NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.6233 8.1476 120.6136 55.5649 34.3168 173.4162 3 I 4.8360 8.2101 113.9719 58.6347 40.2952 173.4429 4 R 4.7516 9.1074 123.1879 54.3199 34.8695 175.8145 5 G 4.2574 8.6894 108.6030 45.7311 0.0000 173.0394 6 I 4.7803 8.6562 124.3012 59.3560 40.5063 174.9641 7 R 5.1493 8.7217 124.1211 54.8764 33.6126 174.9467 8 G 4.8221 8.4567 106.4789 45.1496 0.0000 171.8331 9 A 5.6430 8.1822 120.7743 51.6667 22.9470 175.0078 10 T 5.1065 8.2211 113.4151 61.6316 71.1416 171.9516 11 T 5.1987 8.3605 113.3780 60.0204 71.9829 173.3110 12 V 4.3773 8.3104 115.7043 60.0454 34.0972 175.7090 13 E 4.3214 8.7260 120.4891 57.9605 30.1008 177.2583 14 R 4.6988 7.4223 114.4524 54.4511 34.2370 175.0314 15 D 4.5990 8.3463 120.4234 53.2265 39.8500 175.6600 16 T 4.7081 7.4279 116.4639 58.5457 72.3603 172.9565 17 E 3.8864 8.5951 125.0674 59.4884 29.7009 178.8229 18 E 3.8913 8.0588 118.7646 59.2567 29.9402 178.2015 19 E 3.9668 8.0667 118.9425 59.1692 29.7035 178.7377 20 I 3.7123 7.9265 119.9511 64.3791 37.1436 178.4667 21 L 3.9563 8.1156 120.0378 57.6672 41.4640 179.2997 22 Q 3.9149 8.4330 119.8902 59.3652 29.0578 178.6853 23 K 4.0549 7.9244 118.8732 59.4700 32.0347 179.6994 24 T 3.8537 8.1799 116.5709 66.3844 68.3186 176.6712 25 K 3.8476 8.2618 121.8388 59.6644 32.1024 178.8387 26 Q 3.9583 8.1098 118.2721 58.7652 28.5402 178.6820 27 L 3.9273 7.7576 121.0635 57.8842 42.0681 179.0263 28 L 3.7873 7.8566 118.9164 57.7365 41.5080 178.9608 29 E 3.7845 8.2254 118.9559 59.5251 29.3659 179.5993 30 K 3.8791 7.7403 119.0026 59.4504 32.2785 178.9109 31 I 3.6117 7.5983 120.0433 64.3478 37.0543 178.3507 32 I 3.7209 7.9083 120.9456 64.3582 36.7396 177.9337 33 E 3.9202 8.0107 118.5388 59.5609 29.5830 178.2812 34 E 4.0616 8.1079 117.1109 58.7986 29.6286 178.2498 35 N 4.6901 7.8483 112.6074 52.0176 39.3795 174.3377 36 H 4.2069 8.0287 116.2179 56.8490 27.0499 175.2323 37 T 4.1112 8.1108 114.8055 63.6593 69.2034 173.9765 38 K 4.6741 8.3756 124.4769 53.7263 34.5973 175.2881 39 P 2.9700 0.0000 0.0000 65.3587 30.8012 178.2965 40 E 3.8504 7.9110 115.1812 58.2707 29.5523 177.0361 41 D 4.5573 8.0660 118.3828 54.1203 41.2999 175.6437 42 V 4.4197 7.3287 120.5698 61.6034 32.4534 175.8073 43 V 3.8709 8.8181 128.7784 65.2527 31.9796 175.5278 44 Q 4.7882 7.5339 115.8363 56.2746 31.3255 171.8756 45 M 5.2934 8.6288 118.2734 54.0030 36.2458 173.3710 46 L 5.3919 8.9594 124.3254 52.9361 45.5043 175.3765 47 L 5.2851 8.8200 122.4534 52.9872 45.4074 175.9351 48 S 5.6799 9.1828 117.2432 55.8678 66.7503 172.6524 49 A 5.4594 8.3562 120.1790 50.0818 22.6614 175.9169 50 T 4.4217 8.5032 111.1205 60.7095 70.2541 173.6124 51 P 4.4305 0.0000 0.0000 64.1597 31.0625 176.3840 52 D 4.6274 7.9172 118.4319 53.5679 39.9420 175.2824 53 L 4.8943 7.7064 120.6903 53.6729 43.5056 175.8762 54 H 4.7590 9.0658 117.5942 54.9804 31.0397 174.4513 55 A 4.1454 8.3688 123.1664 54.6748 18.5340 177.9173 56 V 4.2663 6.9174 111.5742 60.4767 33.6822 173.0352 57 F 4.2942 8.3985 119.9664 56.8226 39.5599 175.0564 58 P 4.2617 0.0000 0.0000 65.5805 31.2995 178.5555 59 A 3.9691 8.3541 119.1316 55.0384 17.5513 179.1775 60 K 4.0315 7.9779 117.3129 58.9912 32.1162 178.6406 61 A 4.0855 8.3423 121.2473 54.5787 18.1632 179.6310 62 V 3.6222 7.6162 116.8259 65.9785 31.3063 178.3621 63 R 3.9813 7.5434 116.5971 59.1785 29.9162 178.4406 64 E 4.2371 7.6244 116.2812 57.9827 29.6226 177.3368 65 L 4.0677 7.4609 119.7528 53.9086 41.6337 176.6048 66 S 4.2150 8.6904 120.3394 60.5886 63.0030 175.3282 67 G 4.0331 8.9464 113.5888 45.3615 0.0000 173.6798 68 W 4.5288 8.3831 119.4789 56.4245 29.1151 177.9319 69 Q 4.0488 7.9175 117.3811 58.0414 28.2431 176.0669 70 Y 4.5903 7.3782 114.4611 57.4919 38.8744 175.6553 71 V 3.6851 7.5285 121.5167 61.9241 32.0967 173.5901 72 P 4.6082 0.0000 0.0000 62.8620 32.4854 175.6497 73 V 5.5746 8.1940 115.8550 59.1289 35.7555 174.5065 74 T 4.6429 8.3172 116.6557 61.2454 70.8720 172.0473 75 C 5.9307 8.8310 123.4738 58.1833 30.7589 172.4422 76 M 4.9407 8.2677 117.1276 54.0533 35.0728 173.0040 77 Q 4.8583 8.4941 120.2471 54.7480 30.4149 174.6781 78 E 4.4029 8.9225 