NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4730 8.3049 120.3241 55.0940 33.7855 175.2648 2 T 3.8713 7.8284 115.8549 63.5200 68.9292 173.3521 3 T 4.1900 8.8278 122.2346 62.5155 70.8406 173.9710 4 F 2.7070 7.2148 119.1600 56.4292 35.9938 175.7445 5 R 4.7131 7.2866 127.2914 54.1446 33.9073 174.7183 6 F 5.2905 8.6922 119.7112 55.2216 42.7296 175.6447 7 C 3.5231 8.9294 121.6180 57.2962 43.6685 175.0372 8 R 3.6683 7.3159 126.1229 59.3313 30.0244 177.2897 9 D 4.4769 7.6350 117.0640 57.0444 40.2805 176.4987 10 C 4.3520 7.9841 112.6451 55.7592 42.4392 173.5793 11 N 4.4187 7.7720 117.4600 54.6210 37.5764 173.1607 12 N 5.1121 7.3322 113.1245 51.2588 41.3867 174.2740 13 M 4.2663 8.5593 119.7878 55.5955 33.1795 175.0523 14 L 4.9992 7.6559 122.9930 53.4145 43.9550 175.6875 15 Y 5.0026 8.8057 119.1830 55.5514 41.7056 173.5555 16 P 4.3008 0.0000 0.0000 62.7608 32.5364 176.0886 17 R 4.5825 8.3698 120.6966 54.8793 35.0696 173.6400 18 E 4.3717 8.5972 124.5340 55.1916 30.9956 176.3164 19 D 4.5619 9.4107 127.4106 52.9828 39.6613 176.1181 20 K 3.8612 8.5121 124.5264 59.3255 32.5630 178.3007 21 E 4.1280 8.3760 116.5809 58.7376 29.6491 177.1800 22 N 4.7073 8.0112 111.7770 52.1056 39.9174 174.1599 23 N 4.1728 7.8073 114.6489 54.2717 36.4147 173.3108 24 R 4.7239 7.0274 116.1773 54.3146 36.1489 175.6583 25 L 4.4875 8.3936 123.1431 54.3805 43.3490 175.3312 26 L 5.0832 8.5770 126.3332 53.0335 45.2950 175.4449 27 F 5.3137 8.9916 120.9462 56.1661 40.7331 175.3020 28 E 5.1584 9.3164 122.5442 55.0319 32.5408 174.3419 29 C 5.1528 8.7508 120.5765 58.1516 33.3095 173.6279 30 R 4.5466 8.9221 121.7568 56.5430 30.2215 177.0043 31 T 4.4295 7.9620 114.9932 63.9943 70.3712 173.3428 32 C 5.0657 7.8927 116.6952 58.2411 31.3776 173.7141 33 S 4.8028 8.4379 114.7807 58.7655 63.2665 173.8636 34 Y 4.3867 7.9041 122.0459 58.1125 39.6300 174.8864 35 V 5.3207 7.6567 117.0190 59.8124 36.2234 173.7596 36 E 4.7948 8.3477 118.9139 55.0128 32.7093 174.1742 37 E 4.5673 8.7299 119.2490 56.0864 31.0588 175.7734 38 A 4.4719 8.9078 124.4825 51.6150 18.9765 178.0769 39 G 3.6369 9.1663 112.5492 48.0175 0.0000 173.2828 40 S 4.8256 7.7906 112.0747 55.3982 65.8545 171.5763 41 P 4.5125 0.0000 0.0000 62.5688 31.6142 175.4398 42 L 4.1163 7.6172 121.8128 55.2372 41.2420 176.3256 43 V 4.1429 8.1917 125.8949 63.5946 32.3010 175.1832 44 Y 4.7013 7.3793 117.5661 57.0546 41.4708 173.1097 45 R 4.2774 7.8813 126.1296 54.5716 33.2499 173.7370 46 H 4.5278 8.3151 122.9653 54.3174 31.4950 172.3918 47 E 4.3515 8.6701 127.5441 55.2005 29.6935 176.8871 48 L 4.0222 8.4762 125.0034 56.5020 42.0455 176.9420 49 I 4.3077 7.6148 118.6976 59.7873 37.7889 174.3817 50 T 4.6643 8.2366 119.1391 60.3019 70.0019 173.5741 51 N 4.8092 8.3918 121.6304 53.0545 39.7935 175.0439 52 I 3.8609 7.3231 120.6866 63.0942 37.3808 176.2522 53 G 3.9925 9.0248 113.5683 45.1364 0.0000 174.6309 54 E 3.8926 8.2184 120.3082 59.0274 29.3759 178.5982 55 T 4.3078 7.5751 112.1447 62.6641 69.3260 174.0509 56 A 3.9553 6.9907 124.1531 54.1384 18.6350 178.1506 57 G 3.7022 8.9262 110.0015 45.0188 0.0000 173.2700 58 V 3.9508 6.9778 119.6637 61.5697 31.7326 175.4547 59 V 4.5054 7.8650 126.0107 60.5356 34.8084 175.5117 60 Q 3.9170 8.8619 125.7879 59.4439 28.8271 177.6433 61 D 4.8607 7.8982 115.6528 54.1248 41.2369 178.0379 62 I 3.6374 8.0539 123.5945 63.8334 37.9699 177.8380 63 G 3.8097 7.9523 107.5110 46.9594 0.0000 174.2885 64 S 4.2777 7.7083 113.1650 58.6299 63.5601 173.8100 65 D 4.5685 7.8159 122.9081 52.5607 40.0685 174.9652 66 P 4.4356 0.0000 0.0000 64.8183 