NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3079 8.3001 118.2016 55.1755 33.1974 176.0496 2 A 4.1097 7.6040 120.6146 53.3221 16.6670 177.2131 3 S 4.1065 7.8334 112.1153 58.9271 62.1356 173.6972 4 I 2.6570 6.9040 114.0674 62.3005 37.4223 176.0860 5 E 4.1314 6.9494 120.0122 55.7131 30.2743 176.3598 6 G 4.2188 7.2886 106.6389 43.7636 0.0000 171.3544 7 K 4.9788 7.9805 120.8554 54.6413 34.5020 174.7837 8 Y 5.5239 8.5349 124.4786 55.4665 41.8437 174.0419 9 K 4.9994 9.0268 120.5670 53.9931 36.2908 175.2946 10 L 4.5668 8.6613 125.1086 55.6410 42.4455 177.3341 11 E 4.7399 8.4529 129.1597 54.8099 28.4961 174.6568 12 K 4.5553 8.3371 120.2649 57.9169 39.8670 175.2319 13 S 3.6861 8.0516 111.7785 59.4025 59.7190 171.6621 14 E 4.7093 7.3792 119.0203 55.6249 33.1938 176.6152 15 K 3.8934 9.1021 120.7485 57.0276 30.5632 176.7843 16 F 4.3862 8.0634 115.4139 60.5961 37.2563 177.0309 17 D 4.2851 6.0958 116.7359 56.3527 40.5891 177.4917 18 E 4.0351 7.8100 119.4455 59.1181 29.8233 178.1951 19 F 4.4230 8.4432 120.8897 61.3961 39.4480 177.0213 20 L 3.5449 8.3445 118.8216 57.4255 41.0731 178.7995 21 D 4.3308 7.5047 116.4198 56.8628 40.8110 177.7198 22 K 4.2629 8.1571 118.6613 58.0484 32.5266 178.6090 23 L 3.9879 7.4020 119.5793 56.4151 42.1074 177.6765 24 G 3.9676 8.0078 105.9399 45.0475 0.0000 173.8240 25 V 4.1933 7.2810 112.6240 60.4643 33.8835 175.6548 26 G 4.1077 7.7484 110.5598 44.1051 0.0000 174.7572 27 F 4.1782 9.0776 114.8893 60.8027 37.1321 177.6040 28 M 3.6784 6.4664 117.8895 57.1393 31.4354 177.8253 29 V 4.1207 7.4413 117.3503 63.6182 32.4725 177.4189 30 K 4.2608 8.1486 118.8224 59.8792 32.1975 178.1879 31 T 4.1217 8.5285 110.1541 64.4848 68.9823 176.7100 32 A 3.9898 7.5932 123.5400 54.8689 18.1082 179.4182 33 A 3.7901 7.8190 118.5375 54.6952 18.3328 179.2973 34 K 4.1030 7.4208 114.7142 59.9383 32.4948 177.0096 35 T 4.3555 7.9571 114.9956 61.2632 69.0717 173.9669 36 L 4.9857 8.3914 123.1084 55.4020 41.2745 177.5399 37 K 3.9571 8.5997 120.9339 59.7664 32.2830 175.4762 38 P 4.8569 0.0000 0.0000 61.9872 32.6563 175.3213 39 T 5.1045 8.2809 117.5465 60.6615 71.7268 171.8063 40 F 4.7886 8.4321 121.5264 55.5290 44.0331 173.3543 41 E 4.7490 8.6427 121.6658 54.4048 32.7266 174.7944 42 V 4.6152 8.5720 119.9668 59.6871 34.0958 174.7117 43 A 4.5615 8.7448 127.7781 50.2606 21.0176 174.4806 44 I 3.9697 7.9453 122.3874 60.7594 36.3149 175.8268 45 E 4.3503 8.3600 125.8904 55.1937 30.5841 177.3466 46 N 4.9717 8.3664 117.3018 52.7041 37.3758 175.2772 47 D 4.8848 8.0990 117.2581 56.7172 47.3800 175.5138 48 Q 4.8088 7.6892 116.2080 54.9247 34.2308 173.0411 49 Y 4.6789 9.0693 118.5429 57.1134 40.1081 175.1158 50 I 4.6188 8.6591 125.1088 59.9872 39.2999 174.5455 51 F 5.3758 9.2748 132.7211 56.7328 38.7548 172.6407 52 R 4.1204 8.8053 123.2722 55.5176 31.3255 174.3783 53 S 2.8077 8.3593 122.0449 55.8361 64.0525 173.9404 54 L 4.5095 8.0483 125.4001 54.1356 43.3662 176.2067 55 S 4.9017 7.5353 118.4982 56.6988 61.2973 175.0488 56 T 3.6859 9.2887 107.1661 61.9816 67.3429 172.0907 57 F 3.9547 8.4544 119.0367 58.9792 37.8830 175.0117 58 K 4.0343 7.9653 117.1279 54.8627 33.8941 174.6230 59 N 4.5499 8.6756 125.2169 53.1445 38.2243 174.1780 60 T 4.2631 8.3766 114.6765 61.4513 71.6325 171.1942 61 E 4.9977 8.8069 123.6957 54.5925 31.9845 174.9239 62 A 4.7276 8.5142 122.9716 49.8879 22.7424 175.0605 63 K 4.9124 7.6264 119.6363 55.2332 35.2427 175.4317 64 F 5.2332 9.1196 122.2985 56.2353 44.4101 173.8962 65 K 4.7106 8.6559 120.1893 55.7757 33.7718 175.9714 66 L 3.8038 8.2135 123.2898 54.8254 42.4979 176.7487 67 G 3.7795 8.8609 114.7029 45.6508 0.0000 173.1698 68 E 3.8331 7.4582 117.6141 56.4768 30.9544 176.0314 69 E 4.4894 7.3519 121.4472 55.2789 31.8789 173.6890 70 F 5.2264 8.5976 124.9781 55.8472 44.3564 173.8961 71 E 5.1160 9.0778 119.5974 53.7608 31.2377 173.7848 72 E 4.9854 8.5751 