NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 H 4.7635 8.4293 117.8395 55.8005 30.5424 173.1910 1 M 4.1893 7.7363 117.2944 54.1478 32.9702 174.6223 2 K 4.6771 8.6750 122.9383 55.3953 34.6069 176.8118 3 C 4.2852 9.1846 127.1707 59.0978 32.0504 172.4990 4 P 4.5103 0.0000 0.0000 64.2008 30.9748 176.6619 5 V 3.9931 7.3452 117.6635 64.4544 32.3877 176.1379 6 C 4.1506 7.7342 113.3185 58.2670 30.4262 174.3269 7 H 4.3249 7.9807 115.4083 56.6840 26.5626 174.8286 8 Q 4.5827 7.7751 115.9470 55.4771 30.3873 175.5573 9 G 4.3226 7.8815 105.6782 44.1604 0.0000 171.5693 10 E 4.8986 8.5818 120.9817 55.2529 31.8760 174.8958 11 M 4.8581 8.8996 125.4803 54.7540 32.9233 175.9430 12 V 4.5281 8.8145 124.8695 60.4883 34.6263 174.8453 13 S 4.6274 8.9489 123.3307 59.0934 63.4261 173.9392 14 G 4.2781 8.6282 111.3684 46.1918 0.0000 171.8550 15 I 5.4001 8.5077 114.5548 59.2363 41.2107 175.1215 16 K 4.4114 8.7725 123.7396 54.8608 35.9098 174.6971 17 D 4.9956 8.6717 126.9840 54.1366 41.9363 175.6377 18 I 4.4508 9.0877 125.7277 58.8167 39.1084 173.6921 19 P 4.8771 0.0000 0.0000 63.0053 32.2096 175.5346 20 Y 4.8760 8.8476 122.9702 56.6334 42.6914 173.6553 21 T 5.2689 7.6518 121.5595 61.8041 72.2962 173.2664 22 F 4.8227 9.2694 127.3120 57.8828 42.3894 174.5362 23 R 3.5242 9.2591 126.3998 56.9689 27.4642 177.3937 24 G 3.9208 8.3610 105.5168 45.2903 0.0000 174.3872 25 R 4.4408 8.0587 120.3388 55.2056 31.1239 175.3218 26 K 5.1637 8.5838 121.7091 55.2109 34.7116 175.1460 27 T 4.6131 8.7973 117.4342 60.7001 71.8398 172.1859 28 V 4.7001 8.0479 122.9924 60.8984 33.9303 174.5974 29 L 4.3541 9.0889 129.2311 54.0448 42.4315 176.1306 30 K 4.7216 8.7158 123.7882 55.2209 34.1219 176.5809 31 G 3.8360 9.1890 110.5157 46.6482 0.0000 174.0511 32 I 4.0595 8.0085 121.9416 60.9567 37.9458 175.8393 33 H 4.8003 9.1651 125.3635 55.8450 29.6686 175.1148 34 G 3.6196 8.3812 108.3437 46.0240 0.0000 171.5488 35 L 4.9333 7.9159 120.3704 53.7712 43.2997 176.0807 36 Y 5.1385 8.5297 120.7747 56.0043 40.4117 174.5754 37 C 4.7300 9.0018 124.4185 59.3120 32.2375 174.5905 38 V 3.8510 8.6381 126.5286 66.2024 31.2822 176.5984 39 H 4.5237 7.9110 117.5913 57.6607 30.5314 173.6600 40 C 5.1668 7.6755 112.6854 56.9156 31.7094 172.7744 41 E 4.3105 8.6797 117.3172 57.0382 29.9121 175.9530 42 E 4.0976 8.1748 121.3301 57.0816 30.3123 175.7660 43 S 5.0704 8.6360 120.1885 56.5821 66.6951 173.5981 44 I 4.4114 8.6247 121.8272 60.1411 40.4055 174.1152 45 M 5.0116 8.4197 126.8619 53.4866 34.3673 177.0490 46 N 4.7101 9.0510 123.0585 52.7667 40.1920 176.8391 47 K 3.9586 8.4043 123.7402 60.0983 31.8010 174.3813 48 E 4.1277 8.2080 120.5390 59.3426 29.4787 178.8012 49 E 4.0040 9.5808 119.4831 59.3796 29.5675 179.3744 50 S 4.1740 8.4065 115.5859 61.7521 62.8997 176.4797 51 D 4.3257 8.5069 121.5347 57.3750 40.6194 178.5845 52 A 3.9899 7.9769 121.1648 55.2266 18.2670 179.4812 53 F 3.9930 8.3235 118.8137 61.8972 39.5647 177.3051 54 M 3.8537 8.7330 118.4334 58.2418 31.5885 178.6841 55 A 3.9988 8.1840 121.1487 55.0511 18.4179 179.7750 56 Q 3.7898 7.7833 116.5940 58.9556 28.8087 178.9193 57 V 3.0349 7.3013 119.4311 65.7765 31.4230 177.9199 58 K 3.7852 8.2591 119.3892 59.3863 32.0926 178.5572 59 A 3.9520 8.1978 121.3276 54.9943 18.2665 179.4028 60 F 4.2283 8.4179 119.3694 61.5978 39.4469 177.5565 61 R 3.5915 8.0271 117.4202 59.1198 29.7686 178.8605 62 A 4.8025 8.1132 122.0891 54.7536 18.1106 179.8662 63 S 4.0968 7.7512 111.6708 61.2422 63.5123 176.6887 64 V 3.5854 7.6645 121.9057 66.0124 31.3279 177.8098 65 N 4.3708 8.5806 116.3214 56.1370 38.1751 176.6365 66 A 4.7730 7.5560 121.1298 53.0600 18.5903 178.8513 67 E 4.0599 7.9227 117.3614 58.3766 29.6181 177.6547 68 T 4.4422 7.4820 106.6044 61.4864 70.8176 174.9180 69 V 4.1822 7.2170 121.0161 60.2504 34.3702 172.6744 70 A 4.4520 8.5382 