NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 V 4.1223 8.0544 120.3974 63.0736 34.5803 177.3278 7 S 4.3523 7.7557 120.9879 58.2823 62.9253 174.2796 8 A 3.9906 9.5166 118.6281 55.2391 19.2799 179.2305 9 S 4.1816 8.1181 113.1242 62.0741 62.9755 177.0114 10 S 4.1862 8.1224 117.2524 61.7947 62.5196 176.9231 11 R 4.0058 8.1065 120.4804 58.7487 29.7799 178.9117 12 W 4.2870 8.1377 128.1554 60.3310 30.6289 177.9495 13 L 3.9096 8.4373 120.7567 57.8967 41.4993 178.5332 14 E 4.0580 8.5958 120.0500 59.0626 29.5206 178.9534 15 G 3.5130 8.2898 106.0995 47.2420 0.0000 176.0101 16 I 3.5149 7.4199 122.0915 64.3769 37.1154 178.6456 17 R 3.9816 8.1413 119.1160 59.1647 29.8822 179.1059 18 K 2.9575 7.8485 119.4977 58.6431 32.0814 178.7494 19 W 4.0192 8.3892 129.2371 60.4967 30.5420 177.3574 20 Y 2.9699 8.3693 119.6488 60.4024 38.0485 176.9202 21 Y 3.8747 7.9726 120.4937 61.0460 38.6337 177.9868 22 N 4.0254 7.8789 115.9171 56.4039 39.0544 176.4077 23 A 3.6287 6.8951 121.2923 54.6808 18.4171 178.8902 24 A 3.5435 7.3471 119.1341 53.1441 18.0037 178.7639 25 G 3.4184 6.8986 103.7049 45.9395 0.0000 175.5816 26 F 4.2504 6.7235 117.0242 59.2113 38.6272 177.0893 27 N 4.2646 7.4844 118.7014 56.4493 38.0872 177.0813 28 K 2.9484 7.2468 117.9543 57.7070 31.7135 178.1434 29 L 4.8037 7.7607 119.3331 53.8726 42.4785 177.5308 30 G 4.1021 7.7400 104.9309 46.1346 0.0000 174.8285 31 L 4.2751 7.5113 119.1199 54.5129 42.5284 175.8918 32 M 4.9998 8.7776 119.9872 53.5156 35.0528 176.7806 33 R 3.1309 9.0841 122.3986 59.7043 29.6348 178.5889 34 D 4.2457 7.8372 117.2521 56.6842 40.5094 177.7802 35 D 4.5704 7.7682 118.6172 56.0675 41.0089 177.4671 36 T 4.1527 7.2513 108.7682 60.8064 69.8614 174.9097 37 I 3.5653 6.5947 121.2854 61.5542 38.4458 174.6222 38 H 4.3603 8.5753 126.7493 56.0606 30.2579 175.3598 39 E 4.1524 8.3931 126.9362 55.6097 28.2285 176.1669 40 N 4.8146 7.8605 123.0433 51.0873 41.2790 174.7454 41 D 4.3200 8.4774 118.8190 57.9790 40.8433 178.3838 42 D 4.3804 8.1685 119.1844 57.6864 40.8132 179.3955 43 V 3.6203 7.9226 117.9455 65.7875 31.7328 177.7362 44 K 3.9353 8.5797 119.8424 59.4295 31.9688 178.4565 45 E 3.9415 8.5638 119.7383 59.0026 29.3496 178.6059 46 A 4.0381 7.7810 119.8914 55.2817 18.8560 179.0711 47 I 3.8392 8.0952 118.7585 64.7336 36.9807 178.5270 48 R 3.8490 7.5795 117.7601 59.5259 30.0936 178.4146 49 R 4.0488 7.7927 115.0609 56.7228 30.4175 177.1844 50 L 3.5210 6.7020 119.3268 53.6849 42.3550 175.7972 51 P 4.5078 0.0000 0.0000 61.9782 33.5901 176.8216 52 E 3.8814 8.7357 119.7550 59.6991 29.3080 178.9120 53 N 4.2964 8.1404 115.9905 56.1350 37.3786 176.7610 54 L 3.7808 7.8248 121.5458 57.1677 41.8117 178.5929 55 Y 3.8644 8.1449 119.5343 60.9396 38.8077 178.0856 56 D 4.4259 8.5153 119.8770 57.4479 40.8949 178.5289 57 D 4.3679 8.3414 119.7171 57.2839 40.7984 178.6469 58 R 3.7335 8.1893 119.4479 59.6473 29.9569 178.9514 59 V 3.4684 7.4977 111.9768 64.2894 31.4193 178.3963 60 F 4.1317 8.1307 120.1269 61.0765 39.1362 177.4323 61 R 3.6798 8.1219 117.7539 59.3648 29.9531 178.8678 62 I 3.5945 7.6986 119.4911 64.4283 37.0803 178.4251 63 K 3.8609 8.0361 120.3436 59.3431 32.0153 178.8468 64 R 3.5708 7.7402 119.2024 59.0856 29.8208 178.4448 65 A 3.8476 8.1439 120.8540 55.2851 18.4967 179.4656 66 L 3.6036 8.2096 117.9211 58.0082 41.7176 179.4928 67 D 4.2618 8.0238 117.8338 57.2279 41.2665 178.2964 68 L 3.9321 7.6734 119.4001 58.0101 41.4807 179.4130 69 S 4.0905 8.5485 112.5315 61.4368 61.9403 175.8558 70 M 4.1860 7.9922 121.2129 58.3758 31.8564 177.5598 71 R 4.4007 7.5183 112.7140 55.1573 30.0020 175.7878 72 Q 3.3293 7.2940 115.3128 57.4654 27.0829 173.6328 73 Q 4.7007 7.4250 116.6940 55.3226 31.3688 174.8744 74 I 4.5875 7.8703 118.1412 60.5710 41.2688 175.0019 75 L 4.4334 8.7892 124.6672 53.7584 42.5189 175.6846 76 P 4.3088 0.0000 0.0000 62.7186 32.2853 177.3599 77 K 2.0000 8.3759 122.0216 58.9165 31.9908 178.7263 