NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 V 4.4273 7.9014 120.4122 62.2317 33.2813 176.8423 4 G 3.5222 8.0596 106.4706 46.7883 0.0000 174.0588 5 T 3.8130 8.6631 113.0528 65.3412 68.9086 174.3351 6 Y 4.1540 7.6599 119.3429 60.1513 37.9767 178.0645 7 A 4.1169 8.1187 122.0150 54.9294 18.5780 179.2776 8 E 3.9865 7.9211 114.9424 59.2967 29.8473 179.0175 9 L 4.0134 8.6454 120.2568 57.7185 41.7762 179.4519 10 A 4.2019 8.2232 120.7055 55.1893 18.2585 179.8510 11 S 4.1264 8.0790 112.4536 61.4934 63.1140 176.8757 12 V 3.4345 7.8566 121.9245 65.8247 31.2217 178.1327 13 F 4.2186 8.3697 117.5356 60.2987 38.4788 177.4994 14 A 4.0735 8.4818 120.1197 55.1516 18.2461 179.1880 15 A 4.1221 8.0305 118.3451 55.3419 18.5733 179.5243 16 L 4.3879 8.2003 116.7449 56.8061 41.6486 178.9726 17 S 4.2336 7.7748 112.8738 58.7088 63.7622 173.2872 18 D 4.8470 7.1775 123.6566 52.6034 42.6829 176.6453 19 E 4.0087 8.7526 126.6532 59.7651 29.7886 179.1320 20 T 3.9525 7.9650 115.4310 66.4210 68.5520 176.6942 21 R 3.7904 8.2840 120.8537 58.8731 29.9698 178.2929 22 W 4.1060 8.5710 128.7499 60.5019 30.7168 177.4389 23 E 3.9601 8.5710 119.2793 59.3933 28.9433 178.9974 24 I 3.6532 7.8151 119.6930 64.3021 37.2378 178.0670 25 L 3.8259 7.9701 121.5665 58.3082 41.5913 179.1564 26 T 3.5959 7.5420 108.9244 64.6054 69.0702 175.8498 27 E 4.0098 7.8939 121.8131 58.9910 29.5543 178.7588 28 L 4.3568 7.6464 120.6851 57.2218 41.4094 179.7936 29 G 3.5812 7.7389 104.8404 47.5996 0.0000 175.7125 30 R 4.0409 7.6454 119.0842 57.9116 30.3146 176.8625 31 A 4.3415 6.9614 117.5207 50.9780 22.5919 175.0193 32 D 5.0660 8.6243 121.1725 54.6343 41.6943 175.8111 33 Q 4.6864 8.3785 120.4323 55.1260 33.9167 173.4065 34 S 5.0862 8.8231 114.6390 57.1456 64.7136 175.3500 35 A 4.0042 8.9093 121.7364 55.2904 17.9768 180.0360 36 S 4.0562 8.0734 113.1859 62.1407 63.0475 177.0822 37 S 4.2525 8.0559 116.8848 61.1578 62.6038 176.5979 38 L 3.9885 7.9994 122.0531 57.5908 41.1016 179.2495 39 A 4.0037 7.7580 119.7956 55.4963 18.4062 179.5208 40 T 3.9633 7.7071 113.2091 66.7229 68.6045 176.6695 41 R 4.2100 8.0369 118.4923 56.4779 30.7367 176.6563 42 L 4.8214 7.2613 117.4939 52.0892 44.8507 175.3761 43 P 4.6686 0.0000 0.0000 61.6545 29.8434 175.6122 44 V 4.5533 7.0287 119.0346 59.6482 35.3675 176.4612 45 S 4.5585 8.2883 115.7575 57.7512 65.6287 175.4477 46 R 3.9275 8.4804 122.1681 59.3573 29.8107 179.1767 47 Q 3.8760 8.0369 118.7670 59.1377 29.0939 178.0487 48 A 3.8928 7.8143 121.2467 55.1731 18.3465 179.5692 49 I 3.5827 7.8719 118.1023 64.3769 37.1520 178.4671 50 A 3.8819 7.8721 121.4507 55.1378 18.1942 179.6220 51 K 3.8315 7.8501 118.0211 59.9885 32.1664 178.6653 52 H 4.4308 8.3638 116.5513 58.4109 28.6539 177.7788 53 L 3.8293 8.1547 121.4403 57.5151 41.3682 178.8756 54 N 4.2460 8.0966 116.8244 56.7388 38.7500 176.7941 55 A 4.0211 7.8054 121.7791 55.1792 18.4879 179.6068 56 L 3.9484 8.2979 117.9114 58.0319 41.6953 179.8387 57 Q 4.4175 8.6296 119.3033 58.3777 28.4777 178.4574 58 A 4.1617 8.0499 120.8110 53.9900 18.5104 178.2557 59 C 4.5716 7.7713 110.9775 57.8084 30.3367 174.6318 60 G 3.9204 7.9057 109.5848 45.6929 0.0000 174.3343 61 L 4.3367 7.9924 120.6278 55.8566 42.9315 176.7434 62 V 5.1074 7.6296 117.6565 61.0409 35.5843 173.6836 63 E 4.9842 9.1782 122.5410 54.5793 33.3035 174.3213 64 S 4.7610 8.5648 115.2891 57.0012 65.2402 173.7268 65 V 4.3737 8.6017 115.4190 59.3019 35.4247 174.6032 66 K 4.3847 8.6677 126.9437 56.0619 32.9666 176.4784 67 V 4.1729 9.0395 128.2352 61.3851 33.0074 175.9494 68 G 3.7493 8.0834 119.9605 46.9381 0.0000 173.0421 69 R 4.5884 8.5643 116.1385 55.9416 30.1896 175.6488 70 E 4.7364 8.2438 115.3222 55.5441 32.4907 174.1191 71 I 4.6522 8.0322 120.2312 60.0422 