NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 5.1047 0.0000 0.0000 62.9626 33.5176 174.4557 2 I 4.7154 8.1426 120.9845 59.6465 38.7626 170.3086 3 V 4.5467 8.8687 118.7836 60.0347 37.1738 173.1850 4 Q 5.5357 8.8181 123.1045 54.5003 30.4669 174.8517 5 N 4.8555 8.4057 122.7104 50.8044 39.6779 175.5521 6 L 3.9982 8.4099 117.5550 57.7244 41.5624 178.4905 7 Q 4.2733 7.7318 115.1539 55.3039 29.2126 175.4083 8 G 4.1341 8.0038 109.8344 46.0103 0.0000 174.8720 9 Q 4.3624 8.0702 117.3966 55.6626 30.6502 174.9062 10 M 4.9257 8.3757 119.2661 54.8879 33.1698 176.3961 11 V 4.5955 9.2378 116.0242 59.6494 36.7614 174.1883 12 H 4.7263 8.8517 123.1451 56.3658 30.4064 174.1771 13 Q 4.6552 8.5208 125.9656 53.8484 31.8778 175.0116 14 A 4.1949 8.4357 127.0983 51.4126 19.2907 177.4220 15 I 3.6908 8.1167 120.4822 61.1664 38.8760 176.2170 16 S 4.3423 8.4909 121.2309 57.2386 63.8157 173.4209 17 P 4.3353 0.0000 0.0000 66.0973 30.8493 178.8767 18 R 3.9649 8.0250 118.0501 59.1113 29.8621 178.8624 19 T 3.8716 7.8616 115.1687 66.6544 68.4838 176.1984 20 L 4.1105 7.8125 120.5249 58.1889 41.6549 179.5165 21 N 4.3455 8.4769 116.0846 56.0924 38.3577 177.2658 22 A 3.9914 8.2137 122.2599 54.9029 18.5287 179.3310 23 W 4.3669 8.5324 127.0307 60.8407 30.8577 177.9262 24 V 3.3401 8.0084 118.2184 66.3233 30.9532 178.2105 25 K 3.9456 8.1553 117.9466 59.0985 31.8086 179.5213 26 V 3.4555 7.9574 119.0386 66.0351 31.3633 178.2882 27 V 3.0514 7.0810 117.7587 65.6479 30.9431 177.8705 28 E 3.8117 7.4516 116.9841 59.3531 29.4001 178.6639 29 E 4.0252 7.7377 117.5768 58.4331 30.1660 177.9509 30 K 4.2022 8.2947 116.5274 55.6806 33.4111 177.2070 31 A 3.0498 8.0751 122.1745 53.5257 17.5241 179.0652 32 F 4.4957 6.6660 107.8980 57.9565 39.5746 175.7570 33 S 4.5760 7.5429 114.7036 57.4049 64.1209 173.3554 34 P 4.2710 0.0000 0.0000 66.3641 30.6040 178.6534 35 E 4.1474 8.2076 116.3423 58.7857 29.3551 179.3994 36 V 3.8340 7.8832 119.5585 64.4001 31.5338 178.6429 37 I 3.8528 7.9850 121.2129 63.9108 36.9798 176.5598 38 P 4.3613 0.0000 0.0000 65.9181 31.0904 178.1794 39 M 4.0767 7.8975 118.1441 58.3879 31.7482 178.3419 40 F 3.6064 8.5599 119.5637 61.2929 39.6445 176.8109 41 S 4.0630 8.1292 112.0695 61.1774 61.9875 175.9156 42 A 3.9449 7.9060 122.6303 55.0769 18.2771 179.0875 43 L 4.1588 7.8875 115.2511 55.7973 41.9959 177.8268 44 S 4.4082 7.0339 114.1104 57.4788 63.1910 173.5094 45 E 4.0266 8.0254 121.0108 58.3827 29.5553 177.4027 46 G 3.8231 8.9671 111.0242 45.4252 0.0000 172.9157 47 A 4.3495 7.6630 123.6194 52.0934 19.0241 178.1113 48 T 4.3725 8.9546 113.0376 60.4230 71.3916 174.5376 49 P 4.4399 0.0000 0.0000 65.6771 31.2846 178.7051 50 Q 3.9879 8.5086 118.5240 59.3283 29.0563 178.0625 51 D 4.4102 8.2218 119.7876 57.4988 40.8706 178.9208 52 L 4.0114 8.2328 119.4461 57.9712 41.6594 179.3887 53 N 4.5167 8.7212 116.7379 56.5171 38.2265 177.4061 54 T 3.9627 7.8907 116.4311 67.1087 68.7345 176.1090 55 M 4.3928 8.0356 120.0335 58.5123 31.8638 178.8867 56 L 4.3144 8.1296 119.1799 57.8506 41.6571 178.6471 57 N 4.7772 8.6753 114.1312 54.5211 38.7241 176.4384 58 T 4.4020 7.7038 111.0722 61.6031 69.5688 174.9875 59 V 3.7050 7.3223 123.2624 62.5910 31.9182 175.3068 60 G 3.9130 8.6411 116.7309 45.4918 0.0000 175.0071 61 G 3.7363 8.5337 111.2503 44.2908 0.0000 172.2320 62 H 4.2328 8.5601 110.3289 56.8860 26.3755 176.9951 63 Q 4.0210 8.1614 118.9130 58.8264 28.8192 177.7770 64 A 4.0201 8.0813 121.1675 55.2183 18.4910 179.3181 65 A 3.9541 8.0756 118.6267 55.7520 18.4972 179.6528 