NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5067 8.3049 120.3270 55.4565 32.8305 174.3063 2 L 4.4143 8.6269 123.8431 55.3463 43.8576 175.4967 3 M 4.6270 8.3721 118.5300 52.2547 33.9790 172.4082 4 P 4.4226 0.0000 0.0000 62.7705 32.3504 176.3374 5 R 4.7665 8.0525 114.0327 55.0548 29.7164 176.0662 6 R 4.7727 7.7707 113.8114 58.8026 36.5374 175.7173 7 M 4.2481 7.8153 117.0143 55.0941 32.5635 175.7966 8 K 4.5455 8.0096 119.8230 55.0420 36.2543 175.9357 9 Y 3.9025 8.6579 120.7769 58.3059 36.8965 175.2771 10 R 4.5023 8.1870 125.2026 54.8804 31.4960 175.2924 11 K 4.6361 8.0142 121.4480 55.3199 35.7720 175.1365 12 Q 4.2234 8.3884 120.1744 55.7396 29.7086 174.5328 13 Q 4.4035 8.3908 120.1292 54.9428 29.9144 175.1852 14 R 3.8672 8.5408 126.1491 55.5516 29.8605 176.1813 15 G 3.8564 8.5129 107.2784 47.2971 0.0000 174.9860 16 R 4.1656 7.6475 114.8020 55.7628 30.2189 175.6882 17 L 4.5125 7.9252 119.8125 53.9155 44.6255 175.7517 18 K 4.1406 8.8016 126.0716 58.6273 32.2499 177.9194 19 G 3.4051 7.5796 107.5023 47.6552 0.0000 173.3857 20 A 4.1732 7.9929 134.2474 51.7337 18.5246 178.2538 21 T 4.5487 7.9719 113.0456 60.7929 68.5838 174.3101 22 K 4.2771 7.7480 123.6436 58.9744 32.7264 174.9044 23 G 4.2329 8.8482 117.0944 45.7510 0.0000 173.3365 24 G 3.9171 7.8795 110.6891 43.5198 0.0000 172.7817 25 D 4.2184 8.2413 124.9470 54.4789 41.8365 175.2450 26 Y 4.5097 7.1666 120.8279 58.2393 39.2766 175.5176 27 V 4.3355 6.8774 119.2538 60.8413 39.9639 168.9355 28 A 3.3548 8.5509 130.7632 52.1246 18.3262 173.5873 29 F 3.4171 8.9968 127.7101 57.8495 39.0085 176.6868 30 G 4.0007 8.3727 112.0170 45.1989 0.0000 171.9431 31 D 4.7015 9.0090 116.4923 54.9404 43.2047 176.5020 32 Y 5.3938 7.9268 114.4527 56.4176 42.4474 175.1283 33 G 4.5482 9.5392 107.0052 45.2887 0.0000 172.0257 34 L 4.9943 9.8248 129.3369 54.1132 43.3107 175.5572 35 V 4.9003 8.4870 126.3034 60.1488 34.3642 174.9588 36 A 4.9529 8.9404 125.6729 50.7601 19.8848 177.3121 37 L 4.6156 9.1650 122.0671 55.9576 42.1247 177.0997 38 E 4.8847 7.7543 117.5959 53.9177 33.7423 173.1294 39 P 5.1061 0.0000 0.0000 62.6846 32.4166 175.1227 40 A 4.1509 8.2354 122.9966 51.2128 23.0699 174.6237 41 W 5.2023 8.5341 118.9361 55.3179 30.8071 176.2345 42 I 5.1249 8.7831 127.1750 60.1450 37.4305 176.9180 43 T 4.6341 8.7502 117.2786 60.5845 70.4234 175.4776 44 A 3.9891 8.5940 122.9458 55.5403 18.0179 179.7939 45 Q 3.9727 8.0443 115.9875 59.2733 28.6849 178.8993 46 Q 3.9156 8.1099 118.5221 58.9240 28.1847 179.0392 47 I 3.9397 7.4948 119.7871 64.3442 37.1453 178.0114 48 E 4.0041 8.0181 119.2121 58.9108 29.5237 178.0906 49 A 3.9587 9.0039 121.6261 55.2724 18.4494 179.5416 50 A 3.8570 7.7831 119.2062 55.1737 18.4398 179.7474 51 R 3.9316 7.7916 116.3061 59.5566 30.1412 178.8219 52 V 3.5580 8.1356 118.0379 66.1062 31.5798 177.9005 53 A 3.9610 7.7205 120.5060 55.2532 18.2671 179.6532 54 M 3.5828 7.9253 117.2098 58.4557 31.8903 178.9995 55 V 4.0141 8.1222 117.3089 66.4162 31.7268 177.9919 56 R 4.1099 7.8090 116.6948 58.9221 29.9481 178.1498 57 H 4.3558 7.5307 117.5281 58.3610 30.4101 175.4238 58 F 4.2890 6.9728 124.8900 57.7889 38.9519 176.1179 59 R 4.0057 9.0494 124.0899 58.6448 30.1205 178.2558 60 R 4.4863 7.9663 115.5265 55.7453 30.6780 176.4586 61 G 4.0149 8.0259 108.6689 44.4948 0.0000 173.8499 62 G 3.5790 7.3826 108.1028 44.8429 0.0000 172.4060 63 K 4.5571 7.0814 117.4156 54.8269 35.6537 175.3140 64 I 4.7300 8.1990 122.7063 59.5580 40.6639 174.7600 65 F 4.7781 9.2449 123.7721 55.8879 41.4272 174.3533 66 I 4.2499 8.4417 124.4621 59.5662 38.6228 175.4198 67 R 4.6826 7.8127 123.1381 56.9310 32.4680 176.5923 68 I 3.9357 7.6563 112.0219 60.8603 38.1156 175.2186 69 F 4.5641 8.4115 121.5447 54.7515 42.7793 172.5451 70 P 4.6418 0.0000 0.0000 63.1120 31.7646 175.0546 71 D 4.3829 9.0526 120.9394 55.4118 45.2296 176.1585 72 K 4.1137 7.9852 121.0781 55.6026 32.9935 174.5287 73 P 4.7940 0.0000 0.0000 63.4393 32.5651 175.5633 74 Y 4.2282 8.3560 122.2643 55.9718 40.4861 174.2278 75 T 4.9732 7.9427 115.6690 59.7605 71.3753 174.1954 76 K 4.5065 8.5215 122.0635 56.4992 32.7479 176.2504 77 K 