NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 F 4.9368 8.3093 119.4041 57.1344 40.5873 174.3120 4 S 4.2413 8.3047 116.7040 57.1250 63.8873 172.0256 5 E 3.9887 8.9061 122.9647 58.6262 30.0132 178.4921 6 E 3.6993 7.8626 116.9819 60.7435 30.0492 178.3877 7 Q 3.7816 8.0229 117.3405 59.5072 29.1979 178.8479 8 T 3.9314 8.1771 117.8656 66.1506 68.4332 176.2795 9 A 3.9649 8.0621 122.8997 55.3093 18.3911 179.5876 10 E 4.0750 7.6457 115.8509 59.6140 29.4714 179.5054 11 F 4.5968 8.6409 118.2757 60.5785 38.8371 177.9146 12 K 2.9812 8.1112 118.0051 59.1425 31.7544 179.0510 13 E 3.9296 8.0519 118.4365 59.6001 29.2335 179.3725 14 A 4.0884 7.8723 119.1614 55.1414 18.8139 179.1292 15 F 4.2712 8.2622 118.8629 61.6959 39.5646 177.4881 16 Q 4.0452 8.5018 118.0140 58.7084 28.3092 178.0600 17 L 4.1029 8.1718 120.1123 56.9724 42.2456 178.2181 18 F 4.0600 7.7529 116.0965 58.6980 39.1981 175.2905 19 D 4.4069 7.1065 117.9150 54.3205 41.7487 175.7344 20 R 4.2653 8.5182 123.6574 57.9089 30.9101 177.0835 21 T 4.3487 8.5212 106.0819 63.1785 70.4308 174.2716 22 G 3.7945 8.7898 109.4688 45.6008 0.0000 174.3250 23 D 4.3639 8.2007 118.9037 54.4155 39.1265 177.3975 24 G 3.9462 8.7183 108.3781 45.4951 0.0000 173.9075 25 K 5.3920 7.7149 117.8614 53.3763 34.0966 174.9603 26 I 4.0588 8.0226 125.9763 60.3309 38.6779 175.9948 27 L 4.8080 8.4870 126.4993 54.3955 42.6675 177.6053 28 Y 4.2665 8.8369 118.8252 61.9630 37.9179 178.4118 29 S 4.1302 8.0873 114.2846 61.9439 62.7748 176.3624 30 Q 3.9972 8.0842 122.0684 57.6191 28.7103 178.3563 31 C 3.6933 8.1156 120.5372 62.6505 31.5856 176.2458 32 G 3.5726 7.9785 106.7001 47.8306 0.0000 175.4261 33 D 4.4176 8.0485 121.1649 56.6758 40.8798 179.1113 34 V 2.9481 6.9365 118.3290 65.9556 31.6193 177.4860 35 M 4.1305 8.3262 118.7498 59.1135 31.8761 178.4697 36 R 4.5969 8.2727 118.6528 59.0550 30.0567 178.7961 37 A 4.1248 8.5517 121.1248 55.3689 18.5104 179.4199 38 L 4.1940 7.9827 117.1278 55.7405 41.7363 178.8402 39 G 5.1187 7.1641 118.5889 46.3835 0.0000 172.1889 40 Q 4.5525 7.3077 120.0001 54.9529 30.6569 174.9169 41 N 5.3005 8.0543 115.0938 51.1865 39.2087 172.8245 42 P 5.1372 0.0000 0.0000 61.4727 32.8336 176.9330 43 T 4.0588 8.4713 111.5437 61.5320 69.5366 175.2894 44 N 4.2630 8.8778 121.4943 56.1605 38.3786 177.3492 45 A 3.9800 8.0501 122.0011 55.3327 18.1021 179.0879 46 E 3.8644 8.2540 117.1345 59.8082 29.4415 179.5966 47 V 3.5553 7.7622 117.4780 66.2688 31.7003 177.2100 48 M 3.8962 8.2808 117.7538 58.7351 31.7328 177.9183 49 K 3.7421 8.0257 118.9473 59.9249 32.4375 178.5079 50 V 3.7723 7.2361 115.1000 64.9057 31.5866 177.6176 51 L 3.8694 7.8670 118.8980 55.9271 41.5762 177.8877 52 G 3.8855 7.8398 105.9297 46.5164 0.0000 172.9883 53 N 4.1218 8.0932 111.4605 53.4619 36.0163 172.3784 54 P 4.6120 0.0000 0.0000 61.9064 33.2640 176.5744 55 K 4.5464 8.6683 120.1375 54.9495 34.4234 177.7654 56 S 4.1448 8.6311 113.9561 62.6588 62.5471 174.9831 57 D 4.2962 8.5174 120.9030 57.3074 38.5830 177.7578 58 E 3.9302 8.0940 119.8391 58.0796 29.7642 179.0588 59 M 4.1590 8.3340 120.8972 58.3687 31.7486 177.9208 60 N 4.4289 8.1953 116.4749 56.3737 39.3078 176.7683 61 L 4.0960 7.9901 119.8909 56.5107 42.4619 177.9313 62 K 4.1124 7.7654 119.1379 56.3041 32.9470 176.8185 63 T 4.9361 8.3262 113.9262 60.3242 71.2573 173.6391 64 L 5.3154 9.0795 122.4769 53.1882 45.9213 175.6048 65 K 5.2537 9.2690 120.3376 54.4910 35.8624 177.4167 66 F 3.2866 8.9098 122.6244 61.4522 39.2318 176.5214 67 E 4.1149 8.1763 116.2668 57.6433 29.4110 177.8372 68 Q 4.2644 7.6659 117.6152 57.4486 29.7082 177.1552 69 F 4.1202 7.8499 121.8278 60.8282 39.3999 177.0843 70 L 3.4403 7.5984 