NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9820 8.3393 109.7362 45.4002 0.0000 173.0650 2 S 4.5166 8.2277 115.7608 55.3417 65.6897 172.3781 3 S 4.3799 8.8447 120.4540 58.6951 64.8179 174.0649 4 G 3.8885 8.0760 118.2277 43.9968 0.0000 173.3707 5 S 4.1382 8.7922 121.1840 59.0419 63.1935 174.4393 6 S 4.4904 8.4228 118.2577 60.4795 64.2786 172.4328 7 G 3.9554 8.4490 113.5306 44.2774 0.0000 173.1944 8 S 4.6730 8.4701 111.1390 55.8011 62.9943 172.5712 9 P 4.5017 0.0000 0.0000 65.2788 30.6084 178.9598 10 L 3.9708 8.1012 119.0449 58.4513 41.8890 176.6496 11 G 4.5385 6.1983 103.4531 43.2118 0.0000 171.1700 12 Q 5.1189 8.1437 118.0855 55.1400 33.7349 174.1876 13 I 4.4596 8.1544 115.5120 60.7710 42.1770 172.8549 14 Q 4.6270 7.2699 129.0276 53.2960 30.7679 174.1039 15 L 5.4664 7.8024 125.4378 52.1728 45.3394 176.3709 16 T 4.4342 8.3477 120.9483 62.0610 69.5861 173.5166 17 I 4.4693 7.3029 128.1111 59.6300 39.5016 175.4321 18 R 4.9533 8.5378 127.7915 55.8586 33.3688 172.9405 19 H 5.5347 8.6734 127.5690 53.8702 31.9391 173.4358 20 S 4.6226 8.3738 121.2471 57.8999 63.1218 174.9285 21 S 4.2595 8.8081 121.3856 61.1055 62.8223 175.1426 22 Q 4.0901 8.1816 120.3655 59.1524 28.8616 177.0681 23 R 4.1319 7.9399 113.3737 56.2112 31.3315 175.7299 24 N 4.2588 7.7648 115.3863 54.4685 37.0641 173.2596 25 K 4.9880 7.3081 114.5865 54.5175 37.6279 176.6198 26 L 4.6968 9.0110 124.7761 53.7410 43.9341 174.9813 27 I 4.8670 8.2448 127.8979 60.0976 39.2511 175.4247 28 V 4.5956 8.8380 126.1753 61.3615 34.7687 173.9693 29 V 4.6250 8.3110 128.2694 61.6456 33.3783 175.1769 30 V 4.0737 8.6221 129.0593 61.0356 29.9415 174.5236 31 H 3.9650 8.3870 119.2708 57.4676 29.1825 175.1064 32 A 4.7354 7.1320 116.3154 52.2026 22.7300 173.9220 33 C 5.5584 8.3814 115.9301 58.3213 32.0699 173.7570 34 R 4.6085 8.2563 116.1885 54.5953 33.4088 174.0147 35 N 4.2670 8.5118 113.2149 54.5587 35.9166 175.1397 36 L 5.0328 7.7372 118.5273 52.7367 41.7649 177.0694 37 I 3.8174 7.7454 116.4664 61.4680 37.9238 175.1947 38 A 4.8012 8.4336 125.9299 50.0440 20.6128 177.5816 39 F 3.8209 9.2023 125.0283 60.6576 39.9273 175.2537 40 S 4.5875 8.1896 114.9051 56.9285 65.3291 174.0838 41 E 3.9668 9.2952 126.6177 59.8366 29.2953 178.0922 42 D 4.5568 8.0903 118.1969 55.6781 40.9794 176.8751 43 G 4.4457 6.6563 113.4557 44.9566 0.0000 171.6612 44 S 4.8606 8.0948 118.4345 56.6667 66.9600 172.6705 45 D 5.8500 8.7217 120.8162 50.9838 40.7195 173.3337 46 P 5.1747 0.0000 0.0000 63.0983 33.4884 175.2904 47 Y 5.1023 8.6717 118.2750 56.1605 41.2508 173.4432 48 V 4.3400 7.8049 121.8435 61.7381 33.8437 174.4314 49 R 4.9724 8.4502 127.1791 54.7919 32.7890 173.7795 50 M 5.1368 8.7608 125.8647 53.8392 34.8368 174.5435 51 Y 4.5268 8.5336 120.2647 56.1489 42.3801 174.7010 52 L 4.6295 8.3597 126.4704 53.7294 41.7171 175.9693 53 L 4.3746 8.6868 125.8843 53.5898 42.5797 176.6216 54 P 4.2612 0.0000 0.0000 65.8289 31.6432 176.7204 55 D 4.3249 7.7613 117.4272 54.6127 40.6118 176.5731 56 K 4.8278 8.4174 121.7069 56.0095 33.5047 176.0615 57 R 3.8352 7.7492 117.7562 56.6683 30.3758 176.4891 58 R 4.7581 8.5997 120.8686 56.7785 30.3083 177.2991 59 S 4.5273 8.0601 113.9784 60.0351 64.3430 175.7837 60 G 3.9240 7.8443 107.1496 44.7278 0.0000 172.9450 61 R 3.2414 7.1936 119.2005 56.7502 30.2808 175.9962 62 R 4.8328 8.2047 124.7981 54.3933 32.4604 175.1187 63 K 5.0584 8.6823 122.3746 55.2254 36.3189 175.5033 64 T 4.5912 7.7041 110.5372 59.9983 70.6789 173.9885 65 H 4.1696 8.8566 121.3352 56.8671 30.1823 174.6049 66 V 4.5291 7.6189 123.7235 61.2495 32.1571 175.3876 67 S 4.5125 8.5869 125.0709 58.4718 63.9677 173.7361 68 K 4.8400 8.4782 122.0336 54.7274 34.9202 176.0217 69 K 3.8375 7.8532 120.7722 56.9274 29.8599 175.5227 70 T 4.4436 7.4266 108.4825 61.5622 70.3081 172.2888 71 L 4.5290 8.6491 126.5057 55.3115 43.1447 176.6056 72 N 5.3209 7.9556 116.4926 49.4692 36.4520 172.8777 73 P 4.3745 0.0000 0.0000 63.4987 33.4715 175.9395 74 V 4.1967 7.5530 120.1724 61.5466 33.8287 174.4531 75 F 4.7939 8.5257 125.3932 57.7452 41.2763 175.8456 76 D 4.4549 8.3042 117.6494 55.2010 39.1150 173.6786 