NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4265 8.1585 120.3622 55.6614 34.3569 177.5072 2 A 3.9279 8.0280 120.3414 54.0370 18.5460 177.6236 3 L 3.5132 8.1791 118.7596 58.0032 42.4235 177.5118 4 K 3.8851 7.8772 119.0553 59.3376 32.3272 178.4973 5 R 3.8187 7.6389 118.7216 59.5816 30.0320 178.2974 6 I 3.1328 7.6167 119.6222 64.2473 36.9160 178.0321 7 Q 3.9843 7.7119 119.6582 59.0838 28.9290 178.1071 8 K 3.8349 8.2490 120.8187 59.8998 32.2970 178.3464 9 E 4.2869 8.2409 119.8466 58.9087 29.3612 179.2551 10 L 4.1433 8.2623 120.3301 58.1094 42.2166 179.2159 11 S 4.2334 8.4182 115.4862 61.6255 62.2544 176.2818 12 D 4.3971 8.0615 121.3735 57.5019 40.4380 178.8711 13 L 4.1420 7.7372 117.1834 56.9736 41.6282 178.5925 14 Q 4.1344 7.4128 117.5769 57.9221 29.1407 177.2442 15 R 4.3610 7.5168 118.6575 57.4670 31.2118 176.0378 16 D 4.6523 8.5026 119.9835 51.1346 41.7897 171.4940 17 P 4.4475 0.0000 0.0000 61.5355 32.2151 177.1895 18 P 4.4674 0.0000 0.0000 62.3813 30.7080 178.5221 19 A 3.9700 8.3443 125.9480 52.9700 18.4900 179.2463 20 H 5.0316 8.3042 107.0824 55.0749 31.3398 173.1437 21 C 5.9784 8.4524 116.4818 57.1593 31.2938 173.4873 22 S 4.7643 8.3202 114.6378 56.6751 66.0309 172.7826 23 A 4.9998 8.4698 123.3694 50.0897 22.5159 175.0504 24 G 3.0753 7.5042 106.8489 45.1032 0.0000 171.0261 25 P 4.8165 0.0000 0.0000 62.0884 31.6514 176.7587 26 V 3.9480 8.3840 121.5559 62.4120 32.3495 175.5890 27 G 4.0745 8.4537 118.1894 47.0797 0.0000 173.4161 28 D 4.6398 8.6960 123.8141 52.9262 39.9802 175.9374 29 D 4.6866 7.6199 119.8579 53.7115 41.1034 176.2014 30 L 4.5182 8.5912 127.2808 57.3693 42.3611 178.3824 31 F 4.4339 8.5631 117.3762 59.6247 40.5084 174.7324 32 H 5.4319 8.8920 119.5082 54.2909 31.6433 173.9298 33 W 5.5714 9.4105 125.2890 54.8572 33.4555 174.1585 34 Q 5.0480 9.3182 120.0957 54.6032 31.0826 174.3188 35 A 5.2494 8.6462 121.6310 50.8684 23.4311 174.9536 36 T 4.9299 9.0595 109.3696 59.7963 72.6697 172.9907 37 I 4.7807 8.4796 124.1097 59.6045 39.9588 175.0043 38 M 4.5795 9.4752 128.6391 54.9566 32.5321 176.9325 39 G 4.4315 9.3376 111.6968 45.3728 0.0000 171.7682 40 P 4.5681 0.0000 0.0000 61.4946 32.1320 174.3948 41 P 4.4332 0.0000 0.0000 64.1845 31.7599 176.0178 42 D 4.5581 9.6239 120.5383 54.7742 39.2594 173.8630 43 S 4.8669 7.5187 113.7805 55.9319 65.4253 175.0941 44 A 3.8969 8.4827 124.3158 54.8832 18.4652 177.9919 45 Y 5.2939 7.3750 111.3226 56.9112 38.2023 175.2866 46 Q 4.3117 7.8809 121.8342 57.9084 29.5731 175.7646 47 G 4.3748 9.1811 114.3367 45.6123 0.0000 174.4732 48 G 3.7101 7.8525 105.7205 46.0289 0.0000 172.7258 49 V 4.8941 7.4964 120.6040 60.7005 34.2404 174.9177 50 F 5.0388 8.9539 125.4464 55.7981 42.2593 174.1450 51 F 4.8285 9.9440 124.0280 56.9446 40.4638 175.1446 52 L 5.1949 9.4283 122.5415 53.0691 46.3779 175.1443 53 T 4.9392 9.1625 114.3068 60.4242 70.7142 172.6695 54 V 4.6614 8.7985 128.4659 60.2175 34.2016 174.0417 55 H 5.1509 8.8094 123.0627 53.7646 31.0892 173.7064 56 F 4.7223 8.4585 122.9380 55.6760 39.8425 174.3954 57 P 4.4937 0.0000 0.0000 62.5177 31.9459 177.4724 58 T 3.9273 8.4988 110.4901 64.4331 68.9184 174.0434 59 D 5.0087 7.9892 121.0744 53.2883 40.1684 175.4986 60 Y 4.4996 8.0075 120.9707 58.2156 38.9722 173.3347 61 P 2.9700 0.0000 0.0000 62.3195 31.6978 177.7578 62 F 4.3881 7.9236 119.7232 60.0743 39.1006 176.1069 63 K 4.5868 7.9266 118.5464 53.8765 33.5333 174.6232 64 P 2.9700 0.0000 0.0000 61.0254 31.9278 174.3151 65 P 4.2950 0.0000 0.0000 62.8104 32.4914 175.9368 66 K 4.3196 8.8392 121.7078 55.3120 