4.5584 7.7884 118.7705 53.8269 33.8443 174.5034 78 P 4.3676 0.0000 0.0000 65.2211 31.4856 176.2257 79 L 4.7723 7.2635 118.1684 52.3442 43.7716 176.5489 80 E 4.5699 8.2500 122.1369 55.3228 29.5004 175.4106 81 V 3.8774 7.8304 118.6921 62.1601 31.3533 175.5310 82 R 3.8409 8.7111 126.7583 57.2986 27.4923 176.1790 83 M 4.7220 8.2598 112.7508 52.9979 35.7397 174.7499 84 G 4.3568 8.1983 108.8964 43.6274 0.0000 172.3905 85 K 4.3556 8.9671 120.4592 54.3732 31.4383 177.7637 86 G 4.4368 6.9240 112.4527 43.6366 0.0000 172.5733 87 K 4.1061 6.8796 116.7294 54.6985 35.3533 175.5772 88 G 3.7248 8.6836 115.3462 44.8921 0.0000 172.6009 89 N 4.4384 8.4657 119.2778 52.5403 38.7932 175.3315 90 V 3.7603 8.1387 126.0784 61.8889 32.3702 176.1488 91 E 4.2316 8.6109 122.9952 56.1886 29.4886 176.5532 92 G 3.6238 7.7980 106.4690 44.9467 0.0000 171.4951 93 Y 5.0841 7.8910 114.6796 56.3828 41.1759 175.5642 94 V 4.9064 8.6318 112.8444 60.1066 37.4664 174.4245 95 A 4.9869 9.1241 123.5144 49.9332 20.7169 176.0148 96 V 4.4485 8.6887 121.7802 64.4753 32.2690 175.4170 97 V 4.7182 8.8960 126.5018 61.1342 35.1517 173.9752 98 K 4.9772 8.3159 121.6963 53.4475 36.8636 173.9778 99 P 4.4001 0.0000 0.0000 65.7051 31.2182 176.7755 100 G 4.0931 9.6452 114.4531 45.3585 0.0000 172.1868 101 R 4.5148 7.7577 119.2506 54.0511 32.2217 175.1941 102 V 4.5481 8.5049 127.0885 63.0475 29.9334 175.1458 103 M 4.3718 9.4656 129.4539 56.8091 33.4143 176.2528 104 F 5.2858 8.2586 115.7752 55.1546 44.5290 173.5659 105 E 5.5760 8.6566 113.8388 57.1955 32.2880 175.3575 106 V 5.0959 8.7933 117.2291 59.2261 35.8013 174.3089 107 A 4.6280 8.4549 121.0916 52.7409 21.7782 175.8605 108 G 3.8110 9.2131 109.1696 45.9456 0.0000 174.8909 109 V 3.9004 7.1044 111.0018 60.5698 32.4550 176.3575 110 T 4.2747 8.2172 112.3825 61.3438 70.8047 175.0947 111 E 4.0890 8.7904 121.7302 59.5643 29.7934 178.5065 112 E 3.9243 8.1644 118.7936 59.4794 29.7665 178.6794 113 Q 4.0998 8.1155 117.5341 58.6507 28.7464 178.4888 114 A 4.3372 9.0177 122.8715 55.5870 18.6433 179.5878 115 M 3.7301 8.3225 117.5532 58.3330 31.9010 178.7280 116 E 3.7995 8.0706 118.7301 59.1186 29.7357 178.5049 117 A 3.6520 8.0676 120.8887 55.3138 17.9200 179.6454 118 L 3.8617 8.2149 117.5790 57.8348 41.5301 179.8457 119 R 3.8762 7.6726 118.3453 59.2175 29.7839 178.3626 120 I 3.6005 7.6197 119.0012 64.2860 37.3802 177.9595 121 A 3.9761 7.5402 121.6374 55.0636 18.2140 179.9465 122 G 3.8531 7.5556 103.9595 46.9029 0.0000 175.3602 123 H 4.2416 8.2009 120.9007 58.7397 29.9407 175.8474 124 K 4.3005 7.2766 115.9811 56.7319 32.9602 176.6703 125 L 4.4031 7.5325 120.1900 53.9908 42.4103 174.5021 126 P 4.7380 0.0000 0.0000 62.7302 31.3654 175.1250 127 I 4.6694 7.1014 110.8459 59.6725 41.0602 173.9639 128 K 4.4218 8.5574 124.0486 56.4916 33.4382 175.5200 129 T 5.8262 8.5853 115.4462 59.3564 72.7385 172.5207 130 K 4.8892 8.4803 121.2585 55.1596 36.6978 174.7001 131 I 4.5074 8.1348 121.5510 60.8264 38.4393 175.8707 132 V 4.5284 8.3866 118.0574 59.8215 36.4794 174.7481 133 R 4.6598 8.8530 124.4395 55.7565 31.9263 173.9693 134 R 4.3490 8.8446 123.5188 56.2880 29.8902 176.1103 135 D 4.2348 8.7755 126.5547 55.4936 39.1848 174.9002 136 A 4.6849 8.8746 122.6222 50.3735 19.1545 175.3724 137 Y 4.5043 8.5248 117.5542 56.9834 40.3862 175.3045 138 D 4.9266 8.4145 124.0621 52.1764 43.3668 175.6591 139 E 4.0440 8.5242 122.0124 56.1913 30.0531 177.0922 140 A 4.4655 8.2044 125.4358 50.4092 18.9720 176.9637 141 Q 4.1287 8.4642 121.4616 57.2475 29.1451 175.9838 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 4.51 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 L 8.63 4.41 0.00 1.67 1.68 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 3 M 8.37 4.63 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 4 P 0.00 4.42 0.00 2.03 2.02 0.00 3.63 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 5 R 8.05 4.77 0.00 1.88 1.97 0.00 3.06 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 6 R 7.77 4.77 0.00 1.89 2.01 0.00 3.03 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 7 M 7.82 4.25 0.00 1.98 2.02 