 7.3226 116.2926 51.0575 41.6306 173.9171 12 L 5.3437 7.8199 118.5574 55.6264 39.5038 177.3222 13 G 4.0032 7.4209 114.7084 49.7202 0.0000 171.6301 14 D 3.9537 8.6798 116.4420 54.5552 40.9684 176.1708 15 V 4.2668 9.4449 121.0484 62.9764 30.5669 175.6790 16 G 3.7381 8.3089 112.2490 48.8922 0.0000 174.5935 17 Q 4.5507 7.6930 119.9462 55.7912 35.3168 173.6307 18 V 5.1781 8.1110 122.1176 64.3066 34.8339 173.8698 19 V 4.4993 8.2236 126.3603 61.7212 36.1207 172.8263 20 D 5.3242 8.5528 121.5184 51.5067 41.5674 177.8535 21 V 4.1690 7.8792 127.1664 64.3423 32.0669 175.7615 22 K 3.2798 8.1074 113.5789 57.1316 32.3188 175.3083 23 P 4.4679 0.0000 0.0000 61.4877 32.9675 178.6173 24 G 4.1513 9.7587 115.7295 50.7526 0.0000 175.2000 25 Y 2.3900 6.1086 111.6094 58.2071 39.1187 177.9545 26 A 3.9893 8.8664 125.9936 55.9087 21.2147 180.5219 27 R 3.4181 8.6770 105.8421 59.1576 29.7284 177.5307 28 N 4.7960 5.8968 115.2466 54.8136 39.7465 174.4783 29 Y 4.5538 8.3960 118.6159 59.2214 38.6392 177.0663 30 L 4.5949 8.3463 117.8822 54.8930 43.7166 177.8114 31 L 4.6502 7.9143 116.8591 53.8006 42.5951 176.7635 32 P 4.2617 0.0000 0.0000 67.0453 31.0368 178.9671 33 R 3.5064 6.9213 115.9718 57.5230 30.6524 175.6287 34 G 3.5726 6.6013 109.3694 45.4802 0.0000 173.5568 35 L 5.5394 8.1396 119.1528 53.9532 45.6570 176.2411 36 A 4.2228 7.2318 118.7766 53.3957 23.7857 174.1190 37 V 4.3253 7.6585 113.7700 62.4551 34.2136 173.4739 38 L 5.1014 7.7259 119.1427 54.1050 46.5001 177.8089 39 A 3.0502 9.6879 121.0499 50.8190 20.4950 176.6517 40 T 3.4927 9.0736 120.6680 62.2901 69.2705 172.9831 41 E 3.9872 8.6202 123.4929 59.3659 29.4082 179.6158 42 S 4.1157 8.1351 113.9807 61.8372 62.7062 176.3116 43 N 4.3168 7.9015 120.0793 55.6304 38.4875 177.1681 44 L 3.9156 7.9746 120.3715 58.2142 41.7712 179.4703 45 K 3.8751 8.6523 119.1154 59.5904 32.0798 178.9626 46 A 3.8978 8.2461 121.0011 55.3562 18.5015 178.6580 47 L 3.8500 8.2906 119.0344 58.1629 41.9409 178.7312 48 E 3.8662 8.6621 117.6666 60.1542 29.5761 179.1069 49 A 4.0000 8.4354 120.7677 55.6384 18.2925 179.8302 50 R 3.8739 8.6107 115.2944 59.1536 30.1993 179.2046 51 I 3.6729 8.1345 120.1828 64.1026 37.0747 177.8665 52 R 3.8307 8.4197 119.1813 59.9675 29.8419 177.9006 53 A 3.9238 8.1547 119.9281 55.8303 18.2536 179.2184 54 Q 3.8670 8.5916 117.0926 59.0986 29.0192 178.4694 55 A 3.9953 8.1255 121.9312 55.4042 18.3243 179.7701 56 K 3.8921 8.1731 116.5808 59.6851 32.0520 179.4273 57 R 3.9152 8.2651 118.5171 59.4893 29.9573 178.8558 58 L 3.9438 8.3609 118.2155 57.8781 41.5434 179.1935 59 A 3.9743 7.8480 119.3215 55.8440 18.4632 178.5676 60 E 3.8496 8.4637 117.4419 59.9062 29.4910 178.9805 61 R 4.7567 8.3200 116.8075 58.8222 29.2500 178.4970 62 K 3.6740 8.2257 119.0194 59.2445 32.0560 178.7483 63 A 3.9595 8.0861 120.6354 55.3292 18.3471 179.3589 64 E 3.8554 8.2204 116.1781 60.2816 29.4755 178.4032 65 A 3.8639 8.3919 119.4739 55.0582 18.0765 179.3512 66 E 3.8418 8.8180 114.8106 59.1685 30.0158 180.1300 67 R 3.9202 8.1518 117.9107 59.5957 30.1311 179.2135 68 L 4.0316 8.0938 118.7196 57.3712 41.5133 179.5701 69 K 3.9354 8.4248 119.3295 60.4709 32.3998 178.8600 70 K 3.9617 8.4651 120.3201 58.5230 31.8685 178.9450 71 I 3.6874 8.0706 119.6397 65.0742 37.0608 178.1484 72 L 3.9645 7.9735 118.1735 57.8302 41.6090 179.0254 73 E 4.0855 8.4807 118.9430 59.7632 29.4937 178.9620 74 N 4.4374 8.0888 116.5764 55.4733 39.4695 175.2118 75 L 4.1266 7.4333 120.7027 55.4096 42.5273 176.8559 76 T 4.5795 8.1971 110.9026 60.5289 70.9077 174.5532 77 L 4.6792 8.8148 125.2600 54.5422 41.4954 174.8048 78 T 5.1243 8.1762 114.7596 59.7585 71.2594 174.3017 79 I 4.5861 8.4687 123.9274 59.3495 42.0416 172.4845 80 P 4.6804 0.0000 0.0000 62.4010 31.5064 175.9347 81 V 4.1479 8.8286 125.9254 61.5633 33.9923 174.9491 82 R 4.6681 8.8640 125.7260 53.8669 30.6907 174.9885 83 A 3.3283 7.6095 132.2559 52.3801 23.0313 175.2524 84 G 4.0539 7.8368 112.6842 47.2666 0.0000 174.4852 85 E 4.7700 8.0733 116.1570 55.3569 30.7266 175.2461 86 T 4.7942 7.3518 115.4924 64.1542 73.4732 173.3806 87 K 5.0444 8.7560 124.2786 57.7107 32.7159 176.2005 88 I 4.0016 7.9318 122.4200 60.0263 38.5431 175.4307 89 Y 