66 M 3.9620 8.3990 117.4630 58.4296 31.8860 179.1165 67 Q 3.9537 8.2795 118.3875 59.0629 28.8806 178.0654 68 M 3.9258 8.0980 119.3083 58.7124 32.1218 178.0312 69 L 3.8390 7.9325 120.0901 58.0662 42.2380 178.7694 70 K 3.9214 8.1642 119.6523 59.5199 32.0794 178.2623 71 E 3.8990 8.4237 119.7045 59.6550 29.6192 178.9470 72 T 3.8350 8.0858 115.8269 66.7030 68.4280 176.7645 73 I 3.8356 8.0233 121.8546 64.3402 37.1041 178.3016 74 N 4.3074 8.3226 117.6692 56.1754 38.3419 177.1935 75 E 3.8794 8.2069 120.0649 59.6310 29.4842 179.4139 76 E 3.5299 7.7216 117.6818 58.6908 29.3426 179.2082 77 A 3.4841 7.3240 120.7125 54.9186 18.4522 179.5064 78 A 3.9203 7.7836 119.2320 55.3462 18.4539 179.4695 79 E 3.8420 8.2256 117.8918 59.0260 29.7867 178.7022 80 W 4.2299 8.5294 128.8603 60.7187 30.5831 177.7210 81 D 4.4804 8.1033 117.5126 57.4237 40.3672 178.2486 82 R 3.9896 7.9640 118.1497 59.1099 30.1502 177.7040 83 L 4.3894 7.5932 115.7672 54.5775 43.2352 176.8456 84 H 4.6213 7.3628 115.6666 52.3611 29.0274 170.9800 85 P 4.3505 0.0000 0.0000 62.0459 32.1647 177.6140 86 V 3.7441 8.1729 120.2867 63.2967 32.1356 174.8190 87 H 4.7264 8.5750 122.9180 53.5588 30.0812 174.8099 88 A 4.1113 8.6425 127.7854 52.4384 19.0180 177.8187 89 G 4.0502 8.2246 110.3085 43.9703 0.0000 171.7217 90 P 4.4974 0.0000 0.0000 62.1816 32.3114 175.6681 91 I 4.0330 8.0991 120.5965 60.2276 37.6411 176.1528 92 A 4.1916 8.4498 129.0023 50.9319 19.0223 174.7531 93 P 4.4208 0.0000 0.0000 64.2037 31.7889 176.9422 94 G 3.9618 8.9814 109.5418 45.3919 0.0000 173.2426 95 Q 4.5785 7.7312 117.8720 54.6655 30.7160 174.5386 96 M 4.8336 7.9887 117.5754 52.9877 35.7366 175.9468 97 R 4.1713 8.6197 117.8368 56.5321 29.9651 176.0817 98 E 4.3483 8.6373 119.0235 55.1804 30.2973 175.2561 99 P 3.9299 0.0000 0.0000 62.6647 32.1423 176.9419 100 R 4.6962 9.2426 121.3701 54.7118 32.8640 178.1140 101 G 4.1169 9.6088 107.6573 48.4596 0.0000 176.1380 102 S 4.1657 8.1696 116.8852 61.1239 62.8724 176.1003 103 D 4.3830 7.9827 121.8425 57.2288 40.3922 178.6789 104 I 3.3207 7.1126 118.7625 63.7073 37.0747 177.4925 105 A 2.6157 7.4903 118.8125 51.5417 18.5099 178.2372 106 G 3.8563 7.4751 105.8331 45.4675 0.0000 175.1310 107 T 4.0941 7.8679 117.4029 65.6855 68.5948 175.6957 108 T 4.5782 7.8883 107.5373 60.9028 69.7439 173.4831 109 S 5.0174 7.8046 117.1484 56.7983 65.6913 173.7822 110 T 4.3635 8.3581 113.7501 60.5735 71.3716 175.8425 111 L 3.9086 8.1954 122.1481 58.3471 42.0493 178.8507 112 Q 3.8753 7.8875 117.5767 58.8525 28.6908 178.3804 113 E 3.4143 7.7818 119.0802 59.1890 29.3030 179.2113 114 Q 4.2761 7.9896 118.0249 59.3295 28.8129 179.3052 115 I 3.7995 8.0031 120.9001 64.1152 37.2368 178.5316 116 G 3.5301 8.2238 106.9778 47.7034 0.0000 175.7538 117 W 4.4076 8.3263 122.0617 59.7505 28.9695 178.7001 118 M 4.3375 8.4984 117.3121 57.2828 31.4306 177.7676 119 T 4.5245 7.6272 107.9118 60.7203 69.5995 173.7523 120 H 4.3575 7.3988 120.5258 56.3264 30.5359 174.4180 121 N 4.7703 7.7669 119.6691 50.8894 39.7998 171.4978 122 P 4.5529 0.0000 0.0000 60.9861 32.5174 174.7955 123 P 4.3564 0.0000 0.0000 63.0937 31.6791 175.9269 124 I 4.2346 8.1358 123.2704 59.6301 37.5443 175.5316 125 P 4.6089 0.0000 0.0000 61.6697 28.1142 176.8454 126 V 3.3405 7.5560 116.7763 64.7087 31.9175 178.1443 127 G 3.7681 7.9460 106.4453 47.3675 0.0000 175.4177 128 E 3.9099 7.9676 121.1442 58.7317 29.6383 179.4390 129 I 3.4492 7.6532 119.8917 64.3730 37.0419 177.8207 130 Y 3.4403 7.4300 120.2608 60.3624 38.5651 177.7709 131 K 3.7182 8.0881 