31.5884 177.3845 67 T 4.1323 8.3000 108.7605 62.4113 69.2374 174.6475 68 L 4.3465 7.3554 122.8704 52.9699 43.0476 174.7280 69 P 4.4382 0.0000 0.0000 62.8518 32.7409 175.0157 70 R 5.4918 8.6994 118.6490 53.6719 32.9791 174.8823 71 S 4.9995 8.8315 115.4983 56.5205 67.1856 173.6113 72 D 4.8460 8.5237 116.2034 53.0698 39.6575 176.8681 73 R 3.9886 7.5081 118.0615 56.9324 30.6076 175.1686 74 E 5.5905 8.4993 119.6887 53.7547 32.1490 174.4227 75 C 3.6366 8.1370 118.5165 53.2924 43.1537 172.7048 76 P 3.8610 0.0000 0.0000 65.2612 30.8490 177.0525 77 K 4.0915 7.4021 117.6863 58.1398 32.9471 176.2210 78 C 4.2849 7.7891 112.5090 56.0319 42.3679 174.1416 79 H 3.8770 7.2536 113.6839 56.0889 27.2683 174.6619 80 S 4.2622 7.4241 114.4951 58.4556 63.4383 174.2101 81 R 5.4502 8.1998 122.2651 55.3168 30.5270 176.3512 82 E 4.6382 8.1286 119.9587 54.9637 31.2928 175.8245 83 N 5.8159 8.6163 122.4563 51.2292 42.7944 174.1276 84 V 4.8762 8.7258 120.3461 60.1507 34.7091 174.4877 85 F 5.5742 8.6767 115.8939 54.7674 41.0454 173.2546 86 F 4.9866 7.4654 113.8405 55.7296 41.6337 173.3039 87 Q 4.9668 8.7013 118.3034 54.2175 30.0385 175.9341 88 S 4.0815 8.9623 114.7998 59.7300 62.2657 174.2260 89 Q 4.2948 8.6106 124.9488 56.1170 29.0622 176.1614 90 Q 4.2353 7.4404 117.5923 56.3660 29.2933 177.0209 91 R 4.5467 8.0818 117.7949 53.9333 30.7267 174.4217 92 R 4.7336 7.7423 119.8747 53.7494 33.1543 176.0403 93 K 4.1515 8.7305 122.4874 58.6848 32.2361 177.7007 94 D 4.9042 7.8094 114.8138 52.8705 39.9701 176.3199 95 T 3.9751 7.8270 116.6613 64.0334 68.9006 174.0309 96 S 4.5082 8.4393 119.3439 58.5957 64.1275 173.4605 97 M 4.5674 8.2563 117.5385 55.0435 32.1793 177.0314 98 V 3.7567 7.4094 119.0698 62.0882 32.9124 174.7525 99 L 4.6982 8.2675 121.8705 53.2056 44.1622 175.3915 100 F 4.6016 8.7334 121.9501 55.4871 41.5564 174.5205 101 F 4.8824 8.6888 122.5244 55.4598 42.0118 175.0967 102 V 4.6392 8.5145 121.3904 60.9370 34.3823 174.2845 103 C 4.7562 9.4540 130.2547 60.1174 32.0257 173.7367 104 L 4.5346 8.9357 125.6043 55.4204 41.6011 177.8289 105 S 4.4727 8.2722 115.0330 59.9974 63.5561 174.6298 106 C 4.6381 7.9747 111.1945 56.8580 30.5643 173.7507 107 S 4.1058 8.2030 112.6419 58.5117 61.5697 171.2919 108 H 4.6178 8.1415 120.0908 56.9708 30.9146 173.6619 109 I 5.0617 8.2791 126.0035 59.9335 38.8995 174.7420 110 F 5.1969 8.7388 120.3620 55.8657 41.9529 173.1776 111 T 5.3266 8.8044 115.0213 60.5678 70.9852 174.9681 112 S 4.3431 8.7980 117.1342 59.5114 63.5211 173.8595 113 D 4.4522 7.8986 120.6117 54.0088 40.0211 175.8439 114 Q 4.1654 8.6014 126.5640 57.9968 29.0768 177.3234 115 K 4.4497 7.5129 117.9026 55.5799 32.4231 176.6112 116 N 4.3430 8.1589 117.9390 54.1740 38.8673 173.9724 117 K 4.1580 8.6055 126.1465 58.5465 32.8540 178.3732 118 R 3.7084 7.9897 116.6543 57.4105 30.3619 176.2513 119 T 3.9854 8.4999 119.7244 66.1682 68.6415 175.2590 120 Q 4.1515 7.4276 119.5564 56.1224 30.2335 175.1040 121 F 4.3331 7.7601 120.8227 57.7067 38.3220 174.6732 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 4.47 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 2 T 7.83 3.87 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 1.15 0.00 0.00 3 T 8.83 4.19 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 1.27 0.00 0.00 4 F 7.21 2.71 0.00 3.19 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 5 R 7.29 4.71 0.00 1.17 1.57 0.00 2.98 0.00 0.00 3.33 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.25 0.00 6 F 8.69 5.29 0.00 2.87 3.01 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 7 C 8.93 3.52 