NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1911 8.3144 121.7899 55.7445 32.9089 175.0145 2 E 3.6364 8.9600 126.7990 55.3202 29.9655 175.9878 3 T 4.1976 8.7897 118.6491 61.3212 72.1361 174.8940 4 A 4.0003 8.5090 123.5546 55.1934 18.4772 179.9239 5 A 3.9357 8.0126 118.6689 55.3834 18.5406 179.6003 6 A 4.0175 8.1099 119.3023 55.1055 18.3548 179.7984 7 K 4.0584 8.2922 118.3123 59.5194 32.2754 178.7907 8 F 4.0898 8.4049 121.0239 61.3705 39.3591 176.9870 9 E 4.0347 8.2780 117.7403 59.3643 29.0506 179.3453 10 R 3.8671 7.8636 117.5930 59.6620 30.2945 178.3247 11 Q 4.0024 7.9926 116.4623 58.0905 29.0376 176.3385 12 H 4.7018 7.9210 113.8249 53.7407 31.6728 173.0663 13 M 4.7520 7.8977 118.5535 53.6838 32.9387 176.4277 14 D 4.7126 8.9106 123.3660 52.5523 41.2076 175.7117 15 S 4.1576 9.0935 120.6554 62.4141 63.2792 177.9716 16 S 3.8085 6.6518 114.3391 59.7324 63.2824 176.7566 17 T 4.6960 7.3993 110.7865 59.5019 71.1329 174.4764 18 S 4.3468 8.3834 115.5838 59.6331 63.9708 173.2999 19 A 4.2610 7.1056 121.1461 50.9629 21.5553 174.1426 20 A 3.4279 8.3672 121.2598 52.2907 19.0564 179.8456 21 S 4.0127 8.3844 120.3784 60.1222 62.8941 171.0202 22 S 4.6509 7.0516 112.9060 58.9857 66.3553 178.3298 23 S 4.2502 8.8207 115.7267 60.9534 62.3331 170.5482 24 N 4.8445 8.0546 114.2801 53.8042 39.1776 175.8866 25 Y 4.0415 8.1332 120.9487 61.2236 38.7272 177.6635 26 C 4.1535 8.2552 116.6852 60.0145 38.5581 175.6897 27 N 4.3900 8.2671 117.5555 56.6103 38.1964 177.3433 28 Q 3.9134 7.7991 118.6536 59.2571 28.9084 178.6624 29 M 3.6948 7.6792 119.8061 58.4368 31.8612 178.6735 30 M 4.0103 7.9131 118.9235 58.1855 32.0147 178.8457 31 K 4.0892 7.8358 120.6171 58.9252 32.3023 178.7740 32 S 4.3726 7.7610 111.7958 59.8746 63.2901 175.3002 33 R 4.3939 7.5322 120.6038 55.3324 30.1448 175.5994 34 N 4.2978 7.8670 114.8313 54.7297 36.2810 174.8180 35 L 4.5617 8.0396 116.2849 54.9567 42.0717 177.7364 36 T 5.2423 7.5006 107.8618 60.3751 68.8844 175.8944 37 K 4.1049 8.1954 125.5767 60.2062 32.6501 178.0704 38 D 4.6177 7.8999 117.8510 54.5438 40.8244 178.6113 39 R 4.2045 7.2546 112.5118 54.7896 32.2033 174.6861 40 C 4.7403 8.6309 116.9329 55.9598 40.3057 173.8712 41 K 4.2012 8.3885 127.4242 55.9807 32.3546 175.0523 42 P 4.7312 0.0000 0.0000 65.1576 32.5034 176.5016 43 V 5.0261 7.5709 116.8695 61.5152 34.7795 174.0216 44 N 4.7665 8.9714 123.3590 52.8597 42.6351 172.9324 45 T 4.7770 7.8727 120.0803 61.6284 71.9388 172.7898 46 F 4.9521 8.8401 124.3642 55.7022 42.0476 174.6532 47 V 4.5549 8.8192 122.9740 60.9565 33.5490 175.3779 48 H 5.6602 8.5021 125.5520 54.0462 26.9502 172.4873 49 E 4.8260 7.7924 117.6005 53.2991 34.4825 176.8190 50 S 4.3570 8.3203 114.7963 58.2456 64.9507 174.8969 51 L 3.9901 8.5630 124.5418 58.3880 41.8587 179.0903 52 A 3.9994 8.0596 120.1435 55.5428 18.0923 179.2546 53 D 4.3398 7.7993 115.6114 57.3331 41.2322 178.9183 54 V 3.7976 7.7830 118.4613 66.0589 31.6052 178.1605 55 Q 3.9195 8.5135 117.9585 58.7942 28.5222 178.6175 56 A 4.0237 8.0173 121.5837 54.6655 18.3315 179.6174 57 V 3.4641 7.5280 116.8621 66.1084 31.2752 176.9218 58 C 3.7681 7.6293 113.9044 58.0719 39.8784 174.1703 59 S 4.6555 7.5215 115.6664 58.2552 64.0006 174.3808 60 Q 4.1516 7.2070 120.2458 55.7591 30.4635 178.2248 61 K 4.3371 8.5200 133.7288 56.6051 32.8526 174.8556 62 N 4.4759 8.7967 127.4938 53.6346 39.3188 174.3219 63 V 4.6005 8.3862 118.0477 59.1583 36.7286 174.9129 64 A 4.3270 8.4055 124.7035 52.3875 19.0469 178.4339 65 C 4.7090 8.9602 118.9503 55.7791 41.3632 175.4099 66 K 3.7456 9.0434 121.6040 59.4881 31.5817 