77 Q 4.5595 7.6448 115.2829 55.0839 31.2130 174.8513 78 S 5.1173 8.2190 114.3522 56.8385 65.1867 173.0925 79 F 4.8075 9.5520 125.7826 55.9883 42.1953 173.9627 80 D 5.6942 7.5467 117.5920 52.4473 42.3983 174.9559 81 F 4.7740 8.5443 118.5226 56.0643 43.3712 174.1344 82 S 4.7257 9.0051 119.5858 58.3741 61.7775 173.0974 83 V 4.6001 8.1190 124.5639 60.4550 34.5478 175.6923 84 S 4.4407 8.7681 120.0000 57.9951 63.8844 174.8145 85 L 3.7091 8.7548 125.0649 58.0873 41.5067 177.5008 86 P 4.9521 0.0000 0.0000 65.0829 31.4495 177.6760 87 E 4.2330 7.9743 116.7277 58.5808 29.8222 178.7327 88 V 3.6225 7.9387 119.2792 65.0096 31.0764 178.3980 89 Q 4.4069 8.4858 118.3404 58.5937 28.6343 178.3525 90 R 4.1317 7.8298 111.2625 57.1122 29.1613 176.4288 91 R 4.5054 7.4036 119.2040 55.4528 32.2564 174.7518 92 T 4.7426 7.8736 112.7409 62.0932 72.4854 173.7238 93 L 4.7953 8.0631 126.3634 53.3609 43.0876 174.6323 94 D 4.5015 8.9077 126.8605 54.3330 42.1398 175.1983 95 V 5.0597 8.4980 126.3868 60.4323 33.3278 173.7235 96 A 4.8308 8.3076 129.5559 49.9092 22.2150 174.8279 97 V 4.4355 8.7228 123.0884 60.6443 32.8666 174.7010 98 K 4.7221 7.5254 127.0562 54.3052 36.0987 174.2277 99 N 5.5604 7.9785 115.4940 50.7623 38.8168 175.7904 100 S 4.4134 9.1277 121.3143 58.2346 62.6517 175.5028 101 G 4.0181 7.7749 109.2930 44.4571 0.0000 173.7952 102 G 3.7008 7.4230 103.4303 46.2812 0.0000 172.7446 103 F 4.6071 7.9493 119.5608 55.9268 39.9332 175.7719 104 L 3.7204 8.6375 127.8173 56.1962 38.9287 175.5097 105 S 4.2849 7.8022 110.6814 59.9242 64.4216 175.2129 106 K 3.8452 8.8461 115.7913 56.8561 28.6050 175.0358 107 D 4.5762 7.5655 114.5965 53.2330 43.8699 174.9810 108 K 4.0530 8.7362 122.4502 57.3563 32.8873 176.8021 109 G 3.8742 8.5637 107.1277 45.7987 0.0000 170.0387 110 L 4.2686 7.9869 123.1642 55.4565 42.7211 176.4533 111 L 4.3431 8.6425 126.7341 56.9667 42.6677 177.5671 112 G 4.2555 7.7475 101.0431 45.5738 0.0000 172.7467 113 K 5.2847 8.3608 120.6540 55.4086 36.2747 175.2227 114 V 4.7842 8.8203 120.8976 60.2750 35.0277 173.7912 115 L 4.7434 8.4566 122.5546 53.1517 43.6313 175.8764 116 V 4.2549 7.7207 121.7795 60.9083 34.7523 174.1799 117 A 4.5683 8.5154 129.4059 50.6214 19.8470 176.9054 118 L 4.4970 8.0347 119.5955 55.6995 41.7217 177.4830 119 A 4.5907 7.5469 120.2359 52.5166 18.7853 178.2931 120 S 4.7277 7.9535 113.2053 58.4967 63.9807 173.6142 121 E 4.4240 8.5304 121.8985 57.7485 30.1013 176.0296 122 E 4.5293 7.8500 119.8667 56.8575 30.2063 178.8615 123 L 4.3823 8.2163 120.7593 57.3102 42.6043 179.1589 124 A 4.6080 8.2661 119.8569 54.6464 18.4531 178.8928 125 K 4.0381 8.2049 113.5591 59.0824 32.4566 178.7522 126 G 4.2626 8.7454 102.0708 45.3910 0.0000 172.1539 127 W 5.4334 7.6121 115.9955 55.0277 32.4092 173.6524 128 T 4.8445 8.5375 116.3191 61.9356 71.1995 173.3680 129 Q 4.5724 8.2228 122.1893 55.1162 32.2759 173.2241 130 W 4.6715 8.6530 120.3430 55.6394 29.6844 176.3891 131 Y 4.6994 8.9782 125.2313 57.0778 37.9175 174.8798 132 D 4.7379 8.9052 124.9780 54.3552 41.3302 176.8454 133 L 4.3761 8.6767 124.8025 55.3048 42.6816 176.6430 134 T 4.8047 8.8601 111.7931 59.6906 72.9921 172.9940 135 E 4.5401 8.7056 121.4830 55.7609 30.2698 177.1969 136 D 4.3107 8.7517 119.7440 56.5330 39.2366 175.3328 137 S 3.9908 7.1643 117.4013 58.4142 61.7658 173.3762 138 G 4.0231 7.7516 114.0476 44.0406 0.0000 169.7423 139 P 4.3805 0.0000 0.0000 62.7571 32.0346 177.3827 140 S 4.5737 8.2477 118.7868 57.2641 62.2609 174.2604 141 S 4.4146 7.8419 121.4049 56.7050 61.1047 174.1808 142 G 3.7465 7.7618 112.8854 45.4743 0.0000 171.5374 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.34 3.98 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 2 S 8.23 4.52 0.00 4.01 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 3 S 8.84 4.38 0.00 3.88 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 G 8.08 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 5 S 8.79 4.14 0.00 3.86 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 6 S 8.42 4.49 0.00 3.80 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.45 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 