4.5567 7.1114 121.0139 60.9003 38.1320 177.1032 90 G 4.4067 7.7979 107.7253 43.8757 0.0000 171.9670 91 S 4.7373 8.3258 112.7456 56.6495 66.8478 174.4693 92 V 4.2388 8.4496 121.5750 61.9071 31.9786 173.8406 93 T 4.7252 12.0000 122.6683 60.3751 68.7004 175.1558 94 A 4.0302 8.9495 130.1287 55.4677 18.2498 179.8114 95 K 3.7816 8.0973 117.2248 59.8450 32.3160 178.2063 96 D 5.3352 8.2876 120.8477 57.0588 40.6948 179.1438 97 I 3.6093 7.9296 118.9985 65.3687 37.1445 177.9117 98 A 3.7548 8.3288 120.1500 55.6291 18.3115 179.3643 99 E 3.8886 8.7444 115.2102 59.9176 29.8109 178.6760 100 A 4.5309 8.5439 120.2274 55.3995 18.1098 179.4270 101 L 3.9084 8.7845 115.7087 59.4944 41.0157 179.4812 102 S 4.0705 8.0707 110.0426 60.6257 62.4405 174.7417 103 R 4.3321 7.3137 126.4999 57.5441 31.3106 177.7866 104 Q 4.1465 8.2279 118.1851 58.5158 28.4864 176.9561 105 H 4.6725 9.6642 117.3760 55.3645 31.8918 173.2388 106 G 3.8630 7.1486 113.6897 45.4495 0.0000 173.0864 107 V 3.8974 7.2692 121.4003 61.5026 32.4086 174.8798 108 T 4.8492 8.3309 123.8306 62.0204 69.9666 174.1553 109 I 4.6126 7.9635 125.9597 58.8770 40.7217 174.9831 110 D 4.5763 8.8321 124.3986 52.8045 40.7341 174.5097 111 P 4.0677 0.0000 0.0000 63.3707 30.4880 181.5968 112 K 3.3851 8.9673 112.7546 56.9153 34.2019 176.7387 113 R 4.0680 6.2518 124.2988 56.0838 30.8193 175.2651 114 L 3.8807 8.4877 114.1430 53.9527 40.2432 173.4747 115 A 4.5117 8.1567 123.3835 51.0013 19.0064 176.7001 116 L 4.3395 8.0061 124.1345 55.1037 44.0366 174.7005 117 E 3.9104 8.9896 129.4500 58.0135 28.3911 178.9542 118 K 4.2443 8.7846 120.9652 55.4559 33.8553 175.2811 119 P 4.3475 0.0000 0.0000 63.3123 31.7507 175.2151 120 I 4.5126 8.1823 119.6453 59.8157 39.7640 176.8173 121 K 4.3461 8.1841 121.6307 58.2441 33.8398 176.6213 122 E 4.1683 8.5213 117.4982 56.8414 29.3528 173.9928 123 L 3.5714 8.9662 125.3249 55.5026 43.5651 173.3255 124 G 4.0085 7.7443 107.1453 43.7641 0.0000 173.2315 125 E 4.6207 7.9800 121.1240 54.9528 32.6547 174.4312 126 Y 5.1268 8.6604 118.0166 56.5000 43.0391 174.3201 127 V 5.4226 8.4734 120.1984 60.5087 34.5407 174.1319 128 L 4.5695 9.3049 129.0519 53.9370 46.5653 174.0602 129 T 4.2913 7.8056 114.3875 60.7100 68.7656 173.0536 130 Y 4.9829 8.3402 128.3375 55.6393 40.4484 175.8744 131 K 4.4761 8.8698 124.8476 56.2420 33.5901 174.6247 132 P 4.7518 0.0000 0.0000 63.7554 33.1983 174.8689 133 H 4.7775 8.0913 117.6397 54.5408 32.6874 174.3945 134 P 3.6887 0.0000 0.0000 64.3627 32.2350 176.5919 135 E 4.6540 7.7272 111.2393 55.9356 30.7452 175.8387 136 V 4.2768 8.2773 114.6943 59.3597 32.5382 172.7676 137 P 4.9537 0.0000 0.0000 61.8327 33.1782 175.4754 138 I 4.7131 8.5866 122.2422 59.5112 40.1067 173.9230 139 Q 5.0981 8.7345 127.7065 54.9192 30.6696 174.8485 140 L 4.8753 9.2750 120.5679 53.4021 47.1988 175.5756 141 K 4.5487 8.7963 121.2105 56.0911 33.1515 174.8477 142 V 5.3149 9.1562 128.1185 61.0732 32.8023 174.0225 143 S 5.0702 8.4489 123.8626 56.9439 65.2050 173.5092 144 V 4.7663 8.5311 123.2207 60.1947 34.6824 174.5801 145 V 4.6829 8.6359 121.8536 60.9345 35.7716 173.3005 146 A 4.3940 8.6221 126.1836 52.3519 18.8101 178.3781 147 Q 4.1633 9.1892 120.1546 55.7045 28.5345 176.5395 148 E 4.1092 8.1744 124.5589 57.0323 30.1666 174.3590 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 M 8.16 4.27 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.71 0.00 2 K 8.05 4.34 0.00 1.95 1.68 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.49 7.81 3 V 9.41 4.16 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 0.91 0.00 0.00 0.98 0.00 0.00 4 I 8.78 4.57 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.80 0.91 0.00 0.00 5 L 8.76 4.67 0.00 1.60 1.57 0.94 0.42 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 6 L 9.11 4.23 0.00 1.71 1.64 0.93 1.03 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 7 E 7.79 5.60 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.63 0.00 8 P 0.00 5.50 0.00 2.06 1.94 0.00 3.48 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 2.04 2.07 0.00 9 L 9.42 5.78 0.00 1.89 1.56 0.98 0.88 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 10 E 7.59 5.06 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 