NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3621 8.3049 120.3285 55.0321 33.4243 174.3498 2 K 4.3248 8.2771 122.8606 54.3563 33.8803 175.4964 3 F 4.9735 9.1649 124.4881 54.1213 43.5898 175.7726 4 Q 4.1050 9.2433 122.6057 59.4880 28.3414 178.7466 5 Y 4.1643 8.9196 120.7346 60.5901 38.6379 178.0035 6 K 4.0877 8.3025 118.2328 59.5596 32.3309 178.7768 7 E 4.1388 8.0568 117.4431 58.5552 29.4847 178.1844 8 E 4.3386 7.8268 116.0984 55.6998 30.4462 175.6223 9 H 4.7591 7.1405 116.3257 52.8181 31.8430 174.3078 10 S 4.2790 8.6196 118.7987 58.9814 64.4237 175.5187 11 F 4.1903 8.8540 125.2559 61.4924 39.3754 177.1460 12 E 3.8837 8.4370 118.5871 59.1320 29.3449 178.8991 13 K 3.9927 8.2006 118.5629 59.4587 32.1349 179.4730 14 R 4.1102 7.9721 118.3549 59.3288 30.0425 179.1150 15 K 4.3966 8.3527 120.7420 58.9612 32.0704 178.7948 16 A 4.0082 8.0053 120.8636 54.4813 18.1342 179.2552 17 E 4.0045 8.1379 118.1520 59.2076 29.9437 178.5718 18 G 3.3792 8.1564 105.8423 47.8632 0.0000 175.1564 19 E 3.3261 8.1216 121.5820 58.6559 29.6567 179.0789 20 K 3.8753 7.6790 118.7285 59.8349 32.6260 178.9918 21 I 3.6442 7.7696 121.1816 64.4368 36.8889 178.5698 22 R 3.8627 7.5513 116.6328 58.2882 29.8431 178.7062 23 R 3.9851 7.0587 117.7855 58.8488 30.3246 177.9292 24 K 3.9574 8.0134 118.5692 58.0392 33.3570 176.4161 25 Y 4.6842 7.7486 118.7975 55.4034 38.0374 174.1772 26 P 4.4434 0.0000 0.0000 63.8937 32.2823 176.8088 27 D 4.8963 7.9915 118.1794 53.9659 41.1622 175.5586 28 R 5.0910 7.7485 116.6900 54.5722 34.4817 175.0877 29 V 4.0741 9.0374 114.9428 58.7049 35.5829 173.1398 30 P 5.0402 0.0000 0.0000 62.2485 32.8371 175.3001 31 V 4.9477 9.3030 123.7399 59.8535 34.9283 174.2705 32 I 4.7111 8.7199 125.0334 59.5262 39.2250 174.6039 33 V 5.0587 8.6738 126.9977 61.3067 33.2727 174.5323 34 E 4.9755 9.3643 126.1834 54.2783 34.4692 174.5734 35 K 2.9739 8.2443 123.4099 55.4059 33.0511 176.5264 36 A 3.9184 8.3570 129.6039 51.3481 19.5761 175.0273 37 P 4.1779 0.0000 0.0000 64.6204 32.0536 176.6486 38 K 3.7232 8.6485 121.3574 57.2694 29.7415 174.9870 39 A 4.2845 7.6134 119.0821 52.3701 19.8226 178.8786 40 R 4.6142 8.7262 119.5772 55.0930 29.3459 175.9831 41 L 4.9090 7.3356 116.3864 52.5180 46.4221 177.2122 42 G 3.8644 8.6528 109.5789 45.8812 0.0000 172.5979 43 D 5.1569 8.2778 119.2455 51.2982 41.6160 175.9548 44 L 4.3733 8.5012 119.9686 54.0504 42.3956 176.7416 45 D 4.4618 8.8679 123.6318 56.0183 39.3009 176.2550 46 K 4.3642 7.8487 120.6672 54.1226 33.4639 176.0523 47 K 4.6087 8.5497 125.1440 57.3570 33.9610 176.0699 48 K 4.8670 7.6049 120.9089 54.6734 33.9266 175.0499 49 Y 4.7088 9.2443 124.9628 56.0996 42.1967 174.6800 50 L 4.9942 8.6626 123.9711 53.4888 43.4018 175.4130 51 V 4.4530 8.5126 119.4441 58.5814 34.5558 173.8019 52 P 4.7055 0.0000 0.0000 62.4752 32.1006 177.8916 53 S 4.1078 8.7000 119.9464 61.3074 62.9414 175.7789 54 D 4.6473 7.8497 117.6894 54.4904 41.3787 176.4340 55 L 4.2387 7.7205 123.0489 54.8821 42.8897 176.5150 56 T 4.6889 8.9051 116.4237 60.9059 71.3386 176.2721 57 V 3.8508 9.1533 121.4138 66.1069 31.3354 178.3717 58 G 3.7711 8.5905 105.9298 47.7573 0.0000 175.5795 59 Q 4.1998 8.1339 119.9827 58.2767 28.7919 178.2945 60 F 4.3279 8.6235 121.9481 61.8229 39.4282 176.9066 61 Y 3.8113 8.3650 116.9915 61.1090 37.6205 178.8520 62 F 4.0558 8.0598 121.5124 61.2850 39.4864 177.1621 63 L 3.8010 7.6506 118.6066 57.4973 41.3905 179.5121 64 I 3.4003 7.5215 120.0307 64.0552 36.9756 178.4620 65 R 3.6860 7.8616 119.1383 59.1548 29.9532 179.2699 66 K 3.7030 7.4031 118.0148 59.4971 31.8222 179.7498 67 R 3.9224 7.7025 117.0305 58.0720 29.9691 178.0381 68 I 4.0607 7.0896 110.4635 59.9647 38.2386 174.9043 69 H 4.0666 7.7153 115.6274 57.1195 26.1623 175.3304 70 L 4.1458 7.5209 118.2037 54.8066 42.3705 177.5591 71 R 4.4074 8.7165 120.7663 54.5677 31.1551 176.3088 72 P 4.2494 0.0000 0.0000 65.0643 31.4242 177.2921 73 E 4.2363 7.9430 114.1348 57.0952 30.3524 176.4435 74 D 4.5088 7.8649 119.8011 53.8079 41.6142 175.8594 75 A 4.2063 8.2175 124.8634 51.7038 19.6842 176.7421 76 L 4.9732 7.3774 121.4986 53.5305 45.5323 175.1828 77 F 5.0504 9.7590 124.0930 55.8112 42.8187 174.1535 78 F 5.7573 8.9456 121.5005 56.5395 41.3468 174.9873 79 F 5.2919 