120.4869 57.4502 41.6797 177.0912 71 P 4.2181 0.0000 0.0000 66.0826 30.9147 178.3687 72 M 3.8667 7.2941 119.1247 57.8288 32.0512 177.9487 73 M 3.6908 7.1796 118.1737 58.7185 32.0718 178.1619 74 Q 3.9341 7.9495 117.2437 59.1444 28.8734 178.7074 75 T 3.9477 7.8566 110.8098 65.6927 68.4974 175.6638 76 I 3.7706 8.1421 121.9633 62.1791 36.9414 179.0761 77 A 3.8654 8.2212 125.5343 55.1079 20.1158 179.0208 78 K 4.3668 7.7021 114.0573 56.3856 30.8715 176.0582 79 N 4.8011 7.6188 118.2654 52.2254 40.3605 173.9354 80 K 3.7892 8.1024 121.6059 60.1365 32.8716 175.7986 81 D 4.7316 7.5771 119.1782 51.6773 45.0897 174.6393 82 Q 4.5084 8.5575 123.8560 53.8602 31.4951 174.8376 83 G 3.7169 8.6025 114.4580 44.4174 0.0000 173.8997 84 C 4.2418 8.1161 120.8044 57.2476 32.0962 174.0210 85 F 4.0125 8.6907 122.3778 61.7651 38.2428 177.0672 86 E 3.7934 8.0410 117.3134 59.4343 29.3123 178.8284 87 D 4.3793 7.8880 118.3988 57.5340 40.6232 178.3963 88 Y 4.2354 7.6721 117.0568 61.1759 37.9442 178.6091 89 V 3.6958 7.4356 113.3043 64.7008 31.6752 178.2557 90 E 4.0415 7.8638 118.2551 59.0211 29.1562 178.8226 91 G 3.6799 8.0977 105.3359 48.1361 0.0000 175.3732 92 L 4.0847 8.0634 121.6536 56.6352 41.6308 179.3849 93 R 2.9934 8.0820 119.2201 58.8967 29.6093 178.9992 94 V 3.1847 6.7165 117.3144 65.4136 31.7423 176.4961 95 F 4.4742 7.1150 112.9854 57.1796 39.4283 175.9159 96 D 4.6110 8.1805 122.4390 53.1066 39.6277 176.1691 97 K 3.9839 8.5087 128.3359 58.7509 32.5136 176.3689 98 E 4.5212 9.2641 114.0660 57.3342 31.3107 177.2161 99 G 4.5047 9.0517 115.5389 47.1276 0.0000 174.7787 100 N 3.9051 7.2401 117.5781 54.3942 38.9558 175.6974 101 G 3.8128 9.9918 106.3697 44.7109 0.0000 172.4629 102 T 5.0099 7.6582 107.9047 60.0532 72.0189 173.4132 103 V 4.6636 9.0894 122.8862 61.1690 36.0093 174.2080 104 M 4.6052 8.8593 125.9494 55.6808 32.5394 177.7918 105 G 3.8816 9.6475 112.1327 46.4057 0.0000 175.7152 106 A 4.0141 7.8638 123.0761 55.0889 18.6006 179.3298 107 E 3.7709 8.0137 116.8373 59.6099 29.6187 179.4022 108 I 3.5946 7.7313 119.2309 64.7425 36.9755 178.4159 109 R 3.9312 7.7606 117.1959 59.4411 30.0637 178.4290 110 H 4.3091 8.0353 117.8594 59.1173 29.9718 177.3951 111 V 3.2760 8.0605 120.3151 66.0418 31.3348 178.0257 112 L 4.2286 7.4585 117.6835 57.0682 41.1433 178.5674 113 V 4.5328 7.7234 117.7463 62.3975 31.5930 176.0481 114 T 4.4798 7.4385 105.2828 61.3613 70.4846 173.6624 115 L 4.7485 8.2235 121.2313 53.0695 45.1926 179.5661 116 G 3.7373 8.0925 109.9441 47.3873 0.0000 177.0971 117 E 4.3034 8.6249 117.7281 53.9687 27.7300 175.1214 118 K 4.0994 7.5400 118.2421 56.6056 33.3779 176.4659 119 M 5.4565 9.4198 123.5367 53.2082 35.1059 175.7302 120 T 4.6365 8.3619 111.3101 60.7945 71.0008 175.4354 121 E 3.9233 8.9425 120.3483 59.8494 29.2919 178.8460 122 E 3.9260 8.2502 119.1530 59.2294 29.4023 179.1728 123 E 4.0108 8.0266 117.7990 59.5458 29.5346 179.9798 124 V 3.5772 8.1111 112.7661 64.2925 31.6215 178.3642 125 E 3.9238 8.7251 119.3937 59.3807 29.3191 178.6999 126 Q 4.0240 7.3972 116.1454 58.8713 28.8441 178.5476 127 L 4.0877 7.2594 119.5266 58.2639 42.0768 179.0478 128 V 3.8399 8.2693 112.1908 62.9761 32.0114 176.6049 129 A 4.1191 7.0697 119.7286 53.1271 18.5780 177.8288 130 G 3.8915 8.9270 108.2632 46.1460 0.0000 173.7212 131 H 4.8243 7.7431 114.0580 54.9349 30.1460 173.8880 132 E 4.2822 7.9624 118.5293 56.0009 30.6528 176.3201 133 D 4.9725 8.6224 120.7550 52.0141 41.8018 177.4875 134 S 4.3871 8.6339 112.4027 60.0601 62.5099 174.0049 135 N 4.7900 8.6588 116.9221 52.7966 39.5885 175.1630 136 G 3.8879 8.4532 107.0567 46.0310 0.0000 172.4265 137 C 4.9286 7.9880 117.4011 58.4260 30.0376 