11 N 7.32 5.09 0.00 2.77 2.73 0.00 0.00 6.59 6.74 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 12 L 7.82 5.34 0.00 1.61 1.62 0.93 1.15 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 13 G 7.42 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 14 D 8.68 3.95 0.00 2.87 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 15 V 9.44 4.27 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 0.73 0.00 0.00 0.98 0.00 0.00 16 G 8.31 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 0.00 0.00 0.00 17 Q 7.69 4.55 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 18 V 8.11 5.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.93 0.00 0.00 19 V 8.22 4.50 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.92 0.00 0.00 20 D 8.55 5.32 0.00 2.52 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 V 7.88 4.17 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 1.06 0.00 0.00 0.92 0.00 0.00 22 K 8.11 3.28 0.00 0.79 0.74 0.00 1.40 0.00 0.00 1.38 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.96 0.72 7.81 23 P 0.00 4.47 0.00 2.49 1.37 0.00 2.95 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 24 G 9.76 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 6.11 2.39 0.00 3.29 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 26 A 8.87 3.99 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 27 R 8.68 3.42 0.00 1.92 1.75 0.00 3.19 0.00 0.00 3.25 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.73 0.00 28 N 5.90 4.80 0.00 3.24 2.90 0.00 0.00 7.02 6.74 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 29 Y 8.40 4.55 0.00 3.05 2.97 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 30 L 8.35 4.59 0.00 1.67 1.71 1.11 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.91 4.65 0.00 1.83 1.69 1.02 1.07 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 32 P 0.00 4.26 0.00 2.21 2.26 0.00 3.92 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.49 0.00 33 R 6.92 3.51 0.00 1.94 1.94 0.00 3.21 0.00 0.00 3.25 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 34 G 6.60 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 35 L 8.14 5.54 0.00 1.64 1.62 1.03 1.13 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 36 A 7.23 4.22 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 37 V 7.66 4.33 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 1.10 0.00 0.00 0.94 0.00 0.00 38 L 7.73 5.10 0.00 1.59 1.47 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 39 A 9.69 3.05 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 40 T 9.07 3.49 4.34 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 1.24 0.00 0.00 41 E 8.62 3.99 0.00 2.01 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 0.00 2.40 2.37 0.00 42 S 8.14 4.12 0.00 4.04 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 N 7.90 4.32 0.00 3.10 2.89 0.00 0.00 7.03 6.85 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 44 L 7.97 3.92 0.00 1.68 1.76 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.65 3.88 0.00 1.83 1.83 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 46 A 8.25 3.90 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.29 3.85 0.00 1.76 1.86 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.66 3.87 0.00 2.18 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 2.47 2.52 0.00 49 A 8.44 4.00 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 50 R 8.61 3.87 0.00 1.86 2.00 0.00 3.14 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 51 I 8.13 3.67 2.03 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 0.75 0.91 0.00 0.00 52 R 8.42 3.83 0.00 1.90 2.21 0.00 3.13 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 53 A 8.15 3.92 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 54 Q 8.59 3.87 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 55 A 8.13 4.00 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 56 K 8.17 3.89 0.00 1.97 1.87 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.63 7.81 57 R 8.27 3.92 0.00 2.04 2.04 0.00 3.14 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 58 L 8.36 3.94 0.00 1.87 1.74 0.95 0.84 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 