NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3511 8.2493 123.5817 50.6132 21.0889 176.3716 2 K 4.2284 7.4090 111.7196 55.1506 35.2827 174.4082 3 K 4.4159 8.3663 122.8415 54.6992 34.6763 176.6163 4 V 4.4423 7.8278 122.3188 59.1215 33.8192 176.2935 5 Q 4.0514 8.2566 120.1308 56.9429 29.2455 175.4271 6 A 3.7807 8.3840 123.0274 54.0812 19.3313 177.1639 7 Y 3.3289 8.1199 123.6778 58.1169 36.4497 168.9527 8 V 4.2829 8.0471 116.7300 59.6090 34.3825 175.2483 9 K 5.0915 7.9451 121.1350 54.7909 35.7990 175.6099 10 L 4.2931 8.2957 120.3802 55.1749 44.1156 173.7413 11 Q 4.9119 8.7853 121.0251 54.6388 29.7993 175.1035 12 V 4.5233 7.9815 123.5301 59.0904 34.6207 175.2397 13 A 4.0715 8.7314 123.5602 52.3417 18.5492 176.4522 14 A 3.8508 8.3589 121.4537 53.9268 19.1832 179.2153 15 G 4.3831 7.2360 106.7323 41.0000 0.0000 171.9900 16 M 4.2363 7.4674 115.8641 55.3314 35.3346 173.3119 17 A 4.2119 8.5142 126.4093 52.5200 21.6712 175.4702 18 N 4.6399 9.0850 117.3841 52.9006 38.3222 173.0597 19 P 4.3668 0.0000 0.0000 62.7220 32.0500 176.8825 20 S 4.0069 8.6203 116.9440 61.2000 62.7506 173.6009 21 P 4.3977 0.0000 0.0000 65.3452 31.3422 176.2132 22 P 4.4461 0.0000 0.0000 65.2238 32.8336 177.3081 23 V 4.2054 7.4624 113.7079 61.2865 32.8519 181.0854 24 G 3.8246 9.5086 108.6917 45.3840 0.0000 173.2120 25 P 4.3549 0.0000 0.0000 66.1661 31.2036 175.7281 26 A 3.9098 7.8277 118.6739 55.4194 18.4295 178.9178 27 L 4.0868 7.5511 116.6483 57.4487 40.8402 179.2427 28 G 3.6847 8.3782 107.5287 48.0090 0.0000 175.6035 29 Q 3.9940 7.5594 119.3270 59.0376 28.8345 178.5810 30 Q 4.1443 7.6063 117.8822 57.7165 28.6731 177.4672 31 G 4.1267 7.2654 106.6240 45.2557 0.0000 174.1988 32 V 3.5249 7.4406 118.6149 62.4702 32.3234 176.2480 33 N 4.7936 8.4584 122.2486 52.0804 38.9498 175.7485 34 I 3.5775 8.3364 125.7389 65.0275 37.2528 177.2059 35 M 3.9641 8.1039 117.6393 59.0864 32.1078 177.8048 36 E 4.0038 8.4304 118.4623 59.5990 29.5017 178.5819 37 F 4.4045 8.5188 120.1278 61.4345 39.5088 176.1654 38 C 4.1792 8.4233 118.6003 62.7795 31.2150 175.9169 39 K 3.9336 8.1696 119.3375 59.2245 31.2663 179.2512 40 A 4.0389 8.4432 121.4386 55.2565 18.3854 179.2248 41 F 3.8735 8.5685 119.9497 61.5933 39.4577 177.0567 42 N 4.6954 8.3198 116.5946 54.9909 38.1146 177.0945 43 A 4.0862 7.4361 123.9848 54.7578 18.5480 179.8505 44 K 3.9608 7.6867 116.4188 59.3485 32.1328 179.5396 45 T 3.7994 7.5308 109.5808 63.7390 68.4148 176.2145 46 D 4.2956 7.6859 122.5605 57.5879 40.7111 178.5378 47 S 4.1594 7.8340 113.5347 60.7675 63.3204 175.1178 48 I 3.7852 6.8508 119.9072 60.2942 38.3306 175.1197 49 E 3.8529 8.7151 123.7600 57.1553 29.6167 177.3856 50 K 4.2118 8.5248 123.1921 56.9069 33.1553 177.4971 51 G 3.9433 8.9900 110.2888 45.0349 0.0000 172.8301 52 L 4.8200 7.4389 120.3880 51.7900 44.1631 173.9841 53 P 4.5812 0.0000 0.0000 63.0636 31.8403 175.4558 54 I 4.6836 8.3517 125.3321 58.1045 39.8602 173.1185 55 P 4.7962 0.0000 0.0000 62.7744 32.7409 175.5791 56 V 4.7573 9.1448 122.7242 59.8952 35.3443 174.6267 57 V 4.2445 8.2796 123.5879 61.3718 33.1992 174.2989 58 I 4.6688 8.0289 129.8648 60.5555 39.0489 175.0158 59 T 4.5193 8.8826 121.3226 60.2852 69.7313 173.2022 60 V 4.3415 8.2859 128.2489 61.7541 33.3376 174.0743 61 Y 4.8962 8.2886 122.1385 55.7163 40.5631 176.7619 62 A 4.2029 8.7301 122.8083 55.4819 18.4762 178.6126 63 D 4.3922 8.1463 114.2946 55.8932 41.3276 177.4021 64 R 4.2283 8.6383 116.3512 56.0685 28.8607 176.0180 65 S 4.5829 7.8983 113.4181 58.2050 63.2506 171.8097 66 F 5.1274 7.4967 116.1624 56.3857 40.2004 172.6937 67 T 5.0463 8.6271 109.3266 60.5536 72.7205 172.3722 68 F 5.8004 7.7936 114.4643 56.6548 40.6834 173.6488 69 V 4.4379 8.5797 114.2462 60.0492 34.0698 174.3353 70 T 4.6251 8.6862 120.2105 60.8057 68.1255 174.0131 71 K 4.6547 8.2456 131.0487 56.3365 32.9320 175.5220 72 T 4.5895 8.3705 118.4679 60.2919 69.0766 173.5462 73 P 4.5194 0.0000 0.0000 62.0642 32.0003 174.9344 74 P 4.3376 0.0000 0.0000 62.9406 33.1388 177.5134 