9.5125 120.2241 55.9194 42.9591 173.7970 80 V 4.5266 9.0616 124.6064 61.3010 33.6520 175.4348 81 N 4.3449 9.6972 126.2597 54.7776 35.9606 174.4734 82 N 4.3412 8.6418 110.6930 53.7546 36.9217 174.3277 83 V 4.4039 7.6112 118.5791 60.8125 33.5616 174.8897 84 I 4.8561 8.5635 127.4898 59.4577 36.7287 174.1778 85 P 4.5594 0.0000 0.0000 61.4741 32.4470 174.5101 86 P 4.5824 0.0000 0.0000 62.4773 32.2427 177.5986 87 T 4.1256 8.6582 110.8442 64.5353 68.7417 175.7711 88 S 4.3053 8.0098 114.5126 59.0819 63.9547 174.3166 89 A 4.2298 7.8161 125.1071 52.1936 19.1329 176.8748 90 T 4.7560 8.1142 110.7462 61.1662 71.7974 176.1936 91 M 4.2283 9.2923 122.6653 57.9226 31.8136 179.6242 92 G 3.5708 8.0176 106.7642 47.8418 0.0000 176.0871 93 S 4.2340 8.2803 117.0948 60.5016 62.9035 176.3554 94 L 3.9844 7.8588 123.9172 58.0992 41.9887 178.0696 95 Y 4.0057 8.1385 119.4848 61.0507 38.5487 178.1708 96 Q 4.0966 8.2415 117.4028 58.8496 28.8825 178.2234 97 E 4.2927 7.7650 117.7997 57.4713 29.9651 176.6941 98 H 4.8996 7.3624 112.5615 55.0353 30.9315 173.2697 99 H 4.2770 7.5389 115.3010 55.1385 28.9547 174.7313 100 D 4.6551 9.1255 120.9781 53.4936 41.8647 177.2216 101 E 3.9778 8.6575 121.3889 58.8720 29.5927 177.8362 102 D 4.5555 8.7891 117.4900 53.0786 39.6939 177.4797 103 F 3.9242 8.2402 117.4988 58.3148 37.3562 174.7571 104 F 4.8458 8.6383 120.0490 56.5479 40.8955 174.3641 105 L 4.9135 8.9800 123.7163 53.8283 44.2211 174.5795 106 Y 4.7294 8.5728 122.8159 56.1620 40.2096 174.9648 107 I 4.8723 9.2928 125.2599 59.4880 40.4324 174.6302 108 A 5.4346 9.3923 129.4055 50.8778 20.9790 175.8825 109 F 6.0056 8.7101 115.3068 55.6312 41.7360 173.9133 110 S 5.3038 9.7073 114.3194 57.3968 66.1515 174.1946 111 D 5.0794 9.1828 121.1161 54.2836 39.9056 176.0374 112 E 4.8803 8.5335 120.2490 54.5966 32.2776 176.0723 113 N 3.6913 8.1098 117.1605 53.1931 37.7770 175.9337 114 V 4.2652 7.0832 110.5492 63.1616 34.8192 175.1695 115 Y 4.2370 7.5802 120.1168 58.2464 37.6784 175.6042 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.36 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 2 K 8.28 4.32 0.00 1.68 1.64 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.41 7.81 3 F 9.16 4.97 0.00 2.95 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 4 Q 9.24 4.10 0.00 2.50 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.92 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 5 Y 8.92 4.16 0.00 3.34 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 6 K 8.30 4.09 0.00 2.03 1.91 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.68 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.45 1.42 7.81 7 E 8.06 4.14 0.00 1.94 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 0.00 2.36 2.54 0.00 8 E 7.83 4.34 0.00 1.89 1.80 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 2.25 2.40 0.00 9 H 7.14 4.76 0.00 2.68 3.03 0.00 5.87 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 10 S 8.62 4.28 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 11 F 8.85 4.19 0.00 3.26 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 12 E 8.44 3.88 0.00 2.21 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 2.41 2.44 0.00 13 K 8.20 3.99 0.00 2.04 1.87 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.50 7.81 14 R 7.97 4.11 0.00 2.01 2.28 0.00 3.12 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 15 K 8.35 4.40 0.00 1.19 1.59 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.14 0.00 0.00 3.48 0.00 0.00 0.00 0.00 1.62 1.57 7.81 16 A 8.01 4.01 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 17 E 8.14 4.00 0.00 2.11 2.28 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 2.39 2.38 0.00 18 G 8.16 3.38 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 19 E 8.12 3.33 0.00 2.12 1.73 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 1.85 1.47 0.00 20 K 7.68 3.88 0.00 1.89 2.04 0.00 1.33 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.56 1.44 7.81 21 I 7.77 3.64 1.90 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 1.54 0.85 0.86 0.00 0.00 22 R 7.55 3.86 0.00 1.83 1.87 0.00 3.08 0.00 0.00 2.55 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.82 0.00 23 R 7.06 3.99 0.00 1.78 1.96 0.00 3.18 