59 A 7.85 3.97 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 60 E 8.46 3.85 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 61 R 8.32 4.76 0.00 1.90 2.16 0.00 3.29 0.00 0.00 3.34 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.73 0.00 62 K 8.23 3.67 0.00 2.09 2.06 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.54 1.64 7.81 63 A 8.09 3.96 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 64 E 8.22 3.86 0.00 1.99 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 2.39 2.37 0.00 65 A 8.39 3.86 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 66 E 8.82 3.84 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 2.34 2.45 0.00 67 R 8.15 3.92 0.00 2.04 1.98 0.00 3.17 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 68 L 8.09 4.03 0.00 1.69 1.71 0.91 0.95 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 69 K 8.42 3.94 0.00 2.23 2.09 0.00 1.21 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.81 7.81 70 K 8.47 3.96 0.00 1.95 1.85 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.70 7.81 71 I 8.07 3.69 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.81 0.90 0.00 0.00 72 L 7.97 3.96 0.00 1.61 1.69 0.91 1.13 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 73 E 8.48 4.09 0.00 1.99 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 2.40 2.46 0.00 74 N 8.09 4.44 0.00 2.79 3.07 0.00 0.00 7.20 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.43 4.13 0.00 1.84 1.59 0.99 0.86 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 76 T 8.20 4.58 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 77 L 8.81 4.68 0.00 1.68 1.83 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.18 5.12 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 1.20 0.00 0.00 79 I 8.47 4.59 1.84 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 1.20 0.75 0.89 0.00 0.00 80 P 0.00 4.68 0.00 1.92 2.00 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 81 V 8.83 4.15 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 0.96 0.00 0.00 0.92 0.00 0.00 82 R 8.86 4.67 0.00 1.90 1.84 0.00 3.78 0.00 0.00 3.48 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.39 0.00 83 A 7.61 3.33 0.14 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 0.00 0.00 84 G 7.84 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 0.00 0.00 0.00 85 E 8.07 4.77 0.00 1.90 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 2.19 2.32 0.00 86 T 7.35 4.79 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 1.25 0.00 0.00 87 K 8.76 5.04 0.00 1.74 1.80 0.00 1.83 0.00 0.00 2.56 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.68 1.43 7.81 88 I 7.93 4.00 1.81 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.25 0.99 0.00 0.00 89 Y 7.11 4.56 0.00 2.97 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 90 G 7.80 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 S 8.33 4.74 0.00 3.85 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 92 V 8.45 4.24 2.60 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 0.95 0.00 0.00 0.98 0.00 0.00 93 T 12.00 4.73 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 94 A 8.95 4.03 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 95 K 8.10 3.78 0.00 1.83 1.82 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.77 1.53 7.81 96 D 8.29 5.34 0.00 2.81 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 97 I 7.93 3.61 1.85 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.82 0.78 0.00 0.00 98 A 8.33 3.75 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 99 E 8.74 3.89 0.00 2.08 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 2.33 2.37 0.00 100 A 8.54 4.53 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 0.00 101 L 8.78 3.91 0.00 1.82 1.90 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.07 4.07 0.00 4.24 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 0.00 103 R 7.31 4.33 0.00 1.85 1.92 0.00 3.48 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 104 Q 8.23 4.15 0.00 2.63 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.33 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 105 H 9.66 4.67 0.00 3.05 3.34 0.00 5.80 