NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1262 8.1727 122.0470 56.2992 34.0736 174.1059 2 V 4.5501 8.1738 127.3383 60.5468 32.1720 174.3634 3 F 4.4572 10.0869 128.7522 57.7007 40.2067 174.7551 4 E 4.1833 9.0289 120.9186 55.4940 31.0023 176.5652 5 R 3.1897 8.9608 120.1251 61.0498 29.9172 179.2746 6 C 4.2867 8.0036 115.4092 59.7499 36.2387 175.8051 7 E 3.8840 8.1016 120.6652 59.2535 29.3358 178.5138 8 L 3.4411 7.9510 120.0744 57.7627 42.0485 178.4796 9 A 3.9254 7.8617 120.7482 55.5750 18.2119 179.9411 10 R 3.9504 7.9576 116.2129 59.3586 30.1090 179.4726 11 T 3.8452 7.7179 115.6913 66.6308 68.5000 176.7513 12 L 3.8526 8.2893 121.2308 57.4360 41.5512 179.4881 13 K 3.8892 8.0232 119.6518 59.5968 31.9782 178.8699 14 R 3.9165 8.0666 117.8811 58.9840 29.9660 177.4095 15 L 4.4102 7.3600 116.1224 54.0722 41.7037 176.9433 16 G 3.8836 7.9306 106.8494 46.8340 0.0000 175.0576 17 M 4.0224 7.8070 120.6803 56.1973 32.3899 175.7988 18 D 4.6115 8.0845 118.4495 55.2524 41.1614 175.8030 19 G 3.8905 9.4594 115.5603 45.6303 0.0000 171.4168 20 Y 4.1389 8.1057 121.2622 58.6094 38.7430 176.4134 21 R 3.6136 9.0059 127.3358 57.2421 27.6852 177.5455 22 G 3.8392 8.3466 104.7998 45.4752 0.0000 174.2206 23 I 3.9326 7.6111 122.3738 59.8197 37.5174 176.0698 24 S 4.7254 8.3058 120.8716 57.7558 65.0188 174.8691 25 L 4.2134 8.6559 123.1967 58.4064 41.8686 178.6816 26 A 4.1183 8.1672 120.2303 55.3969 18.2620 179.2577 27 N 4.4627 7.9003 113.7329 56.1891 38.5887 177.7565 28 W 4.3174 7.8205 120.4466 59.9988 29.0703 178.4654 29 M 4.1642 8.5528 119.0071 58.6193 31.4438 177.9594 30 C 2.9931 7.7686 118.4994 59.0723 43.6000 175.1505 31 L 3.9963 8.0369 121.6234 58.3662 41.7129 178.7688 32 A 4.2407 8.3727 121.9544 54.3450 18.2885 179.4055 33 K 2.7610 8.2327 118.2880 59.3646 32.0302 179.1767 34 W 4.3398 7.6933 117.3844 59.3694 29.0246 178.3510 35 E 4.3758 8.4291 118.8365 58.8604 29.2192 178.1127 36 S 4.5184 8.0978 108.6781 57.1188 65.4425 173.9763 37 G 3.6161 8.2536 108.7803 47.2697 0.0000 173.5688 38 Y 3.6657 7.5794 111.9287 58.6096 35.6644 169.0847 39 N 5.2610 7.6552 119.5580 51.9560 39.6061 175.7296 40 T 4.0730 8.9692 117.9085 64.2813 69.0503 176.1095 41 R 4.3126 8.1739 119.0345 56.2049 30.9224 176.4384 42 A 4.2876 7.6125 121.3089 52.9913 19.2761 176.7996 43 T 5.5134 8.2208 110.1694 60.0812 72.3218 173.0556 44 N 4.8676 8.3572 121.6809 52.3841 42.2328 172.4881 45 Y 4.5575 8.7971 128.1292 57.6089 40.8321 173.9542 46 N 4.7431 8.4315 124.4375 51.1041 38.9619 175.1602 47 A 3.6484 8.3284 127.6483 54.8140 18.9161 179.1123 48 G 3.7706 8.1084 104.1119 48.1939 0.0000 173.8932 49 D 4.7225 7.5183 115.3810 52.0402 39.9435 175.8215 50 R 4.1076 7.9509 115.0974 56.7677 28.2942 176.0108 51 S 4.8808 7.7794 113.4346 57.5018 65.9815 172.8492 52 T 5.1287 8.8001 115.3899 62.0399 73.1608 172.8723 53 D 5.4389 8.9002 124.9491 53.2324 42.9431 175.0571 54 Y 4.8960 9.3674 121.8920 57.3725 41.1087 177.7571 55 G 4.5565 8.6913 111.1284 45.9774 0.0000 173.7506 56 I 4.1362 8.0996 116.5074 62.8767 38.0646 178.0827 57 F 4.8543 7.9363 115.7779 56.4180 40.0726 175.0470 58 Q 3.6674 7.7405 118.9549 57.1221 26.5655 174.1651 59 I 4.3305 8.1216 118.9842 61.2045 39.2065 176.7374 60 N 5.4278 9.1782 126.0818 53.0943 39.7387 175.8194 61 S 4.5793 9.1507 121.0260 60.4713 63.2055 175.4763 62 R 3.7903 8.8253 122.4091 58.9626 30.2839 177.8216 63 Y 4.3379 7.7576 113.2824 57.1287 40.5430 176.9156 64 W 4.8089 8.3193 119.2557 57.6042 30.2685 173.6655 65 C 6.0667 7.7947 110.0859 52.7884 44.8463 171.9136 66 N 4.9384 9.0566 120.3678 52.3411 39.6107 174.9808 67 D 4.8283 8.5136 123.0239 52.1605 40.5582 178.2134 68 G 4.1071 8.5128 110.3413 46.3410 0.0000 174.9133 69 K 4.2411 8.0284 116.2675 57.1617 32.9715 176.5942 70 T 4.2019 7.6423 