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 24 K 8.01 3.96 0.00 1.45 1.16 0.00 1.50 0.00 0.00 1.07 0.00 0.00 3.00 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 1.00 7.81 25 Y 7.75 4.68 0.00 2.96 2.73 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 0.00 26 P 0.00 4.44 0.00 2.01 2.06 0.00 3.64 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 27 D 7.99 4.90 0.00 2.69 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 28 R 7.75 5.09 0.00 1.56 1.68 0.00 2.40 0.00 0.00 2.68 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 29 V 9.04 4.07 1.56 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 0.31 0.00 0.00 0.85 0.00 0.00 30 P 0.00 5.04 0.00 1.49 1.88 0.00 2.93 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.58 0.00 31 V 9.30 4.95 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 0.74 0.00 0.00 0.80 0.00 0.00 32 I 8.72 4.71 0.94 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 0.23 -0.32 0.60 0.00 0.00 33 V 8.67 5.06 2.28 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 0.98 0.00 0.00 0.98 0.00 0.00 34 E 9.36 4.98 0.00 2.12 1.77 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 2.40 2.52 0.00 35 K 8.24 2.97 0.00 1.14 1.47 0.00 1.85 0.00 0.00 2.02 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.23 1.22 7.81 36 A 8.36 3.92 1.16 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 0.00 0.00 37 P 0.00 4.18 0.00 2.00 1.97 0.00 3.90 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 1.92 1.90 0.00 38 K 8.65 3.72 0.00 1.78 1.79 0.00 1.61 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.44 7.81 39 A 7.61 4.28 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 40 R 8.73 4.61 0.00 1.84 1.93 0.00 3.27 0.00 0.00 3.19 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 41 L 7.34 4.91 0.00 1.78 1.75 1.21 1.07 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 42 G 8.65 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 43 D 8.28 5.16 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 44 L 8.50 4.37 0.00 1.88 1.92 1.34 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.87 4.46 0.00 2.81 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 46 K 7.85 4.36 0.00 1.68 1.70 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.60 1.20 7.81 47 K 8.55 4.61 0.00 1.74 1.74 0.00 1.85 0.00 0.00 1.98 0.00 0.00 3.03 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.62 1.54 7.81 48 K 7.60 4.87 0.00 1.47 1.52 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.31 1.42 7.81 49 Y 9.24 4.71 0.00 3.04 2.95 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 50 L 8.66 4.99 0.00 1.52 1.45 0.83 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.51 4.45 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 0.53 0.00 0.00 0.62 0.00 0.00 52 P 0.00 4.71 0.00 2.04 1.93 0.00 3.60 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 53 S 8.70 4.11 0.00 3.87 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 54 D 7.85 4.65 0.00 2.65 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 55 L 7.72 4.24 0.00 1.81 1.58 1.07 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 56 T 8.91 4.69 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 1.24 0.00 0.00 57 V 9.15 3.85 2.32 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 1.19 0.00 0.00 0.99 0.00 0.00 58 G 8.59 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 59 Q 8.13 4.20 0.00 2.39 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 60 F 8.62 4.33 0.00 3.14 3.32 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 61 Y 8.36 3.81 0.00 3.15 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 62 F 8.06 4.06 0.00 3.11 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 63 L 7.65 3.80 0.00 1.42 1.57 1.08 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 64 I 7.52 3.40 1.72 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.32 0.57 0.00 0.00 65 R 7.86 3.69 0.00 1.61 1.76 0.00 3.02 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.74 0.00 66 K 7.40 3.70 0.00 1.55 1.64 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.66 1.22 7.81 67 R 7.70 3.92 0.00 1.77 1.95 0.00 3.31 0.00 0.00 3.44 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 68 I 7.09 4.06 1.82 