NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8024 8.3549 109.7380 44.1680 0.0000 173.6146 3 R 3.7439 7.8900 116.8998 55.1068 27.4247 172.0921 4 E 4.2811 9.6497 122.6364 55.7179 32.3389 175.7506 5 L 4.7877 8.3987 127.2586 53.7773 42.9547 176.0946 6 S 4.5296 8.4995 117.2948 56.3350 66.9792 172.8044 7 F 5.4124 8.0163 118.0915 55.8413 43.1582 173.8064 8 F 5.0992 9.7367 121.3547 55.7409 42.3543 173.8364 9 L 4.7953 8.6864 123.3083 53.5220 43.8307 175.7901 10 Q 4.3289 9.3211 124.6966 57.7468 28.8967 176.3952 *14 A 4.1523 7.9842 121.7792 51.9111 20.7439 177.4341 15 G 3.9540 9.4811 106.0212 46.3565 0.0000 172.0411 16 F 4.9212 6.6908 112.1705 56.6578 40.1879 172.9757 17 F 4.8435 9.7004 117.0837 55.5371 42.7277 174.1752 18 L 4.9779 8.7527 124.2583 53.3747 43.7860 175.4172 19 G 4.1982 9.1606 114.3949 44.7879 0.0000 171.7613 20 M 4.8121 8.4286 123.7761 53.7630 34.2473 175.3390 21 D 4.2636 9.1609 127.5992 54.7562 39.3028 173.8399 22 A 4.2409 7.2371 118.3398 51.6568 19.2082 176.9020 23 P 4.2912 0.0000 0.0000 62.0267 32.1190 175.7741 24 A 4.0393 8.5310 124.1522 54.2358 18.4781 178.1795 25 G 3.9519 8.9418 109.2028 45.6286 0.0000 174.0945 26 S 4.3126 7.6707 115.5811 59.0602 63.3464 173.3805 27 S 4.8987 7.9577 115.5790 57.3401 66.2684 173.1724 28 V 4.0892 8.5384 119.7574 60.8721 34.0882 173.8472 29 A 4.8537 8.3630 129.7049 50.7884 20.1305 176.5886 30 C 4.3104 9.1437 123.9808 59.7150 33.4315 173.6293 31 G 4.1986 8.6345 118.3700 45.8317 0.0000 173.4710 32 S 4.6511 8.4168 109.8925 56.7840 61.2255 173.5070 33 E 4.6350 8.1000 122.8156 54.6363 31.7918 175.5325 34 V 4.7324 8.2023 121.5913 61.3452 33.3262 174.6242 35 L 4.7958 9.3293 129.1353 53.4828 43.5391 176.0932 36 R 5.1751 8.5353 121.4341 53.8510 33.2786 175.6822 37 A 3.3159 8.4831 122.7764 52.1328 18.6019 178.1424 38 V 3.8952 8.1975 117.2612 60.6054 32.3341 174.8196 39 P 4.5051 0.0000 0.0000 62.4694 32.4546 175.8212 40 V 3.9512 8.1084 120.4422 61.6419 32.5651 177.5328 41 G 2.0000 7.0530 115.2365 44.8607 0.0000 172.0274 *44 D 4.6958 8.7409 116.8499 54.4331 42.5802 177.9829 45 A 3.8843 8.0615 119.3517 54.8941 18.7471 178.2381 46 A 4.0591 7.9329 117.4007 53.6435 19.3208 179.4846 47 K 3.7592 8.1383 116.5327 59.4311 32.2649 179.2127 48 E 3.8301 8.1657 117.8005 59.1315 29.4014 178.6043 49 K 4.0664 7.5877 114.3319 56.8534 32.7016 176.7174 50 H 4.5178 6.8609 112.2748 54.6247 30.9771 174.1790 51 I 4.1014 7.5560 121.8030 60.2055 37.6163 174.1171 52 P 4.6825 0.0000 0.0000 62.9259 32.6460 175.1535 53 V 4.4272 8.9536 124.4117 61.4202 33.2780 174.3513 54 V 4.8191 8.3812 127.6124 61.3365 33.4976 174.7007 55 E 4.5864 9.1605 126.4326 54.8244 32.9466 174.4918 56 V 4.6508 8.4579 124.9204 61.6966 33.4927 174.9107 57 H 4.7711 8.9701 126.7374 55.1501 32.9985 173.7019 58 G 3.6620 8.3735 118.0752 47.5512 0.0000 173.1358 59 H 4.9444 8.7601 121.7853 55.0523 29.0163 172.8956 60 E 5.2761 8.1554 119.7062 54.5590 32.8836 175.3675 61 V 4.7232 8.9958 122.5976 61.2162 34.7492 173.9282 62 K 4.9393 9.1382 130.4165 55.0921 34.2085 175.0688 63 V 4.9518 9.1094 127.5486 61.1207 34.1377 174.1439 64 K 4.9807 9.1924 127.5479 54.5559 35.4581 175.3084 65 V 4.2396 8.5780 125.1852 64.5189 33.1852 175.5339 66 G 4.8373 8.0683 115.8455 46.2433 0.0000 172.6180 67 S 4.2076 8.5754 121.5773 60.0552 63.4477 175.0886 68 V 4.5924 7.1036 112.3094 58.5327 35.4155 175.3309 69 A 4.4498 8.4559 124.8434 52.5137 18.6413 177.1136 70 H 4.2046 8.7057 123.0915 54.9344 30.9358 173.3377 71 P 4.1632 0.0000 0.0000 63.5902 32.2568 175.5441 72 M 4.9759 8.5545 122.5346 