75 A 3.9664 8.5791 122.2990 55.2484 18.4460 179.9665 76 A 3.9294 8.0110 118.7966 55.3483 18.4741 179.8276 77 V 3.5059 7.7160 115.9635 66.2812 31.7037 177.8920 78 L 4.0155 8.0571 118.7170 58.0184 41.4430 179.6718 79 L 4.0114 8.3791 119.1739 57.4981 41.4050 179.7373 80 K 3.9501 8.0098 118.5138 59.3479 31.9774 179.4323 81 K 3.9088 8.1218 118.3557 59.4566 31.8110 178.9969 82 A 4.0756 7.9010 119.2982 55.4838 18.3789 179.4177 83 A 4.2814 8.2821 118.0567 53.2279 18.3958 178.7643 84 G 3.8591 8.1794 104.9310 46.5632 0.0000 173.1855 85 I 4.4533 7.3582 111.5720 58.9420 39.6912 175.6531 86 K 4.1879 8.4900 120.7973 58.2006 32.5979 176.7902 87 S 4.6688 7.5934 110.3381 55.9092 65.8046 173.4583 88 G 3.9138 8.3189 111.9100 45.1711 0.0000 173.2059 89 S 4.3133 8.4284 111.9846 58.3443 63.7699 175.6519 90 G 4.1449 8.4973 114.2574 45.5797 0.0000 174.5191 91 K 4.5498 7.2664 120.0121 52.4700 32.1395 173.7915 92 P 4.9464 0.0000 0.0000 63.3030 32.3760 176.0978 93 N 4.8578 8.9274 120.8611 54.0054 37.5324 176.1726 94 K 4.0527 8.0202 117.4131 58.6202 32.5515 176.1989 95 D 4.8052 7.8404 116.7908 51.8981 43.4362 174.5786 96 K 4.5610 8.6257 125.9631 56.0883 33.6022 176.7990 97 V 3.9749 8.3071 117.7738 63.1142 32.7471 175.7426 98 G 4.2854 7.6400 106.0735 45.5139 0.0000 171.8080 99 K 5.3860 8.3875 117.6004 55.7070 36.0654 175.8434 100 I 4.9490 8.9403 121.4402 59.6616 41.7673 175.4355 101 S 5.4078 9.1243 120.2539 57.4846 63.8329 175.6293 102 R 3.9347 8.5671 120.3358 59.1440 29.7156 179.2436 103 A 4.1338 7.9348 120.3172 55.2619 18.4246 179.2798 104 Q 4.1634 7.7676 117.3563 58.6707 28.8610 179.2395 105 L 4.0107 7.6881 119.6598 58.1132 41.5338 179.7516 106 Q 4.0604 7.8665 117.6512 58.9359 28.3087 178.6539 107 E 3.9718 8.0728 119.6178 59.4804 29.4641 179.5253 108 I 3.8129 8.2435 120.1010 64.2385 37.1608 178.2709 109 A 4.0447 8.5129 122.0426 55.1922 17.9242 179.5317 110 Q 3.9095 8.1181 117.5961 59.4735 29.2132 178.2490 111 T 4.0254 7.6813 115.6905 66.7643 68.8459 176.7018 112 K 4.1523 8.7961 119.6983 58.3926 32.1410 179.5179 113 A 3.9185 7.7677 122.0969 55.1094 18.1456 179.1544 114 A 3.9724 8.0187 118.3907 55.5936 18.4243 178.5677 115 D 4.5681 8.2549 113.5601 56.1196 41.3631 176.8573 116 M 4.4654 7.3733 118.2195 54.3761 33.0910 176.4372 117 T 4.0254 8.7680 115.9991 64.4256 67.9842 175.0058 118 G 3.8568 7.7088 108.2761 44.6816 0.0000 173.4209 119 A 4.1129 8.8091 128.8489 54.3745 19.0361 177.1619 120 D 5.0582 7.6236 113.9613 50.6779 44.0047 176.5618 121 I 3.7144 8.2036 113.4453 64.2267 37.3441 178.0021 122 E 3.9090 8.2111 119.5303 59.0868 29.1346 178.8653 123 A 3.9970 8.5004 119.8137 55.4806 18.7415 179.3138 124 M 4.1451 7.9240 116.7777 58.9853 32.1187 178.8621 125 T 3.8641 8.4206 116.1061 67.0305 68.8192 176.3966 126 R 4.1646 8.2266 119.7470 58.8504 30.0657 178.6955 127 S 4.1564 7.9514 115.5252 61.6764 62.7941 176.5616 128 I 3.8707 7.6871 122.0714 64.3318 36.8540 178.1151 129 E 4.0809 8.3262 119.7103 59.3091 28.9993 179.5899 130 G 3.6379 7.7435 105.0808 47.9335 0.0000 175.5619 131 T 4.0632 7.5670 110.5044 64.4483 68.8927 176.7119 132 A 3.9896 8.1006 123.7283 55.0737 18.2468 179.8678 133 R 3.9499 8.0681 115.0834 58.8559 30.1667 178.7388 134 S 4.4131 7.7294 113.4070 60.1091 63.5447 175.2407 135 M 4.4060 7.8781 120.0782 54.5615 32.2644 176.7504 136 G 3.9224 8.0870 107.3884 46.1245 0.0000 172.4466 137 L 4.9097 7.8175 120.0343 52.5769 43.2038 176.9652 138 V 4.0105 8.5974 124.7348 62.3953 33.3362 174.8560 139 V 5.5903 8.4739 124.1408 60.1742 34.0217 174.1534 140 E 4.5982 8.6583 126.1414 54.4383 31.7588 175.6890 141 D 4.4588 8.6629 122.9043 54.3706 41.3797 175.5399 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 A 8.25 4.35 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 K 7.41 4.23 0.00 1.91 1.75 0.00 1.55 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.46 7.81 3 K 8.37 4.42 0.00 1.68 1.74 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.47 7.81 4 V 7.83 4.44 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 0.76 0.00 0.00 0.93 0.00 0.00 5 Q 8.26 4.05 0.00 2.