NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 S 4.4172 8.1776 115.4014 58.3385 64.6342 175.2336 15 S 3.9351 8.6178 118.4869 60.5011 63.4919 174.7515 16 H 4.1257 8.8681 120.8608 58.3718 28.8792 178.9823 17 R 3.5888 7.6364 119.4984 59.0693 29.9072 178.7358 18 L 3.4594 7.4345 118.4653 57.6953 41.5806 179.5269 19 A 3.9115 7.6065 120.3176 54.8198 18.1835 179.5133 20 L 3.7973 7.3400 118.6658 58.5477 42.2968 178.4237 21 Y 4.2058 7.7906 116.9534 61.3213 37.7419 179.0184 22 R 4.1189 8.0778 119.2756 59.6845 30.0867 178.3398 23 N 4.4176 8.1142 116.2355 56.4229 38.5604 177.5369 24 Q 4.0467 8.9150 119.6389 58.9179 28.7560 178.6018 25 A 4.1393 8.7795 122.1709 55.0126 18.4228 179.7816 26 K 3.9381 8.2439 116.9587 59.9617 32.1537 179.7857 27 S 4.2429 7.8901 115.3989 61.4581 62.6409 176.5784 28 L 4.0054 8.1425 123.1462 58.2003 41.6376 179.0930 29 L 4.0376 8.0570 118.1917 57.9364 41.5531 179.3757 30 T 3.9958 7.7130 115.2528 66.7947 68.6629 176.3221 31 H 4.5543 8.2912 117.0553 56.6013 29.0382 176.8048 32 G 4.0581 10.2871 109.8373 45.0332 0.0000 172.6898 33 R 5.1091 7.3125 117.1227 55.6194 33.1982 173.5337 34 I 4.7407 8.9400 123.0808 60.0821 42.1816 173.4701 35 T 5.1442 8.3738 122.4489 62.3255 71.6346 173.5083 36 T 4.5549 8.2714 116.0863 61.3630 72.4155 173.4763 37 T 4.4048 8.6016 110.5401 61.5346 70.3367 175.5411 38 V 3.5624 8.2405 121.9544 65.7684 31.4789 176.5676 39 P 4.2167 0.0000 0.0000 65.7434 31.4552 178.6913 40 K 3.9919 7.9186 116.7188 59.4705 31.8924 179.3398 41 A 4.0073 8.0866 121.1228 55.0198 18.0397 179.8637 42 K 3.9201 7.9680 116.8505 59.7120 32.2215 179.5537 43 E 3.9128 8.1415 118.8163 58.9706 29.2232 179.2690 44 L 3.6178 7.6784 120.4603 57.9503 42.2404 178.9326 45 R 4.0041 8.1028 116.3191 59.5638 29.1905 179.0427 46 G 3.5606 7.8173 105.9922 47.1945 0.0000 175.5981 47 F 4.2609 7.8506 122.4945 61.2337 39.3804 177.4882 48 V 3.3908 8.1656 118.2321 66.0484 31.3420 177.5607 49 D 4.5211 8.2064 118.6712 57.6657 40.3715 178.3442 50 H 4.1305 8.0539 118.1688 59.3810 29.8852 177.4220 51 L 3.6937 7.3562 120.3421 57.6908 41.4129 179.5807 52 I 3.5667 7.9856 120.1444 64.1486 36.9305 177.9362 53 H 4.0911 8.1569 119.3213 59.3447 29.7326 177.3849 54 L 3.9586 7.6036 120.3815 57.6936 41.1958 179.3950 55 A 2.5800 7.2884 119.7480 54.1221 18.1734 179.5756 56 K 3.8819 7.4017 116.7211 59.4494 32.2501 179.3215 57 R 3.8414 8.0819 117.9464 57.8089 31.0772 177.2633 58 G 4.1114 7.0488 107.6996 47.0828 0.0000 171.3145 59 D 5.1477 7.4032 121.5326 50.4840 43.5398 176.8438 60 L 3.8813 8.5860 118.5830 59.8877 39.9199 178.9979 61 H 4.4199 8.2900 116.2325 58.0836 28.8088 177.4742 62 A 4.0639 8.2248 122.2625 55.3344 17.8080 179.7140 63 R 3.8155 8.3974 117.2193 59.1869 29.9342 178.8407 64 R 3.9130 7.5305 117.5774 59.4470 30.3441 178.4832 65 L 4.1240 7.9510 118.6320 57.5902 41.5038 179.6839 66 V 3.6642 8.0925 118.6111 65.7483 31.2326 177.9036 67 L 4.1671 7.4587 120.0540 57.5584 42.0321 178.6087 68 R 4.0542 7.9219 117.8455 59.1796 30.0172 177.8780 69 D 4.8784 7.9503 117.5596 55.2508 40.9968 176.4425 70 L 4.6348 8.3294 121.9759 53.3442 42.4688 177.2332 71 Q 4.2996 8.4492 127.8313 55.0576 28.6370 177.5823 72 D 4.5552 7.5764 117.2445 51.8064 44.5807 174.2158 73 V 3.5309 8.4313 126.8761 66.2177 31.8220 177.7554 74 K 3.9617 8.1396 117.6837 59.5765 31.7966 179.1500 75 L 4.0409 9.3702 120.2177 57.7129 41.7864 179.4797 76 V 3.7525 7.8345 118.2184 66.0366 31.3885 178.3582 77 R 3.8903 8.4590 118.2185 59.0639 29.9469 178.6759 78 K 3.8742 8.0403 119.3863 59.6110 32.1162 178.3551 79 L 3.9667 8.3571 119.3787 58.0727 41.4005 179.6424 80 F 3.8847 8.1932 115.6123 60.3700 39.0921 176.8075 81 D 4.8032 8.0949 114.5725 54.2789 41.1335 175.8150 82 E 4.4483 8.1479 118.1477 57.3978 31.6141 177.4914 83 I 3.7676 7.7333 118.5377 