78 E 3.9205 7.7640 116.7427 58.6016 29.5449 177.3074 79 Q 4.5061 7.7378 115.9106 55.3478 29.1006 175.9953 80 W 4.7413 7.5646 118.4529 56.6204 29.6904 175.9062 81 T 4.2672 8.4939 116.3307 61.7948 67.5631 174.2675 82 K 4.4838 8.5615 128.0867 55.4875 33.1966 176.2929 83 Y 3.2182 8.6177 123.6149 58.5112 39.6364 175.6765 84 E 3.3576 7.2623 121.7550 56.2806 26.7462 175.1258 85 E 4.4957 7.2827 114.1018 56.6701 33.4961 174.7384 86 D 4.6569 7.7486 118.0791 53.2431 40.1141 174.8541 87 K 4.1684 8.4289 125.6963 56.2014 32.9225 178.8560 88 S 4.5087 8.3890 121.8255 56.5123 61.7648 174.1072 89 Y 4.2163 7.7644 123.8418 60.7749 38.6191 179.4349 90 L 4.3549 7.6482 120.7184 57.5123 41.6793 178.7336 91 E 3.8031 7.7014 118.9103 59.1365 29.6791 177.5095 92 P 4.2036 0.0000 0.0000 65.6295 31.3689 178.3902 93 Y 4.0355 7.7062 115.1688 60.8566 37.9752 177.7487 94 L 3.9955 8.2598 121.4815 57.9733 42.1410 178.7777 95 K 3.8774 8.6531 119.8978 59.7178 32.0506 178.3822 96 E 3.9259 8.0514 118.9737 59.1523 29.5155 178.9326 97 V 3.6138 7.9555 118.5527 65.9043 31.4969 178.1777 98 I 3.7406 7.9259 119.7011 64.3165 36.9884 178.3310 99 R 3.9088 8.1518 119.7202 59.4701 29.9822 178.4537 100 E 3.9762 8.4770 118.6479 59.3698 29.3760 179.3334 101 R 3.9303 8.0909 118.7833 59.3955 30.1611 178.7247 102 K 3.9940 8.4716 118.7480 59.3627 31.9376 178.9899 103 E 4.0579 8.2667 119.7244 59.1821 29.5577 179.0117 104 R 3.9762 7.8560 117.7055 59.4624 29.9614 178.7963 105 E 4.0383 8.3284 117.2778 59.5237 29.7070 179.0802 106 E 4.1383 8.4204 118.5917 59.3060 29.6251 179.4377 107 W 3.8857 8.6631 118.8639 59.5034 28.9354 177.9974 108 A 4.3619 8.1505 118.9427 53.8622 17.8617 178.8560 109 K 4.2159 7.7411 116.7016 57.8468 32.6561 176.8484 110 K 4.0899 7.4545 120.9382 56.9897 32.5502 176.5855 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 6 V 8.05 4.12 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 0.97 0.00 0.00 0.95 0.00 0.00 7 S 7.76 4.35 0.00 3.99 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 8 A 9.52 3.99 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 9 S 8.12 4.18 0.00 3.93 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 10 S 8.12 4.19 0.00 4.14 3.96 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 0.00 0.00 0.00 11 R 8.11 4.01 0.00 2.17 2.07 0.00 3.18 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 12 W 8.14 4.29 0.00 3.50 3.24 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 13 L 8.44 3.91 0.00 1.84 1.82 0.91 1.13 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 14 E 8.60 4.06 0.00 2.37 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 2.40 2.49 0.00 15 G 8.29 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.42 3.51 1.80 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.39 0.86 0.00 0.00 17 R 8.14 3.98 0.00 2.04 2.09 0.00 3.20 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 1.70 1.83 0.00 18 K 7.85 2.96 0.00 1.23 1.65 0.00 1.55 0.00 0.00 1.49 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.18 0.64 7.81 19 W 8.39 4.02 0.00 3.32 3.34 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 20 Y 8.37 2.97 0.00 3.19 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 21 Y 7.97 3.87 0.00 3.34 3.09 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 22 N 7.88 4.03 0.00 2.82 2.66 0.00 0.00 7.32 7.25 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 23 A 6.90 3.63 0.42 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 0.00 0.00 24 A 7.35 3.54 0.65 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 0.00 0.00 0.00 25 G 6.90 3.42 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 0.00 0.00 0.00 26 F 6.72 4.25 0.00 3.00 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 27 N 7.48 4.26 0.00 2.58 3.20 0.00 0.00 7.18 6.94 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 28 K 7.25 2.95 0.00 1.47 1.28 0.00 1.01 0.00 0.00 1.05 0.00 0.00 2.13 