127.8087 50.9628 19.2022 176.1044 71 P 4.3505 0.0000 0.0000 66.0178 31.3623 178.7289 72 E 4.0429 8.2076 116.8506 59.1758 29.4295 178.9071 73 F 4.1885 8.2449 120.4402 61.2378 39.4405 177.2233 74 I 3.5809 7.8509 118.8954 64.4464 37.0119 178.3022 75 V 3.6151 7.7358 118.9582 65.8694 31.3985 177.8709 76 K 3.8399 8.0108 119.2313 59.6725 32.0635 179.0262 77 V 3.4864 7.5449 118.3786 65.5098 31.2884 178.0386 78 R 3.7643 7.8818 118.6838 59.4835 30.0905 178.7520 79 K 3.9905 8.1758 118.1836 59.1789 31.7290 179.2694 80 K 4.0353 7.6168 118.9715 58.8335 32.2023 177.9158 81 L 4.2920 7.6439 116.5976 53.6633 42.6263 176.4992 82 S 3.7899 7.6079 113.7482 60.0251 60.7107 172.1958 83 L 5.5107 7.9423 117.8055 52.1448 44.5048 178.1609 84 T 4.2995 8.2252 113.0354 60.9532 71.4672 175.8423 85 Q 3.8371 8.3713 119.0613 58.9181 28.7900 178.7885 86 K 3.9645 7.9535 120.2390 59.4801 31.8667 178.6331 87 E 4.3386 8.2559 120.1118 58.7911 29.3324 179.1314 88 A 3.9864 8.1942 121.5298 55.0452 18.3697 179.8735 89 S 4.6614 8.4354 113.2732 61.7262 63.0137 176.5364 90 E 4.0866 8.1671 121.9102 59.0600 28.9153 179.4110 91 I 3.6354 7.1383 118.2623 64.1135 37.5348 177.9279 92 F 4.6797 8.3892 116.1998 57.6166 39.3727 176.1946 93 G 3.9244 8.0972 104.9184 44.5759 0.0000 173.3255 94 G 3.9806 8.7667 105.7932 44.5315 0.0000 175.0076 95 G 4.1012 8.1990 104.0994 45.0870 0.0000 174.8173 96 V 3.7302 8.0763 111.0897 63.5353 31.8807 177.6040 97 N 4.4963 8.1966 115.3690 54.3470 39.1437 176.6205 98 A 3.4783 7.8056 120.7488 55.7167 18.3291 179.7154 99 F 3.7211 8.1766 114.7919 60.0528 39.2596 177.9101 100 S 4.1036 7.9875 112.8124 61.3488 62.3499 176.2581 101 R 3.9057 7.6776 120.5800 59.2901 29.8149 178.6330 102 Y 4.5767 7.1466 117.8697 60.8154 37.6960 178.4263 103 E 4.1887 8.2769 117.8226 58.5646 29.7122 178.6720 104 K 4.2990 7.8960 116.7992 56.7422 32.6749 177.8498 105 G 3.9853 7.9606 107.5021 45.5074 0.0000 174.7725 106 N 4.4831 7.8861 116.8885 54.1262 38.8932 175.3448 107 A 4.8544 7.6718 119.9199 50.1244 22.3205 174.2949 108 Q 4.4928 8.6686 122.2246 54.2347 29.9890 174.2124 109 P 3.8052 0.0000 0.0000 61.8704 32.2194 176.2488 110 H 4.1492 8.3290 119.4121 55.8587 31.7816 174.6180 111 P 4.2379 0.0000 0.0000 65.7480 31.1543 178.9901 112 S 4.3536 8.3000 113.2318 61.1299 62.9414 176.6015 113 T 3.9777 7.7318 118.4798 66.4957 68.2885 176.6441 114 I 3.6990 7.6245 121.6764 64.4904 37.2105 178.7668 115 K 4.0578 8.1183 119.2732 59.3051 31.8197 179.2815 116 L 4.1061 8.2463 120.8282 58.0398 42.1563 178.9535 117 L 4.0470 8.1845 119.1173 57.7754 41.6425 179.7514 118 R 4.2934 8.2052 118.2460 59.1337 30.0007 179.1098 119 V 3.7672 8.0107 118.1095 66.1469 31.1418 177.9541 120 L 4.3799 8.1308 117.7943 56.8781 41.3066 178.7864 121 D 4.2900 7.7716 117.7282 56.8841 41.2487 177.3722 122 K 4.2351 7.5732 117.5652 57.3263 34.1832 176.3338 123 H 5.1001 8.1541 115.7224 52.6916 29.0902 172.1968 124 P 4.5085 0.0000 0.0000 65.1551 31.5066 178.4509 125 E 4.0533 8.2417 116.8263 59.0571 29.5818 178.5572 126 L 4.1747 7.9053 119.1100 56.5680 41.5908 178.7690 127 L 4.0266 7.9921 121.1644 57.9544 41.7850 178.3021 128 N 4.4736 7.8250 115.0573 55.6166 38.4593 176.7061 129 E 4.2025 7.8588 119.7356 57.9857 29.7216 177.3005 130 I 4.4096 7.3663 108.2665 60.0121 39.0934 175.2375 131 R 3.9355 7.9451 126.7374 56.7725 29.7882 175.7495 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 0 H 8.43 4.76 0.00 3.18 3.37 0.00 5.66 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 7.74 4.19 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 2 K 8.68 4.68 0.00 2.06 1.75 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.00 7.81 3 C 9.18 4.29 0.00 3.07 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 4 P 0.00 4.51 0.00 2.22 2.17 0.00 3.79 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 2.11 1.94 