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.46 0.71 0.00 0.00 69 H 7.72 4.07 0.00 3.37 3.44 0.00 5.66 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 7.52 4.15 0.00 1.71 1.50 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.72 4.41 0.00 1.96 1.95 0.00 3.13 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 72 P 0.00 4.25 0.00 2.02 2.12 0.00 3.65 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 2.03 2.09 0.00 73 E 7.94 4.24 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 74 D 7.86 4.51 0.00 2.77 2.62 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 75 A 8.22 4.21 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 76 L 7.38 4.97 0.00 1.44 1.16 1.10 0.51 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 77 F 9.76 5.05 0.00 3.13 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 78 F 8.95 5.76 0.00 2.68 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 79 F 9.51 5.29 0.00 3.06 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 80 V 9.06 4.53 2.06 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 0.96 0.00 0.00 0.96 0.00 0.00 81 N 9.70 4.34 0.00 2.88 2.89 0.00 0.00 7.19 8.00 0.00 0.00 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 N 8.64 4.34 0.00 2.91 2.97 0.00 0.00 6.92 7.68 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 83 V 7.61 4.40 2.22 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 1.11 0.00 0.00 0.98 0.00 0.00 84 I 8.56 4.86 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.56 1.01 0.00 0.00 85 P 0.00 4.56 0.00 2.24 2.10 0.00 3.96 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 2.09 2.02 0.00 86 P 0.00 4.58 0.00 2.29 2.26 0.00 3.76 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.99 0.00 87 T 8.66 4.13 4.34 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 1.44 0.00 0.00 88 S 8.01 4.31 0.00 4.02 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.82 4.23 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 90 T 8.11 4.76 4.40 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 1.22 0.00 0.00 91 M 9.29 4.23 0.00 1.81 2.04 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.88 0.00 92 G 8.02 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.28 4.23 0.00 4.09 4.16 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 94 L 7.86 3.98 0.00 2.02 1.90 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 8.14 4.01 0.00 3.21 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 96 Q 8.24 4.10 0.00 2.35 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.67 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 97 E 7.77 4.29 0.00 2.01 1.57 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 2.18 2.27 0.00 98 H 7.36 4.90 0.00 3.20 3.22 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 H 7.54 4.28 0.00 2.86 2.21 0.00 5.75 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 0.00 100 D 9.13 4.66 0.00 3.10 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 0.00 101 E 8.66 3.98 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 102 D 8.79 4.56 0.00 3.07 2.81 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 0.00 103 F 8.24 3.92 0.00 3.16 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 8.64 4.85 0.00 3.08 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.98 4.91 0.00 1.80 1.66 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.57 4.73 0.00 2.54 1.67 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 0.00 107 I 9.29 4.87 1.71 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.78 0.39 0.00 0.00 108 A 9.39 5.43 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 0.00 109 F 8.71 6.01 0.00 3.55 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 9.71 5.30 0.00 4.09 4.33 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 0.00 111 D 9.18 5.08 0.00 2.95 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 0.00 112 E 8.53 4.88 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 113 N 8.11 3.69 0.00 2.29 1.42 0.00 0.00 5.85 7.68 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 0.00 114 V 7.08 4.27 1.73 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 0.53 0.00 0.00 -0.20 0.00 0.00 115 Y 7.58 4.24 0.00 2.98 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