NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3952 8.3044 118.1907 55.2338 32.5636 174.2185 2 H 4.4856 8.5667 120.2059 54.7259 30.8660 173.0709 3 L 4.8576 7.7595 125.9763 52.2223 45.9234 176.6163 4 T 4.0094 9.3673 113.9794 61.0558 70.6627 173.7262 5 P 4.1732 0.0000 0.0000 65.8464 31.4078 178.8514 6 E 3.9400 8.0326 116.7588 59.4566 29.5035 179.1334 7 E 3.9184 8.1215 118.5912 59.2175 29.5460 179.3337 8 K 3.8387 8.1738 119.8591 59.4776 32.2368 178.6915 9 S 4.0655 8.0982 113.2367 61.3778 62.3880 176.0863 10 A 4.0014 7.8909 122.9998 54.9833 18.1784 179.7919 11 V 3.4358 7.7760 116.9911 66.4253 31.5000 178.4791 12 T 4.0172 8.0766 109.3558 64.5192 68.4178 176.2755 13 A 4.0029 7.9821 122.9562 55.1607 18.7582 179.1450 14 L 3.9348 8.0045 118.2912 57.8418 42.1711 178.8584 15 W 4.4249 8.6282 128.4090 60.0492 30.4315 178.0611 16 G 3.7969 8.0336 104.7417 46.6884 0.0000 174.6893 17 K 4.5111 7.6911 118.4979 55.2750 32.8866 176.3941 18 V 3.6587 6.8805 120.6270 61.8436 31.8637 175.5983 19 N 4.4513 8.3701 125.9466 52.7395 39.0360 175.2870 20 V 3.4822 8.1327 128.7774 65.8849 31.6910 177.0228 21 D 4.3333 7.9298 118.8694 57.5594 40.8546 178.5384 22 E 3.8233 8.0985 118.7731 59.3608 29.7428 178.9784 23 V 3.5818 8.0431 118.8323 65.6641 31.5486 178.1320 24 G 3.7407 8.3968 106.1773 47.9443 0.0000 175.9643 25 G 3.6093 8.0719 108.4438 47.0971 0.0000 175.5116 26 E 3.8498 8.0740 121.0663 59.0051 29.7068 178.7989 27 A 3.9072 8.2092 121.1087 55.1557 18.5467 179.4081 28 L 3.9977 7.9929 119.0465 58.0763 42.1364 179.3038 29 G 3.5715 8.0171 105.7225 48.0300 0.0000 175.9078 30 R 3.8821 8.1692 121.0265 58.4714 30.0097 178.7355 31 L 3.9797 7.9552 120.2569 58.4893 41.9815 179.2930 32 L 4.0789 7.7734 119.7749 56.8423 41.2266 179.7249 33 V 3.5331 7.3149 117.7685 65.7719 31.6495 177.9316 34 V 3.5649 7.8442 117.0071 64.1119 32.8409 175.6232 35 Y 3.8910 7.1790 116.2659 54.5969 37.7314 174.2967 36 P 4.6986 0.0000 0.0000 63.8322 31.9856 177.6289 37 W 4.3780 7.8828 115.6050 59.0748 27.9742 177.8386 38 T 4.2402 7.6752 110.7147 64.0413 68.2354 175.9124 39 Q 4.4613 8.2062 121.3843 57.8393 28.4583 178.1158 40 R 3.8361 7.5691 116.5688 58.4245 29.4054 177.7770 41 F 4.3879 6.9535 114.9865 57.3581 39.3236 175.6178 42 F 4.5892 7.8970 118.0615 56.7517 39.8847 176.9056 43 E 3.9603 8.4898 123.2706 59.6375 29.3438 178.9705 44 S 4.5079 8.0444 110.0594 59.1532 63.3818 174.4345 45 F 4.7180 8.4987 119.9070 58.0201 40.0122 175.8740 46 G 4.0058 7.3947 105.8717 44.3125 0.0000 175.8508 47 D 4.6280 8.6414 128.0843 53.4969 40.7021 175.4307 48 L 4.8682 8.2797 127.1948 54.4539 42.8084 178.3004 49 S 4.2940 8.0124 115.6799 60.6586 63.3520 174.7704 50 T 4.7388 7.4220 109.5481 58.3115 72.9400 172.8668 51 P 4.2518 0.0000 0.0000 65.9093 31.4779 178.8333 52 D 4.3314 8.0625 117.0895 57.0593 40.5595 178.4816 53 A 4.0000 7.8384 120.8161 54.9554 18.6371 179.5972 54 V 3.6749 8.1818 117.1477 66.6064 31.4880 178.3426 55 M 4.2081 8.2807 117.2800 57.6443 31.8366 178.0850 56 G 3.9834 7.6445 103.1740 43.8506 0.0000 173.3312 57 N 4.4246 7.4836 121.3159 52.7453 39.3763 173.8856 58 P 4.2900 0.0000 0.0000 65.7537 31.3393 178.6037 59 K 3.7633 8.2351 118.4648 58.7261 31.7562 179.4409 60 V 3.6558 7.8295 118.3288 66.0023 31.5445 178.0523 61 K 3.9456 7.9279 117.6819 59.3122 31.8491 179.2710 62 A 3.9461 7.9737 121.0262 55.4773 18.3319 179.2256 63 H 4.3262 8.5953 117.2885 59.2379 29.9486 177.5472 64 G 3.6725 8.5461 108.1157 47.7982 0.0000 175.4796 65 K 3.9707 8.0937 122.1057 58.9671 32.1886 178.7731 66 K 3.9599 8.0503 119.9340 59.4692 32.1787 178.9658 67 V 3.6047 7.8629 118.4399 66.1283 31.5183 177.8265 68 L 4.3867 8.2969 119.8057 57.4551 42.0117 178.9829 69 G 3.7618 8.3999 106.0720 48.0232 0.0000 175.6134 70 A 4.1901 8.0192 122.3007 54.5817 18.6885 179.2013 71 F 4.3465 8.5369 119.4761 61.4379 39.5891 177.1974 72 S 4.1407 8.8921 113.2618 61.7955 62.3482 176.0488 73 D 4.5584 8.2656 120.8613 56.9521 40.4830 178.9533 74 G 3.5564 7.9181 106.6237 47.3253 0.0000 175.3110 75 L 3.9330 7.1532 118.4119 55.9811 41.7050 178.2702 76 A 4.2036 7.3919 119.6376 53.1977 19.2903 176.8280 77 H 4.8634 7.9737 115.3557 