0.00 5 V 7.35 3.99 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 0.84 0.00 0.00 1.00 0.00 0.00 6 C 7.73 4.15 0.00 3.06 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 7 H 7.98 4.32 0.00 3.34 3.39 0.00 5.60 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 7.78 4.58 0.00 1.60 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.23 2.46 0.00 9 G 7.88 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 0.00 0.00 0.00 0.00 10 E 8.58 4.90 0.00 2.09 1.84 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 2.43 2.41 0.00 11 M 8.90 4.86 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 12 V 8.81 4.53 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 1.03 0.00 0.00 0.96 0.00 0.00 13 S 8.95 4.63 0.00 3.94 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 14 G 8.63 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 0.00 0.00 0.00 0.00 15 I 8.51 5.40 1.68 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.70 0.62 0.00 0.00 16 K 8.77 4.41 0.00 0.79 1.34 0.00 0.61 0.00 0.00 1.38 0.00 0.00 2.66 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.07 0.95 7.81 17 D 8.67 5.00 0.00 2.57 2.58 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 18 I 9.09 4.45 2.14 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.06 1.15 0.00 0.00 19 P 0.00 4.88 0.00 1.97 1.99 0.00 3.71 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 20 Y 8.85 4.88 0.00 3.00 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 21 T 7.65 5.27 4.14 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 1.26 0.00 0.00 22 F 9.27 4.82 0.00 3.12 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 23 R 9.26 3.52 0.00 1.40 1.57 0.00 2.94 0.00 0.00 2.91 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.50 0.00 24 G 8.36 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 25 R 8.06 4.44 0.00 2.11 2.11 0.00 3.11 0.00 0.00 3.09 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 26 K 8.58 5.16 0.00 1.91 1.72 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 0.97 7.81 27 T 8.80 4.61 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 28 V 8.05 4.70 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 0.87 0.00 0.00 0.91 0.00 0.00 29 L 9.09 4.35 0.00 1.67 1.56 0.39 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.72 4.72 0.00 1.63 1.72 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.62 7.81 31 G 9.19 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 0.00 0.00 0.00 32 I 8.01 4.06 2.09 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.11 0.99 0.00 0.00 33 H 9.17 4.80 0.00 3.07 3.44 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.38 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.92 4.93 0.00 1.54 1.48 0.86 0.76 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 36 Y 8.53 5.14 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 37 C 9.00 4.73 0.00 3.04 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 38 V 8.64 3.85 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 0.78 0.00 0.00 0.96 0.00 0.00 39 H 7.91 4.52 0.00 3.15 3.29 0.00 5.75 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 C 7.68 5.17 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.68 4.31 0.00 2.00 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 2.28 2.24 0.00 42 E 8.17 4.10 0.00 2.09 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 2.37 2.38 0.00 43 S 8.64 5.07 0.00 3.41 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 44 I 8.62 4.41 1.75 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.67 0.84 0.00 0.00 45 M 8.42 5.01 0.00 1.79 1.86 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 46 N 9.05 4.71 0.00 2.96 2.96 0.00 0.00 7.08 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 47 K 8.40 3.96 0.00 1.78 1.86 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.06 