0.00 3.12 3.01 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 8 R 7.32 3.67 0.00 1.74 1.61 0.00 3.35 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 9 D 7.64 4.48 0.00 2.68 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 10 C 7.98 4.35 0.00 3.13 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 11 N 7.77 4.42 0.00 2.79 2.85 0.00 0.00 7.11 7.92 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 12 N 7.33 5.11 0.00 2.98 2.83 0.00 0.00 6.70 7.54 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 13 M 8.56 4.27 0.00 1.59 1.88 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.03 0.00 14 L 7.66 5.00 0.00 1.43 1.68 1.07 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.81 5.00 0.00 2.96 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 16 P 0.00 4.30 0.00 1.78 1.48 0.00 3.76 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.20 0.00 17 R 8.37 4.58 0.00 1.61 1.70 0.00 3.24 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.89 0.00 18 E 8.60 4.37 0.00 1.92 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 2.21 2.26 0.00 19 D 9.41 4.56 0.00 2.67 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 20 K 8.51 3.86 0.00 1.76 1.88 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.48 7.81 21 E 8.38 4.13 0.00 2.11 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 2.29 2.31 0.00 22 N 8.01 4.71 0.00 2.90 2.80 0.00 0.00 6.97 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 N 7.81 4.17 0.00 2.82 2.82 0.00 0.00 6.66 8.70 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 24 R 7.03 4.72 0.00 1.67 1.72 0.00 3.10 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 25 L 8.39 4.49 0.00 1.70 1.50 0.74 0.38 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 26 L 8.58 5.08 0.00 1.61 1.48 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.99 5.31 0.00 3.05 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 28 E 9.32 5.16 0.00 2.08 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 0.00 2.28 2.35 0.00 29 C 8.75 5.15 0.00 3.21 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 30 R 8.92 4.55 0.00 1.95 1.95 0.00 2.61 0.00 0.00 3.02 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 31 T 7.96 4.43 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 32 C 7.89 5.07 0.00 3.17 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 33 S 8.44 4.80 0.00 3.86 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 34 Y 7.90 4.39 0.00 3.05 2.74 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 35 V 7.66 5.32 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 0.99 0.00 0.00 0.78 0.00 0.00 36 E 8.35 4.79 0.00 2.00 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 2.39 2.42 0.00 37 E 8.73 4.57 0.00 2.01 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 2.29 2.35 0.00 38 A 8.91 4.47 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 39 G 9.17 3.64 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 0.00 40 S 7.79 4.83 0.00 3.96 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 41 P 0.00 4.51 0.00 2.20 2.20 0.00 3.79 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 1.94 1.95 0.00 42 L 7.62 4.12 0.00 1.61 1.68 1.