128.0767 55.7437 30.5600 176.3142 79 M 4.1312 8.5035 123.0950 55.0405 32.0848 175.5642 80 D 4.4897 8.5570 121.4889 53.7398 41.4813 175.4059 81 V 4.4103 7.9778 126.4102 60.8689 33.7834 174.8419 82 T 4.1626 8.3227 123.2839 64.8114 68.6920 175.0933 83 G 3.9151 9.0191 114.0897 45.3824 0.0000 173.8285 84 G 3.7357 7.6874 108.3901 44.5708 0.0000 173.6939 85 L 3.9843 8.2432 122.9520 54.8201 42.5455 177.2824 86 K 4.2491 8.5086 125.1581 55.9944 33.6781 176.1783 87 K 3.9307 8.6555 116.9001 56.6769 30.2580 174.1913 88 C 5.2888 8.2920 118.5117 57.7307 34.6163 172.8401 89 I 4.8804 8.8353 126.5795 59.7171 39.6350 174.8406 90 R 5.2640 8.6991 125.6120 54.2801 33.7440 175.3167 91 V 4.9662 8.7890 120.2598 60.1810 35.3470 174.2529 92 M 4.9337 9.1120 122.6628 54.2813 34.8514 173.5148 93 M 4.8418 8.9612 127.2342 54.1540 34.8061 174.4764 94 T 4.9933 8.7802 123.3505 62.3460 70.4089 174.2841 95 V 4.9236 8.5771 119.4571 59.2139 36.0226 174.6853 96 Q 4.4474 9.0291 125.1354 56.3044 29.2420 175.0018 97 T 4.4854 8.3846 119.3664 61.7967 70.3814 172.3461 98 D 4.6680 8.6779 123.8435 54.7307 42.6524 177.1592 99 V 3.6557 7.3544 118.9524 62.0442 32.0773 173.9382 100 P 4.4053 0.0000 0.0000 62.6153 32.2477 176.9159 101 Q 3.9895 8.7689 121.3191 59.3576 29.0176 177.9854 102 D 4.5982 8.0556 114.5488 54.7051 39.9240 176.5302 103 Q 4.3938 7.8000 118.0400 56.4671 29.8149 176.2905 104 I 3.6003 7.0911 118.5965 61.4973 37.4214 175.9758 105 R 4.3238 8.5264 124.7067 55.0144 29.6262 175.5403 106 H 4.5647 8.4862 120.6866 55.0685 30.0623 175.2397 107 V 4.1134 8.1002 123.1018 61.3663 33.4107 173.6924 108 Y 5.1718 8.4605 125.5723 56.2672 40.3816 175.1012 109 L 4.8743 8.8058 123.1282 51.9827 46.8710 178.5826 110 E 3.5527 8.8585 119.7205 57.9597 28.3737 179.1787 111 K 4.0865 9.1236 127.2477 59.6135 31.9828 177.9896 112 A 4.2509 7.8287 120.1019 52.8715 18.3110 178.6928 113 V 3.8744 7.7557 110.9613 63.4826 31.6874 178.6937 114 V 3.6623 7.2649 115.9102 62.2028 30.7002 176.2679 115 L 4.1302 7.6018 126.3102 55.2526 42.0371 176.2241 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 2 M 8.15 4.62 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 3 I 8.21 4.84 1.94 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 1.35 0.97 0.91 0.00 0.00 4 R 9.11 4.75 0.00 1.74 1.82 0.00 3.19 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 5 G 8.69 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 6 I 8.66 4.78 1.88 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 1.21 0.70 0.84 0.00 0.00 7 R 8.72 5.15 0.00 1.71 1.79 0.00 3.35 0.00 0.00 3.38 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 8 G 8.46 4.82 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 9 A 8.18 5.64 1.44 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 10 T 8.22 5.11 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 11 T 8.36 5.20 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 12 V 8.31 4.38 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 0.76 0.00 0.00 1.01 0.00 0.00 13 E 8.73 4.32 0.00 1.92 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 0.00 2.41 2.41 0.00 14 R 7.42 4.70 0.00 1.72 1.76 0.00 3.19 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 15 D 8.35 4.60 0.00 2.60 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 16 T 7.43 4.71 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 1.24 0.00 0.00 17 E 8.60 3.89 0.00 2.06 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 2.38 2.37 0.00 18 E 8.06 3.89 0.00 2.07 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 2.37 2.35 0.00 19 E 8.07 3.97 0.00 2.11 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 0.00 2.57 2.45 0.00 20 I 7.93 3.71 1.93 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.53 0.90 0.00 0.00 21 L 8.12 3.96 0.00 1.67 1.70 0.92 1.23 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 22 Q 8.43 3.91 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 23 K 7.92 4.05 0.00 1.90 1.83 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.60 1.61 7.81 24 T 8.18 3.85 4.22 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 1.19 0.00 0.00 25 K 8.26 3.85 0.00 1.85 