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 6 A 8.38 3.78 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 7 Y 8.12 3.33 0.00 3.11 2.99 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 0.00 8 V 8.05 4.28 1.90 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 0.63 0.00 0.00 0.65 0.00 0.00 9 K 7.95 5.09 0.00 1.54 1.61 0.00 1.89 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.25 1.35 7.81 10 L 8.30 4.29 0.00 1.60 1.56 0.71 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.79 4.91 0.00 1.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 12 V 7.98 4.52 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.90 0.00 0.00 13 A 8.73 4.07 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 14 A 8.36 3.85 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 15 G 7.24 4.38 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 0.00 16 M 7.47 4.24 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 17 A 8.51 4.21 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 N 9.08 4.64 0.00 2.77 3.27 0.00 0.00 6.98 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.37 0.00 2.20 1.95 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 20 S 8.62 4.01 0.00 3.81 3.87 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 21 P 0.00 4.40 0.00 2.06 2.09 0.00 3.72 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 2.02 2.11 0.00 22 P 0.00 4.45 0.00 2.01 2.08 0.00 3.65 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 23 V 7.46 4.21 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 0.93 0.00 0.00 0.90 0.00 0.00 24 G 9.51 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 25 P 0.00 4.35 0.00 2.13 2.11 0.00 3.94 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 26 A 7.83 3.91 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 27 L 7.55 4.09 0.00 1.53 1.61 0.23 0.17 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 28 G 8.38 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 29 Q 7.56 3.99 0.00 1.93 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.28 2.71 0.00 30 Q 7.61 4.14 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.37 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 31 G 7.27 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.44 3.52 1.74 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 -0.33 0.00 0.00 0.60 0.00 0.00 33 N 8.46 4.79 0.00 3.21 2.94 0.00 0.00 6.85 7.23 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 34 I 8.34 3.58 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.97 0.93 0.00 0.00 35 M 8.10 3.96 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.72 0.00 36 E 8.43 4.00 0.00 2.22 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 2.48 2.44 0.00 37 F 8.52 4.40 0.00 3.22 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 C 8.42 4.18 0.00 3.11 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.17 3.93 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.61 7.81 40 A 8.44 4.04 1.63 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 0.00 0.00 41 F 8.57 3.87 0.00 1.51 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 0.00 0.00 0.00 42 N 8.32 4.70 0.00 2.83 2.79 0.00 0.00 6.50 7.95 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 43 A 7.44 4.09 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 44 K 7.69 3.96 0.00 1.73 1.82 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.45 7.81 45 T 7.53 3.80 3.90 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 -0.29 0.00 0.00 46 D 7.69 4.30 0.00 2.73 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 47 S 7.83 4.16 0.00 3.94 3.90 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 48 I 6.85 3.79 1.82 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.74 0.89 0.00 0.00 49 E 8.72 3.85 0.00 2.00 1.93 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 2.33 2.32 0.00 50 K 8.52 4.21 0.00 1.73 1.72 