33.3617 175.4821 67 I 4.9344 8.2395 125.9450 59.3204 39.4908 175.1651 68 A 5.0356 8.8700 128.0395 49.9200 22.9671 174.7083 69 F 4.6587 9.3545 119.3641 57.5228 39.6953 176.9378 70 T 4.3010 9.3289 114.1248 63.3046 69.8313 175.1046 71 T 4.6978 8.2294 118.5398 61.9948 70.0596 175.0433 72 K 4.3388 8.6864 125.1707 56.3521 32.9411 176.4998 73 I 4.9867 8.2420 121.8603 59.9230 40.8529 174.4830 74 Y 3.8058 9.0550 129.1315 56.5223 36.9246 173.1261 75 H 4.9740 7.7023 123.9664 53.4169 33.5197 172.6746 76 P 4.2177 0.0000 0.0000 64.8800 31.6018 177.4396 77 N 4.7762 8.1294 113.5037 52.8388 39.3073 173.9616 78 I 5.0308 7.6008 118.3694 58.3543 39.3372 175.3101 79 N 4.7878 8.4422 123.6457 51.1671 39.1173 175.9575 80 S 4.1375 8.5063 112.0805 61.4846 62.9817 174.8743 81 N 4.5237 8.2975 115.7430 53.1892 38.5242 175.5143 82 G 4.1846 8.4595 106.5403 46.1565 0.0000 173.9583 83 S 4.5037 8.5759 116.8248 58.2537 63.3727 173.0919 84 I 4.6006 8.2013 125.1101 59.9488 38.6216 175.4954 85 C 4.4621 8.6694 129.3141 58.1237 30.7014 171.6551 86 L 4.8264 7.9858 125.9028 52.9846 45.0138 176.7640 87 D 4.4625 8.9364 125.4103 57.0604 41.1851 178.2250 88 I 4.0402 7.8203 110.6547 62.4726 37.8919 176.2917 89 L 4.5160 7.5492 120.1967 54.8559 42.7536 176.5718 90 R 4.3166 7.9191 115.4018 56.0083 32.0222 176.4388 91 S 4.5064 8.8551 119.0816 60.5835 64.8479 175.8771 92 Q 4.3899 8.2208 117.8346 55.3024 28.6444 175.7991 93 W 4.4453 8.0141 128.3756 57.6147 31.4827 175.0805 94 S 4.2034 6.6469 117.4694 55.5797 64.7141 172.7788 95 P 4.1525 0.0000 0.0000 63.5350 30.9427 176.8755 96 A 3.9823 7.1400 121.7428 54.1237 18.7767 178.1894 97 L 4.0975 7.1152 116.1088 54.5644 42.5762 176.7408 98 T 5.0463 8.0046 111.4854 59.9207 72.7838 175.3488 99 V 3.8116 9.3135 119.9103 65.8503 31.4968 177.5597 100 S 4.1724 8.3370 112.7020 61.6519 62.0411 176.2688 101 K 4.0166 8.0633 120.6519 59.4168 31.7313 179.6185 102 V 3.6676 7.8785 118.1000 66.0976 31.5400 177.9135 103 L 3.9695 8.2316 118.9712 58.0400 41.4286 179.6370 104 L 4.0555 7.9477 118.4282 57.9333 41.5001 179.7924 105 S 4.2686 7.9127 115.1982 61.5220 62.8314 176.7638 106 I 3.7722 8.0839 122.8655 64.1613 36.7792 178.0919 107 C 4.0604 8.0167 119.8558 62.5120 31.4021 175.4017 108 S 4.1067 8.4716 115.2195 61.4401 61.6488 175.9398 109 L 4.0061 7.8208 122.2179 58.0667 41.8593 178.6634 110 L 4.0310 7.4324 117.8170 57.8629 41.5453 178.9483 111 C 4.6197 7.8356 116.0210 61.5439 29.0927 173.6746 112 D 4.7098 8.2890 119.8027 51.3228 41.2253 172.2483 113 P 4.2629 0.0000 0.0000 61.9359 32.2397 176.5800 114 N 4.6212 8.6474 120.0467 52.0110 37.5134 174.2129 115 P 4.5728 0.0000 0.0000 63.9189 32.0662 176.7034 116 D 4.8113 7.9677 117.3374 54.3148 41.8609 175.9682 117 D 4.7388 7.5280 116.8378 51.6089 40.8781 172.3277 118 P 4.6722 0.0000 0.0000 60.9736 32.8392 176.6934 119 L 4.0294 8.7213 124.1236 57.0474 41.9327 177.7448 120 V 4.2057 7.5328 121.2458 59.6900 31.2596 173.5809 121 P 4.2520 0.0000 0.0000 65.1688 30.7486 177.3365 122 D 4.3964 8.1667 117.2767 57.8541 40.8707 179.1391 123 I 3.7157 7.6379 119.5947 64.1429 36.7533 178.4066 124 A 4.0389 7.7884 121.2950 54.9610 18.1675 179.2589 125 Q 3.9297 8.5738 118.7701 59.4317 29.1022 178.6177 126 I 3.7739 7.5838 120.1663 64.4959 36.9899 177.6583 127 Y 4.1047 7.7788 118.5136 59.3983 38.4945 177.3372 128 K 4.0769 7.3741 118.3335 58.8629 33.0772 178.6559 129 S 4.3736 8.1573 113.4231 60.3155 64.7779 174.2805 130 D 4.7365 8.4153 121.7815 50.9777 41.8751 174.9391 131 K 3.8101 8.2313 123.0419 59.5152 32.4613 178.2123 132 E 