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 2.57 2.52 0.00 8 K 8.01 4.55 0.00 1.69 1.68 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.62 7.81 9 Y 8.66 3.90 0.00 2.99 2.94 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 10 R 8.19 4.50 0.00 1.77 1.81 0.00 3.21 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 11 K 8.01 4.64 0.00 1.88 1.80 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.44 7.81 12 Q 8.39 4.22 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 13 Q 8.39 4.40 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.99 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 14 R 8.54 3.87 0.00 1.96 1.93 0.00 3.20 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 15 G 8.51 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 16 R 7.65 4.17 0.00 1.92 1.97 0.00 3.08 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 17 L 7.93 4.51 0.00 1.57 1.54 0.94 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.80 4.14 0.00 1.78 1.84 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.37 7.81 19 G 7.58 3.41 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 0.00 0.00 0.00 0.00 20 A 7.99 4.17 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 21 T 7.97 4.55 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 1.24 0.00 0.00 22 K 7.75 4.28 0.00 1.71 1.77 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.32 1.34 7.81 23 G 8.85 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 0.00 0.00 0.00 0.00 24 G 7.88 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 25 D 8.24 4.22 0.00 2.84 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 26 Y 7.17 4.51 0.00 2.95 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 27 V 6.88 4.34 2.36 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 0.80 0.00 0.00 1.27 0.00 0.00 28 A 8.55 3.35 1.18 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 29 F 9.00 3.42 0.00 2.99 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 0.00 0.00 0.00 30 G 8.37 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.01 4.70 0.00 2.47 2.36 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 32 Y 7.93 5.39 0.00 3.00 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 33 G 9.54 4.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 9.82 4.99 0.00 1.79 1.82 1.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.49 4.90 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 0.88 0.00 0.00 1.08 0.00 0.00 36 A 8.94 4.95 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 37 L 9.17 4.62 0.00 1.50 1.73 0.92 0.86 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 38 E 7.75 4.88 0.00 1.78 1.76 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 2.19 2.29 0.00 39 P 0.00 5.11 0.00 1.96 2.02 0.00 3.37 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00 40 A 8.24 4.15 1.19 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 0.00 0.00 41 W 8.53 5.20 0.00 3.51 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 42 I 8.78 5.12 1.97 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 1.17 0.50 1.07 0.00 0.00 43 T 8.75 4.63 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 1.08 0.00 0.00 44 A 8.59 3.99 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 45 Q 8.04 3.97 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 46 Q 8.11 3.92 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 47 I 7.49 3.94 1.89 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.28 0.67 0.00 0.00 48 E 8.02 4.00 0.00 2.08 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 2.29 2.37 0.00 49 A 9.00 3.96 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 50 A 7.78 3.86 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 51 R 7.79 3.93 0.00 2.35 2.01 0.00 3.15 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.93 0.00 52 V 8.14 3.56 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 0.95 0.00 0.00 0.95 0.00 0.00 53 A 7.72 3.96 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 54 M 7.93 3.58 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.44 0.00 55 V 8.12 4.01 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 