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.17 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.38 1.52 7.81 51 G 8.99 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 0.00 0.00 0.00 52 L 7.44 4.82 0.00 1.75 1.60 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.58 0.00 2.10 2.10 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 54 I 8.35 4.68 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.32 1.29 0.00 0.00 55 P 0.00 4.80 0.00 2.18 2.18 0.00 3.82 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 2.12 2.00 0.00 56 V 9.14 4.76 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 0.51 0.00 0.00 1.30 0.00 0.00 57 V 8.28 4.24 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 0.25 0.00 0.00 0.92 0.00 0.00 58 I 8.03 4.67 1.40 0.00 0.00 -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 0.72 -0.01 0.53 0.00 0.00 59 T 8.88 4.52 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 1.15 0.00 0.00 60 V 8.29 4.34 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 0.98 0.00 0.00 0.77 0.00 0.00 61 Y 8.29 4.90 0.00 3.09 2.84 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 62 A 8.73 4.20 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 63 D 8.15 4.39 0.00 2.72 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 64 R 8.64 4.23 0.00 2.05 2.40 0.00 3.26 0.00 0.00 3.19 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.81 0.00 65 S 7.90 4.58 0.00 4.17 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 66 F 7.50 5.13 0.00 3.07 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 67 T 8.63 5.05 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 1.39 0.00 0.00 68 F 7.79 5.80 0.00 3.21 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.58 4.44 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.02 0.00 0.00 70 T 8.69 4.63 4.51 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 1.28 0.00 0.00 71 K 8.25 4.65 0.00 1.87 2.13 0.00 1.97 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.43 7.81 72 T 8.37 4.59 4.27 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 1.30 0.00 0.00 73 P 0.00 4.52 0.00 2.24 2.22 0.00 3.87 0.00 0.00 3.69 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 74 P 0.00 4.34 0.00 2.19 2.05 0.00 3.62 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 75 A 8.58 3.97 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 76 A 8.01 3.93 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 77 V 7.72 3.51 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 0.94 0.00 0.00 78 L 8.06 4.02 0.00 1.88 1.72 0.98 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.38 4.01 0.00 1.85 1.72 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.01 3.95 0.00 2.05 2.04 0.00 1.68 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.74 7.81 81 K 8.12 3.91 0.00 1.94 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 82 A 7.90 4.08 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 83 A 8.28 4.28 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 84 G 8.18 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 I 7.36 4.45 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.72 0.91 0.00 0.00 86 K 8.49 4.19 0.00 1.77 1.90 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.42 7.81 87 S 7.59 4.67 0.00 3.76 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 88 G 8.32 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.43 4.31 0.00 4.18 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 90 G 8.50 4.14 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 0.00 91 K 7.27 4.55 0.00 1.83 1.71 0.00 1.58 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.47 7.81 92 P 0.00 4.95 0.00 2.03 2.07 0.00 3.80 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 93 N 8.93 4.86 0.00 2.90 3.02 0.00 0.00 6.92 7.61 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 94 K 8.02 4.05 0.00 1.71 2.02 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.42 7.81 95 D 7.84 4.81 0.00 2.64 2.49 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 0.00 0.00 0.00 0.00 96 K 8.63 4.56 0.00 1.90 1.81 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.45 7.81 97 V 8.31 3.