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.19 4.14 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 0.89 0.00 0.00 1.05 0.00 0.00 44 Y 7.38 4.70 0.00 2.83 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 45 R 7.88 4.28 0.00 1.58 1.50 0.00 3.24 0.00 0.00 3.12 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.55 0.00 46 H 8.32 4.53 0.00 2.89 3.13 0.00 5.97 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.67 4.35 0.00 1.99 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 2.25 2.29 0.00 48 L 8.48 4.02 0.00 1.61 1.70 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.61 4.31 1.88 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 1.31 0.60 0.93 0.00 0.00 50 T 8.24 4.66 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 51 N 8.39 4.81 0.00 2.89 3.03 0.00 0.00 6.94 6.91 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 52 I 7.32 3.86 1.87 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 1.24 0.74 0.91 0.00 0.00 53 G 9.02 3.99 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 0.00 0.00 0.00 54 E 8.22 3.89 0.00 2.08 1.42 0.00 0.00 0.00 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 2.30 0.00 55 T 7.58 4.31 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 1.26 0.00 0.00 56 A 6.99 3.96 1.24 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 0.00 0.00 57 G 8.93 3.70 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 0.00 0.00 0.00 58 V 6.98 3.95 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 0.82 0.00 0.00 1.15 0.00 0.00 59 V 7.87 4.51 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 1.03 0.00 0.00 0.90 0.00 0.00 60 Q 8.86 3.92 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.32 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 61 D 7.90 4.86 0.00 2.76 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 62 I 8.05 3.64 1.95 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 1.29 1.33 1.00 0.00 0.00 63 G 7.95 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 64 S 7.71 4.28 0.00 3.93 3.98 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 65 D 7.82 4.57 0.00 2.61 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 66 P 0.00 4.44 0.00 2.20 2.15 0.00 3.79 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 67 T 8.30 4.13 4.19 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 1.18 0.00 0.00 68 L 7.36 4.35 0.00 1.81 1.56 0.93 0.75 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 69 P 0.00 4.44 0.00 1.45 1.86 0.00 3.37 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.19 0.00 70 R 8.70 5.49 0.00 1.74 2.04 0.00 3.22 0.00 0.00 2.25 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.43 0.00 71 S 8.83 5.00 0.00 3.92 4.08 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 72 D 8.52 4.85 0.00 2.82 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 73 R 7.51 3.99 0.00 1.70 1.75 0.00 2.21 0.00 0.00 2.81 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.38 0.00 74 E 8.50 5.59 0.00 1.85 1.72 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 2.11 2.33 0.00 75 C 8.14 3.64 0.00 2.63 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 3.86 0.00 1.88 2.07 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.85 0.00 77 K 7.40 4.09 0.00 1.51 1.67 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.25 7.81 78 C 7.79 4.28 0.00 3.11 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 79 H 7.25 3.88 0.00 3.41 3.42 0.00 5.68 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.42 4.26 0.00 3.86 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.20 5.45 0.00 1.71 2.12 0.00 3.27 0.00 0.00 3.89 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.47 0.00 82 E 8.13 4.64 0.00 1.73 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 2.26 2.43 0.00 83 N 8.62 5.82 0.00 3.02 2.90 0.00 0.00 6.33 7.56 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 84 V 8.73 4.88 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 