178.1537 67 N 4.5313 8.0761 113.4782 52.7968 37.5700 175.9429 68 G 3.9331 8.1309 108.0954 45.5507 0.0000 174.2426 69 Q 4.1789 8.2191 119.1822 56.4333 29.2100 176.6550 70 T 4.5379 8.3220 108.5751 61.6501 69.2025 173.8129 71 N 4.9821 7.9376 118.5848 53.8560 38.5731 174.9155 72 C 5.3380 7.4543 115.9766 56.7996 44.4640 172.6712 73 Y 5.0527 8.7976 118.4661 56.3870 42.0753 173.9265 74 Q 5.1029 9.1185 125.4768 54.1397 31.2147 174.9293 75 S 4.4492 8.7495 121.9123 58.7771 63.1491 174.2918 76 Y 4.5156 8.9905 121.3973 60.8585 37.8925 176.8054 77 S 4.7987 7.8572 113.9862 57.0090 64.8061 173.6978 78 T 4.3051 8.0213 112.1134 62.0619 69.7556 173.6827 79 M 5.0278 8.8147 121.8647 53.3503 36.8278 174.7285 80 S 4.8700 9.4223 117.6240 58.4394 63.5787 173.0946 81 I 5.1653 8.8876 120.1616 59.4213 41.7031 174.2979 82 T 5.0518 8.8533 119.2412 61.8548 71.8350 172.6892 83 D 4.8528 9.2345 127.4950 53.6285 43.0319 174.1832 84 C 5.6078 9.1889 123.5719 55.2323 42.6697 172.8797 85 R 5.2823 8.7768 123.5084 54.0664 33.0420 174.1033 86 E 4.1449 9.2001 128.1277 56.4172 30.1929 176.8276 87 T 4.2025 8.4060 116.4006 61.0274 69.7171 175.8554 88 G 3.6295 8.4700 110.6663 47.8469 0.0000 174.7571 89 S 4.4420 7.3022 113.9627 58.9675 63.5876 174.7256 90 S 4.1155 7.5877 118.2907 58.7884 62.8829 174.1303 91 K 4.6545 8.2562 127.3445 52.5277 35.3572 173.0066 92 Y 4.3892 8.6870 125.1208 56.5033 39.2473 173.7631 93 P 3.5265 0.0000 0.0000 63.2825 32.0603 177.3675 94 N 4.6315 7.4317 118.3886 51.2916 35.9203 178.3196 95 C 4.4383 7.8855 118.9095 56.6589 40.8455 173.4741 96 A 5.1319 8.3887 125.7071 50.3438 21.9010 174.4041 97 Y 5.1502 9.1432 118.2551 56.0538 42.4120 174.8690 98 K 4.5207 9.1425 124.0884 55.7529 34.1805 175.2218 99 T 5.1035 8.5509 123.6141 62.4284 70.3449 174.0930 100 T 4.5992 8.9762 125.2112 62.4402 71.8942 173.8211 101 Q 4.8981 8.8032 127.0722 55.1441 29.4777 171.3115 102 A 4.6573 8.8516 123.4288 50.3948 23.6591 174.9819 103 N 5.3800 8.7168 116.2151 51.7441 40.5307 174.2752 104 K 4.7780 8.7838 122.4692 54.6024 37.5945 175.8163 105 H 4.8051 9.0394 119.1151 55.9675 29.8896 174.8410 106 I 4.9567 8.6167 115.0218 59.2131 40.8902 174.2893 107 I 4.8853 8.1487 124.3609 59.7182 39.9397 175.1105 108 V 4.7685 8.6239 119.1689 59.3700 36.1865 174.3859 109 A 4.9797 8.6748 124.8120 51.1134 20.6170 175.6958 110 C 5.1062 8.5437 118.9489 55.2978 42.2161 173.0805 111 E 4.6899 8.5906 121.0710 56.5479 33.7617 175.5582 112 G 3.8329 9.3369 110.7567 44.8195 0.0000 171.5982 113 N 4.8812 8.1934 116.0690 50.7204 40.3967 172.2126 114 P 4.3850 0.0000 0.0000 62.6576 32.1979 175.7399 115 Y 5.0089 8.2305 121.2067 56.4365 38.7570 174.5648 116 V 4.4322 7.8597 118.5042 58.3755 36.7797 173.4625 117 P 4.3872 0.0000 0.0000 63.0403 31.0301 176.9169 118 V 4.3649 8.6446 115.4883 61.2641 33.9945 175.4822 119 H 5.1723 7.8279 116.5931 54.1931 33.5516 172.0142 120 F 4.6651 9.0197 124.3926 57.4963 39.6097 174.6155 121 D 4.5576 8.4468 126.8017 55.7890 41.4876 175.8460 122 A 4.6484 6.6784 117.1851 51.3494 22.5320 174.2932 123 S 5.3186 8.9060 113.7644 56.5326 66.0374 174.6459 124 V 4.1485 8.5848 120.7651 62.0544 31.5267 175.1668 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 K 8.31 4.19 0.00 1.72 1.82 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.51 7.81 2 E 8.96 3.64 0.00 2.05 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 2.32 2.37 0.00 3 T 8.79 4.20 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 4 A 8.51 4.00 1.32 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 0.00 0.00 0.00 5 A 8.01 3.94 1.32 