NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3598 8.2893 120.3488 53.8267 34.4617 176.0737 2 L 4.4601 8.4275 119.1637 53.2988 43.4163 172.8882 3 S 5.3269 7.4698 110.7816 56.6992 63.9600 175.4378 4 E 4.4819 8.8616 122.6036 56.1006 30.8209 173.9447 5 Q 4.5007 8.5221 125.3426 54.9810 29.8969 175.4096 6 K 4.5426 8.7951 124.7902 54.7631 34.5800 176.2460 7 E 4.6994 8.2948 121.2609 55.6944 31.9350 174.7258 8 I 4.5863 8.3464 118.1963 59.8899 41.5218 172.8928 9 A 5.2863 8.4760 128.8946 50.8971 22.0308 175.0689 10 M 4.7731 8.6130 118.9950 54.8776 36.9375 173.0041 11 Q 5.1370 9.0431 122.0814 54.2499 32.7778 173.9275 12 V 4.7813 8.4044 124.9715 59.9774 34.5064 174.6371 13 S 4.6024 9.4563 119.2076 57.3835 64.1956 173.6865 14 G 3.7771 8.8352 113.3581 45.8847 0.0000 174.4585 15 M 4.2036 7.4251 122.0330 54.5833 30.4405 175.9379 16 T 4.3164 7.5484 110.1150 62.1640 68.4594 173.2641 17 C 4.7269 7.5516 118.7284 56.8636 34.7897 174.2742 18 A 4.0400 8.7857 125.9946 55.3708 17.7505 180.0594 19 A 3.9961 8.0132 118.7428 55.2173 18.3884 179.5833 20 C 4.3492 8.4735 116.7394 62.4001 28.2593 175.9393 21 A 3.9126 7.9923 121.5669 55.1164 18.0059 178.9604 22 A 3.9297 8.2489 119.5903 55.8398 18.3338 180.2522 23 R 4.0710 8.2542 115.7893 58.9226 29.9404 179.6153 24 I 3.8616 7.6877 119.7934 64.3708 37.2892 178.1533 25 E 3.9755 8.1007 119.2976 59.5292 29.1840 179.7019 26 K 4.2252 8.4097 117.1249 58.5058 32.1788 179.3619 27 G 3.8012 7.6773 106.5092 47.4037 0.0000 176.0777 28 L 4.0353 8.2180 122.5872 57.1437 41.4947 179.3375 29 K 3.9636 7.7452 117.4259 58.8059 32.1349 178.1389 30 R 4.1856 7.6253 116.4318 57.4926 30.6800 176.6238 31 M 4.2837 7.9713 120.6554 54.1694 32.5127 175.8186 32 P 4.2183 0.0000 0.0000 65.3484 31.7954 177.4765 33 G 3.8122 8.0212 106.4578 46.0688 0.0000 173.2235 34 V 4.4179 7.7141 120.4961 62.3940 32.6951 174.8090 35 T 4.4923 8.7545 120.8435 63.5546 68.7081 174.1569 36 D 5.0313 7.8821 118.4913 52.9781 45.7289 174.1403 37 A 5.2025 8.3283 120.8292 50.9933 22.5745 175.5284 38 N 5.2490 9.4037 118.1097 51.5653 43.0697 173.9212 39 V 4.7459 9.4408 123.5566 59.7440 34.2061 174.8374 40 N 4.5704 9.0560 124.9122 52.2535 39.4760 174.1376 41 L 4.0054 8.5699 128.1687 56.5832 42.7823 176.6060 42 A 4.1575 8.7698 131.7900 53.6302 17.5775 179.4740 43 T 3.9394 7.6245 110.4481 64.9276 68.9271 175.5828 44 E 3.9929 8.7108 119.5340 55.9363 28.2150 173.8089 45 T 4.6747 7.5974 116.7928 62.6902 70.0900 173.3870 46 S 5.0609 9.1615 122.5689 56.6765 64.8343 172.5427 47 N 5.4625 9.2746 124.0023 51.6205 41.8476 173.5180 48 V 4.9275 9.1165 124.0031 61.1013 35.6602 174.2950 49 I 5.0161 9.0152 127.3204 59.6875 40.6352 173.9358 50 Y 5.2349 8.0816 123.7543 55.6127 42.1334 174.0313 51 D 4.8330 9.2601 122.1040 53.0863 41.5420 175.0399 52 P 5.0040 0.0000 0.0000 62.6118 31.2604 177.0885 53 A 4.3233 7.7558 122.9536 53.8670 18.9766 178.5855 54 E 4.5336 8.0802 112.9476 56.0381 31.2133 175.5428 55 T 4.2347 7.7332 115.0310 62.4118 71.1179 173.3134 56 G 3.8026 8.0873 116.0316 43.4447 0.0000 173.1261 57 T 3.7665 8.7222 111.8922 64.4210 67.4889 175.8604 58 A 4.0362 8.0021 122.2228 54.9669 18.2991 179.2593 59 A 3.9756 7.8390 118.8625 54.9910 18.3373 180.0588 60 I 3.6486 7.5495 118.8082 64.5314 37.1795 178.5271 61 Q 4.0389 7.9877 118.1273 59.2879 28.4236 178.0532 62 E 3.9062 8.1908 121.2872 58.8770 29.4771 178.7256 63 K 3.9661 8.0703 118.8561 59.2556 32.5209 178.7392 64 I 3.9730 7.9230 120.3256 64.4948 37.0170 178.0070 65 E 4.0389 8.3942 119.5022 59.5019 29.1330 179.3577 66 K 4.0182 8.0514 116.5614 58.3495 32.1430 178.4239 67 L 4.0773 7.6174 118.7375 55.2877 41.6811 177.3791 68 G 3.7555 8.1101 107.1380 45.8850 0.0000 173.2219 69 Y 4.7834 7.4613 118.9022 56.6336 40.5425 173.3090 70 H 5.3400 8.6490 117.9782 54.4206 31.9941 173.8179 71 V 3.9216 9.4626 125.1058 61.7897 31.6568 177.7106 72 V 4.1739 8.3159 122.1385 59.9423 29.4144 175.4688 73 T 4.8246 7.8176 112.5932 59.6975 72.1655 173.5940 74 E 4.8938 8.7806 122.4286 54.5571 33.6115 173.9382 75 K 5.5290 8.7325 122.0922 55.4375 36.0532 174.6651 76 A 4.8017 9.1519 121.9441 50.9275 23.6495 174.5542 77 E 5.2625 8.5658 117.7048 54.8428 32.5204 175.4771 78 F 5.1468 9.2171 121.0223 55.6989 43.5262 173.2643 79 D 5.0932 9.2686 122.1547 