172.8043 138 I 4.6522 8.7764 125.3426 59.9626 37.4398 174.7005 139 N 4.7276 8.7643 126.4257 53.4045 39.4298 175.4490 140 Y 4.4201 7.8300 125.7941 59.9818 38.3528 177.8399 141 E 4.2233 7.9625 120.0749 59.7879 29.5718 179.2446 142 E 4.1340 8.7681 118.1427 59.0793 29.5914 179.1658 143 L 3.9779 7.4804 117.7327 57.8491 42.2059 179.1680 144 V 3.7061 8.1921 118.3699 66.3067 31.6193 178.0658 145 R 4.0815 8.2346 117.4388 59.6032 29.6505 178.6684 146 M 4.0444 8.2583 117.3684 58.9579 32.3774 178.6028 147 V 3.8405 7.5904 110.4961 64.3641 31.6942 178.0767 148 L 4.2079 7.7614 118.4765 57.0665 42.9109 178.3607 149 S 4.5728 8.2209 117.3542 57.0697 61.6089 174.9906 150 G 3.7556 7.5690 112.2418 45.7465 0.0000 170.5535 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 3 F 8.31 4.94 0.00 3.14 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 4 S 8.30 4.24 0.00 4.08 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 5 E 8.91 3.99 0.00 2.09 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 2.39 2.36 0.00 6 E 7.86 3.70 0.00 2.00 1.74 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 2.32 2.30 0.00 7 Q 8.02 3.78 0.00 1.62 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.70 0.00 0.00 0.00 0.00 0.00 2.26 1.31 0.00 8 T 8.18 3.93 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 9 A 8.06 3.96 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 10 E 7.65 4.08 0.00 2.12 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 2.31 2.28 0.00 11 F 8.64 4.60 0.00 3.22 3.19 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 12 K 8.11 2.98 0.00 1.80 1.47 0.00 1.57 0.00 0.00 1.49 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.30 1.50 7.81 13 E 8.05 3.93 0.00 2.26 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 2.32 2.52 0.00 14 A 7.87 4.09 1.48 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 0.00 0.00 15 F 8.26 4.27 0.00 3.23 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 16 Q 8.50 4.05 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.76 0.00 0.00 0.00 0.00 0.00 2.66 2.52 0.00 17 L 8.17 4.10 0.00 1.68 1.79 0.85 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 18 F 7.75 4.06 0.00 3.03 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 19 D 7.11 4.41 0.00 2.72 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 20 R 8.52 4.27 0.00 1.79 1.91 0.00 3.23 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 21 T 8.52 4.35 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 22 G 8.79 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 0.00 0.00 0.00 23 D 8.20 4.36 0.00 2.80 2.82 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 24 G 8.72 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 0.00 0.00 0.00 25 K 7.71 5.39 0.00 1.84 1.79 0.00 1.76 0.00 0.00 2.58 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.62 7.81 26 I 8.02 4.06 1.26 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.24 0.61 0.00 0.00 27 L 8.49 4.81 0.00 1.65 1.66 0.95 0.99 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 28 Y 8.84 4.27 0.00 3.05 3.08 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 0.00 0.00 0.00 29 S 8.09 4.13 0.00 4.11 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 30 Q 8.08 4.00 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.93 0.00 0.00 0.00 0.00 0.00 2.53 2.44 0.00 31 C 8.12 3.69 0.00 3.17 3.10 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 32 G 7.98 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 33 D 8.05 4.42 0.00 2.60 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 34 V 6.94 2.95 1.52 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 0.95 0.00 0.00 -0.02 0.00 