120.7007 59.6887 32.1720 178.7277 132 R 3.9586 7.8665 118.0618 59.1181 30.0507 179.0358 133 W 4.4199 7.9392 118.0856 59.9432 29.0856 178.6483 134 I 3.5860 7.9693 119.9287 64.5243 36.4534 178.6479 135 I 3.7787 8.2068 120.9440 64.1593 36.7307 178.5231 136 L 4.0943 8.1774 120.1775 57.7316 41.4924 179.7125 137 G 3.5879 8.0697 105.6122 47.7805 0.0000 175.7457 138 L 3.9152 8.2678 121.8488 57.5998 41.4657 179.3396 139 N 4.3666 8.1878 115.0581 55.4257 38.6733 177.1265 140 K 4.1349 7.7295 121.6249 59.3065 32.4306 178.8623 141 I 3.8933 7.7884 112.9866 63.6304 37.5471 178.0522 142 V 4.4322 8.0355 115.3708 62.8029 31.3694 178.2537 143 R 3.9596 7.9143 118.4908 59.6938 29.7899 178.6034 144 M 4.1147 7.7669 116.6451 57.5077 31.8323 176.8013 145 Y 4.5995 7.4985 114.8417 56.7925 39.1384 175.8141 146 S 4.1107 8.0925 122.0420 59.2443 63.6578 172.1434 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 P 0.00 5.10 0.00 2.08 2.20 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.80 0.00 2 I 8.14 4.72 1.87 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 1.36 0.26 0.91 0.00 0.00 3 V 8.87 4.55 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 0.72 0.00 0.00 0.93 0.00 0.00 4 Q 8.82 5.54 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 5 N 8.41 4.86 0.00 2.97 2.93 0.00 0.00 6.21 6.67 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 6 L 8.41 4.00 0.00 1.65 1.79 0.91 0.88 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 7 Q 7.73 4.27 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.15 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 8 G 8.00 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.07 4.36 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.97 0.00 0.00 0.00 0.00 0.00 2.56 2.33 0.00 10 M 8.38 4.93 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 11 V 9.24 4.60 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 0.68 0.00 0.00 0.98 0.00 0.00 12 H 8.85 4.73 0.00 3.16 3.20 0.00 5.67 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 13 Q 8.52 4.66 0.00 1.93 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.69 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 14 A 8.44 4.19 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 15 I 8.12 3.69 2.09 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 1.30 0.83 0.93 0.00 0.00 16 S 8.49 4.34 0.00 3.91 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 17 P 0.00 4.34 0.00 2.31 2.32 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 18 R 8.02 3.96 0.00 1.91 2.02 0.00 3.13 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 19 T 7.86 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 1.18 0.00 0.00 20 L 7.81 4.11 0.00 1.97 1.81 0.96 0.80 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 21 N 8.48 4.35 0.00 2.94 2.89 0.00 0.00 6.96 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 22 A 8.21 3.99 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 23 W 8.53 4.37 0.00 3.35 3.31 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 24 V 8.01 3.34 2.31 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 0.94 0.00 0.00 1.00 0.00 0.00 25 K 8.16 3.95 0.00 1.89 1.79 0.00 1.87 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.61 1.57 7.81 26 V 7.96 3.46 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 0.94 0.00 0.00 0.96 0.00 0.00 27 V 7.08 3.05 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 0.25 0.00 0.00 -0.44 0.00 0.00 28 E 7.45 3.81 0.00 2.03 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 