52.2567 43.5420 175.7997 80 I 5.4278 8.1708 126.1842 58.4520 37.0762 174.1839 81 E 4.0343 7.9568 124.5646 57.5100 30.3797 177.3712 82 G 3.6116 8.9894 115.4512 45.8502 0.0000 173.5005 83 M 3.6479 7.1096 120.4517 55.4410 32.3447 175.7312 84 T 4.4808 7.8465 113.6599 60.4283 70.6403 173.0412 85 C 4.7185 7.5157 119.9995 57.5940 35.4312 173.5654 86 A 4.0841 8.4306 124.9513 55.4167 17.8083 179.8173 87 A 3.9956 8.0071 118.5882 55.3149 18.3145 179.6086 88 C 4.2688 8.1325 114.7937 62.8483 28.2971 175.6438 89 A 4.1457 8.1799 122.3609 55.6076 18.0173 179.2864 90 N 4.3062 8.5662 114.9972 56.5689 38.3590 177.7561 91 R 3.9346 8.0407 118.8111 59.4105 30.5166 178.8263 92 I 3.8990 7.6336 112.7244 63.5155 37.7235 177.5612 93 E 3.8560 8.5861 122.0673 59.1766 29.4780 178.4997 94 K 4.2365 8.1476 114.6481 57.2709 32.1250 176.3130 95 R 4.4537 7.7725 115.2674 58.0280 32.2760 177.7248 96 L 3.8669 8.1515 116.5997 57.8362 41.9444 178.0960 97 N 4.5829 8.4856 116.8073 55.6127 38.9507 176.1081 98 K 5.0435 7.7887 111.8887 54.5447 37.3449 179.9194 99 I 3.1284 8.1646 116.2154 61.9316 38.1306 176.4074 100 E 4.5945 9.3270 125.0521 53.9941 29.6987 172.3041 101 G 3.3725 7.7097 109.5866 43.9373 0.0000 171.2686 102 V 4.3075 8.0956 122.0976 61.3278 32.9265 176.4406 103 A 4.3116 8.9251 129.5894 54.7133 19.0996 177.5159 104 N 4.9612 8.2425 108.9993 53.0930 40.2122 174.3017 105 A 5.2324 8.5979 123.3841 50.7574 21.8843 173.2277 106 P 4.9589 0.0000 0.0000 62.2426 32.6873 175.6275 107 V 4.1869 8.9669 123.7804 61.1323 32.6509 174.8418 108 N 4.6543 8.7886 126.5419 53.4279 39.3334 174.6071 109 F 4.7946 8.6917 118.5171 56.8197 38.7677 175.9245 110 A 4.3801 7.4818 120.8854 53.1512 21.7616 176.9664 111 L 4.1942 8.4711 113.4017 54.4418 42.1473 176.4658 112 E 3.8204 8.1101 117.8071 57.2948 27.1622 173.6173 113 T 5.3866 7.5522 105.9890 60.2339 73.2405 172.7274 114 V 4.7639 8.7445 120.9183 60.4463 35.3164 174.3056 115 T 4.7730 8.6360 120.6185 62.9106 70.0556 173.5571 116 V 4.5779 9.1841 127.6799 61.0362 34.0820 173.6706 117 E 5.4151 9.3329 130.1178 54.7233 31.8460 174.2608 118 Y 5.3400 9.2738 124.2933 56.1165 42.5363 173.2984 119 N 4.9517 8.3071 117.9158 50.3330 39.2831 175.3827 120 P 4.6936 0.0000 0.0000 61.9786 30.1420 175.7310 121 K 4.4621 7.7671 117.2138 58.2102 35.9084 177.6660 122 E 4.6173 8.2142 112.0450 55.5136 31.7253 174.1856 123 A 4.7363 7.6902 120.3527 51.2170 22.8382 173.9360 124 S 4.5562 8.8786 111.7058 56.7285 65.3545 174.5489 125 V 3.7109 8.4993 118.2463 66.1399 30.8649 178.4897 126 S 4.1217 8.0727 114.6840 61.8362 62.7129 176.2458 127 D 4.3318 8.1794 121.4354 57.0495 40.4658 178.8591 128 L 3.8288 7.7610 119.1015 57.6583 41.6656 179.1045 129 K 3.8438 8.1202 118.4065 59.9897 31.7364 179.2371 130 E 4.0507 8.5259 118.3238 59.2868 29.0989 179.4079 131 A 3.9591 7.9862 120.4135 54.7122 18.6793 179.2620 132 V 3.7405 7.6000 116.2853 65.4688 31.5661 177.5751 133 D 4.3133 8.2852 117.6292 57.2067 41.0289 177.3580 134 K 3.9896 7.5191 119.3161 59.0548 32.3679 177.5860 135 L 3.9274 7.5498 117.3352 55.4906 41.9468 177.5335 136 G 4.0873 7.8384 105.0968 45.3808 0.0000 174.1324 137 Y 4.8500 7.1411 119.6636 57.5219 39.1846 173.7475 138 K 4.8572 8.3521 120.7964 56.5034 37.1079 175.2416 139 L 5.1664 8.5399 119.5025 52.9514 44.1756 176.4229 140 K 4.7756 9.0400 122.2845 54.5686 36.1302 174.8950 141 L 4.4978 8.3785 122.4935 52.8494 44.1252 176.0877 142 K 4.0868 8.0914 125.0900 57.1840 31.3612 175.6695 143 G 4.3004 8.9487 120.4986 45.7811 0.0000 173.0348 144 E 4.0281 7.7300 117.0735 56.6427 30.1559 176.2537 145 Q 4.2102 8.4181 117.1734 57.3859 30.4193 172.4812 146 D 4.7807 8.8421 126.2971 52.4872 41.3833 174.0615 147 S 4.3997 7.8626 116.3011 58.5022 63.0605 168.6612 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 8.29 4.36 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 2 L 8.43 4.46 0.00 1.83 1.65 0.92 0.33 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 3 S 7.47 5.33 0.00 3.97 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 4 E 8.86 4.48 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 5 Q 8.52 4.50 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.57 6.83 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 6 K 8.80 4.54 0.00 1.52 1.49 