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 0.00 106 G 7.15 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 0.00 0.00 0.00 107 V 7.27 3.90 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 0.97 0.00 0.00 0.90 0.00 0.00 108 T 8.33 4.85 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 1.20 0.00 0.00 109 I 7.96 4.61 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.47 0.90 0.00 0.00 110 D 8.83 4.58 0.00 2.78 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 0.00 111 P 0.00 4.07 0.00 2.20 1.94 0.00 3.81 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 1.99 1.99 0.00 112 K 8.97 3.39 0.00 2.07 1.96 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.39 1.38 7.81 113 R 6.25 4.07 0.00 2.06 2.00 0.00 3.12 0.00 0.00 3.59 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 2.09 0.00 114 L 8.49 3.88 0.00 1.83 2.33 0.80 0.66 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 0.00 115 A 8.16 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.01 4.34 0.00 1.68 1.62 0.95 1.08 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 0.00 117 E 8.99 3.91 0.00 1.97 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 2.30 2.38 0.00 118 K 8.78 4.24 0.00 1.72 1.73 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.49 7.81 119 P 0.00 4.35 0.00 2.19 2.10 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 120 I 8.18 4.51 1.93 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.25 1.24 0.00 0.00 121 K 8.18 4.35 0.00 1.95 2.01 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.47 7.81 122 E 8.52 4.17 0.00 2.29 2.14 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 2.43 2.21 0.00 123 L 8.97 3.57 0.00 1.81 1.55 0.89 1.07 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 0.00 124 G 7.74 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 0.00 125 E 7.98 4.62 0.00 1.88 1.74 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 2.11 2.30 0.00 126 Y 8.66 5.13 0.00 2.97 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 0.00 127 V 8.47 5.42 2.14 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 1.03 0.00 0.00 1.02 0.00 0.00 128 L 9.30 4.57 0.00 1.63 0.84 0.70 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.81 4.29 4.08 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 0.00 0.00 1.06 0.00 0.00 130 Y 8.34 4.98 0.00 2.98 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 0.00 131 K 8.87 4.48 0.00 1.86 1.83 0.00 1.53 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.50 7.81 132 P 0.00 4.75 0.00 2.21 2.22 0.00 3.82 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 1.99 0.00 133 H 8.09 4.78 0.00 3.19 3.14 0.00 5.79 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 3.69 0.00 1.91 2.14 0.00 3.24 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.99 0.00 135 E 7.73 4.65 0.00 1.97 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 2.15 2.34 0.00 136 V 8.28 4.28 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.12 0.00 0.00 137 P 0.00 4.95 0.00 2.06 2.03 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 138 I 8.59 4.71 1.93 0.00 0.00 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 1.36 1.63 1.09 0.00 0.00 139 Q 8.73 5.10 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.54 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 140 L 9.27 4.88 0.00 1.75 1.61 0.97 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 141 K 8.80 4.55 0.00 1.85 2.02 0.00 1.48 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.45 7.81 142 V 9.16 5.31 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 1.07 0.00 0.00 1.09 0.00 0.00 143 S 8.45 5.07 0.00 3.87 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 0.00 144 V 8.53 4.77 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.91 0.00 0.00 145 V 8.64 4.68 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 0.90 0.00 0.00 0.87 0.00 0.00 146 A 8.62 4.39 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 0.00 147 Q 9.19 4.16 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.09 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 148 E 8.17 4.11 0.00 2.06 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 2.24 2.26 0.00