2.27 2.34 0.00 29 E 7.74 4.03 0.00 1.92 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 2.27 2.32 0.00 30 K 8.29 4.20 0.00 1.67 1.66 0.00 1.95 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.49 7.81 31 A 8.08 3.05 1.17 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 0.00 0.00 0.00 32 F 6.67 4.50 0.00 1.77 2.68 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 0.00 0.00 0.00 0.00 33 S 7.54 4.58 0.00 4.35 4.03 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 0.00 0.00 0.00 34 P 0.00 4.27 0.00 2.21 2.22 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.26 0.00 35 E 8.21 4.15 0.00 2.06 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 2.41 2.45 0.00 36 V 7.88 3.83 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 1.25 0.00 0.00 1.02 0.00 0.00 37 I 7.99 3.85 2.03 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 1.66 1.15 0.97 0.00 0.00 38 P 0.00 4.36 0.00 2.30 2.34 0.00 3.93 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.09 0.00 39 M 7.90 4.08 0.00 2.30 2.53 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.90 0.00 40 F 8.56 3.61 0.00 2.73 3.19 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 41 S 8.13 4.06 0.00 4.03 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 42 A 7.91 3.94 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 43 L 7.89 4.16 0.00 1.40 1.57 1.11 1.12 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 44 S 7.03 4.41 0.00 3.42 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 45 E 8.03 4.03 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.20 0.00 46 G 8.97 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.66 4.35 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 48 T 8.95 4.37 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 1.26 0.00 0.00 49 P 0.00 4.44 0.00 2.11 2.07 0.00 3.78 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 50 Q 8.51 3.99 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 51 D 8.22 4.41 0.00 2.88 2.68 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 0.00 0.00 0.00 0.00 52 L 8.23 4.01 0.00 2.01 1.69 0.97 0.65 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 53 N 8.72 4.52 0.00 2.95 2.97 0.00 0.00 7.04 7.70 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 54 T 7.89 3.96 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 1.27 0.00 0.00 55 M 8.04 4.39 0.00 1.77 2.22 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.50 0.00 56 L 8.13 4.31 0.00 1.96 1.81 0.88 0.67 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 57 N 8.68 4.78 0.00 2.77 2.93 0.00 0.00 7.05 7.57 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 58 T 7.70 4.40 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 1.37 0.00 0.00 59 V 7.32 3.70 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 0.94 0.00 0.00 1.21 0.00 0.00 60 G 8.64 3.91 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 0.00 0.00 0.00 61 G 8.53 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 62 H 8.56 4.23 0.00 3.59 3.65 0.00 5.63 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.16 4.02 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 64 A 8.08 4.02 1.34 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 0.00 0.00 0.00 65 A 8.08 3.95 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 66 M 8.40 3.96 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.94 0.00 67 Q 8.28 3.95 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.73 0.00 0.00 0.00 0.00 0.00 2.56 2.52 0.00 68 M 8.10 3.93 