53.1759 32.1177 174.3944 73 T 4.7885 8.7344 112.3589 58.4936 72.3766 174.4828 74 P 4.0920 0.0000 0.0000 65.2657 31.4629 177.6988 75 E 4.3366 7.6841 116.3311 57.8939 30.1511 175.7648 76 H 5.0664 8.4403 118.8646 55.2651 32.7877 171.8049 77 Y 5.4834 8.4177 123.1134 55.8683 41.9194 173.8565 78 I 4.1852 8.2497 121.4273 60.7775 37.5323 175.9867 79 A 4.4630 9.1032 131.7782 54.6065 19.0402 176.6934 80 W 5.5150 7.0230 110.0958 55.8847 31.6261 173.5722 81 V 5.2358 9.2470 120.1549 61.4585 34.4887 173.5674 82 C 5.5063 9.9573 127.8726 57.5603 34.6030 171.9642 83 L 5.0433 8.7307 127.6838 53.1120 44.4116 174.6240 84 K 4.8814 9.3626 128.6284 55.2839 34.0306 175.2643 85 T 5.1908 8.6644 117.0783 59.5777 71.5740 174.2871 86 R 4.0560 9.0337 120.8913 59.0750 30.0093 178.5682 87 K 4.3082 8.1882 115.1275 56.9696 33.3219 176.9038 88 G 4.0569 7.1361 105.8904 45.5354 0.0000 171.9034 89 I 5.2030 8.3033 112.6053 59.5149 40.9873 174.8252 90 Q 4.7763 9.0668 121.2725 54.4886 33.5591 173.8513 91 L 5.3881 8.5566 122.4154 53.7626 45.5508 175.2646 92 K 4.8468 9.5076 124.8414 54.5828 35.7600 175.6784 93 E 4.9326 9.1102 124.0288 56.4515 30.5606 175.9749 94 L 4.6665 8.6164 123.3410 52.4346 43.4895 175.1180 95 P 4.2899 0.0000 0.0000 62.6056 31.7546 177.9076 96 V 3.6131 8.4494 123.2377 64.0737 31.4789 176.4750 97 D 4.7528 8.0738 118.0661 52.8368 39.7562 176.3789 98 G 4.1676 7.5868 110.1414 44.5639 0.0000 173.5140 99 A 4.3845 8.2453 122.6136 50.8334 20.5265 176.1470 100 P 4.8351 0.0000 0.0000 61.3289 29.5952 174.9428 101 E 5.3283 7.6404 116.3670 56.2090 33.2222 176.3296 102 V 4.4919 8.5596 119.1250 61.0464 35.1411 172.8314 103 T 5.1191 8.1907 117.8391 61.8998 71.4451 173.4091 104 F 5.0612 9.4789 123.0193 55.6799 42.7413 174.0283 105 A 5.3392 8.7586 122.3119 50.3374 21.1844 175.8848 106 L 4.9814 9.0859 121.5354 52.8207 44.9896 176.9831 107 T 4.0997 8.3637 111.1774 60.9686 69.7048 175.5069 108 A 3.5798 8.3584 125.3001 54.6381 18.4172 178.2090 109 D 4.6211 7.9211 112.9420 53.4602 40.2235 175.6539 110 D 4.9782 7.7174 119.5748 52.9039 43.3621 175.2448 111 Q 4.6323 8.0392 121.3223 53.8259 32.8922 174.9464 112 V 4.0543 8.3054 120.8694 62.2623 31.9310 175.0858 113 L 4.6423 8.5537 121.7812 56.0961 43.8386 176.4958 114 E 4.7009 7.8199 116.3414 55.0535 32.9938 173.5300 115 A 5.3245 8.7839 127.0870 50.4213 22.7266 174.8229 116 Y 5.3872 9.2513 117.3078 56.2365 42.5507 174.3866 117 E 5.0304 9.4385 120.9516 54.4294 33.6253 174.1021 118 F 4.5100 7.5773 124.3122 56.4504 41.5293 173.5354 119 C 4.5221 8.1245 127.3289 57.4929 32.5819 174.4464 120 N 3.7242 7.7589 123.3951 54.7988 37.0992 175.9263 121 L 4.2294 7.4103 117.1699 55.4985 42.7688 176.6365 122 H 4.7002 7.9239 112.2331 54.7354 30.2935 175.7875 123 G 3.8453 7.7479 108.8891 44.7413 0.0000 172.3622 124 V 4.6299 7.9782 118.2282 61.8831 33.5130 176.4061 125 W 5.4010 9.1810 125.8955 54.9115 33.2701 174.2819 126 S 5.1673 8.9331 117.8508 56.8871 65.2714 173.2347 127 G 4.4031 9.0973 107.7567 45.1704 0.0000 173.2807 128 K 4.2612 8.3653 118.6915 56.7510 32.7965 176.0814 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 G 8.35 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 3 R 7.89 3.74 0.00 1.98 1.92 0.00 3.26 0.00 0.00 2.73 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 4 E 9.65 4.28 0.00 2.04 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 2.28 2.31 0.00 5 L 8.40 4.79 0.00 1.07 0.72 0.66 0.70 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 6 S 8.50 4.53 0.00 3.40 3.75 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 7 F 8.02 5.41 0.00 3.02 3.02 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 8 F 9.74 5.10 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 9 L 8.69 4.80 0.00 1.49 1.49 0.04 0.93 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 10 Q 9.32 4.33 0.00 2.