7.81 48 E 8.21 4.13 0.00 2.11 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 2.38 1.99 0.00 49 E 9.58 4.00 0.00 2.23 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 2.35 2.43 0.00 50 S 8.41 4.17 0.00 4.06 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 51 D 8.51 4.33 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.98 3.99 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 53 F 8.32 3.99 0.00 3.23 3.27 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 0.00 0.00 0.00 0.00 54 M 8.73 3.85 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.00 2.68 0.00 55 A 8.18 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 56 Q 7.78 3.79 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 57 V 7.30 3.03 1.68 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 0.53 0.00 0.00 -0.30 0.00 0.00 58 K 8.26 3.79 0.00 1.80 1.83 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.39 7.81 59 A 8.20 3.95 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 60 F 8.42 4.23 0.00 3.00 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 61 R 8.03 3.59 0.00 1.59 1.13 0.00 3.11 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.74 0.00 62 A 8.11 4.80 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 63 S 7.75 4.10 0.00 4.07 4.01 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 0.00 0.00 0.00 64 V 7.66 3.59 2.25 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 0.96 0.00 0.00 0.18 0.00 0.00 65 N 8.58 4.37 0.00 2.90 2.89 0.00 0.00 6.99 7.54 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 66 A 7.56 4.77 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 67 E 7.92 4.06 0.00 2.03 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 2.32 2.60 0.00 68 T 7.48 4.44 4.16 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 1.14 0.00 0.00 69 V 7.22 4.18 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 0.61 0.00 0.00 0.96 0.00 0.00 70 A 8.54 4.45 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 71 P 0.00 4.35 0.00 2.20 2.37 0.00 3.63 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 72 E 8.21 4.04 0.00 2.12 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 2.43 2.46 0.00 73 F 8.24 4.19 0.00 3.13 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 74 I 7.85 3.58 2.11 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 1.57 0.67 1.05 0.00 0.00 75 V 7.74 3.62 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 1.12 0.00 0.00 76 K 8.01 3.84 0.00 2.02 1.81 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.43 7.81 77 V 7.54 3.49 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 0.88 0.00 0.00 0.25 0.00 0.00 78 R 7.88 3.76 0.00 2.00 2.03 0.00 3.02 0.00 0.00 2.90 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.48 0.00 79 K 8.18 3.99 0.00 1.82 1.83 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.67 7.81 80 K 7.62 4.04 0.00 1.82 1.93 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 81 L 7.64 4.29 0.00 1.82 1.71 1.07 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.61 3.79 0.00 3.99 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 83 L 7.94 5.51 0.00 1.55 1.46 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 84 T 8.23 4.30 4.22 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 1.19 0.00 0.00 85 Q 8.37 3.84 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.94 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 86 K 7.95 3.96 0.00 1.82 1.79 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.61 1.53 7.81 87 E 8.26 4.34 0.00 2.18 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 2.15 0.00 88 A 8.19 3.99 0.43 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 89 S 8.44 4.66 0.00 4.38 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 0.00 90 E 8.17 4.09 0.00 2.20 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 