64.0312 37.3195 177.9977 84 A 3.9069 8.4164 121.9374 54.8689 18.1681 177.6397 85 P 4.1046 0.0000 0.0000 66.0108 31.1605 178.6631 86 R 3.7636 7.2285 114.5629 58.4497 29.5882 176.5072 87 Y 5.0110 7.3587 115.7464 57.6390 38.4452 177.7527 88 R 3.7190 7.7065 122.6874 58.8085 30.5000 177.4962 89 D 4.5259 8.1281 116.8357 55.9894 39.9681 177.2810 90 R 4.3079 7.4425 117.1276 55.8571 30.9507 175.6826 91 Q 4.5965 8.8823 118.5216 54.8849 29.3446 173.8571 92 G 3.5389 9.3990 102.4188 43.0455 0.0000 173.8282 93 G 3.7062 7.4901 106.1588 46.7160 0.0000 172.6078 94 Y 4.1348 7.1473 116.3790 59.1212 40.0419 176.4088 95 T 4.9733 7.8486 115.6341 61.5089 71.2568 173.6544 96 R 4.6100 9.3225 126.3803 54.5007 32.7592 174.6270 97 V 4.8627 8.3642 125.1970 61.0696 34.0535 174.3755 98 L 4.7015 9.0683 128.2875 52.5829 43.9979 176.1309 99 K 4.3475 8.7457 124.2897 56.5396 32.6522 176.9653 100 L 4.6445 8.5730 124.4996 53.1964 43.9189 177.0681 101 A 4.0694 8.6957 122.4755 55.2816 19.0555 177.7897 102 E 3.9325 7.9289 115.9054 56.5149 30.3395 176.1111 103 R 4.9413 8.0998 122.0808 53.9555 34.2386 175.0139 104 R 3.9117 8.4072 122.5670 56.9244 30.7975 175.4329 105 R 4.9561 8.2983 123.5547 52.5785 28.9091 175.2869 106 G 4.8379 7.3434 120.8355 45.8724 0.0000 170.7339 107 D 4.6146 7.6882 114.8018 51.3276 41.4613 175.0244 108 G 4.3322 8.0505 107.6910 45.9930 0.0000 173.4594 109 A 4.6134 7.4930 119.6582 49.6685 21.1235 176.5599 110 P 4.4623 0.0000 0.0000 63.5425 32.3531 176.1783 111 L 5.0305 8.5154 122.8906 53.9587 44.2520 175.2811 112 A 5.0209 8.8096 121.0119 50.5252 23.2908 174.8765 113 L 4.8426 9.1235 123.6744 53.7347 43.9118 175.3173 114 V 4.9821 8.8448 127.0497 61.2846 34.0631 174.1370 115 E 5.0836 8.7346 123.7446 55.4245 33.3775 174.1610 116 L 4.7619 7.9816 121.0221 54.3233 42.3037 177.8527 117 V 3.8812 8.6497 123.9694 60.9606 32.5097 175.9791 118 E 4.8319 8.8654 122.0958 56.5240 30.0813 176.5745 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 14 S 8.18 4.42 0.00 3.99 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 15 S 8.62 3.94 0.00 4.07 4.12 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 16 H 8.87 4.13 0.00 3.13 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.64 3.59 0.00 1.71 1.28 0.00 3.13 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 18 L 7.43 3.46 0.00 1.66 1.62 0.96 0.72 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 19 A 7.61 3.91 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 20 L 7.34 3.80 0.00 1.80 1.73 1.04 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.79 4.21 0.00 2.31 1.43 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 22 R 8.08 4.12 0.00 2.04 2.14 0.00 3.13 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 23 N 8.11 4.42 0.00 2.95 2.88 0.00 0.00 7.09 7.51 0.00 0.00 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 Q 8.91 4.05 0.00 2.27 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.64 0.00 25 A 8.78 4.14 1.64 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 26 K 8.24 3.94 0.00 2.06 1.92 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.78 7.81 27 S 7.89 4.24 0.00 4.01 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 28 L 8.14 4.01 0.00 1.87 1.90 0.96 0.56 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 29 L 8.06 4.04 0.00 1.97 1.73 0.95 1.20 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 30 T 7.71 4.00 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 0.94 0.00 0.00 31 H 8.29 4.55 0.00 3.15 3.36 0.00 5.64 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 10.29 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 33 R 7.31 5.11 0.00 1.82 1.78 0.00 3.25 0.00 0.00 3.16 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.77 0.00 34 I 8.94 4.74 1.91 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 