0.84 0.00 0.00 0.96 0.00 0.00 85 F 8.68 5.57 0.00 1.93 2.42 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.47 4.99 0.00 3.06 3.01 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 87 Q 8.70 4.97 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.85 0.00 0.00 0.00 0.00 0.00 2.54 2.27 0.00 88 S 8.96 4.08 0.00 4.08 3.91 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 0.00 0.00 0.00 89 Q 8.61 4.29 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.69 0.00 0.00 0.00 0.00 0.00 2.19 2.39 0.00 90 Q 7.44 4.24 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 7.11 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 91 R 8.08 4.55 0.00 1.73 1.81 0.00 3.30 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.50 0.00 92 R 7.74 4.73 0.00 1.74 1.87 0.00 3.26 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 93 K 8.73 4.15 0.00 1.80 1.87 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.44 7.81 94 D 7.81 4.90 0.00 2.76 2.74 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 95 T 7.83 3.98 4.45 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 1.26 0.00 0.00 96 S 8.44 4.51 0.00 4.00 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 97 M 8.26 4.57 0.00 2.03 2.11 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 2.54 2.52 0.00 98 V 7.41 3.76 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 0.59 0.00 0.00 0.68 0.00 0.00 99 L 8.27 4.70 0.00 1.10 0.68 0.32 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.73 4.60 0.00 1.75 2.23 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 0.00 101 F 8.69 4.88 0.00 1.51 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 0.00 0.00 0.00 102 V 8.51 4.64 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 1.10 0.00 0.00 1.08 0.00 0.00 103 C 9.45 4.76 0.00 3.35 3.12 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 0.00 104 L 8.94 4.53 0.00 1.76 1.73 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.27 4.47 0.00 3.88 3.93 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 0.00 106 C 7.97 4.64 0.00 3.07 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 0.00 107 S 8.20 4.11 0.00 4.21 4.10 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 0.00 108 H 8.14 4.62 0.00 3.36 3.33 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 8.28 5.06 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.61 0.50 0.00 0.00 110 F 8.74 5.20 0.00 3.13 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 0.00 111 T 8.80 5.33 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 0.78 0.00 0.00 112 S 8.80 4.34 0.00 3.92 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 0.00 113 D 7.90 4.45 0.00 2.56 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 0.00 114 Q 8.60 4.17 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 7.33 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 115 K 7.51 4.45 0.00 1.72 1.82 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.36 7.81 116 N 8.16 4.34 0.00 2.88 2.80 0.00 0.00 7.26 6.68 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 0.00 117 K 8.61 4.16 0.00 1.77 1.84 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.42 1.51 7.81 118 R 7.99 3.71 0.00 1.57 1.42 0.00 3.79 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 119 T 8.50 3.99 4.19 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 1.19 0.00 0.00 120 Q 7.43 4.15 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 5.58 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 121 F 7.76 4.33 0.00 3.20 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00