39.1715 175.1968 72 R 4.7310 9.0579 125.6327 54.5972 34.0921 174.2344 73 Y 5.0199 9.0631 118.2574 56.2643 41.0391 174.9542 74 R 5.0531 9.0884 123.5392 54.3157 33.2511 174.4121 75 A 4.5234 8.7046 127.8357 51.9649 19.8138 177.2802 76 L 4.4097 8.8181 122.6909 52.7707 42.1318 177.6126 77 G 3.6051 8.6105 111.5944 47.2676 0.0000 172.5824 78 A 3.9954 8.0294 122.7167 55.3130 18.4240 179.1465 79 E 3.8766 8.2822 117.6922 59.0605 29.6244 178.9935 80 L 3.9224 7.7567 118.6608 57.9585 41.7825 179.0726 81 N 4.3449 8.2185 116.3627 56.1035 38.4508 177.4586 82 K 3.9177 8.2060 121.1237 59.6957 32.2042 179.0798 83 T 3.8331 7.7796 115.3541 66.6080 68.4151 176.5443 84 A 4.0222 8.3609 123.0765 55.2933 18.4647 179.9662 85 R 3.8970 8.2026 116.6573 59.5478 30.1313 179.4328 86 T 3.8085 7.9801 115.5846 66.6800 68.4864 176.7979 87 L 3.9528 8.2178 121.0326 57.6656 41.5580 179.4943 88 E 3.9789 8.2565 118.8298 59.0712 29.3621 179.2941 89 R 3.7896 7.8250 118.5753 59.4808 30.2354 178.4823 90 I 3.6164 7.5936 119.6518 64.2243 37.0365 178.4905 91 G 3.3506 8.0782 106.4401 47.7591 0.0000 175.2829 92 A 4.0238 7.8909 123.4913 55.1019 17.9257 179.6675 93 E 4.0462 7.9813 116.7960 59.1206 29.4880 179.6542 94 W 4.4569 8.1633 119.3119 59.8524 29.1320 178.3191 95 D 4.4715 8.7539 119.3517 57.4767 40.2412 179.1697 96 R 3.9510 8.2057 118.6000 59.2153 30.0579 179.0685 97 R 3.9265 7.8238 118.0347 59.1655 29.9881 178.2634 98 L 3.9188 8.1829 119.9690 58.1433 42.0593 178.7136 99 A 3.9680 8.3735 120.7895 55.2855 18.0110 179.3683 100 A 3.9564 8.1447 119.1243 55.3676 18.2995 179.7216 101 I 3.5947 7.9578 118.2526 64.5019 37.3199 178.4731 102 K 3.8899 8.2969 119.1323 59.9599 31.8736 179.5091 103 Q 4.1258 8.2974 116.2747 57.7888 28.5798 177.8404 104 I 4.1076 6.9775 118.3302 63.1130 38.8144 177.0735 105 A 4.1780 8.0428 120.2680 53.5023 18.4601 176.9664 106 E 4.7028 7.3698 113.8961 54.2442 33.2407 176.0727 107 S 4.2902 8.4898 113.2986 58.7256 62.4924 173.7453 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 V 7.90 4.43 2.20 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 1.09 0.00 0.00 1.13 0.00 0.00 4 G 8.06 3.52 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 0.00 0.00 0.00 5 T 8.66 3.81 3.65 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 6 Y 7.66 4.15 0.00 3.04 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 7 A 8.12 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 8 E 7.92 3.99 0.00 2.24 2.34 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 2.29 2.31 0.00 9 L 8.65 4.01 0.00 1.81 2.04 0.86 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.22 4.20 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 11 S 8.08 4.13 0.00 4.12 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 0.00 12 V 7.86 3.43 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 0.56 0.00 0.00 0.91 0.00 0.00 13 F 8.37 4.22 0.00 3.22 3.17 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 14 A 8.48 4.07 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 15 A 8.03 4.12 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 16 L 8.20 4.39 0.00 1.90 2.01 0.86 0.72 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 17 S 7.77 4.23 0.00 4.05 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 0.00 18 D 7.18 4.85 0.00 2.70 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 19 E 8.75 4.01 0.00 2.06 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 2.42 2.37 0.00 20 T 7.97 3.95 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 1.25 0.00 0.00 21 R 8.28 3.79 0.00 1.57 2.05 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 22 W 8.57 4.11 0.00 3.52 3.26 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 23 E 8.57 3.96 0.00 2.25 2.21 