0.87 0.00 0.00 1.06 0.00 0.00 56 R 7.81 4.11 0.00 1.92 1.95 0.00 3.22 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 1.66 1.64 0.00 57 H 7.53 4.36 0.00 3.04 2.79 0.00 5.97 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 6.97 4.29 0.00 3.19 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 59 R 9.05 4.01 0.00 1.88 2.01 0.00 3.12 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 60 R 7.97 4.49 0.00 1.83 1.95 0.00 3.51 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 61 G 8.03 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 7.38 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 0.00 0.00 0.00 63 K 7.08 4.56 0.00 1.49 1.71 0.00 1.18 0.00 0.00 1.64 0.00 0.00 3.43 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.21 1.23 7.81 64 I 8.20 4.73 1.98 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.80 1.24 0.00 0.00 65 F 9.24 4.78 0.00 3.06 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 66 I 8.44 4.25 1.68 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.72 0.33 0.00 0.00 67 R 7.81 4.68 0.00 1.79 1.92 0.00 3.38 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 68 I 7.66 3.94 1.87 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 1.09 0.51 0.90 0.00 0.00 69 F 8.41 4.56 0.00 2.98 3.05 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 70 P 0.00 4.64 0.00 2.34 2.17 0.00 3.82 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 71 D 9.05 4.38 0.00 2.61 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 72 K 7.99 4.11 0.00 1.81 1.55 0.00 1.62 0.00 0.00 1.77 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.44 7.81 73 P 0.00 4.79 0.00 1.95 2.06 0.00 3.65 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 2.06 2.23 0.00 74 Y 8.36 4.23 0.00 2.91 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 75 T 7.94 4.97 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 1.16 0.00 0.00 76 K 8.52 4.51 0.00 1.80 1.91 0.00 1.84 0.00 0.00 1.94 0.00 0.00 3.29 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.57 1.51 7.81 77 K 7.79 4.56 0.00 1.68 1.71 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.17 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.45 7.81 78 P 0.00 4.37 0.00 2.18 2.19 0.00 3.72 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 1.99 2.00 0.00 79 L 7.26 4.77 0.00 1.62 1.60 0.93 0.81 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 E 8.25 4.57 0.00 1.85 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 0.00 2.12 2.40 0.00 81 V 7.83 3.88 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 0.91 0.00 0.00 0.93 0.00 0.00 82 R 8.71 3.84 0.00 2.00 2.00 0.00 3.21 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 83 M 8.26 4.72 0.00 1.93 1.90 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 2.52 2.61 0.00 84 G 8.20 4.36 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 0.00 85 K 8.97 4.36 0.00 1.70 1.79 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.48 7.81 86 G 6.92 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 0.00 0.00 0.00 0.00 87 K 6.88 4.11 0.00 1.67 1.64 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.19 1.29 7.81 88 G 8.68 3.72 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 0.00 89 N 8.47 4.44 0.00 2.68 2.75 0.00 0.00 7.02 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 90 V 8.14 3.76 1.98 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 0.63 0.00 0.00 0.81 0.00 0.00 91 E 8.61 4.23 0.00 2.27 1.85 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 2.30 2.44 0.00 92 G 7.80 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 93 Y 7.89 5.08 0.00 2.89 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 94 V 8.63 4.91 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 0.97 0.00 0.00 0.94 0.00 0.00 95 A 9.12 4.99 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 96 V 8.69 4.45 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 1.09 0.00 0.00 1.16 0.00 0.00 97 V 8.90 4.72 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 0.94 0.00 0.00 1.08 0.00 0.00 98 K 8.32 4.98 0.00 1.73 1.65 0.00 1.77 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.45 