8 S 8.47 4.67 0.00 3.86 3.79 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 9 P 0.00 4.50 0.00 2.17 2.17 0.00 3.80 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 1.98 1.98 0.00 10 L 8.10 3.97 0.00 1.75 1.94 1.02 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 11 G 6.20 4.54 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 0.00 12 Q 8.14 5.12 0.00 2.21 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.61 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 13 I 8.15 4.46 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.84 1.13 0.00 0.00 14 Q 7.27 4.63 0.00 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.66 0.00 0.00 0.00 0.00 0.00 1.71 1.43 0.00 15 L 7.80 5.47 0.00 1.64 1.52 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 16 T 8.35 4.43 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 1.17 0.00 0.00 17 I 7.30 4.47 0.84 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.86 0.70 0.00 0.00 18 R 8.54 4.95 0.00 1.74 1.66 0.00 3.09 0.00 0.00 3.16 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 19 H 8.67 5.53 0.00 3.26 3.17 0.00 5.75 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.37 4.62 0.00 3.91 3.65 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 0.00 0.00 0.00 0.00 21 S 8.81 4.26 0.00 3.93 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 22 Q 8.18 4.09 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 23 R 7.94 4.13 0.00 1.79 1.93 0.00 3.45 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 24 N 7.76 4.26 0.00 2.90 2.86 0.00 0.00 6.65 6.99 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 25 K 7.31 4.99 0.00 1.61 1.63 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.58 7.81 26 L 9.01 4.70 0.00 1.86 1.85 0.95 0.94 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 27 I 8.24 4.87 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.34 0.93 0.00 0.00 28 V 8.84 4.60 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 0.94 0.00 0.00 1.00 0.00 0.00 29 V 8.31 4.62 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 0.74 0.00 0.00 0.89 0.00 0.00 30 V 8.62 4.07 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 0.93 0.00 0.00 0.89 0.00 0.00 31 H 8.39 3.97 0.00 3.07 3.18 0.00 5.71 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.13 4.74 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 33 C 8.38 5.56 0.00 3.03 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 34 R 8.26 4.61 0.00 1.63 2.03 0.00 2.63 0.00 0.00 2.66 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.48 0.00 35 N 8.51 4.27 0.00 3.05 2.89 0.00 0.00 6.63 6.65 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 36 L 7.74 5.03 0.00 1.78 1.70 1.04 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.75 3.82 1.86 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 1.16 0.42 0.96 0.00 0.00 38 A 8.43 4.80 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 39 F 9.20 3.82 0.00 3.08 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 40 S 8.19 4.59 0.00 4.03 3.75 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 41 E 9.30 3.97 0.00 2.12 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 2.31 2.39 0.00 42 D 8.09 4.56 0.00 2.70 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 G 6.66 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 0.00 0.00 0.00 0.00 44 S 8.09 4.86 0.00 3.98 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 45 D 8.72 5.85 0.00 2.68 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 46 P 0.00 5.17 0.00 2.26 2.28 0.00 4.08 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 2.20 2.17 0.00 47 Y 8.67 5.10 0.00 3.02 3.07 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 48 V 7.80 4.34 1.83 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 0.89 0.00 0.00 0.97 0.00 0.00 49 R 8.45 4.97 0.00 1.99 1.79 0.00 3.12 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.69 0.00 50 M 8.76 5.14 0.00 1.86 1.95 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 51 Y 8.53 4.53 0.00 2.92 2.77 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 52 L 8.36 4.63 