4.0956 8.0867 117.9622 58.9869 29.6038 178.8453 133 K 4.1604 8.1598 119.6821 59.3643 32.1218 178.2695 134 Y 4.0379 8.0763 119.8351 60.9074 38.8976 177.4629 135 N 4.2910 8.3710 117.2969 56.3436 38.0993 177.5262 136 R 3.8595 8.4304 120.2701 59.8590 30.4181 178.3739 137 H 4.0604 8.3258 117.2021 57.9781 28.4952 177.7457 138 A 3.7929 7.7787 123.1049 54.8559 18.0571 179.9332 139 R 3.9200 7.3491 115.2643 59.3576 30.1933 178.9438 140 E 3.8901 7.6955 117.5819 59.4578 29.4312 179.6777 141 W 3.0310 8.1577 117.8995 59.2366 29.0137 178.7539 142 T 4.1915 7.9686 116.2174 66.4464 67.3407 177.0249 143 Q 3.9805 7.9644 119.9498 58.7848 28.6412 178.7258 144 K 4.1929 7.9201 118.8414 59.1062 32.1482 178.2368 145 Y 4.6753 7.0689 114.4319 58.5343 38.5306 176.3818 146 A 4.4511 7.9887 121.2462 52.5747 20.9924 176.4497 147 M 4.2250 7.3559 120.2600 55.7321 31.9338 176.1517 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.16 4.43 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 2 A 8.03 3.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.18 3.51 0.00 1.80 1.67 0.93 0.34 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 4 K 7.88 3.89 0.00 1.86 1.92 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.49 7.81 5 R 7.64 3.82 0.00 1.86 2.05 0.00 3.18 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.84 0.00 6 I 7.62 3.13 1.37 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.03 0.30 0.00 0.00 7 Q 7.71 3.98 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 8 K 8.25 3.83 0.00 1.92 2.00 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.50 7.81 9 E 8.24 4.29 0.00 2.31 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 2.41 2.43 0.00 10 L 8.26 4.14 0.00 2.34 2.02 0.37 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.42 4.23 0.00 4.11 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 12 D 8.06 4.40 0.00 2.96 2.75 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 0.00 0.00 0.00 0.00 13 L 7.74 4.14 0.00 1.65 1.71 1.09 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 14 Q 7.41 4.13 0.00 2.06 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 15 R 7.52 4.36 0.00 1.99 2.05 0.00 3.26 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 16 D 8.50 4.65 0.00 2.56 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 4.45 0.00 2.23 2.27 0.00 3.74 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 2.05 1.96 0.00 18 P 0.00 4.47 0.00 2.21 2.11 0.00 3.85 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 19 A 8.34 3.97 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 20 H 8.30 5.03 0.00 3.20 3.52 0.00 5.40 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 C 8.45 5.98 0.00 2.87 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 22 S 8.32 4.76 0.00 3.73 3.83 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 23 A 8.47 5.00 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 24 G 7.50 3.08 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 0.00 0.00 0.00 25 P 0.00 4.82 0.00 2.17 2.25 0.00 3.38 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 26 V 8.38 3.