1.27 1.43 0.94 0.00 0.00 35 T 8.37 5.14 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 36 T 8.27 4.55 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 1.23 0.00 0.00 37 T 8.60 4.40 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 38 V 8.24 3.56 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 1.02 0.00 0.00 0.99 0.00 0.00 39 P 0.00 4.22 0.00 2.21 2.09 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 40 K 7.92 3.99 0.00 1.78 1.91 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.50 7.81 41 A 8.09 4.01 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 42 K 7.97 3.92 0.00 1.90 1.85 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.72 1.59 7.81 43 E 8.14 3.91 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 2.38 2.53 0.00 44 L 7.68 3.62 0.00 1.90 1.71 0.96 0.75 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 45 R 8.10 4.00 0.00 2.05 2.32 0.00 2.77 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 46 G 7.82 3.56 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 0.00 0.00 0.00 47 F 7.85 4.26 0.00 2.80 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 48 V 8.17 3.39 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 1.05 0.00 0.00 1.08 0.00 0.00 49 D 8.21 4.52 0.00 3.01 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 50 H 8.05 4.13 0.00 3.24 3.46 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.36 3.69 0.00 1.68 1.48 0.51 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.99 3.57 1.67 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.04 0.26 0.00 0.00 53 H 8.16 4.09 0.00 3.49 3.50 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.60 3.96 0.00 1.77 1.68 0.88 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 55 A 7.29 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.40 3.88 0.00 1.75 1.75 0.00 1.61 0.00 0.00 1.42 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.23 1.34 7.81 57 R 8.08 3.84 0.00 1.89 2.05 0.00 3.33 0.00 0.00 3.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 58 G 7.05 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 59 D 7.40 5.15 0.00 2.82 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 60 L 8.59 3.88 0.00 1.74 1.91 0.84 0.64 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 61 H 8.29 4.42 0.00 3.24 3.40 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.22 4.06 1.59 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 0.00 0.00 63 R 8.40 3.82 0.00 1.79 1.78 0.00 2.58 0.00 0.00 2.77 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.52 0.00 64 R 7.53 3.91 0.00 2.01 2.09 0.00 3.17 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 65 L 7.95 4.12 0.00 1.80 1.77 0.97 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.09 3.66 2.30 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 1.09 0.00 0.00 1.10 0.00 0.00 67 L 7.46 4.17 0.00 1.93 1.83 0.92 0.97 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 68 R 7.92 4.05 0.00 2.01 2.13 0.00 3.35 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 69 D 7.95 4.88 0.00 3.03 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 70 L 8.33 4.63 0.00 1.91 1.66 0.96 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.45 4.30 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 72 D 7.58 4.56 0.00 2.71 2.50 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 73 V 8.43 3.53 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 1.01 0.00 0.00 0.92 0.00 0.00 74 K 8.14 3.96 0.00 1.97 1.86 0.00 1.60 0.00 0.00 1.82 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.61 7.81 75 L 9.37 4.04 0.00 1.83 1.74 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.83 3.75 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 1.03 0.00 0.00 1.01 0.00 0.00 77 R 8.46 3.89 0.00 2.03 