0.00 35 M 8.33 4.13 0.00 2.11 2.40 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.52 0.00 36 R 8.27 4.60 0.00 2.03 1.99 0.00 3.24 0.00 0.00 3.29 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.63 0.00 37 A 8.55 4.12 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 0.00 0.00 0.00 0.00 0.00 38 L 7.98 4.19 0.00 1.30 0.79 0.70 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 39 G 7.16 5.12 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 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 7.31 4.55 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.88 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 41 N 8.05 5.30 0.00 2.69 2.73 0.00 0.00 7.01 8.07 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 42 P 0.00 5.14 0.00 2.04 1.97 0.00 3.74 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 43 T 8.47 4.06 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 1.27 0.00 0.00 44 N 8.88 4.26 0.00 2.97 2.92 0.00 0.00 7.26 7.08 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 45 A 8.05 3.98 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 46 E 8.25 3.86 0.00 2.21 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 0.00 2.32 2.32 0.00 47 V 7.76 3.56 2.26 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 1.11 0.00 0.00 0.98 0.00 0.00 48 M 8.28 3.90 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.63 0.00 49 K 8.03 3.74 0.00 1.80 2.04 0.00 1.71 0.00 0.00 1.61 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.48 7.81 50 V 7.24 3.77 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 0.78 0.00 0.00 0.87 0.00 0.00 51 L 7.87 3.87 0.00 1.80 1.68 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 52 G 7.84 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 53 N 8.09 4.12 0.00 2.85 2.86 0.00 0.00 7.19 8.02 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 54 P 0.00 4.61 0.00 2.14 2.02 0.00 3.76 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 2.38 2.29 0.00 55 K 8.67 4.55 0.00 2.17 1.76 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.37 7.81 56 S 8.63 4.14 0.00 4.05 4.13 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 57 D 8.52 4.30 0.00 2.87 2.82 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 58 E 8.09 3.93 0.00 2.04 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 0.00 2.30 2.29 0.00 59 M 8.33 4.16 0.00 2.09 2.42 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.82 0.00 60 N 8.20 4.43 0.00 2.93 2.82 0.00 0.00 7.30 8.31 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 61 L 7.99 4.10 0.00 1.55 1.64 0.89 0.87 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 62 K 7.77 4.11 0.00 0.79 0.74 0.00 1.42 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.15 1.03 7.81 63 T 8.33 4.94 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 1.23 0.00 0.00 64 L 9.08 5.32 0.00 2.01 1.80 1.00 0.68 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 65 K 9.27 5.25 0.00 1.74 1.84 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.55 7.81 66 F 8.91 3.29 0.00 2.68 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 67 E 8.18 4.11 0.00 2.02 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 2.36 2.40 0.00 68 Q 7.67 4.26 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.16 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 69 F 7.85 4.12 0.00 2.99 2.54 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 70 L 7.60 3.44 0.00 0.73 1.24 1.19 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.22 0.00 2.17 2.19 0.00 3.41 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.95 0.00 72 M 7.29 3.87 0.00 1.81 1.68 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.27 