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.74 0.00 0.00 27 G 8.45 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 28 D 8.70 4.64 0.00 2.79 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 29 D 7.62 4.69 0.00 2.80 2.90 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 30 L 8.59 4.52 0.00 1.64 1.55 0.97 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.56 4.43 0.00 3.08 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 32 H 8.89 5.43 0.00 3.29 3.37 0.00 5.54 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.41 5.57 0.00 3.16 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 9.32 5.05 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 35 A 8.65 5.25 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 36 T 9.06 4.93 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 0.41 0.00 0.00 37 I 8.48 4.78 1.98 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 1.22 0.96 0.95 0.00 0.00 38 M 9.48 4.58 0.00 1.94 2.18 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 2.76 2.52 0.00 39 G 9.34 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 0.00 0.00 0.00 0.00 40 P 0.00 4.57 0.00 2.27 2.02 0.00 3.78 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 2.17 2.12 0.00 41 P 0.00 4.43 0.00 2.08 2.03 0.00 3.84 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 2.07 2.16 0.00 42 D 9.62 4.56 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 43 S 7.52 4.87 0.00 4.08 4.04 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 44 A 8.48 3.90 0.97 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 45 Y 7.38 5.29 0.00 3.17 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 46 Q 7.88 4.31 0.00 2.32 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.63 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 47 G 9.18 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 48 G 7.85 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 0.00 0.00 0.00 49 V 7.50 4.89 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 0.57 0.00 0.00 0.90 0.00 0.00 50 F 8.95 5.04 0.00 3.28 3.39 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 51 F 9.94 4.83 0.00 3.01 3.03 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 52 L 9.43 5.19 0.00 1.40 1.45 0.83 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 53 T 9.16 4.94 4.31 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 1.26 0.00 0.00 54 V 8.80 4.66 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 0.87 0.00 0.00 0.16 0.00 0.00 55 H 8.81 5.15 0.00 3.02 3.19 0.00 5.80 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.46 4.72 0.00 2.97 2.67 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 57 P 0.00 4.49 0.00 2.52 2.20 0.00 3.81 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 2.32 2.19 0.00 58 T 8.50 3.93 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 0.83 0.00 0.00 59 D 7.99 5.01 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.01 4.50 0.00 3.21 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 61 P 0.00 2.97 0.00 1.69 1.34 0.00 3.02 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.46 0.00 62 F 7.92 4.39 0.00 3.33 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 63 K 7.93 4.59 0.00 1.91 1.71 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.33 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.58 7.81 64 P 0.00 2.97 0.00 1.60 0.94 0.00 3.62 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 1.74 1.78 0.00 65 P 0.00 4.30 0.00 1.67 1.58 0.00 2.57 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.87 0.00 66 K 8.84 4.32 0.00 1.58 1.71 0.00 1.54 0.00 0.00 1.57 0.00 0.00 2.74 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.30 7.81 67 I 8.24 4.93 1.78 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 1.12 0.42 0.77 0.00 0.00 68 A 8.87 5.04 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 69 F 9.35 4.66 0.00 2.98 3.25 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 70 T 9.33 4.30 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 