117.3863 61.7077 68.4986 171.4746 71 P 4.1881 0.0000 0.0000 63.2622 31.1310 176.2476 72 G 3.9507 8.6547 113.7372 46.1846 0.0000 172.3823 73 A 4.1817 7.2621 122.2388 51.1240 20.1761 177.1776 74 V 4.5373 7.9054 108.8659 60.0669 35.7939 176.0922 75 N 4.8923 7.9919 116.8139 51.7357 38.6321 174.1736 76 A 3.9424 8.8476 124.8500 54.8245 19.0204 178.5587 77 C 4.5409 8.6367 111.4285 57.4802 41.2047 173.0769 78 H 4.0502 7.9942 116.5354 56.2332 26.2431 174.1992 79 L 4.7242 7.3078 117.5380 52.9870 46.4948 176.1686 80 S 4.6041 8.4737 116.2674 58.1131 63.1824 175.9391 81 C 4.0643 8.7550 125.3595 59.8552 40.3370 176.6135 82 S 3.8632 7.7466 115.6457 61.2448 62.1690 176.3160 83 A 4.0422 7.8098 123.2507 54.2207 17.8730 178.5314 84 L 4.4064 7.9915 116.4879 55.3431 41.6147 177.7053 85 L 4.9666 7.6957 118.6490 54.5507 42.1189 176.4199 86 Q 4.4655 7.8269 117.2474 54.9688 29.8466 175.9678 87 D 4.3824 8.5884 120.6569 57.1836 41.1177 176.6429 88 N 4.5509 8.0351 118.1950 53.2564 39.1533 174.5627 89 I 4.2422 8.4458 119.0721 61.0814 37.9482 177.1166 90 A 3.9322 8.2071 124.8782 55.8341 18.2153 180.0637 91 D 4.2721 8.0839 116.6132 57.4519 40.9274 178.7437 92 A 4.0930 7.9566 120.8253 55.1649 18.4114 179.6618 93 V 3.4468 8.3764 116.9920 65.9577 31.5435 178.0600 94 A 3.8351 8.1194 120.6700 55.3422 18.1412 178.8552 95 C 4.2589 8.2431 116.7702 59.6691 41.8630 175.5880 96 A 3.9593 8.3018 122.9163 55.0211 17.6948 179.8206 97 K 3.8348 7.9681 117.1707 59.4519 31.8175 179.4770 98 R 3.9475 7.6651 117.9126 59.3648 30.3275 178.3279 99 V 2.7895 7.7100 118.0366 65.9344 31.6115 178.3203 100 V 3.7348 7.8780 110.8577 63.3092 31.2095 178.2245 101 R 4.1948 7.6042 117.1263 57.3256 30.4473 176.5328 102 D 4.6993 7.6369 119.2435 52.9957 41.7956 175.5220 103 P 4.1784 0.0000 0.0000 66.2193 31.4682 178.0982 104 Q 4.0495 8.1581 116.5571 57.0462 30.0724 177.5356 105 G 4.2816 7.8926 106.4593 46.8914 0.0000 175.7962 106 I 3.8192 7.7693 121.3085 62.9178 37.9400 177.5753 107 R 4.3810 7.3134 117.7861 58.0009 30.0523 177.3844 108 A 4.2228 7.5369 120.2896 53.7145 18.6371 177.7361 109 W 4.7156 8.2284 116.5469 55.5823 29.6279 176.9183 110 F 4.5006 9.4083 126.2837 61.6046 38.7760 176.8260 111 A 3.8187 8.3596 119.7501 54.5535 18.1719 179.3401 112 W 3.9636 8.3670 127.2861 60.5714 30.5947 178.4835 113 R 3.8285 8.2358 116.4373 59.5038 29.7049 178.3750 114 N 4.3028 8.0946 115.1774 55.1377 38.6497 176.7583 115 R 4.2038 7.7678 116.0975 55.8384 31.3122 175.6425 116 C 4.4963 7.1273 114.5063 57.9348 43.0630 174.2918 117 Q 3.0126 6.7468 119.7861 57.3613 28.6989 175.7611 118 N 4.1545 8.5239 121.3904 54.6293 36.3010 173.8757 119 R 4.5123 7.2874 114.2503 54.1844 33.4383 175.8426 120 D 4.5962 8.4513 119.1975 53.7866 40.2752 176.0506 121 V 4.5766 8.1352 118.8059 61.1705 32.5676 178.1474 122 R 3.9816 8.0336 121.8521 59.6628 29.6211 178.5395 123 Q 4.0228 8.1427 115.6595 59.4968 28.3161 178.1424 124 Y 4.2454 8.1930 118.0969 59.8617 38.1422 176.7928 125 V 4.4315 7.7221 110.9059 60.7398 32.8282 175.1688 126 Q 4.1918 8.0205 120.3364 57.1137 28.8156 176.7980 127 G 3.9576 8.9209 110.6069 45.9586 0.0000 174.5234 128 C 4.4099 7.9941 115.7436 56.7491 40.6852 173.5791 129 G 3.8206 8.0520 107.2275 47.1094 0.0000 174.1874 130 V 4.0153 7.8333 117.2335 61.1424 32.2017 176.0543 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 K 8.17 4.13 0.00 1.97 1.59 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.79 1.06 7.81 2 V 8.17 4.55 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 10.09 4.46 0.00 2.94 2.80 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 4 E 9.03 4.18 0.00 1.97 1.86 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 2.30 2.24 0.00 5 R 8.96 3.19 0.00 1.90 1.85 0.00 3.36 0.00 0.00 3.39 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 