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.08 0.00 0.00 0.00 0.00 0.00 2.69 2.49 0.00 *14 A 7.98 4.15 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 15 G 9.48 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 16 F 6.69 4.92 0.00 3.22 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 17 F 9.70 4.84 0.00 2.99 2.92 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 18 L 8.75 4.98 0.00 1.64 1.51 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.16 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 0.00 0.00 0.00 0.00 20 M 8.43 4.81 0.00 2.08 1.86 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.56 0.00 21 D 9.16 4.26 0.00 2.84 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 22 A 7.24 4.24 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 23 P 0.00 4.29 0.00 2.18 1.98 0.00 3.62 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 24 A 8.53 4.04 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 25 G 8.94 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 26 S 7.67 4.31 0.00 4.05 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 27 S 7.96 4.90 0.00 3.93 3.82 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 28 V 8.54 4.09 1.62 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 -0.15 0.00 0.00 -0.01 0.00 0.00 29 A 8.36 4.85 1.17 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 0.00 0.00 30 C 9.14 4.31 0.00 3.01 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 31 G 8.63 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 0.00 0.00 0.00 0.00 32 S 8.42 4.65 0.00 3.83 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 33 E 8.10 4.63 0.00 2.24 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 2.30 2.27 0.00 34 V 8.20 4.73 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 0.81 0.00 0.00 0.92 0.00 0.00 35 L 9.33 4.80 0.00 1.71 1.76 1.16 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.54 5.18 0.00 1.70 1.86 0.00 3.42 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 37 A 8.48 3.32 0.91 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 0.00 0.00 38 V 8.20 3.90 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 0.71 0.00 0.00 1.03 0.00 0.00 39 P 0.00 4.51 0.00 1.95 1.98 0.00 3.72 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.89 0.00 40 V 8.11 3.95 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 0.71 0.00 0.00 1.07 0.00 0.00 41 G 7.05 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 0.00 0.00 0.00 0.00 0.00 0.00 *44 D 8.74 4.70 0.00 2.77 2.78 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 45 A 8.06 3.88 1.28 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 0.00 0.00 0.00 46 A 7.93 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.14 3.76 0.00 2.01 1.82 0.00 1.87 0.00 0.00 1.84 0.00 0.00 3.17 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.51 1.53 7.81 48 E 8.17 3.83 0.00 1.92 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 0.00 2.34 2.28 0.00 49 K 7.59 4.07 0.00 1.45 1.48 0.00 1.56 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.20 1.29 7.81 50 H 6.86 4.52 0.00 1.48 1.64 0.00 5.81 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.56 4.10 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.94 0.93 0.00 0.00 52 P 0.00 4.68 