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.35 7.81 7 E 8.29 4.70 0.00 1.87 1.85 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 2.14 2.18 0.00 8 I 8.35 4.59 1.96 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.30 1.15 0.00 0.00 9 A 8.48 5.29 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 M 8.61 4.77 0.00 2.11 1.91 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.49 0.00 11 Q 9.04 5.14 0.00 2.12 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.65 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 12 V 8.40 4.78 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 0.64 0.00 0.00 0.83 0.00 0.00 13 S 9.46 4.60 0.00 3.87 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 14 G 8.84 3.78 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 0.00 0.00 0.00 15 M 7.43 4.20 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 16 T 7.55 4.32 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 1.23 0.00 0.00 17 C 7.55 4.73 0.00 2.95 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 18 A 8.79 4.04 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 19 A 8.01 4.00 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 20 C 8.47 4.35 0.00 3.12 3.04 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 21 A 7.99 3.91 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 22 A 8.25 3.93 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 23 R 8.25 4.07 0.00 2.06 2.06 0.00 3.29 0.00 0.00 3.18 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 24 I 7.69 3.86 2.06 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.94 0.94 0.00 0.00 25 E 8.10 3.98 0.00 2.17 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 2.44 2.50 0.00 26 K 8.41 4.23 0.00 1.84 1.89 0.00 1.70 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.53 7.81 27 G 7.68 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 28 L 8.22 4.04 0.00 1.71 1.78 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.75 3.96 0.00 1.88 1.86 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.65 7.81 30 R 7.63 4.19 0.00 1.93 1.97 0.00 3.22 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 31 M 7.97 4.28 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.47 0.00 32 P 0.00 4.22 0.00 2.33 2.19 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 33 G 8.02 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 34 V 7.71 4.42 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 0.99 0.00 0.00 0.99 0.00 0.00 35 T 8.75 4.49 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 1.30 0.00 0.00 36 D 7.88 5.03 0.00 2.66 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 37 A 8.33 5.20 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 38 N 9.40 5.25 0.00 2.58 2.66 0.00 0.00 6.50 8.52 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 39 V 9.44 4.75 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 0.70 0.00 0.00 0.92 0.00 0.00 40 N 9.06 4.57 0.00 2.86 2.74 0.00 0.00 6.39 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.57 4.01 0.00 1.60 1.56 0.93 1.10 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 42 A 8.77 4.16 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 43 T 7.62 3.94 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 44 E 8.71 3.99 0.00 2.10 2.41 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 2.12 2.35 0.00 45 T 7.60 4.67 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 1.23 0.00 0.00 46 S 9.16 5.06 0.00 3.83 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 47 N 9.27 5.46 0.00 2.69 2.67 0.00 0.00 6.40 8.33 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 48 V 9.12 4.93 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.00 0.00 0.00 49 I 9.02 5.02 1.83 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 1.22 0.34 0.85 0.00 0.00 50 Y 8.08 5.23 0.00 3.14 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 D 9.26 4.83 0.00 2.80 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 52 P 0.00 5.00 0.00 2.28 2.39 0.00 3.52 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 53 A 7.76 4.32 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 54 E 8.08 4.53 0.00 1.88 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 2.25 2.28 0.00 55 T 7.73 4.23 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 56 G 8.09 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 57 T 8.72 3.77 4.38 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 1.26 0.00 0.00 58 A 8.00 4.04 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 59 A 7.84 3.98 1.25 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 0.00 0.00 0.00 60 I 7.55 3.65 2.