124.1283 53.8193 34.0088 174.3694 73 D 4.8048 8.6994 120.7252 53.9402 40.0905 175.7346 74 R 4.4568 9.1882 118.0295 55.4638 32.9182 174.2783 75 A 3.6438 8.5494 118.9778 52.8492 17.2206 177.2648 76 D 4.3006 7.9120 110.9903 56.0972 41.5953 177.9503 77 G 4.5407 5.8401 121.5294 46.0695 0.0000 172.5488 78 K 4.5903 7.9671 119.0577 54.7531 35.9626 176.1080 79 R 4.9814 8.6699 125.1314 54.4424 30.5634 175.3974 80 V 4.7832 8.1608 118.6494 59.1353 36.9382 174.8776 81 K 4.2449 8.8143 123.3525 57.7701 33.7558 175.4818 82 T 5.1410 8.8564 119.2704 60.9057 71.3781 172.9469 83 V 4.8728 8.4428 128.1207 60.0847 35.0181 173.6509 84 I 4.7769 8.2517 126.1916 59.1072 40.3068 174.4939 85 Q 4.4823 8.9621 125.2513 53.9270 31.5985 174.3367 86 K 4.6442 8.6724 126.3951 56.4009 33.2240 175.9836 87 E 3.7547 9.3281 128.7852 57.8235 29.8839 176.9603 88 G 3.8695 10.3330 117.8962 45.2883 0.0000 172.2697 89 D 4.7014 8.3939 113.4715 53.3436 43.7286 174.7928 90 N 5.1332 7.8974 114.9667 53.5997 45.7800 174.6204 91 K 4.3346 7.6384 118.4023 55.4307 34.1454 175.7667 92 F 5.4863 8.7610 124.1470 55.8671 42.8618 174.3708 93 V 5.1377 9.0373 116.1921 59.6387 35.5755 174.6970 94 Q 5.0299 9.3826 121.9235 55.0274 32.3244 173.7753 95 T 5.3561 8.8717 118.1900 61.8958 72.5324 172.9483 96 Q 5.2452 8.8057 122.0980 53.2919 31.9891 176.0874 97 F 4.1889 9.5578 122.6994 59.8554 41.2668 180.6997 98 G 3.6596 8.2890 104.2141 45.5485 0.0000 173.6847 99 D 4.6797 8.8956 125.0658 54.6528 43.4967 176.5409 100 K 4.0675 6.8915 115.3634 56.1441 39.3685 176.0025 101 E 6.3000 7.2307 128.6912 56.3710 30.9418 176.6715 102 V 4.2312 8.0287 124.0185 60.7273 34.0763 175.4794 103 K 4.8576 9.1917 123.9211 54.9649 34.8828 174.6462 104 I 4.9409 8.9353 128.8521 59.6450 39.9997 174.8667 105 I 5.1377 8.6337 126.0708 59.6811 41.0914 174.8810 106 R 5.0451 9.1922 124.2567 54.6356 34.6207 173.6290 107 E 4.5230 8.7067 124.5256 54.0148 32.4046 175.1900 108 F 4.2882 8.6151 130.8057 58.1423 36.5878 174.2758 109 N 4.2721 8.4939 121.9671 55.0359 38.9956 175.1138 110 G 3.0357 6.5185 110.4466 45.0127 0.0000 173.4507 111 D 4.7880 7.5614 119.1824 54.2188 43.6708 175.2313 112 E 4.7891 7.5299 116.0279 55.2689 35.0442 173.8361 113 V 4.5770 8.5682 119.7279 61.3003 34.9778 174.7101 114 V 4.1162 8.3042 121.6574 61.0157 32.4749 175.4717 115 V 4.4505 8.6452 126.8660 62.2805 33.4421 175.2546 116 T 4.7848 8.8725 123.1926 61.8808 71.2213 172.4711 117 A 4.7656 8.5642 128.8538 51.0539 20.8543 176.3519 118 S 4.7989 9.0002 115.2214 57.8286 66.5484 173.0059 119 C 4.9993 8.6628 127.1590 57.8329 33.5488 172.0239 120 D 4.5612 8.8954 116.0264 57.8526 40.6102 179.8179 121 G 4.0553 7.4581 104.3705 44.5942 0.0000 172.9226 122 V 4.3247 7.8675 119.7323 60.9637 33.7347 173.8062 123 T 5.1356 8.4592 123.3657 61.8727 71.4450 173.4564 124 S 4.8597 8.8600 119.1650 56.7206 66.7478 173.2115 125 V 5.0931 8.3316 123.0966 60.2090 33.8037 174.0751 126 R 4.6151 8.2646 121.1758 54.5523 33.1809 173.8997 127 T 4.6960 8.3583 118.5038 62.9310 70.4819 173.1154 128 Y 5.0794 8.8725 125.2363 56.8447 39.8392 174.7516 129 K 4.5222 9.1139 126.9574 56.0396 33.0843 175.5975 130 R 5.0962 8.2374 128.5973 55.6487 31.1551 176.1541 131 I 4.0664 8.6435 124.4029 61.6413 38.3313 174.0087 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 4.31 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 A 7.60 4.11 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 3 S 7.83 4.11 0.00 4.09 3.95 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 4 I 6.90 2.66 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.30 0.99 0.00 0.00 5 E 6.95 4.13 0.00 2.31 1.84 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 2.20 2.19 0.00 6 G 7.29 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 0.00 0.00 0.00 0.00 7 K 7.98 4.98 0.00 1.81 1.62 0.00 1.53 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 1.34 7.81 8 