1.88 0.00 1.58 0.00 0.00 1.82 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 26 Q 8.11 3.96 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 27 L 7.76 3.93 0.00 1.81 1.76 0.94 0.93 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 28 L 7.86 3.79 0.00 1.65 1.34 0.74 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.23 3.78 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 2.22 2.26 0.00 30 K 7.74 3.88 0.00 1.90 1.90 0.00 1.49 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.47 7.81 31 I 7.60 3.61 1.92 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 1.42 0.83 0.88 0.00 0.00 32 I 7.91 3.72 1.94 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 1.32 0.88 1.07 0.00 0.00 33 E 8.01 3.92 0.00 2.01 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 0.00 2.33 2.36 0.00 34 E 8.11 4.06 0.00 2.03 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 2.49 2.45 0.00 35 N 7.85 4.69 0.00 2.76 2.79 0.00 0.00 7.27 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 36 H 8.03 4.21 0.00 3.34 3.40 0.00 5.68 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.11 4.11 4.52 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 1.38 0.00 0.00 38 K 8.38 4.67 0.00 1.72 1.95 0.00 1.72 0.00 0.00 1.90 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.34 7.81 39 P 0.00 2.97 0.00 1.72 0.72 0.00 3.65 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 1.88 1.78 0.00 40 E 7.91 3.85 0.00 2.01 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 0.00 2.21 2.23 0.00 41 D 8.07 4.56 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 42 V 7.33 4.42 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 0.85 0.00 0.00 0.81 0.00 0.00 43 V 8.82 3.87 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 0.81 0.00 0.00 0.96 0.00 0.00 44 Q 7.53 4.79 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.63 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 45 M 8.63 5.29 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.56 0.00 46 L 8.96 5.39 0.00 1.62 1.53 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.82 5.29 0.00 1.61 1.55 0.98 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 48 S 9.18 5.68 0.00 3.89 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 49 A 8.36 5.46 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 50 T 8.50 4.42 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 1.24 0.00 0.00 51 P 0.00 4.43 0.00 2.20 2.20 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 52 D 7.92 4.63 0.00 2.91 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 53 L 7.71 4.89 0.00 1.64 1.53 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 54 H 9.07 4.76 0.00 3.17 3.19 0.00 5.65 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 55 A 8.37 4.15 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 56 V 6.92 4.27 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 0.67 0.00 0.00 1.03 0.00 0.00 57 F 8.40 4.29 0.00 3.15 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 58 P 0.00 4.26 0.00 2.20 2.12 0.00 3.75 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 59 A 8.35 3.97 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 60 K 7.98 4.03 0.00 1.91 1.86 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.48 7.81 61 A 8.34 4.09 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.62 3.62 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 1.16 0.00 0.00 0.94 0.00 0.00 63 R 7.54 3.98 0.00 2.04 1.97 0.00 3.22 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 64 E 7.62 4.24 0.00 2.11 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 2.33 2.34 0.00 65 L 7.46 4.07 0.00 1.65 1.31 0.05 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.69 4.21 0.00 3.90 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 67 G 8.95 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 W 8.38 4.53 0.00 3.52 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 69 Q 7.92 4.05 0.00 1.81 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.23 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.74 0.00 70 Y 7.38 4.59 0.00 2.96 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 