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.75 0.97 0.00 0.00 61 Q 7.99 4.04 0.00 2.30 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.37 0.00 0.00 0.00 0.00 0.00 2.63 2.43 0.00 62 E 8.19 3.91 0.00 2.18 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 2.30 2.31 0.00 63 K 8.07 3.97 0.00 1.92 1.83 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.53 7.81 64 I 7.92 3.97 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.90 1.02 0.00 0.00 65 E 8.39 4.04 0.00 2.16 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 2.46 2.54 0.00 66 K 8.05 4.02 0.00 1.95 1.84 0.00 1.57 0.00 0.00 1.86 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.51 7.81 67 L 7.62 4.08 0.00 1.32 0.82 0.85 1.07 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 68 G 8.11 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 69 Y 7.46 4.78 0.00 3.02 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 70 H 8.65 5.34 0.00 3.11 3.18 0.00 5.63 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 V 9.46 3.92 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 0.73 0.00 0.00 0.98 0.00 0.00 72 V 8.32 4.17 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 0.82 0.00 0.00 0.92 0.00 0.00 73 T 7.82 4.82 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 1.19 0.00 0.00 74 E 8.78 4.89 0.00 1.84 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 2.33 2.27 0.00 75 K 8.73 5.53 0.00 1.99 1.82 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.47 7.81 76 A 9.15 4.80 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.57 5.26 0.00 1.87 1.85 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 2.34 2.33 0.00 78 F 9.22 5.15 0.00 2.93 2.89 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 79 D 9.27 5.09 0.00 2.75 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 0.00 0.00 0.00 0.00 80 I 8.17 5.43 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 2.22 1.02 0.00 0.00 81 E 7.96 4.03 0.00 2.04 1.84 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 2.36 2.29 0.00 82 G 8.99 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 83 M 7.11 3.65 0.00 2.02 1.93 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 2.54 2.51 0.00 84 T 7.85 4.48 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 1.16 0.00 0.00 85 C 7.52 4.72 0.00 2.97 2.79 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 0.00 86 A 8.43 4.08 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 87 A 8.01 4.00 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 88 C 8.13 4.27 0.00 3.13 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 8.18 4.15 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 90 N 8.57 4.31 0.00 2.94 2.91 0.00 0.00 7.40 7.34 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 91 R 8.04 3.93 0.00 2.09 1.97 0.00 3.10 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 92 I 7.63 3.90 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.36 0.90 0.00 0.00 93 E 8.59 3.86 0.00 2.19 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 0.00 2.33 2.43 0.00 94 K 8.15 4.24 0.00 1.93 1.78 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.41 7.81 95 R 7.77 4.45 0.00 1.90 1.85 0.00 3.33 0.00 0.00 3.31 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 96 L 8.15 3.87 0.00 1.71 1.71 0.69 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.49 4.58 0.00 2.89 2.86 0.00 0.00 6.88 5.84 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 98 K 7.79 5.04 0.00 1.81 1.78 0.00 2.25 0.00 0.00 1.93 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.46 7.81 99 I 8.16 3.13 1.85 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.52 0.88 0.00 0.00 100 E 9.33 4.59 0.00 1.85 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 0.00 2.18 2.29 0.00 101 G 7.71 3.37 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 0.00 102 V 8.10 4.31 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 