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 0.00 0.00 0.00 6 A 8.11 4.02 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 7 K 8.29 4.06 0.00 1.87 2.00 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.45 7.81 8 F 8.40 4.09 0.00 3.22 3.21 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 0.00 9 E 8.28 4.03 0.00 2.29 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 2.51 2.66 0.00 10 R 7.86 3.87 0.00 1.81 2.07 0.00 3.37 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 1.63 1.67 0.00 11 Q 7.99 4.00 0.00 1.55 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.49 0.00 0.00 0.00 0.00 0.00 2.26 2.47 0.00 12 H 7.92 4.70 0.00 2.00 2.64 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 13 M 7.90 4.75 0.00 1.98 2.18 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.67 0.00 14 D 8.91 4.71 0.00 2.72 2.57 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 15 S 9.09 4.16 0.00 3.93 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 16 S 6.65 3.81 0.00 3.65 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 17 T 7.40 4.70 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 1.19 0.00 0.00 18 S 8.38 4.35 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.11 4.26 1.13 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 0.00 0.00 20 A 8.37 3.43 1.04 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 21 S 8.38 4.01 0.00 3.64 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 22 S 7.05 4.65 0.00 4.07 4.03 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 23 S 8.82 4.25 0.00 3.65 3.83 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 24 N 8.05 4.84 0.00 2.76 2.87 0.00 0.00 6.78 7.48 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 25 Y 8.13 4.04 0.00 3.12 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 26 C 8.26 4.15 0.00 3.17 3.06 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 27 N 8.27 4.39 0.00 2.91 2.93 0.00 0.00 7.13 7.74 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 28 Q 7.80 3.91 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 29 M 7.68 3.69 0.00 0.92 1.23 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.59 0.00 30 M 7.91 4.01 0.00 1.77 1.86 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 2.38 0.00 31 K 7.84 4.09 0.00 1.96 1.91 0.00 1.66 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 1.42 1.30 7.81 32 S 7.76 4.37 0.00 4.03 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 33 R 7.53 4.39 0.00 1.93 2.10 0.00 3.56 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.94 0.00 34 N 7.87 4.30 0.00 2.90 2.95 0.00 0.00 6.83 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 35 L 8.04 4.56 0.00 1.83 1.65 0.79 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.50 5.24 4.39 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 1.44 0.00 0.00 37 K 8.20 4.10 0.00 1.78 1.86 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.47 7.81 38 D 7.90 4.62 0.00 2.73 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.25 4.20 0.00 1.81 1.80 0.00 2.86 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 40 C 8.63 4.74 0.00 3.10 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 41 K 8.39 4.20 0.00 1.80 1.78 0.00 1.76 0.00 0.00 1.62 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.43 7.81 42 P 0.00 4.73 0.00 2.15 2.10 0.00 3.63 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 2.13 2.10 0.00 43 V 7.57 5.03 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 0.84 0.00 0.00 0.98 0.00 0.00 44 N 8.97 4.77 0.00 2.66 2.26 0.00 0.00 6.91 6.82 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 