0.00 73 M 7.18 3.69 0.00 1.88 1.20 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 74 Q 7.95 3.93 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.65 0.00 0.00 0.00 0.00 0.00 1.88 2.46 0.00 75 T 7.86 3.95 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 1.16 0.00 0.00 76 I 8.14 3.77 1.81 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 1.41 0.46 0.90 0.00 0.00 77 A 8.22 3.87 1.53 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 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.70 4.37 0.00 1.85 1.88 0.00 1.42 0.00 0.00 1.59 0.00 0.00 3.05 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.34 1.43 7.81 79 N 7.62 4.80 0.00 2.82 2.76 0.00 0.00 7.28 7.02 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 80 K 8.10 3.79 0.00 1.88 1.89 0.00 1.50 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.57 7.81 81 D 7.58 4.73 0.00 2.64 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 82 Q 8.56 4.51 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.03 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 83 G 8.60 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 84 C 8.12 4.24 0.00 3.23 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 85 F 8.69 4.01 0.00 3.13 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 86 E 8.04 3.79 0.00 2.08 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 0.00 2.46 2.55 0.00 87 D 7.89 4.38 0.00 2.62 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 88 Y 7.67 4.24 0.00 2.97 2.89 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 89 V 7.44 3.70 2.15 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 0.35 0.00 0.00 0.63 0.00 0.00 90 E 7.86 4.04 0.00 2.01 2.03 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 2.25 2.28 0.00 91 G 8.10 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 0.00 0.00 0.00 92 L 8.06 4.08 0.00 1.43 1.49 0.99 1.09 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 93 R 8.08 2.99 0.00 1.78 1.87 0.00 3.31 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 94 V 6.72 3.18 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 -0.13 0.00 0.00 0.82 0.00 0.00 95 F 7.11 4.47 0.00 3.18 3.19 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 96 D 8.18 4.61 0.00 2.90 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 97 K 8.51 3.98 0.00 1.80 1.92 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.54 7.81 98 E 9.26 4.52 0.00 2.08 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 2.24 2.27 0.00 99 G 9.05 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.24 3.91 0.00 3.09 2.87 0.00 0.00 7.37 7.97 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 0.00 101 G 9.99 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 0.00 102 T 7.66 5.01 4.27 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 1.18 0.00 0.00 103 V 9.09 4.66 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 1.03 0.00 0.00 1.15 0.00 0.00 104 M 8.86 4.61 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.58 0.00 105 G 9.65 3.88 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 0.00 0.00 0.00 106 A 7.86 4.01 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 0.00 107 E 8.01 3.77 0.00 2.13 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 0.00 2.25 2.32 0.00 108 I 7.73 3.59 1.88 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 1.80 1.18 0.93 0.00 0.00 109 R 7.76 3.93 0.00 1.90 2.00 0.00 3.16 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 110 H 8.04 4.31 0.00 3.17 3.47 0.00 5.59 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 0.00 111 V 8.06 3.28 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 