Y 8.53 5.52 0.00 3.12 3.03 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 9 K 9.03 5.00 0.00 1.85 1.94 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.39 7.81 10 L 8.66 4.57 0.00 1.95 1.88 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.45 4.74 0.00 2.17 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 2.26 2.44 0.00 12 K 8.34 4.56 0.00 1.70 1.70 0.00 1.89 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.29 1.68 7.81 13 S 8.05 3.69 0.00 3.93 3.36 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 14 E 7.38 4.71 0.00 2.15 1.84 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 2.34 2.37 0.00 15 K 9.10 3.89 0.00 2.03 1.88 0.00 1.59 0.00 0.00 1.87 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.45 7.81 16 F 8.06 4.39 0.00 3.41 3.43 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 17 D 6.10 4.29 0.00 1.88 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 0.00 0.00 0.00 0.00 18 E 7.81 4.04 0.00 2.06 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 2.37 2.44 0.00 19 F 8.44 4.42 0.00 3.15 3.29 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 20 L 8.34 3.54 0.00 1.75 1.62 0.83 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 21 D 7.50 4.33 0.00 2.67 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 22 K 8.16 4.26 0.00 1.99 1.88 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.67 7.81 23 L 7.40 3.99 0.00 0.81 1.48 1.07 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.01 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 0.00 0.00 0.00 25 V 7.28 4.19 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 0.90 0.00 0.00 0.88 0.00 0.00 26 G 7.75 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 0.00 0.00 0.00 27 F 9.08 4.18 0.00 3.29 3.35 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 28 M 6.47 3.68 0.00 0.98 0.57 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 1.00 1.44 0.00 29 V 7.44 4.12 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 1.17 0.00 0.00 0.96 0.00 0.00 30 K 8.15 4.26 0.00 2.06 1.97 0.00 1.93 0.00 0.00 1.90 0.00 0.00 3.23 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.72 1.72 7.81 31 T 8.53 4.12 4.28 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 0.00 0.00 1.37 0.00 0.00 32 A 7.59 3.99 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 33 A 7.82 3.79 0.41 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 34 K 7.42 4.10 0.00 1.85 1.85 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.40 7.81 35 T 7.96 4.36 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 1.26 0.00 0.00 36 L 8.39 4.99 0.00 1.83 1.80 0.95 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.60 3.96 0.00 1.77 1.96 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.47 7.81 38 P 0.00 4.86 0.00 2.31 2.29 0.00 3.81 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 2.17 1.86 0.00 39 T 8.28 5.10 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 1.21 0.00 0.00 40 F 8.43 4.79 0.00 1.81 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 0.00 0.00 0.00 41 E 8.64 4.75 0.00 1.80 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 2.14 2.17 0.00 42 V 8.57 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 0.78 0.00 0.00 1.07 0.00 0.00 43 A 8.74 4.56 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 44 I 7.95 3.97 1.52 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 -0.36 0.53 0.00 0.00 45 E 8.36 4.35 0.00 2.18 1.84 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 2.25 2.36 0.00 46 N 8.37 4.97 0.00 2.82 2.91 0.00 0.00 5.86 8.05 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 47 D 8.10 4.88 0.00 2.66 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 48 Q 7.69 4.81 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 49 Y 9.07 4.68 0.00 3.04 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 50 I 8.66 4.62 1.94 