45 T 7.87 4.78 2.97 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 0.90 0.00 0.00 46 F 8.84 4.95 0.00 2.98 2.86 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 47 V 8.82 4.55 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 1.05 0.00 0.00 0.99 0.00 0.00 48 H 8.50 5.66 0.00 3.04 3.43 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.79 4.83 0.00 1.95 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 2.24 2.25 0.00 50 S 8.32 4.36 0.00 4.07 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 51 L 8.56 3.99 0.00 1.82 1.74 1.02 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.06 4.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.80 4.34 0.00 2.87 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 54 V 7.78 3.80 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 1.21 0.00 0.00 1.06 0.00 0.00 55 Q 8.51 3.92 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 56 A 8.02 4.02 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 57 V 7.53 3.46 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 0.98 0.00 0.00 0.93 0.00 0.00 58 C 7.63 3.77 0.00 2.73 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 59 S 7.52 4.66 0.00 3.87 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 60 Q 7.21 4.15 0.00 1.61 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.92 0.00 0.00 0.00 0.00 0.00 1.76 2.13 0.00 61 K 8.52 4.34 0.00 2.04 1.88 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.50 7.81 62 N 8.80 4.48 0.00 2.74 2.66 0.00 0.00 7.00 7.71 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 63 V 8.39 4.60 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 0.68 0.00 0.00 0.82 0.00 0.00 64 A 8.41 4.33 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 65 C 8.96 4.71 0.00 3.07 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 66 K 9.04 3.75 0.00 1.69 1.86 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 67 N 8.08 4.53 0.00 2.81 2.90 0.00 0.00 6.17 7.00 0.00 0.00 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 G 8.13 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 0.00 0.00 0.00 69 Q 8.22 4.18 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 70 T 8.32 4.54 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 1.18 0.00 0.00 71 N 7.94 4.98 0.00 3.06 3.16 0.00 0.00 6.07 7.68 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 72 C 7.45 5.34 0.00 2.95 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 73 Y 8.80 5.05 0.00 2.82 2.84 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 74 Q 9.12 5.10 0.00 2.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 75 S 8.75 4.45 0.00 3.93 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 76 Y 8.99 4.52 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 77 S 7.86 4.80 0.00 3.91 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 78 T 8.02 4.31 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 1.02 0.00 0.00 79 M 8.81 5.03 0.00 1.97 1.99 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 2.54 2.48 0.00 80 S 9.42 4.87 0.00 3.91 4.04 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 81 I 8.89 5.17 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 1.27 0.78 1.03 0.00 0.00 82 T 8.85 5.05 4.42 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 1.30 0.00 0.00 83 D 9.23 4.85 0.00 2.80 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 84 C 9.19 5.61 0.00 2.92 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 85 R 8.78 5.28 0.00 1.95 1.79 0.00 3.13 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 