54.7078 29.8281 175.3258 78 L 3.9898 8.0987 122.2475 57.8762 42.1146 177.0411 79 D 4.6427 7.8873 115.8752 55.4050 42.0265 176.0615 80 N 5.0117 8.2849 118.2433 51.3407 39.4419 174.6290 81 L 4.0675 7.8540 123.0833 57.6909 41.8395 179.2841 82 K 4.0668 8.0972 118.1059 59.6062 31.8561 179.5106 83 G 3.6083 7.7897 104.5704 47.9811 0.0000 175.5607 84 T 3.7965 7.7033 117.2320 65.7864 68.6633 175.8005 85 F 4.6512 8.0897 117.0037 57.0051 39.2087 177.3325 86 A 4.0695 7.5857 122.0509 55.8887 18.1716 180.3979 87 T 3.8527 7.8568 113.3836 66.8691 68.6262 176.8883 88 L 4.1654 7.9901 120.3700 57.4812 41.6919 179.3152 89 S 4.4229 8.5290 115.1465 61.0374 62.3237 176.0073 90 E 3.9158 8.2043 121.2244 59.3305 29.1746 179.1390 91 L 3.9158 7.9913 120.2737 58.6420 42.1166 178.8680 92 H 4.2589 8.4778 116.0516 58.7118 28.4247 177.1915 93 C 3.5530 7.8376 120.8265 62.2733 31.1481 175.3689 94 D 4.3833 8.1984 120.2954 56.5849 40.5774 177.5697 95 K 4.2376 7.7376 116.5978 57.5510 33.3851 177.3606 96 L 4.2183 7.6472 116.6971 54.5940 42.4392 176.1080 97 H 4.1613 7.2504 113.1618 56.6652 26.4717 175.1959 98 V 3.7780 7.9167 118.8510 61.0955 32.3746 174.8175 99 D 4.3536 8.7632 127.2117 53.8616 41.5864 175.1712 100 P 3.2162 0.0000 0.0000 64.6463 31.8013 177.8951 101 E 3.8769 8.0620 118.6296 59.4026 29.2142 178.5275 102 N 4.3173 8.0114 116.4197 56.1679 38.4988 177.3060 103 F 4.4498 7.4225 119.3541 60.5368 38.9158 177.9345 104 R 4.0300 7.9442 117.4387 59.0008 30.0591 178.7804 105 L 3.8245 7.8948 118.9517 57.6572 41.5329 179.2725 106 L 4.0986 8.2589 120.5293 57.9361 41.9799 179.1397 107 G 3.7029 8.0765 105.6520 47.8731 0.0000 175.6966 108 K 4.0250 8.0091 121.2763 59.1785 32.0078 179.6824 109 V 3.6295 7.8229 118.3210 65.8384 31.3794 177.7333 110 L 3.8730 8.3269 120.6102 58.1022 41.8495 179.1815 111 V 3.5556 7.8819 118.1510 66.2259 31.5349 177.6881 112 C 4.0604 8.0239 116.4492 62.9077 27.8643 176.4108 113 V 3.5422 8.0255 119.9779 65.9161 31.0313 178.1035 114 L 3.8471 7.9405 118.7442 57.6407 41.3675 179.3768 115 A 3.6981 7.4580 120.7218 55.1682 18.0315 179.2394 116 H 4.1524 7.8836 116.0903 59.5921 30.0204 176.7691 117 H 3.9793 8.1885 119.4091 58.5612 29.8630 176.4266 118 F 4.6188 8.4235 117.9256 56.1628 39.9031 177.2023 119 G 3.9461 8.7467 108.5553 46.1740 0.0000 177.7049 120 K 4.0938 8.8598 122.7532 59.1737 32.5117 177.8909 121 E 4.0570 7.8803 120.1603 58.6469 30.0434 177.1097 122 F 4.5235 8.0972 123.0313 57.0383 37.8599 175.0321 123 T 4.1737 7.3513 115.7282 60.2786 71.3448 173.5116 124 P 4.1638 0.0000 0.0000 65.5703 31.4522 177.2579 125 P 4.2455 0.0000 0.0000 65.2945 31.2433 178.8836 126 V 3.5316 7.3704 116.9069 65.8744 31.4242 177.7142 127 Q 3.5241 7.9166 119.4245 59.1908 28.7753 178.3236 128 A 4.1101 8.0334 121.3379 55.0365 18.4215 179.5567 129 A 3.9004 7.9156 118.9452 55.5909 18.4942 179.5183 130 Y 3.8661 8.2179 115.2393 61.1901 37.8908 178.8403 131 Q 4.2103 8.7086 119.6450 58.8294 28.7305 178.9700 132 K 3.9753 7.9313 119.3146 59.3727 32.0575 179.6434 133 V 3.4953 7.6569 118.2680 66.1616 31.4972 178.5981 134 V 3.8103 8.4757 112.4028 64.2665 31.2935 178.4701 135 A 4.1448 8.1970 120.9391 55.0599 18.2131 179.9424 136 G 3.4957 8.3110 104.4412 47.8854 0.0000 176.2105 137 V 3.4102 8.0379 120.5195 65.5371 31.6293 178.0653 138 A 3.8802 8.0376 120.6470 55.1387 17.9820 179.4079 139 N 4.3159 8.1953 114.1318 56.2907 38.7678 177.1549 140 A 4.1605 8.0696 122.2401 55.2625 18.6414 179.7175 141 L 3.8333 7.9490 116.9447 56.8782 41.4165 178.4713 142 A 4.5391 7.6772 118.8296 52.7494 18.8723 178.4233 143 H 4.2893 8.0322 117.4403 58.3728 29.9717 175.8239 144 K 4.4925 8.0056 117.7318 56.1438 32.1473 176.1788 145 Y 4.1447 7.8910 117.8251 58.5149 38.3680 175.8556 146 H 4.4527 8.3417 117.7216 56.1712 28.2736 173.2819 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 8.30 4.40 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 2 H 8.57 4.49 0.00 3.17 3.23 0.00 5.69 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.76 4.86 0.00 1.51 1.41 0.79 0.87 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 4 T 9.37 4.01 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 