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 2.32 2.40 0.00 24 I 7.82 3.65 1.97 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 1.38 0.60 0.84 0.00 0.00 25 L 7.97 3.83 0.00 1.71 1.54 0.82 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.54 3.60 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 0.61 0.00 0.00 27 E 7.89 4.01 0.00 2.14 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 0.00 2.29 2.38 0.00 28 L 7.65 4.36 0.00 1.82 1.70 0.91 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.74 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.65 4.04 0.00 2.00 1.98 0.00 3.19 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 31 A 6.96 4.34 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 32 D 8.62 5.07 0.00 2.57 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.38 4.69 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.96 0.00 0.00 0.00 0.00 0.00 2.50 2.36 0.00 34 S 8.82 5.09 0.00 3.96 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 35 A 8.91 4.00 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 36 S 8.07 4.06 0.00 3.90 3.94 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 37 S 8.06 4.25 0.00 3.88 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 38 L 8.00 3.99 0.00 1.89 1.69 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.76 4.00 1.35 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 0.00 0.00 40 T 7.71 3.96 4.37 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 1.21 0.00 0.00 41 R 8.04 4.21 0.00 1.85 1.98 0.00 3.11 0.00 0.00 3.56 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 42 L 7.26 4.82 0.00 1.71 1.55 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.67 0.00 2.19 2.10 0.00 3.83 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.96 0.00 44 V 7.03 4.55 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 0.85 0.00 0.00 0.95 0.00 0.00 45 S 8.29 4.56 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 46 R 8.48 3.93 0.00 1.87 2.02 0.00 3.13 0.00 0.00 3.27 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 47 Q 8.04 3.88 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 48 A 7.81 3.89 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 49 I 7.87 3.58 1.96 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.80 0.81 0.00 0.00 50 A 7.87 3.88 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 51 K 7.85 3.83 0.00 1.88 1.72 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.43 7.81 52 H 8.36 4.43 0.00 3.24 3.28 0.00 5.67 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 53 L 8.15 3.83 0.00 1.45 1.21 0.22 0.12 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 54 N 8.10 4.25 0.00 2.88 2.93 0.00 0.00 7.11 7.88 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 55 A 7.81 4.02 1.39 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 0.00 0.00 56 L 8.30 3.95 0.00 1.78 1.71 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 8.63 4.42 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.63 2.47 0.00 58 A 8.05 4.16 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 59 C 7.77 4.57 0.00 3.08 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 60 G 7.91 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 0.00 0.00 0.00 61 L 7.99 4.34 0.00 1.73 1.66 0.85 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.63 5.11 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 1.30 0.00 0.00 0.92 0.00 0.00 63 E 9.18 4.98 0.00 2.01 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 0.00 2.17 2.20 0.00 64 S 8.56 4.76 0.00 3.33 3.50 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 65 V 8.60 4.37 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 0.65 0.00 0.00 0.89 0.00 0.00 66 K 8.67 4.38 0.00 1.71 1.68 