0.00 1.32 1.47 0.74 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.69 4.37 0.00 1.76 1.56 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.26 0.00 2.18 2.17 0.00 3.79 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 1.98 1.98 0.00 55 D 7.76 4.32 0.00 2.80 2.69 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 0.00 0.00 0.00 0.00 56 K 8.42 4.83 0.00 1.78 1.94 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.65 7.81 57 R 7.75 3.84 0.00 1.84 1.87 0.00 3.11 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 58 R 8.60 4.76 0.00 1.84 1.99 0.00 3.22 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.69 0.00 59 S 8.06 4.53 0.00 3.94 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 60 G 7.84 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 61 R 7.19 3.24 0.00 1.80 1.89 0.00 3.27 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.89 0.00 62 R 8.20 4.83 0.00 2.00 1.94 0.00 3.64 0.00 0.00 3.35 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.97 0.00 63 K 8.68 5.06 0.00 1.93 1.88 0.00 1.68 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.45 7.81 64 T 7.70 4.59 3.66 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 1.07 0.00 0.00 65 H 8.86 4.17 0.00 3.23 3.59 0.00 5.89 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.62 4.53 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.82 0.00 0.00 67 S 8.59 4.51 0.00 3.81 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 68 K 8.48 4.84 0.00 1.64 1.72 0.00 1.96 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.38 1.47 7.81 69 K 7.85 3.84 0.00 1.85 1.89 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.51 7.81 70 T 7.43 4.44 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 71 L 8.65 4.53 0.00 1.68 1.83 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 72 N 7.96 5.32 0.00 2.70 2.84 0.00 0.00 6.43 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 73 P 0.00 4.37 0.00 1.70 2.24 0.00 3.85 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 2.14 2.11 0.00 74 V 7.55 4.20 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 0.98 0.00 0.00 0.90 0.00 0.00 75 F 8.53 4.79 0.00 3.19 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.30 4.45 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 77 Q 7.64 4.56 0.00 2.29 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.57 0.00 78 S 8.22 5.12 0.00 3.79 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 79 F 9.55 4.81 0.00 3.02 2.69 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 0.00 0.00 0.00 0.00 80 D 7.55 5.69 0.00 2.49 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 81 F 8.54 4.77 0.00 2.99 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 82 S 9.01 4.73 0.00 3.89 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 83 V 8.12 4.60 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 0.91 0.00 0.00 0.95 0.00 0.00 84 S 8.77 4.44 0.00 3.93 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.75 3.71 0.00 1.61 1.67 0.88 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 86 P 0.00 4.95 0.00 2.06 2.13 0.00 3.74 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 87 E 7.97 4.23 0.00 2.12 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 0.00 2.36 2.30 0.00 88 V 7.94 3.62 2.07 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 0.85 0.00 0.00 0.92 0.00 0.00 89 Q 8.49 4.41 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.94 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 90 R 7.83 4.13 0.00 1.94 2.04 0.00 3.05 0.00 0.00 3.45 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.59 0.00 91 R 7.40 4.51 0.00 1.97 2.03 0.00 3.05 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 92 T 7.87 4.74 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 1.19 0.00 0.00 93 L 8.06 4.80 0.00 1.69 1.48 0.66 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.91 4.50 0.00 2.83 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 95 V 8.50 5.06 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 1.06 0.00 0.00 0.94 0.00 0.00 96 A 8.31 4.