6 C 8.00 4.29 0.00 2.99 3.11 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 7 E 8.10 3.88 0.00 2.07 2.27 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 2.66 2.44 0.00 8 L 7.95 3.44 0.00 1.28 1.37 -0.18 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.86 3.93 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 10 R 7.96 3.95 0.00 1.89 1.98 0.00 3.13 0.00 0.00 3.28 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 11 T 7.72 3.85 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 12 L 8.29 3.85 0.00 1.69 1.57 0.93 0.41 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 13 K 8.02 3.89 0.00 1.95 1.92 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 R 8.07 3.92 0.00 2.02 1.93 0.00 3.30 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 15 L 7.36 4.41 0.00 1.67 1.54 0.87 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.93 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 0.00 0.00 0.00 0.00 17 M 7.81 4.02 0.00 1.39 1.91 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.22 0.00 18 D 8.08 4.61 0.00 2.68 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 19 G 9.46 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 0.00 0.00 0.00 20 Y 8.11 4.14 0.00 3.41 3.27 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 21 R 9.01 3.61 0.00 1.77 1.80 0.00 3.29 0.00 0.00 2.92 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.30 0.00 22 G 8.35 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.61 3.93 1.73 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.71 -0.24 0.00 0.00 24 S 8.31 4.73 0.00 4.10 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 25 L 8.66 4.21 0.00 1.88 1.80 1.01 1.12 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 26 A 8.17 4.12 1.50 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 27 N 7.90 4.46 0.00 2.81 2.79 0.00 0.00 6.96 7.55 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 28 W 7.82 4.32 0.00 3.52 3.11 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 29 M 8.55 4.16 0.00 2.19 2.33 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.92 0.00 30 C 7.77 2.99 0.00 2.36 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 31 L 8.04 4.00 0.00 1.90 1.92 0.46 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.37 4.24 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 33 K 8.23 2.76 0.00 1.67 1.61 0.00 0.61 0.00 0.00 0.78 0.00 0.00 2.63 0.00 0.00 2.33 0.00 0.00 0.00 0.00 1.19 0.25 7.81 34 W 7.69 4.34 0.00 3.34 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 35 E 8.43 4.38 0.00 2.03 2.12 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 2.61 2.60 0.00 36 S 8.10 4.52 0.00 4.07 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 37 G 8.25 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.58 3.67 0.00 3.27 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 39 N 7.66 5.26 0.00 2.75 2.90 0.00 0.00 7.00 8.26 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 40 T 8.97 4.07 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 41 R 8.17 4.31 0.00 2.00 2.04 0.00 3.19 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 42 A 7.61 4.29 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 T 8.22 5.51 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 1.25 0.00 0.00 44 N 8.36 4.87 0.00 2.84 2.69 0.00 0.00 6.75 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 45 Y 8.80 4.56 0.00 3.02 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 46 N 8.43 4.74 0.00 2.62 2.58 0.00 0.00 6.68 7.62 0.00 0.00 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 8.33 3.65 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 48 G 8.11 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 49 D 7.52 4.72 0.00 2.67 2.64 