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.72 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.39 7.81 67 V 9.04 4.17 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 0.98 0.00 0.00 0.88 0.00 0.00 68 G 8.08 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 0.00 0.00 0.00 69 R 8.56 4.59 0.00 1.91 2.01 0.00 3.14 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 1.52 1.53 0.00 70 E 8.24 4.74 0.00 2.11 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 2.20 0.00 71 I 8.03 4.65 1.82 0.00 0.00 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 1.30 1.04 0.52 0.00 0.00 72 R 9.06 4.73 0.00 1.60 1.77 0.00 3.05 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 73 Y 9.06 5.02 0.00 2.94 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 74 R 9.09 5.05 0.00 1.79 1.71 0.00 3.06 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 75 A 8.70 4.52 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 76 L 8.82 4.41 0.00 1.54 1.59 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.61 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.03 4.00 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 79 E 8.28 3.88 0.00 2.13 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 2.24 2.31 0.00 80 L 7.76 3.92 0.00 1.87 1.67 0.85 0.66 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 81 N 8.22 4.34 0.00 2.85 2.85 0.00 0.00 6.73 7.32 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 82 K 8.21 3.92 0.00 1.93 1.89 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.44 7.81 83 T 7.78 3.83 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 1.12 0.00 0.00 84 A 8.36 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 85 R 8.20 3.90 0.00 1.93 1.96 0.00 3.23 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 86 T 7.98 3.81 4.36 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 1.09 0.00 0.00 87 L 8.22 3.95 0.00 1.86 1.68 1.10 1.35 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 88 E 8.26 3.98 0.00 2.20 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 2.30 2.29 0.00 89 R 7.83 3.79 0.00 1.86 1.96 0.00 3.09 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 90 I 7.59 3.62 1.43 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.39 -0.08 0.00 0.00 91 G 8.08 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 0.00 0.00 0.00 92 A 7.89 4.02 1.39 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 0.00 0.00 93 E 7.98 4.05 0.00 2.19 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 2.35 2.47 0.00 94 W 8.16 4.46 0.00 3.53 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 95 D 8.75 4.47 0.00 2.83 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 96 R 8.21 3.95 0.00 1.92 2.01 0.00 3.15 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 97 R 7.82 3.93 0.00 1.95 1.98 0.00 3.10 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 98 L 8.18 3.92 0.00 1.96 1.86 0.92 1.00 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 99 A 8.37 3.97 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 0.00 100 A 8.14 3.96 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 0.00 101 I 7.96 3.59 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.76 0.91 0.00 0.00 102 K 8.30 3.89 0.00 2.03 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.64 7.81 103 Q 8.30 4.13 0.00 2.01 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 104 I 6.98 4.11 1.87 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 1.45 0.68 1.03 0.00 0.00 105 A 8.04 4.18 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 0.00 106 E 7.37 4.70 0.00 1.96 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 2.22 2.19 0.00 107 S 8.49 4.29 0.00 3.83 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00