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 69 L 7.93 3.84 0.00 1.78 1.79 0.76 0.34 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 70 K 8.16 3.92 0.00 2.01 1.97 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 71 E 8.42 3.90 0.00 2.10 2.15 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 2.29 2.37 0.00 72 T 8.09 3.83 4.37 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 1.21 0.00 0.00 73 I 8.02 3.84 2.13 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.75 1.35 0.00 0.00 74 N 8.32 4.31 0.00 2.94 2.83 0.00 0.00 6.97 7.72 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 75 E 8.21 3.88 0.00 2.07 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 2.28 2.45 0.00 76 E 7.72 3.53 0.00 1.16 1.12 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 2.21 2.16 0.00 77 A 7.32 3.48 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 78 A 7.78 3.92 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 79 E 8.23 3.84 0.00 2.09 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 0.00 2.28 2.36 0.00 80 W 8.53 4.23 0.00 3.85 3.38 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 81 D 8.10 4.48 0.00 2.95 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 82 R 7.96 3.99 0.00 1.95 2.09 0.00 3.22 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 83 L 7.59 4.39 0.00 1.30 1.37 0.85 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 84 H 7.36 4.62 0.00 2.79 2.99 0.00 5.86 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.35 0.00 2.10 2.00 0.00 3.66 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.88 0.00 86 V 8.17 3.74 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 0.86 0.00 0.00 0.98 0.00 0.00 87 H 8.58 4.73 0.00 3.20 3.24 0.00 5.77 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 88 A 8.64 4.11 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 89 G 8.22 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 90 P 0.00 4.50 0.00 2.20 2.07 0.00 3.78 0.00 0.00 3.67 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 91 I 8.10 4.03 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.58 0.92 0.00 0.00 92 A 8.45 4.19 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 93 P 0.00 4.42 0.00 2.19 2.07 0.00 3.79 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 1.99 1.97 0.00 94 G 8.98 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 95 Q 7.73 4.58 0.00 2.26 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 96 M 7.99 4.83 0.00 1.70 1.94 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 97 R 8.62 4.17 0.00 2.04 2.06 0.00 3.14 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 98 E 8.64 4.35 0.00 2.07 1.99 0.00 0.00 0.00 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 2.33 0.00 99 P 0.00 3.93 0.00 1.40 0.49 0.00 3.64 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.96 0.00 100 R 9.24 4.70 0.00 1.89 2.10 0.00 3.40 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 101 G 9.61 4.12 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 0.00 0.00 0.00 102 S 8.17 4.17 0.00 4.06 4.16 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 0.00 103 D 7.98 4.38 0.00 2.72 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 0.00 104 I 7.11 3.32 1.43 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 0.63 -0.12 -0.34 0.00 0.00 105 A 7.49 2.62 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 0.00 106 G 7.48 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 T 7.87 4.09 4.33 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 1.22 