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 0.00 0.00 0.00 0.00 50 R 7.95 4.11 0.00 2.04 2.18 0.00 3.14 0.00 0.00 3.19 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 51 S 7.78 4.88 0.00 3.92 3.93 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 52 T 8.80 5.13 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 53 D 8.90 5.44 0.00 2.71 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 9.37 4.90 0.00 2.94 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 55 G 8.69 4.56 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 56 I 8.10 4.14 1.70 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.49 0.15 0.00 0.00 57 F 7.94 4.85 0.00 3.21 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 58 Q 7.74 3.67 0.00 2.57 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.76 0.00 59 I 8.12 4.33 2.14 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.12 1.15 0.00 0.00 60 N 9.18 5.43 0.00 3.09 3.01 0.00 0.00 6.97 7.63 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 61 S 9.15 4.58 0.00 4.05 4.35 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 62 R 8.83 3.79 0.00 1.62 1.43 0.00 2.64 0.00 0.00 2.80 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.84 0.00 63 Y 7.76 4.34 0.00 1.68 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 0.00 0.00 0.00 64 W 8.32 4.81 0.00 3.63 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 65 C 7.79 6.07 0.00 3.23 3.20 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 0.00 66 N 9.06 4.94 0.00 2.78 2.71 0.00 0.00 6.99 8.56 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 67 D 8.51 4.83 0.00 2.87 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 68 G 8.51 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 0.00 0.00 0.00 69 K 8.03 4.24 0.00 1.92 1.96 0.00 1.62 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.49 7.81 70 T 7.64 4.20 4.24 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 1.18 0.00 0.00 71 P 0.00 4.19 0.00 2.02 2.07 0.00 3.83 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 2.05 2.13 0.00 72 G 8.65 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 73 A 7.26 4.18 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 74 V 7.91 4.54 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.94 0.00 0.00 75 N 7.99 4.89 0.00 2.70 2.57 0.00 0.00 6.76 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 76 A 8.85 3.94 1.20 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 0.00 0.00 0.00 77 C 8.64 4.54 0.00 3.32 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 78 H 7.99 4.05 0.00 3.29 3.34 0.00 5.83 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.31 4.72 0.00 1.69 1.51 0.96 0.79 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 80 S 8.47 4.60 0.00 3.83 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 81 C 8.75 4.06 0.00 2.25 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 82 S 7.75 3.86 0.00 3.99 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 83 A 7.81 4.04 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 84 L 7.99 4.41 0.00 1.93 1.85 1.07 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.70 4.97 0.00 1.78 1.71 1.11 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.83 4.47 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.13 7.08 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 87 D 8.59 4.38 0.00 2.62 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 88 N 8.04 4.55 0.00 2.69 2.75 0.00 0.00 6.95 7.94 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 89 I 8.45 4.24 1.76 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.77 0.96 0.00 0.00 90 A 8.21 3.93 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 91 D 8.08 4.27 0.00 2.75 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 