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 1.09 0.70 0.88 0.00 0.00 51 F 9.27 5.38 0.00 3.18 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 52 R 8.81 4.12 0.00 1.86 1.69 0.00 3.02 0.00 0.00 2.95 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 53 S 8.36 2.81 0.00 3.31 3.35 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 54 L 8.05 4.51 0.00 1.50 1.47 0.66 0.66 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 55 S 7.54 4.90 0.00 4.03 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 56 T 9.29 3.69 4.32 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 1.39 0.00 0.00 57 F 8.45 3.95 0.00 2.91 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 K 7.97 4.03 0.00 1.49 1.53 0.00 1.62 0.00 0.00 1.55 0.00 0.00 3.01 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.39 1.28 7.81 59 N 8.68 4.55 0.00 2.74 2.73 0.00 0.00 6.04 7.67 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 60 T 8.38 4.26 4.17 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 1.21 0.00 0.00 61 E 8.81 5.00 0.00 1.92 1.81 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 2.11 2.21 0.00 62 A 8.51 4.73 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 63 K 7.63 4.91 0.00 1.64 1.65 0.00 1.52 0.00 0.00 1.61 0.00 0.00 2.71 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.03 1.29 7.81 64 F 9.12 5.23 0.00 2.97 2.88 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 0.00 0.00 0.00 65 K 8.66 4.71 0.00 1.61 1.75 0.00 1.77 0.00 0.00 1.79 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.55 7.81 66 L 8.21 3.80 0.00 1.25 1.38 0.74 0.87 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 67 G 8.86 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 0.00 0.00 0.00 68 E 7.46 3.83 0.00 1.56 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 0.00 2.40 2.09 0.00 69 E 7.35 4.49 0.00 1.73 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 70 F 8.60 5.23 0.00 2.77 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 71 E 9.08 5.12 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 2.17 2.09 0.00 72 E 8.58 4.99 0.00 2.06 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 2.40 2.43 0.00 73 D 8.70 4.80 0.00 2.72 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 74 R 9.19 4.46 0.00 2.08 2.17 0.00 3.10 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.68 0.00 75 A 8.55 3.64 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 76 D 7.91 4.30 0.00 2.64 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 77 G 5.84 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 78 K 7.97 4.59 0.00 1.90 1.93 0.00 1.26 0.00 0.00 1.65 0.00 0.00 3.20 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.55 7.81 79 R 8.67 4.98 0.00 1.87 1.93 0.00 3.02 0.00 0.00 2.25 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.43 0.00 80 V 8.16 4.78 2.37 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 0.99 0.00 0.00 1.10 0.00 0.00 81 K 8.81 4.24 0.00 1.88 1.91 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.76 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.52 1.62 7.81 82 T 8.86 5.14 4.30 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 1.15 0.00 0.00 83 V 8.44 4.87 1.97 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 1.11 0.00 0.00 0.88 0.00 0.00 84 I 8.25 4.78 1.51 0.00 0.00 0.60 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 0.29 0.37 0.00 0.00 85 Q 8.96 4.48 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 86 K 8.67 4.64 0.00 2.12 1.85 0.00 1.88 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.71 1.78 7.81 87 E 9.33 3.75 0.00 1.97 1.87 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 2.31 2.26 0.00 88 G 10.33 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 89 D 8.39 4.70 0.00 2.62 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 90 N 7.90 5.13 0.00 2.72 2.87 0.00 0.00 7.04 7.67 