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.30 0.21 7.81 29 L 7.76 4.80 0.00 1.72 1.58 0.86 0.67 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 30 G 7.74 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 0.00 0.00 0.00 31 L 7.51 4.28 0.00 1.80 1.62 0.88 0.73 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 32 M 8.78 5.00 0.00 2.19 2.18 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 2.66 2.72 0.00 33 R 9.08 3.13 0.00 2.23 1.95 0.00 3.21 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.71 0.00 34 D 7.84 4.25 0.00 1.92 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 35 D 7.77 4.57 0.00 2.74 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 36 T 7.25 4.15 3.97 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 0.62 0.00 0.00 37 I 6.59 3.57 1.90 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.03 0.87 0.00 0.00 38 H 8.58 4.36 0.00 3.12 3.18 0.00 5.79 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.39 4.15 0.00 1.93 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 2.28 2.26 0.00 40 N 7.86 4.81 0.00 2.96 2.94 0.00 0.00 6.14 8.07 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 41 D 8.48 4.32 0.00 2.74 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 42 D 8.17 4.38 0.00 2.82 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 43 V 7.92 3.62 2.27 0.00 0.00 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 0.95 0.00 0.00 44 K 8.58 3.94 0.00 2.12 1.79 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.50 7.81 45 E 8.56 3.94 0.00 2.12 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 0.00 2.32 2.39 0.00 46 A 7.78 4.04 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 0.00 0.00 47 I 8.10 3.84 2.11 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 1.72 1.25 1.09 0.00 0.00 48 R 7.58 3.85 0.00 2.00 2.14 0.00 3.23 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 49 R 7.79 4.05 0.00 1.90 1.98 0.00 3.33 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 50 L 6.70 3.52 0.00 1.75 1.53 0.99 0.88 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 51 P 0.00 4.51 0.00 2.35 2.19 0.00 3.41 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 52 E 8.74 3.88 0.00 2.07 2.02 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 2.38 2.48 0.00 53 N 8.14 4.30 0.00 2.98 3.06 0.00 0.00 6.14 6.67 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 54 L 7.82 3.78 0.00 1.77 1.53 1.06 0.69 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 Y 8.14 3.86 0.00 3.03 3.05 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 0.00 0.00 0.00 56 D 8.52 4.43 0.00 2.89 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 57 D 8.34 4.37 0.00 2.72 2.65 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 0.00 58 R 8.19 3.73 0.00 1.43 1.81 0.00 3.16 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.67 0.00 59 V 7.50 3.47 2.02 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 0.32 0.00 0.00 0.94 0.00 0.00 60 F 8.13 4.13 0.00 3.10 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 61 R 8.12 3.68 0.00 2.00 1.99 0.00 3.53 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 62 I 7.70 3.59 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.73 0.84 0.00 0.00 63 K 8.04 3.86 0.00 1.81 1.72 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.38 7.81 64 R 7.74 3.57 0.00 1.30 1.70 0.00 3.07 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.30 0.00 65 A 8.14 3.85 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 66 L 8.21 3.60 0.00 1.59 1.70 0.87 0.91 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 67 D 8.02 4.26 0.00 2.76 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 68 L 7.67 3.93 0.00 1.89 1.82 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.55 4.09 0.00 3.75 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 70 M 7.99 4.19 0.00 2.30 2.01 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 71 R 7.52 4.40 