1.29 0.00 0.00 71 T 8.23 4.70 4.73 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 1.39 0.00 0.00 72 K 8.69 4.34 0.00 1.49 1.38 0.00 1.49 0.00 0.00 1.18 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.49 1.43 7.81 73 I 8.24 4.99 1.75 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.76 0.37 0.00 0.00 74 Y 9.06 3.81 0.00 2.25 2.57 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 75 H 7.70 4.97 0.00 2.97 2.88 0.00 5.73 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.22 0.00 2.05 2.05 0.00 2.96 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.01 0.00 77 N 8.13 4.78 0.00 2.91 2.85 0.00 0.00 6.94 7.39 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 78 I 7.60 5.03 1.64 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.62 0.82 0.00 0.00 79 N 8.44 4.79 0.00 2.87 2.97 0.00 0.00 5.97 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.51 4.14 0.00 4.03 4.11 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 0.00 0.00 0.00 81 N 8.30 4.52 0.00 2.76 2.91 0.00 0.00 6.92 7.65 0.00 0.00 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 G 8.46 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 S 8.58 4.50 0.00 4.01 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 84 I 8.20 4.60 1.91 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.77 0.96 0.00 0.00 85 C 8.67 4.46 0.00 3.02 2.88 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 86 L 7.99 4.83 0.00 1.78 1.46 0.95 1.28 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 87 D 8.94 4.46 0.00 2.78 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 88 I 7.82 4.04 1.99 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.72 0.97 0.00 0.00 89 L 7.55 4.52 0.00 1.80 1.72 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.92 4.32 0.00 1.80 1.72 0.00 3.21 0.00 0.00 3.29 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 91 S 8.86 4.51 0.00 4.01 4.02 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 92 Q 8.22 4.39 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 93 W 8.01 4.45 0.00 3.58 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 94 S 6.65 4.20 0.00 3.60 3.24 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 95 P 0.00 4.15 0.00 1.80 1.82 0.00 3.21 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 1.83 1.92 0.00 96 A 7.14 3.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 7.12 4.10 0.00 0.83 1.48 0.80 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 98 T 8.00 5.05 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 99 V 9.31 3.81 2.38 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 1.21 0.00 0.00 1.12 0.00 0.00 100 S 8.34 4.17 0.00 4.02 3.94 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 0.00 101 K 8.06 4.02 0.00 2.10 1.88 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.48 7.81 102 V 7.88 3.67 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 1.18 0.00 0.00 1.35 0.00 0.00 103 L 8.23 3.97 0.00 1.99 1.74 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.95 4.06 0.00 1.94 1.75 1.02 0.84 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 0.00 105 S 7.91 4.27 0.00 4.02 3.94 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 0.00 106 I 8.08 3.77 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.08 0.95 0.00 0.00 107 C 8.02 4.06 0.00 3.06 3.03 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 0.00 108 S 8.47 4.11 0.00 3.90 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 0.00 109 L 7.82 4.01 0.00 1.83 1.85 0.93 