71 V 7.53 3.69 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.53 0.00 0.00 72 P 0.00 4.61 0.00 2.17 2.18 0.00 3.69 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.00 0.00 73 V 8.19 5.57 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 0.72 0.00 0.00 0.96 0.00 0.00 74 T 8.32 4.64 4.22 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 1.21 0.00 0.00 75 C 8.83 5.93 0.00 3.08 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 76 M 8.27 4.94 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.71 0.00 77 Q 8.49 4.86 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.03 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 78 E 8.92 4.40 0.00 2.00 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 2.33 2.31 0.00 79 M 8.50 4.13 0.00 2.17 2.06 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 2.57 2.53 0.00 80 D 8.56 4.49 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 7.98 4.41 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 0.97 0.00 0.00 0.93 0.00 0.00 82 T 8.32 4.16 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 83 G 9.02 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 84 G 7.69 3.74 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 0.00 0.00 0.00 85 L 8.24 3.98 0.00 1.59 1.59 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.51 4.25 0.00 1.78 1.86 0.00 1.96 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.42 1.39 7.81 87 K 8.66 3.93 0.00 1.90 1.79 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.30 7.81 88 C 8.29 5.29 0.00 2.97 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 89 I 8.84 4.88 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.80 0.97 0.00 0.00 90 R 8.70 5.26 0.00 1.80 1.83 0.00 3.18 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 91 V 8.79 4.97 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 0.76 0.00 0.00 0.93 0.00 0.00 92 M 9.11 4.93 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 93 M 8.96 4.84 0.00 2.17 1.95 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 94 T 8.78 4.99 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 1.22 0.00 0.00 95 V 8.58 4.92 2.10 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 0.74 0.00 0.00 0.99 0.00 0.00 96 Q 9.03 4.45 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 97 T 8.38 4.49 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 98 D 8.68 4.67 0.00 2.64 2.66 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 0.00 99 V 7.35 3.66 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 0.94 0.00 0.00 100 P 0.00 4.41 0.00 2.29 1.98 0.00 3.77 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 2.12 2.10 0.00 101 Q 8.77 3.99 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.99 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 102 D 8.06 4.60 0.00 2.85 2.79 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 0.00 103 Q 7.80 4.39 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.85 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 104 I 7.09 3.60 1.81 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 1.49 0.73 0.71 0.00 0.00 105 R 8.53 4.32 0.00 1.85 1.85 0.00 3.13 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 106 H 8.49 4.56 0.00 3.04 3.04 0.00 5.85 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.10 4.11 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 0.88 0.00 0.00 0.88 0.00 0.00 108 Y 8.46 5.17 0.00 2.93 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 0.00 109 L 8.81 4.87 0.00 1.52 1.53 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.86 3.55 0.00 2.15 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 2.31 2.44 0.00 111 K 9.12 4.09 0.00 1.84 1.85 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.39 7.81 112 A 7.83 4.25 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 0.00 113 V 7.76 3.87 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 0.89 0.00 0.00 0.98 0.00 0.00 114 V 7.26 3.66 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 0.68 0.00 0.00 0.90 0.00 0.00 115 L 7.60 4.13 0.00 0.95 0.74 0.63 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00