E 9.20 4.14 0.00 2.01 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 2.12 1.87 0.00 87 T 8.41 4.20 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 1.18 0.00 0.00 88 G 8.47 3.63 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 0.00 0.00 0.00 89 S 7.30 4.44 0.00 3.98 3.90 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 0.00 0.00 0.00 90 S 7.59 4.12 0.00 3.76 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 91 K 8.26 4.65 0.00 1.65 1.58 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.33 0.97 7.81 92 Y 8.69 4.39 0.00 2.90 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 93 P 0.00 3.53 0.00 1.75 0.87 0.00 3.63 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 94 N 7.43 4.63 0.00 2.80 2.68 0.00 0.00 6.96 7.14 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 95 C 7.89 4.44 0.00 3.11 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 96 A 8.39 5.13 1.14 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 0.00 0.00 97 Y 9.14 5.15 0.00 2.97 2.90 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 0.00 0.00 0.00 98 K 9.14 4.52 0.00 1.91 1.73 0.00 1.54 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.51 7.81 99 T 8.55 5.10 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 1.34 0.00 0.00 100 T 8.98 4.60 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 0.00 101 Q 8.80 4.90 0.00 1.84 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.25 1.93 0.00 102 A 8.85 4.66 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 0.00 103 N 8.72 5.38 0.00 2.58 2.76 0.00 0.00 6.69 7.61 0.00 0.00 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 K 8.78 4.78 0.00 1.72 1.82 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 105 H 9.04 4.81 0.00 3.23 3.25 0.00 5.57 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.62 4.96 1.91 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.90 1.14 0.00 0.00 107 I 8.15 4.89 1.68 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 1.16 0.64 0.84 0.00 0.00 108 V 8.62 4.77 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 0.77 0.00 0.00 0.83 0.00 0.00 109 A 8.67 4.98 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 0.00 110 C 8.54 5.11 0.00 2.11 1.75 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 0.00 111 E 8.59 4.69 0.00 2.01 1.69 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 2.25 2.32 0.00 112 G 9.34 3.83 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 0.00 0.00 0.00 113 N 8.19 4.88 0.00 2.64 2.71 0.00 0.00 6.92 7.69 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 0.00 114 P 0.00 4.38 0.00 2.23 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 115 Y 8.23 5.01 0.00 2.91 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 0.00 116 V 7.86 4.43 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 0.67 0.00 0.00 0.87 0.00 0.00 117 P 0.00 4.39 0.00 0.49 1.17 0.00 3.32 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.80 0.00 118 V 8.64 4.36 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 0.63 0.00 0.00 0.89 0.00 0.00 119 H 7.83 5.17 0.00 3.06 3.20 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 9.02 4.67 0.00 2.74 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 0.00 121 D 8.45 4.56 0.00 2.59 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 0.00 122 A 6.68 4.65 1.16 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 0.00 0.00 123 S 8.91 5.32 0.00 4.06 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 0.00 124 V 8.58 4.15 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 0.74 0.00 0.00 0.94 0.00 0.00