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 0.00 110 L 7.43 4.03 0.00 1.76 1.54 0.30 0.30 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 0.00 111 C 7.84 4.62 0.00 3.10 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 0.00 112 D 8.29 4.71 0.00 2.56 2.54 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 0.00 113 P 0.00 4.26 0.00 1.04 1.41 0.00 3.38 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 0.90 1.92 0.00 114 N 8.65 4.62 0.00 2.78 2.78 0.00 0.00 6.71 7.31 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 0.00 115 P 0.00 4.57 0.00 2.24 2.42 0.00 3.77 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 116 D 7.97 4.81 0.00 2.68 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 0.00 117 D 7.53 4.74 0.00 2.61 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 P 0.00 4.67 0.00 2.18 2.02 0.00 3.82 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 1.92 1.96 0.00 119 L 8.72 4.03 0.00 1.77 1.76 1.02 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.53 4.21 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 0.93 0.00 0.00 0.88 0.00 0.00 121 P 0.00 4.25 0.00 2.18 2.09 0.00 3.65 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 122 D 8.17 4.40 0.00 2.71 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 0.00 123 I 7.64 3.72 1.74 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.80 0.50 0.00 0.00 124 A 7.79 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 0.00 125 Q 8.57 3.93 0.00 2.28 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 126 I 7.58 3.77 2.23 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 1.74 0.79 1.14 0.00 0.00 127 Y 7.78 4.10 0.00 2.31 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 7.37 4.08 0.00 1.71 1.76 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.41 7.81 129 S 8.16 4.37 0.00 4.00 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 0.00 130 D 8.42 4.74 0.00 2.61 2.56 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 0.00 131 K 8.23 3.81 0.00 1.78 1.79 0.00 1.54 0.00 0.00 1.53 0.00 0.00 2.60 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.41 7.81 132 E 8.09 4.10 0.00 1.99 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 2.39 2.30 0.00 133 K 8.16 4.16 0.00 2.03 2.00 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.49 7.81 134 Y 8.08 4.04 0.00 3.22 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 0.00 135 N 8.37 4.29 0.00 3.00 2.86 0.00 0.00 6.78 7.65 0.00 0.00 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 R 8.43 3.86 0.00 1.81 2.04 0.00 3.03 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 137 H 8.33 4.06 0.00 2.67 1.43 0.00 5.68 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 0.00 138 A 7.78 3.79 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.35 3.92 0.00 1.99 1.92 0.00 3.08 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 140 E 7.70 3.89 0.00 2.28 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 2.27 2.40 0.00 141 W 8.16 3.03 0.00 3.58 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 0.00 142 T 7.97 4.19 4.45 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 1.43 0.00 0.00 143 Q 7.96 3.98 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 144 K 7.92 4.19 0.00 1.23 1.96 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.36 7.81 145 Y 7.07 4.68 0.00 3.26 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 0.00 146 A 7.99 4.45 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 M 7.36 4.23 0.00 2.20 2.12 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 2.62 2.80 0.00