NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9672 8.3393 109.7371 46.0655 0.0000 174.5725 2 M 4.5711 8.8163 122.1736 53.9897 31.7790 173.1431 3 N 5.0758 7.6296 115.7175 50.8127 43.7061 173.1270 4 P 4.6253 0.0000 0.0000 62.8647 32.1281 174.9400 5 A 4.4626 8.0357 118.1381 53.2321 20.7304 177.1671 6 Y 3.4446 8.5496 109.0298 58.4424 35.7362 170.7876 7 R 3.8215 8.0511 114.6536 57.4804 27.2518 177.3448 8 K 4.2996 7.0353 115.8013 57.8110 33.5187 176.5295 9 A 4.1679 7.8483 120.1746 55.5418 18.8733 179.4020 10 M 3.9827 8.0415 116.6971 58.5794 32.0720 178.6021 11 L 3.9909 7.8399 119.8600 58.1830 42.3430 178.6550 12 E 3.9877 8.1931 118.6413 59.4629 29.3311 179.3026 13 S 4.1332 8.4623 113.4440 61.1797 62.4499 176.1406 14 E 3.9956 8.0356 121.1815 59.5070 29.2239 179.3570 15 I 3.8526 7.8528 119.8773 63.9508 36.6667 178.1046 16 Q 4.0259 8.1954 120.8531 59.3484 28.8245 178.6256 17 K 4.0732 7.7477 119.8782 59.3053 32.2155 178.4670 18 L 4.3388 7.6681 118.6560 58.3401 41.5977 179.7316 19 L 4.5233 8.2477 118.4919 58.0545 41.4221 179.6816 20 M 4.1882 8.0691 118.3956 58.4256 31.7624 178.3999 21 E 3.9370 8.3672 117.4437 59.4112 29.9740 178.9180 22 A 3.9042 8.1747 120.6074 55.0965 18.4774 179.2260 23 L 4.1646 8.6726 118.9571 58.8229 41.9965 179.3351 24 Q 4.0829 8.3051 116.2770 58.1278 28.6568 177.8069 25 Q 4.5006 7.6307 116.5324 55.6574 29.4320 176.8137 26 L 2.7734 7.7001 122.8002 55.8486 42.1351 177.3808 27 R 3.9428 8.1997 122.5826 57.0913 29.5610 175.7472 28 D 4.4068 7.6886 117.1151 52.4367 40.2674 172.4529 29 P 4.3313 0.0000 0.0000 65.4070 31.4421 178.3174 30 R 4.4671 7.1902 118.2469 54.3685 32.1591 171.9030 31 L 4.5737 7.8591 120.8543 52.6058 44.1576 177.2495 32 K 4.2290 8.5336 126.7462 56.1343 29.8848 177.8518 33 K 4.1258 8.0847 122.5727 58.6540 32.3990 178.2723 34 D 4.4492 7.6312 117.2066 55.9063 41.1752 176.1517 35 F 5.2733 7.8175 119.4261 56.2164 39.6822 174.9374 36 V 4.8933 7.6570 115.4459 61.7920 34.7400 172.3585 37 T 4.4151 8.2945 114.5499 61.1304 71.5262 171.8504 38 F 5.3792 8.5412 122.0034 56.5041 40.0968 174.8396 39 S 4.5202 8.8469 117.2150 59.3514 63.9915 173.5951 40 R 4.2622 7.6072 119.7078 55.5122 31.4381 174.7195 41 V 4.9571 8.1243 124.8370 61.2765 34.9609 174.3561 42 E 4.7770 9.3744 126.5410 54.9340 33.2909 174.9422 43 L 4.8457 9.0733 125.2674 53.7150 43.6368 176.7304 44 S 4.2738 8.8011 116.8490 57.7470 63.7811 174.3025 45 K 3.7371 8.9944 121.6594 59.7119 31.9564 176.5378 46 D 4.6928 8.0832 115.4614 53.6093 41.1948 176.6654 47 K 3.9637 7.9392 113.5077 56.9799 30.4322 176.4409 48 R 3.9856 7.5525 117.2471 58.0691 30.9186 175.8620 49 Y 4.7605 7.8327 115.5051 55.8853 42.8270 174.5934 50 A 4.7358 8.8728 122.5695 50.6567 22.3743 174.8887 51 D 5.2968 9.4372 123.7358 53.9305 42.7314 176.1084 52 V 4.6713 8.8933 124.3913 61.3413 33.9131 173.7962 53 Y 5.0425 9.4383 127.0290 56.9570 39.0660 174.8157 54 V 4.8608 9.1272 126.2272 61.7016 33.4245 174.8752 55 S 4.9786 8.9846 124.7036 56.4473 61.6093 172.5672 56 F 4.3973 8.6279 125.8976 57.3639 40.4110 173.7523 57 L 4.3946 7.2763 125.9852 54.9785 42.5387 176.3262 58 G 4.3651 7.3884 107.9976 43.5693 0.0000 174.3864 59 T 4.1898 8.2540 109.6418 60.8893 70.9679 173.2498 60 P 4.3134 0.0000 0.0000 65.7179 31.1147 178.3192 61 E 3.9084 8.0841 118.1292 59.2513 29.8966 178.1552 62 E 4.0533 8.1384 118.0787 59.3975 29.3223 178.9140 63 R 3.8237 8.3838 119.0893 59.5059 30.0533 178.5289 64 K 4.2656 7.8801 119.0555 58.9744 31.6381 178.6848 65 E 3.8910 7.9093 119.4013 59.6449 29.3833 179.0577 66 T 3.7348 7.4137 109.2255 64.5577 68.5456 176.6961 67 V 3.5182 7.6458 121.3763 65.7403 31.4133 177.9126 68 E 3.9548 7.8937 117.9768 59.2106 29.3144 179.1164 69 I 3.6579 7.6545 119.3949 64.3915 36.9702 178.2378 70 L 3.7525 7.7199 118.5489 57.9355 41.4686 179.2355 71 N 4.6901 8.2125 115.0924 55.9011 38.2317 177.6386 72 R 4.0974 