0.00 0.00 108 T 7.89 4.58 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 109 S 7.80 5.02 0.00 4.23 4.40 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 0.00 110 T 8.36 4.36 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 1.18 0.00 0.00 111 L 8.20 3.91 0.00 1.72 1.63 0.80 0.66 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 0.00 112 Q 7.89 3.88 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 113 E 7.78 3.41 0.00 1.69 1.12 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 1.98 2.11 0.00 114 Q 7.99 4.28 0.00 2.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.68 0.00 115 I 8.00 3.80 1.94 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 1.43 0.79 0.90 0.00 0.00 116 G 8.22 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 0.00 117 W 8.33 4.41 0.00 3.45 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 0.00 118 M 8.50 4.34 0.00 2.00 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 119 T 7.63 4.52 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 0.00 120 H 7.40 4.36 0.00 3.42 3.36 0.00 5.89 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 7.77 4.77 0.00 2.59 2.60 0.00 0.00 7.01 7.69 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 0.00 122 P 0.00 4.55 0.00 2.26 2.05 0.00 3.89 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 123 P 0.00 4.36 0.00 2.24 2.14 0.00 3.78 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 124 I 8.14 4.23 1.94 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.53 0.72 0.00 0.00 125 P 0.00 4.61 0.00 2.30 2.21 0.00 3.70 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 126 V 7.56 3.34 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 1.02 0.00 0.00 127 G 7.95 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 0.00 128 E 7.97 3.91 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 129 I 7.65 3.45 1.28 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.90 0.11 0.00 0.00 130 Y 7.43 3.44 0.00 2.65 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 0.00 131 K 8.09 3.72 0.00 1.84 1.95 0.00 1.54 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.59 7.81 132 R 7.87 3.96 0.00 2.16 2.10 0.00 3.25 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 133 W 7.94 4.42 0.00 3.61 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 0.00 134 I 7.97 3.59 1.74 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.04 0.29 0.00 0.00 135 I 8.21 3.78 1.95 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 1.62 0.70 0.95 0.00 0.00 136 L 8.18 4.09 0.00 1.96 1.73 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.07 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.27 3.92 0.00 1.76 1.73 0.66 0.53 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 0.00 139 N 8.19 4.37 0.00 2.93 2.91 0.00 0.00 7.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 7.73 4.13 0.00 1.77 1.95 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.44 7.81 141 I 7.79 3.89 1.83 0.00 0.00 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 1.60 0.54 0.95 0.00 0.00 142 V 8.04 4.43 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 1.28 0.00 0.00 1.02 0.00 0.00 143 R 7.91 3.96 0.00 1.97 2.01 0.00 3.25 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 1.68 1.75 0.00 144 M 7.77 4.11 0.00 1.48 2.24 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.51 0.00 145 Y 7.50 4.60 0.00 3.06 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 0.00 146 S 8.09 4.11 0.00 4.09 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