1.23 0.00 0.00 5 P 0.00 4.17 0.00 2.15 2.12 0.00 3.57 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 2.16 0.00 6 E 8.03 3.94 0.00 2.02 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 2.38 2.44 0.00 7 E 8.12 3.92 0.00 2.10 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 2.27 0.00 8 K 8.17 3.84 0.00 1.73 1.74 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.36 7.81 9 S 8.10 4.07 0.00 3.93 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 10 A 7.89 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 11 V 7.78 3.44 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 0.65 0.00 0.00 0.46 0.00 0.00 12 T 8.08 4.02 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 1.20 0.00 0.00 13 A 7.98 4.00 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 14 L 8.00 3.93 0.00 1.86 1.95 -0.18 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.63 4.42 0.00 3.83 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.03 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 17 K 7.69 4.51 0.00 1.98 2.05 0.00 1.69 0.00 0.00 1.49 0.00 0.00 3.17 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.44 7.81 18 V 6.88 3.66 1.01 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 0.75 0.00 0.00 19 N 8.37 4.45 0.00 2.71 2.58 0.00 0.00 6.83 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.13 3.48 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 1.24 0.00 0.00 0.98 0.00 0.00 21 D 7.93 4.33 0.00 2.82 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 22 E 8.10 3.82 0.00 1.95 1.82 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 2.23 2.27 0.00 23 V 8.04 3.58 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 0.96 0.00 0.00 0.65 0.00 0.00 24 G 8.40 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 25 G 8.07 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 26 E 8.07 3.85 0.00 2.15 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 2.24 2.32 0.00 27 A 8.21 3.91 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 28 L 7.99 4.00 0.00 1.77 1.63 0.88 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.02 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 30 R 8.17 3.88 0.00 1.81 1.92 0.00 3.09 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.78 0.00 31 L 7.96 3.98 0.00 1.89 1.89 1.01 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.77 4.08 0.00 1.83 1.67 0.77 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.31 3.53 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 0.70 0.00 0.00 0.94 0.00 0.00 34 V 7.84 3.56 1.49 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 -0.06 0.00 0.00 0.72 0.00 0.00 35 Y 7.18 3.89 0.00 2.63 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.70 0.00 2.23 2.09 0.00 3.82 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 2.19 1.96 0.00 37 W 7.88 4.38 0.00 3.55 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.68 4.24 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 39 Q 8.21 4.46 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 40 R 7.57 3.84 0.00 1.66 1.94 0.00 3.04 0.00 0.00 2.79 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.50 0.00 41 F 6.95 4.39 0.00 1.88 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 0.00 0.00 0.00 42 F 7.90 4.59 0.00 2.80 2.05 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 43 E 8.49 3.96 0.00 1.99 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 2.21 0.00 44 S 8.04 4.51 0.00 4.12 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 0.00 45 F 8.50 4.72 0.00 3.11 3.10 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 46 G 7.39 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 47 D 8.64 4.63 0.00 2.65 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 48 L 8.28 4.87 0.00 1.66 1.62 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.01 4.29 0.00 4.05 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 50 T 7.42 4.74 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 1.21 0.00 0.00 51 P 0.00 4.25 0.00 2.15 2.09 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 52 D 8.06 4.33 0.00 2.67 2.70 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 