8.3967 120.0660 59.2154 30.4605 178.5378 73 A 4.2920 8.1577 118.8081 53.0934 18.1782 179.0692 74 K 4.4048 8.0824 118.1149 59.8328 32.2366 179.1367 75 G 3.6778 8.2690 104.9942 47.7518 0.0000 175.1357 76 F 4.1045 8.3893 122.8177 61.0465 39.2083 176.9836 77 F 4.1961 8.3480 116.7348 60.8304 38.9454 177.8014 78 R 3.9534 8.5884 118.5284 59.5353 29.6211 178.4450 79 T 3.8451 7.9529 112.5914 64.8526 67.6269 175.5813 80 F 4.3432 7.7460 121.3393 61.4561 39.3069 177.1702 81 I 3.8959 7.7792 120.4329 63.6579 36.7001 177.8855 82 A 4.0427 7.5591 119.3949 53.5936 18.1963 179.1155 83 K 3.9792 7.6216 118.6109 59.0712 32.6219 178.0431 84 N 4.6029 7.5447 116.6506 54.2248 37.7068 174.7712 85 L 4.1585 7.6428 125.8411 53.9219 41.5362 178.5846 86 R 4.2677 8.2521 124.3461 55.7576 27.8554 175.8110 87 L 4.7849 7.4901 120.1738 52.5200 45.5464 174.9476 88 Y 4.2048 8.0782 120.1209 59.3216 39.1544 176.6665 89 V 3.9253 6.8623 113.9800 59.5936 34.1704 175.2267 90 A 4.6399 7.7594 123.9738 49.3831 21.1667 175.0198 91 P 4.2932 0.0000 0.0000 62.5924 32.5572 176.0970 92 E 3.9068 8.0503 121.8393 56.1403 30.0726 176.0509 93 I 4.2390 8.1183 128.7151 61.4525 36.4433 175.0378 94 R 3.9691 8.6217 126.6306 54.7133 31.0218 175.8526 95 F 4.6894 8.0370 123.4031 57.2945 40.0163 174.9341 96 Y 4.8983 8.9236 119.6220 55.4991 42.4567 175.4399 97 E 4.3924 8.4861 120.2428 56.2654 28.7583 176.3229 98 D 4.5910 7.8341 115.4500 55.8922 39.6202 172.4931 99 K 4.3846 7.0000 119.4799 53.8716 32.8611 175.6761 100 G 3.8461 8.0390 107.8323 44.5800 0.0000 170.6346 101 I 4.2269 7.6490 125.9065 58.3735 39.0377 174.0128 102 E 3.9232 8.7103 125.5907 57.2419 29.3465 174.9651 103 A 4.3871 8.0431 129.1545 52.1709 24.9697 175.2906 104 S 4.7388 7.8761 107.3707 56.4702 65.0403 171.9024 105 V 4.0456 7.0328 119.7530 59.7781 34.1558 174.7085 106 K 4.0961 7.9351 126.1429 56.9198 33.0140 175.3000 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.34 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 M 8.82 4.57 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 3 N 7.63 5.08 0.00 2.66 2.72 0.00 0.00 7.07 8.03 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 4 P 0.00 4.63 0.00 2.49 2.32 0.00 3.75 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 2.05 2.02 0.00 5 A 8.04 4.46 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 6 Y 8.55 3.44 0.00 3.07 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 7 R 8.05 3.82 0.00 1.96 2.02 0.00 3.18 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 8 K 7.04 4.30 0.00 1.84 1.66 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.59 1.45 7.81 9 A 7.85 4.17 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 10 M 8.04 3.98 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.56 0.00 11 L 7.84 3.99 0.00 1.76 1.81 0.92 0.98 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 12 E 8.19 3.99 0.00 2.21 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 0.00 2.33 2.32 0.00 13 S 8.46 4.13 0.00 4.07 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.04 4.00 0.00 2.24 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 2.34 2.36 0.00 15 I 7.85 3.85 2.02 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 1.39 0.75 0.92 0.00 0.00 16 Q 8.20 4.03 0.00 2.30 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.88 0.00 0.00 0.00 0.00 0.00 2.48 2.59 0.00 17 K 7.75 4.07 0.00 2.04 1.88 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.68 7.81 18 L 7.67 4.34 0.00 2.22 1.94 1.01 0.62 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 19 L 8.25 4.52 0.00 2.19 2.02 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 20 M 8.07 4.19 0.00 2.09 2.38 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.89 0.00 21 E 8.37 3.94 0.00 2.23 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 22 A 8.17 3.90 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 