1.19 0.00 0.00 0.93 0.00 0.00 103 A 8.93 4.31 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 0.00 104 N 8.24 4.96 0.00 2.84 2.90 0.00 0.00 6.42 8.20 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 0.00 105 A 8.60 5.23 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 0.00 106 P 0.00 4.96 0.00 2.24 2.11 0.00 4.01 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 107 V 8.97 4.19 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 0.78 0.00 0.00 0.99 0.00 0.00 108 N 8.79 4.65 0.00 2.76 2.74 0.00 0.00 7.14 6.49 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 0.00 109 F 8.69 4.79 0.00 3.28 3.12 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 0.00 0.00 0.00 110 A 7.48 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.47 4.19 0.00 1.62 1.66 0.86 0.66 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 0.00 112 E 8.11 3.82 0.00 2.13 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 2.42 2.38 0.00 113 T 7.55 5.39 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 1.29 0.00 0.00 114 V 8.74 4.76 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 0.81 0.00 0.00 1.00 0.00 0.00 115 T 8.64 4.77 4.30 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 1.27 0.00 0.00 116 V 9.18 4.58 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 0.74 0.00 0.00 0.73 0.00 0.00 117 E 9.33 5.42 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 118 Y 9.27 5.34 0.00 3.04 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 0.00 119 N 8.31 4.95 0.00 2.55 2.75 0.00 0.00 7.24 7.97 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 0.00 120 P 0.00 4.69 0.00 2.13 1.86 0.00 3.60 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.72 0.00 121 K 7.77 4.46 0.00 1.69 1.81 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.27 1.33 7.81 122 E 8.21 4.62 0.00 1.91 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 2.20 2.22 0.00 123 A 7.69 4.74 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.88 4.56 0.00 3.88 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 0.00 125 V 8.50 3.71 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 1.15 0.00 0.00 1.01 0.00 0.00 126 S 8.07 4.12 0.00 3.91 3.90 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 0.00 127 D 8.18 4.33 0.00 2.78 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 0.00 128 L 7.76 3.83 0.00 1.72 1.40 0.50 0.49 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 0.00 129 K 8.12 3.84 0.00 2.05 1.88 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.14 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.67 7.81 130 E 8.53 4.05 0.00 1.97 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 2.32 2.49 0.00 131 A 7.99 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 0.00 132 V 7.60 3.74 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.94 0.00 0.00 133 D 8.29 4.31 0.00 2.77 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 0.00 134 K 7.52 3.99 0.00 1.85 1.94 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.41 7.81 135 L 7.55 3.93 0.00 1.38 1.00 0.83 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 0.00 136 G 7.84 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 0.00 0.00 0.00 137 Y 7.14 4.85 0.00 2.95 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 8.35 4.86 0.00 1.83 1.91 0.00 1.18 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.65 7.81 139 L 8.54 5.17 0.00 1.59 1.78 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 140 K 9.04 4.78 0.00 1.65 1.85 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.53 7.81 141 L 8.38 4.50 0.00 1.52 1.28 1.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 142 K 8.09 4.09 0.00 1.74 1.71 0.00 1.70 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.39 7.81 143 G 8.95 4.30 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 0.00 144 E 7.73 4.03 0.00 1.84 1.87 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 2.25 2.25 0.00 145 Q 8.42 4.21 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 5.28 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 146 D 8.84 4.78 0.00 2.85 2.86 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 0.00 147 S 7.86 4.40 0.00 4.03 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