53 A 7.84 4.00 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 54 V 8.18 3.67 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 0.99 0.00 0.00 0.97 0.00 0.00 55 M 8.28 4.21 0.00 1.97 2.09 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 2.60 2.90 0.00 56 G 7.64 3.98 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 0.00 0.00 0.00 57 N 7.48 4.42 0.00 2.94 2.83 0.00 0.00 6.82 8.73 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 58 P 0.00 4.29 0.00 2.24 2.25 0.00 3.71 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.24 3.76 0.00 1.50 0.74 0.00 1.56 0.00 0.00 1.46 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.10 1.22 7.81 60 V 7.83 3.66 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 1.08 0.00 0.00 1.00 0.00 0.00 61 K 7.93 3.95 0.00 1.84 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.71 7.81 62 A 7.97 3.95 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 63 H 8.60 4.33 0.00 3.52 3.51 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.55 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 0.00 0.00 0.00 65 K 8.09 3.97 0.00 1.93 2.01 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.64 7.81 66 K 8.05 3.96 0.00 1.93 1.96 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.51 1.51 7.81 67 V 7.86 3.60 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.94 0.00 0.00 68 L 8.30 4.39 0.00 2.02 1.81 0.77 1.06 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 69 G 8.40 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 70 A 8.02 4.19 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.54 4.35 0.00 3.20 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.89 4.14 0.00 4.59 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 0.00 73 D 8.27 4.56 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 74 G 7.92 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.15 3.93 0.00 1.44 1.39 -0.42 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.39 4.20 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 77 H 7.97 4.86 0.00 3.09 3.15 0.00 5.83 0.00 0.00 0.00 0.00 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.10 3.99 0.00 1.47 1.63 0.76 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.89 4.64 0.00 2.68 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 80 N 8.28 5.01 0.00 2.59 2.59 0.00 0.00 7.07 6.30 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 81 L 7.85 4.07 0.00 1.75 1.80 0.87 1.08 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 82 K 8.10 4.07 0.00 1.75 1.81 0.00 1.54 0.00 0.00 1.41 0.00 0.00 2.86 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.44 7.81 83 G 7.79 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 84 T 7.70 3.80 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 0.52 0.00 0.00 85 F 8.09 4.65 0.00 3.14 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 86 A 7.59 4.07 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 87 T 7.86 3.85 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 88 L 7.99 4.17 0.00 1.90 1.88 1.12 0.91 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 89 S 8.53 4.42 0.00 4.04 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 90 E 8.20 3.92 0.00 2.21 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 2.56 0.00 91 L 7.99 3.92 0.00 1.79 1.88 0.91 1.10 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 92 H 8.48 4.26 0.00 3.74 3.75 0.00 5.86 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 93 C 7.84 3.55 0.00 1.23 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 0.00 0.00 0.00 0.00 94 D 8.20 4.38 0.00 2.74 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 95 K 7.74 4.24 0.00 1.80 1.80 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.36 7.81 96 L 7.65 4.22 0.00 1.74 1.63 0.72 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.25 4.16 0.00 3.46 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.92 3.78 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 0.11 0.00 0.00 0.52 0.00 0.00 99 D 8.76 4.35 0.00 2.79 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.22 0.00 1.92 1.77 0.00 3.41 