23 L 8.67 4.16 0.00 2.30 2.03 1.08 0.68 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 24 Q 8.31 4.08 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.53 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 25 Q 7.63 4.50 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.95 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 26 L 7.70 2.77 0.00 1.37 1.70 0.01 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 27 R 8.20 3.94 0.00 1.87 1.89 0.00 3.50 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.51 0.00 28 D 7.69 4.41 0.00 2.78 2.61 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 29 P 0.00 4.33 0.00 2.14 2.13 0.00 3.74 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 30 R 7.19 4.47 0.00 1.75 1.85 0.00 3.14 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 31 L 7.86 4.57 0.00 1.53 1.60 1.03 0.80 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 32 K 8.53 4.23 0.00 2.26 1.46 0.00 2.21 0.00 0.00 2.03 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.58 7.81 33 K 8.08 4.13 0.00 1.66 1.81 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.51 7.81 34 D 7.63 4.45 0.00 1.82 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 35 F 7.82 5.27 0.00 2.52 2.21 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 36 V 7.66 4.89 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.18 0.00 0.00 37 T 8.29 4.42 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 38 F 8.54 5.38 0.00 3.00 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 39 S 8.85 4.52 0.00 3.90 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.61 4.26 0.00 1.67 1.26 0.00 2.89 0.00 0.00 2.75 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.06 0.00 41 V 8.12 4.96 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 0.88 0.00 0.00 0.99 0.00 0.00 42 E 9.37 4.78 0.00 1.92 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 0.00 2.33 2.15 0.00 43 L 9.07 4.85 0.00 1.64 1.60 0.92 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.80 4.27 0.00 4.29 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 45 K 8.99 3.74 0.00 1.75 1.85 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.53 7.81 46 D 8.08 4.69 0.00 2.82 2.61 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 47 K 7.94 3.96 0.00 1.91 1.82 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.39 7.81 48 R 7.55 3.99 0.00 1.74 1.57 0.00 3.10 0.00 0.00 3.04 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.74 0.00 49 Y 7.83 4.76 0.00 3.00 2.87 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 50 A 8.87 4.74 1.13 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 51 D 9.44 5.30 0.00 2.96 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 52 V 8.89 4.67 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 0.87 0.00 0.00 0.69 0.00 0.00 53 Y 9.44 5.04 0.00 3.11 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 54 V 9.13 4.86 2.34 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 1.40 0.00 0.00 1.12 0.00 0.00 55 S 8.98 4.98 0.00 4.07 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 56 F 8.63 4.40 0.00 3.13 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 57 L 7.28 4.39 0.00 1.40 1.22 0.88 0.79 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 58 G 7.39 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 0.00 0.00 0.00 0.00 59 T 8.25 4.19 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 1.22 0.00 0.00 60 P 0.00 4.31 0.00 2.31 2.38 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 61 E 8.08 3.91 0.00 1.98 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 2.30 2.46 0.00 62 E 8.14 4.05 0.00 2.29 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 63 R 8.38 3.82 0.00 2.14 2.19 0.00 3.23 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 64 K 7.88 4.27 0.00 2.03 1.84 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.53 