7.81 99 P 0.00 4.40 0.00 2.06 2.22 0.00 3.65 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 2.04 2.10 0.00 100 G 9.65 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 0.00 0.00 0.00 101 R 7.76 4.51 0.00 2.29 1.84 0.00 3.16 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.76 0.00 102 V 8.50 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 1.18 0.00 0.00 1.04 0.00 0.00 103 M 9.47 4.37 0.00 2.06 2.44 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.59 0.00 104 F 8.26 5.29 0.00 3.01 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 0.00 105 E 8.66 5.58 0.00 2.37 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 0.00 2.68 2.47 0.00 106 V 8.79 5.10 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 1.35 0.00 0.00 1.21 0.00 0.00 107 A 8.45 4.63 1.41 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 0.00 0.00 0.00 108 G 9.21 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 0.00 0.00 0.00 109 V 7.10 3.90 2.20 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 0.18 0.00 0.00 0.99 0.00 0.00 110 T 8.22 4.27 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 0.00 111 E 8.79 4.09 0.00 2.25 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 0.00 2.39 2.49 0.00 112 E 8.16 3.92 0.00 2.15 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 2.39 2.47 0.00 113 Q 8.12 4.10 0.00 2.31 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.51 0.00 0.00 0.00 0.00 0.00 2.45 2.62 0.00 114 A 9.02 4.34 1.58 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 0.00 0.00 115 M 8.32 3.73 0.00 1.84 2.10 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.02 0.00 116 E 8.07 3.80 0.00 2.30 1.98 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 2.26 2.26 0.00 117 A 8.07 3.65 1.09 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 0.00 0.00 118 L 8.21 3.86 0.00 1.81 1.70 1.13 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.67 3.88 0.00 2.07 1.81 0.00 3.02 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 120 I 7.62 3.60 1.81 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.65 0.77 0.00 0.00 121 A 7.54 3.98 0.64 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 0.00 122 G 7.56 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 0.00 0.00 0.00 123 H 8.20 4.24 0.00 3.28 3.33 0.00 5.75 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 0.00 124 K 7.28 4.30 0.00 2.01 1.84 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.56 1.51 7.81 125 L 7.53 4.40 0.00 1.83 1.66 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.74 0.00 2.18 2.16 0.00 3.79 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 1.98 2.02 0.00 127 I 7.10 4.67 1.87 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 1.33 0.46 0.95 0.00 0.00 128 K 8.56 4.42 0.00 1.90 1.70 0.00 1.54 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.48 7.81 129 T 8.59 5.83 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 1.29 0.00 0.00 130 K 8.48 4.89 0.00 1.73 1.85 0.00 1.35 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.39 7.81 131 I 8.13 4.51 1.68 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 1.24 0.80 0.56 0.00 0.00 132 V 8.39 4.53 1.79 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 0.09 0.00 0.00 1.27 0.00 0.00 133 R 8.85 4.66 0.00 2.04 1.85 0.00 3.38 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.06 0.00 134 R 8.84 4.35 0.00 1.69 1.96 0.00 3.36 0.00 0.00 3.12 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.82 0.00 135 D 8.78 4.23 0.00 2.67 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 0.00 136 A 8.87 4.68 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 0.00 137 Y 8.52 4.50 0.00 2.85 2.94 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 0.00 138 D 8.41 4.93 0.00 2.62 2.55 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 0.00 0.00 0.00 0.00 139 E 8.52 4.04 0.00 2.02 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 0.00 2.34 2.33 0.00 140 A 8.20 4.47 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 0.00 141 Q 8.46 4.13 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00