92 A 7.96 4.09 1.38 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 0.00 0.00 93 V 8.38 3.45 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 0.78 0.00 0.00 0.85 0.00 0.00 94 A 8.12 3.84 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 C 8.24 4.26 0.00 3.09 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 96 A 8.30 3.96 0.72 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 0.00 0.00 97 K 7.97 3.83 0.00 1.70 1.41 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.23 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.98 7.81 98 R 7.67 3.95 0.00 1.87 2.21 0.00 3.46 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 99 V 7.71 2.79 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 -0.29 0.00 0.00 -0.34 0.00 0.00 100 V 7.88 3.73 2.12 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 1.17 0.00 0.00 1.44 0.00 0.00 101 R 7.60 4.19 0.00 2.02 2.06 0.00 3.25 0.00 0.00 3.40 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.15 0.00 102 D 7.64 4.70 0.00 3.03 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 0.00 103 P 0.00 4.18 0.00 2.02 2.13 0.00 3.70 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 2.03 2.15 0.00 104 Q 8.16 4.05 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.62 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 105 G 7.89 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 0.00 0.00 0.00 0.00 106 I 7.77 3.82 1.02 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.77 -1.00 0.00 0.00 107 R 7.31 4.38 0.00 1.98 2.09 0.00 3.27 0.00 0.00 3.33 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.57 0.00 108 A 7.54 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.23 4.72 0.00 3.65 3.21 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 0.00 110 F 9.41 4.50 0.00 3.05 3.23 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 0.00 111 A 8.36 3.82 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.37 3.96 0.00 3.49 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.24 3.83 0.00 2.04 2.04 0.00 3.56 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.25 0.00 114 N 8.09 4.30 0.00 2.21 2.50 0.00 0.00 6.94 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.77 4.20 0.00 1.33 0.95 0.00 2.68 0.00 0.00 2.25 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.11 0.00 116 C 7.13 4.50 0.00 1.69 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 0.00 117 Q 6.75 3.01 0.00 0.93 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.76 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 118 N 8.52 4.15 0.00 2.77 2.80 0.00 0.00 6.86 7.66 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 0.00 119 R 7.29 4.51 0.00 1.75 1.79 0.00 3.24 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 120 D 8.45 4.60 0.00 2.64 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 0.00 121 V 8.14 4.58 2.33 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 0.82 0.00 0.00 1.02 0.00 0.00 122 R 8.03 3.98 0.00 1.94 2.04 0.00 3.16 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 123 Q 8.14 4.02 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.12 0.00 0.00 0.00 0.00 0.00 2.19 1.84 0.00 124 Y 8.19 4.25 0.00 3.19 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 0.00 125 V 7.72 4.43 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.05 0.00 0.00 126 Q 8.02 4.19 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.80 0.00 0.00 0.00 0.00 0.00 2.61 2.30 0.00 127 G 8.92 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 0.00 128 C 7.99 4.41 0.00 3.07 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 0.00 129 G 8.05 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 0.00 130 V 7.83 4.02 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 0.80 0.00 0.00 0.96 0.00 0.00