2.33 2.56 0.00 91 I 7.14 3.64 1.26 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.42 0.16 0.00 0.00 92 F 8.39 4.68 0.00 3.54 3.32 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 93 G 8.10 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 94 G 8.77 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 0.00 0.00 0.00 95 G 8.20 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 96 V 8.08 3.73 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 0.89 0.00 0.00 0.94 0.00 0.00 97 N 8.20 4.50 0.00 2.72 2.81 0.00 0.00 7.01 8.12 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 98 A 7.81 3.48 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 99 F 8.18 3.72 0.00 3.10 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 0.00 100 S 7.99 4.10 0.00 4.08 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 0.00 101 R 7.68 3.91 0.00 1.78 1.90 0.00 3.15 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.76 0.00 102 Y 7.15 4.58 0.00 2.82 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 0.00 103 E 8.28 4.19 0.00 2.06 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 2.46 2.61 0.00 104 K 7.90 4.30 0.00 1.88 1.91 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.58 7.81 105 G 7.96 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 0.00 0.00 0.00 106 N 7.89 4.48 0.00 2.76 2.85 0.00 0.00 6.58 6.74 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 0.00 107 A 7.67 4.85 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 0.00 108 Q 8.67 4.49 0.00 2.30 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 109 P 0.00 3.81 0.00 1.63 0.84 0.00 3.51 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.80 0.00 110 H 8.33 4.15 0.00 3.16 3.13 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.24 0.00 2.15 2.04 0.00 3.12 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.07 0.00 112 S 8.30 4.35 0.00 3.91 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 0.00 113 T 7.73 3.98 4.24 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 1.00 0.00 0.00 114 I 7.62 3.70 1.97 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.77 0.86 0.00 0.00 115 K 8.12 4.06 0.00 1.92 1.89 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.58 7.81 116 L 8.25 4.11 0.00 1.97 1.88 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.18 4.05 0.00 2.10 1.70 0.83 0.29 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 0.00 118 R 8.21 4.29 0.00 2.13 2.05 0.00 3.07 0.00 0.00 2.82 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.87 0.00 119 V 8.01 3.77 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 1.11 0.00 0.00 0.99 0.00 0.00 120 L 8.13 4.38 0.00 1.84 1.77 1.16 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 121 D 7.77 4.29 0.00 2.80 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 0.00 122 K 7.57 4.24 0.00 1.85 1.68 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.99 1.35 7.81 123 H 8.15 5.10 0.00 3.30 3.32 0.00 5.68 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.51 0.00 2.27 2.32 0.00 3.98 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.89 0.00 125 E 8.24 4.05 0.00 2.19 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 0.00 2.38 2.36 0.00 126 L 7.91 4.17 0.00 1.89 1.78 0.93 0.32 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 0.00 127 L 7.99 4.03 0.00 1.80 1.76 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 128 N 7.83 4.47 0.00 2.71 2.86 0.00 0.00 7.06 8.81 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 0.00 129 E 7.86 4.20 0.00 2.13 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 2.34 2.31 0.00 130 I 7.37 4.41 1.82 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 1.27 0.59 0.90 0.00 0.00 131 R 7.95 3.94 0.00 1.98 1.81 0.00 3.25 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.48 0.00