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 1.01 0.00 0.00 98 G 7.64 4.29 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 0.00 99 K 8.39 5.39 0.00 1.90 1.73 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.43 7.81 100 I 8.94 4.95 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.56 0.95 0.00 0.00 101 S 9.12 5.41 0.00 4.01 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 0.00 102 R 8.57 3.93 0.00 1.90 2.03 0.00 3.30 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 103 A 7.93 4.13 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 0.00 104 Q 7.77 4.16 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.28 0.00 105 L 7.69 4.01 0.00 1.80 1.73 0.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.87 4.06 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 107 E 8.07 3.97 0.00 2.22 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 0.00 2.33 2.63 0.00 108 I 8.24 3.81 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.83 0.92 0.00 0.00 109 A 8.51 4.04 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 0.00 110 Q 8.12 3.91 0.00 2.16 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 111 T 7.68 4.03 4.39 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 1.22 0.00 0.00 112 K 8.80 4.15 0.00 1.74 1.87 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.61 7.81 113 A 7.77 3.92 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 0.00 0.00 114 A 8.02 3.97 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 0.00 115 D 8.25 4.57 0.00 2.81 2.76 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 0.00 116 M 7.37 4.47 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.48 0.00 117 T 8.77 4.03 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 1.22 0.00 0.00 118 G 7.71 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 8.81 4.11 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 0.00 120 D 7.62 5.06 0.00 2.98 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 0.00 121 I 8.20 3.71 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.06 0.91 0.00 0.00 122 E 8.21 3.91 0.00 2.23 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 2.40 2.45 0.00 123 A 8.50 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 0.00 124 M 7.92 4.15 0.00 2.12 2.26 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 2.78 2.59 0.00 125 T 8.42 3.86 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 126 R 8.23 4.16 0.00 1.98 2.05 0.00 3.10 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 127 S 7.95 4.16 0.00 4.09 3.90 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 0.00 128 I 7.69 3.87 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.74 0.92 0.00 0.00 129 E 8.33 4.08 0.00 2.18 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 0.00 2.33 2.55 0.00 130 G 7.74 3.64 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 0.00 0.00 0.00 131 T 7.57 4.06 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 1.27 0.00 0.00 132 A 8.10 3.99 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 0.00 133 R 8.07 3.95 0.00 1.79 2.01 0.00 3.16 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 134 S 7.73 4.41 0.00 4.05 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 0.00 135 M 7.88 4.41 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.59 0.00 136 G 8.09 3.92 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 0.00 0.00 0.00 137 L 7.82 4.91 0.00 1.64 1.61 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.60 4.01 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 0.82 0.00 0.00 0.93 0.00 0.00 139 V 8.47 5.59 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 0.96 0.00 0.00 0.93 0.00 0.00 140 E 8.66 4.60 0.00 2.03 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 2.27 2.22 0.00 141 D 8.66 4.46 0.00 2.64 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00