7.81 65 E 7.91 3.89 0.00 1.94 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 2.23 2.28 0.00 66 T 7.41 3.73 3.99 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 0.00 0.00 0.28 0.00 0.00 67 V 7.65 3.52 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 1.20 0.00 0.00 1.11 0.00 0.00 68 E 7.89 3.95 0.00 2.16 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 2.31 2.32 0.00 69 I 7.65 3.66 1.93 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.76 0.90 0.00 0.00 70 L 7.72 3.75 0.00 1.55 1.01 -0.31 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.21 4.69 0.00 2.84 2.92 0.00 0.00 7.29 8.61 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 72 R 8.40 4.10 0.00 2.01 1.98 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 73 A 8.16 4.29 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.08 4.40 0.00 2.19 2.05 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.65 1.70 7.81 75 G 8.27 3.68 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 0.00 0.00 0.00 76 F 8.39 4.10 0.00 3.04 3.17 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 77 F 8.35 4.20 0.00 3.62 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 78 R 8.59 3.95 0.00 1.99 1.97 0.00 3.07 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 79 T 7.95 3.85 4.32 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 1.28 0.00 0.00 80 F 7.75 4.34 0.00 2.92 3.13 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 81 I 7.78 3.90 1.81 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 1.48 1.92 0.86 0.00 0.00 82 A 7.56 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 83 K 7.62 3.98 0.00 1.72 1.76 0.00 1.86 0.00 0.00 1.88 0.00 0.00 3.16 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.41 7.81 84 N 7.54 4.60 0.00 2.87 2.77 0.00 0.00 5.19 5.60 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 85 L 7.64 4.16 0.00 1.73 1.63 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 86 R 8.25 4.27 0.00 1.78 1.90 0.00 3.15 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 87 L 7.49 4.78 0.00 1.51 1.50 0.90 0.90 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 88 Y 8.08 4.20 0.00 2.82 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 89 V 6.86 3.93 1.73 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 -0.48 0.00 0.00 0.59 0.00 0.00 90 A 7.76 4.64 1.13 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 91 P 0.00 4.29 0.00 2.01 2.13 0.00 3.67 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.88 0.00 92 E 8.05 3.91 0.00 1.91 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 2.32 2.29 0.00 93 I 8.12 4.24 1.57 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.83 -0.19 0.00 0.00 94 R 8.62 3.97 0.00 1.63 1.23 0.00 3.06 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 95 F 8.04 4.69 0.00 2.76 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 96 Y 8.92 4.90 0.00 2.61 2.63 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 97 E 8.49 4.39 0.00 2.23 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 2.40 2.29 0.00 98 D 7.83 4.59 0.00 3.02 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 99 K 7.00 4.38 0.00 1.52 1.52 0.00 1.80 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.32 7.81 100 G 8.04 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 I 7.65 4.23 1.84 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 1.44 0.88 0.85 0.00 0.00 102 E 8.71 3.92 0.00 2.10 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 2.27 2.30 0.00 103 A 8.04 4.39 1.22 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 0.00 0.00 104 S 7.88 4.74 0.00 3.75 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.03 4.05 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 0.77 0.00 0.00 0.88 0.00 0.00 106 K 7.94 4.10 0.00 1.87 1.71 0.00 1.85 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.31 1.39 7.81