0.00 2.12 2.21 0.00 3.83 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.99 0.00 53 V 8.95 4.43 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 0.99 0.00 0.00 0.91 0.00 0.00 54 V 8.38 4.82 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 0.90 0.00 0.00 0.94 0.00 0.00 55 E 9.16 4.59 0.00 1.94 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 2.23 2.24 0.00 56 V 8.46 4.65 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 0.79 0.00 0.00 0.97 0.00 0.00 57 H 8.97 4.77 0.00 3.10 3.11 0.00 5.78 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 8.37 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 59 H 8.76 4.94 0.00 3.17 3.57 0.00 5.59 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.16 5.28 0.00 1.96 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 2.27 2.24 0.00 61 V 9.00 4.72 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 1.07 0.00 0.00 1.00 0.00 0.00 62 K 9.14 4.94 0.00 1.91 1.69 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.39 7.81 63 V 9.11 4.95 2.31 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 1.02 0.00 0.00 1.19 0.00 0.00 64 K 9.19 4.98 0.00 1.68 1.64 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.35 7.81 65 V 8.58 4.24 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 0.86 0.00 0.00 0.90 0.00 0.00 66 G 8.07 4.84 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 0.00 0.00 0.00 67 S 8.58 4.21 0.00 3.95 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 68 V 7.10 4.59 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 0.63 0.00 0.00 0.86 0.00 0.00 69 A 8.46 4.45 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 70 H 8.71 4.20 0.00 3.17 3.04 0.00 5.78 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 71 P 0.00 4.16 0.00 1.81 1.89 0.00 2.67 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.99 0.00 72 M 8.55 4.98 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.60 0.00 73 T 8.73 4.79 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 1.23 0.00 0.00 74 P 0.00 4.09 0.00 2.09 2.15 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 75 E 7.68 4.34 0.00 1.83 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 2.33 2.32 0.00 76 H 8.44 5.07 0.00 3.16 3.12 0.00 5.60 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 8.42 5.48 0.00 3.08 3.18 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 78 I 8.25 4.19 1.81 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.63 0.84 0.00 0.00 79 A 9.10 4.46 1.50 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 80 W 7.02 5.51 0.00 3.56 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 81 V 9.25 5.24 2.47 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 1.36 0.00 0.00 1.07 0.00 0.00 82 C 9.96 5.51 0.00 3.18 3.18 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 83 L 8.73 5.04 0.00 0.63 0.93 0.81 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 84 K 9.36 4.88 0.00 2.05 1.87 0.00 1.67 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.42 7.81 85 T 8.66 5.19 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 1.18 0.00 0.00 86 R 9.03 4.06 0.00 1.92 2.05 0.00 3.16 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 1.68 1.76 0.00 87 K 8.19 4.31 0.00 1.92 1.85 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.59 1.67 7.81 88 G 7.14 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 89 I 8.30 5.20 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.76 0.90 0.00 0.00 90 Q 9.07 4.78 0.00 1.76 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.26 0.00 91 L 8.56 