1.96 0.00 3.17 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.83 0.00 78 K 8.04 3.87 0.00 1.95 2.04 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.70 7.81 79 L 8.36 3.97 0.00 2.06 1.68 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.19 3.88 0.00 3.09 3.13 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 81 D 8.09 4.80 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 82 E 8.15 4.45 0.00 1.86 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 2.16 2.20 0.00 83 I 7.73 3.77 1.86 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 1.57 1.28 1.07 0.00 0.00 84 A 8.42 3.91 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 85 P 0.00 4.10 0.00 2.08 2.08 0.00 3.54 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 86 R 7.23 3.76 0.00 1.65 1.54 0.00 2.40 0.00 0.00 3.28 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.42 0.00 87 Y 7.36 5.01 0.00 2.80 2.80 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 88 R 7.71 3.72 0.00 1.93 1.95 0.00 3.32 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 89 D 8.13 4.53 0.00 2.86 2.80 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 90 R 7.44 4.31 0.00 2.10 2.00 0.00 3.37 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.04 0.00 91 Q 8.88 4.60 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 92 G 9.40 3.54 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 93 G 7.49 3.71 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 0.00 0.00 0.00 94 Y 7.15 4.13 0.00 2.81 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 0.00 0.00 0.00 0.00 95 T 7.85 4.97 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 1.24 0.00 0.00 96 R 9.32 4.61 0.00 1.82 1.87 0.00 3.04 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 97 V 8.36 4.86 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 0.87 0.00 0.00 0.91 0.00 0.00 98 L 9.07 4.70 0.00 1.55 1.55 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.75 4.35 0.00 1.64 1.75 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.47 7.81 100 L 8.57 4.64 0.00 1.50 1.59 0.92 1.11 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 0.00 101 A 8.70 4.07 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 0.00 102 E 7.93 3.93 0.00 2.01 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 2.39 2.39 0.00 103 R 8.10 4.94 0.00 1.77 1.75 0.00 3.30 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 104 R 8.41 3.91 0.00 1.83 2.06 0.00 3.06 0.00 0.00 3.10 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 105 R 8.30 4.96 0.00 1.79 1.82 0.00 3.40 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 106 G 7.34 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 0.00 107 D 7.69 4.61 0.00 2.73 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 0.00 108 G 8.05 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 0.00 0.00 0.00 0.00 109 A 7.49 4.61 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 0.00 110 P 0.00 4.46 0.00 2.12 2.21 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 111 L 8.52 5.03 0.00 1.76 1.62 0.92 0.66 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 0.00 112 A 8.81 5.02 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 0.00 113 L 9.12 4.84 0.00 1.66 1.74 0.97 0.83 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 0.00 114 V 8.84 4.98 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 1.01 0.00 0.00 0.93 0.00 0.00 115 E 8.73 5.08 0.00 2.28 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 2.19 2.28 0.00 116 L 7.98 4.76 0.00 1.66 1.80 1.07 0.92 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 0.00 117 V 8.65 3.88 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 0.72 0.00 0.00 0.97 0.00 0.00 118 E 8.87 4.83 0.00 2.24 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 2.11 2.08 0.00