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.44 0.00 101 E 8.06 3.88 0.00 2.05 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 2.32 2.41 0.00 102 N 8.01 4.32 0.00 2.45 2.70 0.00 0.00 6.92 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 7.42 4.45 0.00 3.07 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 0.00 104 R 7.94 4.03 0.00 1.97 1.97 0.00 3.10 0.00 0.00 3.46 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 105 L 7.89 3.82 0.00 1.75 1.45 0.76 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.26 4.10 0.00 1.91 1.89 0.93 0.95 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 0.00 107 G 8.08 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 0.00 0.00 0.00 108 K 8.01 4.03 0.00 2.06 1.96 0.00 1.68 0.00 0.00 1.53 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.59 7.81 109 V 7.82 3.63 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 1.14 0.00 0.00 1.13 0.00 0.00 110 L 8.33 3.87 0.00 1.76 1.79 0.90 0.27 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 0.00 111 V 7.88 3.56 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 1.28 0.00 0.00 1.16 0.00 0.00 112 C 8.02 4.06 0.00 3.20 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 0.00 113 V 8.03 3.54 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 1.02 0.00 0.00 0.94 0.00 0.00 114 L 7.94 3.85 0.00 0.92 1.24 0.67 1.09 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 0.00 115 A 7.46 3.70 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 0.00 116 H 7.88 4.15 0.00 3.17 3.40 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.19 3.98 0.00 2.86 2.83 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.42 4.62 0.00 3.26 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 0.00 119 G 8.75 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.86 4.09 0.00 1.91 2.01 0.00 1.61 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.47 7.81 121 E 7.88 4.06 0.00 2.00 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 0.00 2.30 2.25 0.00 122 F 8.10 4.52 0.00 3.05 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 0.00 123 T 7.35 4.17 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 1.29 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.14 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.25 0.00 2.11 2.06 0.00 3.49 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 2.08 2.11 0.00 126 V 7.37 3.53 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 0.86 0.00 0.00 0.89 0.00 0.00 127 Q 7.92 3.52 0.00 1.72 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 128 A 8.03 4.11 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 0.00 129 A 7.92 3.90 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 0.00 130 Y 8.22 3.87 0.00 3.34 3.30 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 0.00 131 Q 8.71 4.21 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 132 K 7.93 3.98 0.00 1.93 1.82 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.62 7.81 133 V 7.66 3.50 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 0.83 0.00 0.00 0.72 0.00 0.00 134 V 8.48 3.81 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 1.00 0.00 0.00 1.13 0.00 0.00 135 A 8.20 4.14 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.31 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.04 3.41 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 0.61 0.00 0.00 0.72 0.00 0.00 138 A 8.04 3.88 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 0.00 139 N 8.20 4.32 0.00 2.77 2.90 0.00 0.00 7.01 6.92 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 0.00 140 A 8.07 4.16 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 0.00 141 L 7.95 3.83 0.00 1.00 0.49 -0.03 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.68 4.54 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 0.00 143 H 8.03 4.29 0.00 3.30 3.50 0.00 5.74 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.01 4.49 0.00 1.85 1.83 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.60 7.81 145 Y 7.89 4.14 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 0.00 146 H 8.34 4.45 0.00 3.22 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00