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.72 4.44 2.07 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 1.34 0.00 0.00 0.93 0.00 0.00 98 K 7.53 4.72 0.00 1.65 1.72 0.00 1.59 0.00 0.00 1.89 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.21 7.81 99 N 7.98 5.56 0.00 2.87 2.91 0.00 0.00 7.06 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 9.13 4.41 0.00 3.53 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 0.00 101 G 7.77 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 0.00 0.00 0.00 102 G 7.42 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 0.00 103 F 7.95 4.61 0.00 3.05 2.92 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 0.00 104 L 8.64 3.72 0.00 1.86 1.79 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 105 S 7.80 4.28 0.00 3.67 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 0.00 106 K 8.85 3.85 0.00 1.93 1.91 0.00 1.82 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.34 7.81 107 D 7.57 4.58 0.00 2.51 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 0.00 0.00 0.00 0.00 108 K 8.74 4.05 0.00 1.94 1.92 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.38 7.81 109 G 8.56 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 0.00 0.00 0.00 110 L 7.99 4.27 0.00 1.60 1.63 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.64 4.34 0.00 1.75 1.74 0.98 1.12 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 0.00 112 G 7.75 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.36 5.28 0.00 1.75 1.82 0.00 1.23 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.36 7.81 114 V 8.82 4.78 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 0.88 0.00 0.00 0.90 0.00 0.00 115 L 8.46 4.74 0.00 1.48 1.55 0.87 0.78 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 0.00 116 V 7.72 4.25 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 1.00 0.00 0.00 -0.04 0.00 0.00 117 A 8.52 4.57 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 0.00 118 L 8.03 4.50 0.00 2.00 1.72 0.88 0.54 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 0.00 119 A 7.55 4.59 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 0.00 120 S 7.95 4.73 0.00 3.79 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 0.00 121 E 8.53 4.42 0.00 2.14 2.07 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 2.23 2.34 0.00 122 E 7.85 4.53 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 123 L 8.22 4.38 0.00 1.83 1.89 1.08 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 124 A 8.27 4.61 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 0.00 125 K 8.20 4.04 0.00 1.86 1.96 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.49 7.81 126 G 8.75 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 W 7.61 5.43 0.00 3.37 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 0.00 128 T 8.54 4.84 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 1.11 0.00 0.00 129 Q 8.22 4.57 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 7.02 0.00 0.00 0.00 0.00 0.00 2.35 1.71 0.00 130 W 8.65 4.67 0.00 3.15 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 0.00 131 Y 8.98 4.70 0.00 2.95 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 0.00 132 D 8.91 4.74 0.00 2.63 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 0.00 133 L 8.68 4.38 0.00 1.78 1.71 0.98 0.71 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 0.00 134 T 8.86 4.80 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 1.28 0.00 0.00 135 E 8.71 4.54 0.00 1.98 1.94 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 2.32 2.30 0.00 136 D 8.75 4.31 0.00 2.75 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 0.00 137 S 7.16 3.99 0.00 3.79 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 0.00 138 G 7.75 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 0.00 0.00 0.00 139 P 0.00 4.38 0.00 2.18 2.06 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 1.97 1.97 0.00 140 S 8.25 4.57 0.00 3.84 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 0.00 141 S 7.84 4.41 0.00 3.81 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 7.76 3.75 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 0.00 0.00 0.00