0.85 0.00 0.00 0.13 0.00 0.00 112 L 7.46 4.23 0.00 1.82 1.67 0.90 0.73 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 0.00 113 V 7.72 4.53 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 1.15 0.00 0.00 1.03 0.00 0.00 114 T 7.44 4.48 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 1.18 0.00 0.00 115 L 8.22 4.75 0.00 1.68 1.60 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.09 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 0.00 117 E 8.62 4.30 0.00 1.95 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 2.27 2.25 0.00 118 K 7.54 4.10 0.00 1.62 1.76 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.18 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.62 7.81 119 M 9.42 5.46 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 120 T 8.36 4.64 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 0.00 121 E 8.94 3.92 0.00 2.18 2.27 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 2.37 2.36 0.00 122 E 8.25 3.93 0.00 2.00 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 2.41 2.37 0.00 123 E 8.03 4.01 0.00 2.22 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 2.33 2.35 0.00 124 V 8.11 3.58 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 0.81 0.00 0.00 1.04 0.00 0.00 125 E 8.73 3.92 0.00 2.14 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 2.31 2.40 0.00 126 Q 7.40 4.02 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 127 L 7.26 4.09 0.00 1.88 1.94 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 128 V 8.27 3.84 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 0.94 0.00 0.00 1.00 0.00 0.00 129 A 7.07 4.12 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 0.00 130 G 8.93 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 0.00 131 H 7.74 4.82 0.00 3.44 3.31 0.00 5.81 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 7.96 4.28 0.00 2.18 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 2.37 2.25 0.00 133 D 8.62 4.97 0.00 2.81 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 0.00 134 S 8.63 4.39 0.00 4.00 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 0.00 135 N 8.66 4.79 0.00 2.87 2.85 0.00 0.00 6.96 7.17 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 0.00 136 G 8.45 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 0.00 137 C 7.99 4.93 0.00 3.04 2.89 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 0.00 138 I 8.78 4.65 1.95 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 1.24 1.48 1.03 0.00 0.00 139 N 8.76 4.73 0.00 2.72 2.67 0.00 0.00 7.00 7.35 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 0.00 140 Y 7.83 4.42 0.00 3.33 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 0.00 141 E 7.96 4.22 0.00 2.16 2.29 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 2.11 2.31 0.00 142 E 8.77 4.13 0.00 2.03 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 2.35 2.48 0.00 143 L 7.48 3.98 0.00 1.82 1.96 0.90 0.86 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 0.00 144 V 8.19 3.71 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 1.21 0.00 0.00 1.11 0.00 0.00 145 R 8.23 4.08 0.00 2.12 2.00 0.00 3.05 0.00 0.00 2.71 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 146 M 8.26 4.04 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.73 0.00 147 V 7.59 3.84 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 0.82 0.00 0.00 1.15 0.00 0.00 148 L 7.76 4.21 0.00 1.94 1.74 1.22 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 149 S 8.22 4.57 0.00 3.89 3.84 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 0.00 150 G 7.57 3.76 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 0.00 0.00 0.00