0.00 2.03 1.99 0.00 3.27 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.65 0.00 72 Q 7.29 3.33 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.38 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 73 Q 7.43 4.70 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.93 6.65 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 74 I 7.87 4.59 1.87 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.21 1.06 0.00 0.00 75 L 8.79 4.43 0.00 1.93 1.81 1.01 0.98 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 76 P 0.00 4.31 0.00 2.16 1.97 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 2.15 2.13 0.00 77 K 8.38 2.00 0.00 0.97 1.25 0.00 1.26 0.00 0.00 1.43 0.00 0.00 2.63 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.31 0.21 7.81 78 E 7.76 3.92 0.00 1.94 1.92 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 2.20 2.17 0.00 79 Q 7.74 4.51 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 80 W 7.56 4.74 0.00 3.36 3.09 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 81 T 8.49 4.27 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 1.52 0.00 0.00 82 K 8.56 4.48 0.00 1.97 1.80 0.00 2.03 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.52 7.81 83 Y 8.62 3.22 0.00 2.23 2.65 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 0.00 84 E 7.26 3.36 0.00 1.68 1.71 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 1.47 1.47 0.00 85 E 7.28 4.50 0.00 1.86 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 0.00 2.17 2.24 0.00 86 D 7.75 4.66 0.00 2.84 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 0.00 0.00 0.00 0.00 87 K 8.43 4.17 0.00 1.93 1.86 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.43 7.81 88 S 8.39 4.51 0.00 4.01 3.97 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 0.00 89 Y 7.76 4.22 0.00 3.18 3.23 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 90 L 7.65 4.35 0.00 1.52 1.65 0.90 0.91 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 91 E 7.70 3.80 0.00 2.09 1.92 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 2.29 2.38 0.00 92 P 0.00 4.20 0.00 1.73 1.89 0.00 3.83 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 93 Y 7.71 4.04 0.00 3.18 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 94 L 8.26 4.00 0.00 1.91 1.76 0.91 0.54 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 95 K 8.65 3.88 0.00 1.89 1.90 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.45 7.81 96 E 8.05 3.93 0.00 2.10 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 0.00 2.32 2.38 0.00 97 V 7.96 3.61 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 1.02 0.00 0.00 98 I 7.93 3.74 2.05 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 1.42 0.56 0.92 0.00 0.00 99 R 8.15 3.91 0.00 1.96 2.11 0.00 3.16 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 100 E 8.48 3.98 0.00 2.30 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 2.33 2.39 0.00 101 R 8.09 3.93 0.00 1.90 2.07 0.00 3.22 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.68 0.00 102 K 8.47 3.99 0.00 1.97 1.87 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.61 7.81 103 E 8.27 4.06 0.00 2.13 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 0.00 2.43 2.57 0.00 104 R 7.86 3.98 0.00 2.19 2.00 0.00 3.19 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 105 E 8.33 4.04 0.00 2.11 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 2.38 2.47 0.00 106 E 8.42 4.14 0.00 2.22 1.98 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 2.52 2.51 0.00 107 W 8.66 3.89 0.00 3.69 3.38 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 0.00 108 A 8.15 4.36 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 0.00 0.00 0.00 0.00 0.00 109 K 7.74 4.22 0.00 1.86 1.85 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.66 7.81 110 K 7.45 4.09 0.00 1.77 1.63 0.00 1.21 0.00 0.00 1.10 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.13 7.81