5.39 0.00 1.65 1.53 0.36 0.62 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 92 K 9.51 4.85 0.00 1.69 1.64 0.00 0.98 0.00 0.00 1.39 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.53 7.81 93 E 9.11 4.93 0.00 1.98 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 2.63 2.55 0.00 94 L 8.62 4.67 0.00 1.72 1.63 1.02 1.37 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 95 P 0.00 4.29 0.00 2.17 1.98 0.00 3.60 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 2.11 2.08 0.00 96 V 8.45 3.61 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 0.63 0.00 0.00 0.65 0.00 0.00 97 D 8.07 4.75 0.00 2.78 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 98 G 7.59 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 0.00 0.00 0.00 0.00 99 A 8.25 4.38 1.23 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 0.00 100 P 0.00 4.84 0.00 2.24 2.31 0.00 3.68 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 2.03 2.08 0.00 101 E 7.64 5.33 0.00 2.01 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 0.00 2.17 2.30 0.00 102 V 8.56 4.49 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 0.57 0.00 0.00 0.70 0.00 0.00 103 T 8.19 5.12 4.18 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 1.32 0.00 0.00 104 F 9.48 5.06 0.00 3.01 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 0.00 105 A 8.76 5.34 1.26 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 0.00 106 L 9.09 4.98 0.00 1.61 1.56 0.99 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.36 4.10 4.29 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 1.21 0.00 0.00 108 A 8.36 3.58 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 0.00 109 D 7.92 4.62 0.00 2.78 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 0.00 110 D 7.72 4.98 0.00 2.64 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 0.00 111 Q 8.04 4.63 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 112 V 8.31 4.05 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 0.71 0.00 0.00 0.92 0.00 0.00 113 L 8.55 4.64 0.00 1.70 1.75 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 114 E 7.82 4.70 0.00 1.99 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 1.47 2.13 0.00 115 A 8.78 5.32 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 0.00 116 Y 9.25 5.39 0.00 3.10 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 0.00 117 E 9.44 5.03 0.00 1.92 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 2.18 2.47 0.00 118 F 7.58 4.51 0.00 1.51 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 0.00 119 C 8.12 4.52 0.00 2.78 2.60 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 0.00 120 N 7.76 3.72 0.00 2.52 1.68 0.00 0.00 6.92 7.82 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 0.00 121 L 7.41 4.23 0.00 1.37 1.44 0.68 0.90 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 0.00 122 H 7.92 4.70 0.00 2.99 3.41 0.00 5.95 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 0.00 123 G 7.75 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 0.00 124 V 7.98 4.63 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 0.78 0.00 0.00 0.90 0.00 0.00 125 W 9.18 5.40 0.00 3.45 3.07 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 0.00 126 S 8.93 5.17 0.00 3.63 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 0.00 127 G 9.10 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 0.00 0.00 0.00 0.00 128 K 8.37 4.26 0.00 1.81 1.71 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.37 7.81 * Residues marked with a * may have inaccurate shift predictions.