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 91 K 7.64 4.33 0.00 1.75 1.68 0.00 1.50 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.27 7.81 92 F 8.76 5.49 0.00 3.06 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 93 V 9.04 5.14 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 0.84 0.00 0.00 0.99 0.00 0.00 94 Q 9.38 5.03 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.93 0.00 0.00 0.00 0.00 0.00 2.45 2.68 0.00 95 T 8.87 5.36 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 1.30 0.00 0.00 96 Q 8.81 5.25 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.24 0.00 97 F 9.56 4.19 0.00 3.10 3.20 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 0.00 98 G 8.29 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 0.00 0.00 0.00 0.00 99 D 8.90 4.68 0.00 2.57 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 0.00 100 K 6.89 4.07 0.00 1.64 1.66 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.48 7.81 101 E 7.23 6.30 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 2.14 2.18 0.00 102 V 8.03 4.23 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 0.96 0.00 0.00 1.15 0.00 0.00 103 K 9.19 4.86 0.00 1.83 1.78 0.00 1.48 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.43 7.81 104 I 8.94 4.94 1.96 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 1.25 0.24 0.97 0.00 0.00 105 I 8.63 5.14 1.83 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 1.23 0.85 0.87 0.00 0.00 106 R 9.19 5.05 0.00 2.02 2.05 0.00 3.27 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 107 E 8.71 4.52 0.00 1.88 1.66 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 2.00 2.25 0.00 108 F 8.62 4.29 0.00 3.20 3.03 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 0.00 109 N 8.49 4.27 0.00 2.70 2.71 0.00 0.00 6.85 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 0.00 110 G 6.52 3.04 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 0.00 0.00 0.00 111 D 7.56 4.79 0.00 2.71 2.56 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 0.00 0.00 0.00 0.00 112 E 7.53 4.79 0.00 1.83 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 2.30 2.27 0.00 113 V 8.57 4.58 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 1.17 0.00 0.00 1.05 0.00 0.00 114 V 8.30 4.12 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 0.79 0.00 0.00 0.91 0.00 0.00 115 V 8.65 4.45 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 0.88 0.00 0.00 0.39 0.00 0.00 116 T 8.87 4.78 4.17 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 1.15 0.00 0.00 117 A 8.56 4.77 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.00 4.80 0.00 3.82 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 0.00 119 C 8.66 5.00 0.00 2.97 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 0.00 120 D 8.90 4.56 0.00 2.63 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 0.00 121 G 7.46 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 122 V 7.87 4.32 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 1.36 0.00 0.00 0.95 0.00 0.00 123 T 8.46 5.14 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 1.20 0.00 0.00 124 S 8.86 4.86 0.00 3.61 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 0.00 125 V 8.33 5.09 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 1.03 0.00 0.00 0.87 0.00 0.00 126 R 8.26 4.62 0.00 1.66 1.91 0.00 2.72 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.00 127 T 8.36 4.70 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 1.25 0.00 0.00 128 Y 8.87 5.08 0.00 2.80 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 0.00 129 K 9.11 4.52 0.00 1.91 1.81 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.57 7.81 130 R 8.24 5.10 0.00 2.05 2.06 0.00 3.80 0.00 0.00 3.33 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.14 0.00 131 I 8.64 4.07 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.01 0.96 0.00 0.00