NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3623 0.0000 0.0000 61.8889 32.6005 175.8138 3 K 3.7625 8.7919 121.2033 55.8238 32.5409 174.9046 4 K 4.1565 9.5764 127.0838 56.6495 33.9728 175.2591 5 V 4.9670 8.3391 125.6798 61.1911 33.3063 174.4057 6 L 4.8611 9.0785 126.8202 53.1779 45.9542 175.4489 7 T 4.4135 7.9271 116.7029 62.2181 71.7863 173.5147 8 G 3.9537 8.4357 110.3998 46.1646 0.0000 171.8540 9 V 4.7446 7.8678 119.0864 61.0998 34.1797 175.0466 10 V 4.2257 8.0320 126.9539 62.4562 32.2528 176.3517 11 V 4.3168 8.6761 120.6258 60.8800 32.7303 175.6848 12 S 4.5569 7.7477 114.8647 57.8855 65.2883 174.6550 13 D 4.7844 8.8808 125.6967 54.6718 42.3940 178.1849 14 K 3.8707 7.2989 118.1727 57.8979 32.6254 176.1232 15 M 4.8443 8.2494 118.2646 53.1250 35.0154 175.3775 16 Q 4.0756 8.5782 120.9125 56.7914 29.4285 176.5535 17 K 4.6261 9.2379 121.6711 57.1453 29.9431 174.5497 18 T 5.2192 7.5321 113.8226 62.4858 72.6734 173.8723 19 V 4.6820 8.7917 119.3742 59.8211 35.5754 174.9610 20 T 4.7379 8.2845 121.0112 62.6043 69.9083 174.0651 21 V 4.5370 8.9680 128.3818 60.9410 33.6437 174.7338 22 L 4.4887 8.7502 132.4571 54.6511 42.8360 175.5208 23 V 4.5572 8.9099 128.5047 61.4007 32.9426 174.3882 24 E 4.6959 8.7374 129.2112 55.4695 30.9256 175.1284 25 R 4.8847 9.4884 125.5002 54.7610 33.9525 173.8685 26 Q 5.1848 8.5545 121.8665 54.0893 32.8438 174.4107 27 F 4.8225 8.0803 116.1344 55.6874 41.5594 171.2798 28 P 5.0023 0.0000 0.0000 62.2920 32.3122 175.5885 29 H 4.3708 8.8521 123.5591 55.2453 30.2841 174.2990 30 P 4.3187 0.0000 0.0000 65.0931 30.9661 176.6052 31 L 4.5199 7.8830 117.4742 55.0713 43.9801 176.0743 32 Y 4.8080 8.0324 113.1562 57.1425 39.0710 176.0377 33 G 4.3067 8.0245 115.1452 46.5158 0.0000 173.6532 34 K 4.0032 7.5515 120.0983 54.0480 33.4361 174.9019 35 V 4.0874 8.5140 128.3488 63.0328 31.9462 175.0634 36 I 4.3884 8.6706 122.2164 58.9721 40.7753 174.4366 37 K 4.7748 8.3366 123.8139 54.8806 34.2109 174.9590 38 R 4.8886 8.5943 127.8413 55.0227 33.5911 173.9285 39 S 5.0953 8.3642 114.0253 57.7659 65.9483 173.5703 40 K 4.5726 9.0619 120.5014 55.2539 35.8889 174.3380 41 K 4.9184 8.4906 126.0048 55.4811 33.5337 175.3807 42 Y 4.4888 8.9719 122.8880 56.1603 40.8404 175.1795 43 L 4.9549 8.6996 123.7369 53.6841 42.0945 175.8278 44 A 4.9096 8.7154 126.4461 50.8211 21.4301 175.3522 45 H 4.8773 9.4115 120.9571 55.7204 31.1894 174.1624 46 D 5.0911 8.4849 126.2762 51.2908 40.3275 173.9229 47 P 4.1685 0.0000 0.0000 65.2638 31.8132 178.5414 48 E 4.4041 7.8156 114.6666 58.5903 30.4555 176.6677 49 E 3.9421 7.9093 114.6367 57.5335 27.2556 176.1900 50 K 3.9346 8.2067 122.3015 58.2186 33.2449 176.0587 51 Y 4.6227 8.4696 115.7359 56.1909 39.8065 174.5927 52 K 5.0267 9.4953 121.8839 53.7132 35.9800 175.3684 53 L 4.1786 8.5039 121.2606 57.3342 41.9789 177.2737 54 G 3.8810 8.7191 113.4189 45.2919 0.0000 172.8158 55 D 4.7954 7.8432 120.5359 53.1221 41.9917 176.0939 56 V 4.0303 8.5599 125.5577 63.0229 32.6142 175.4336 57 V 4.9156 9.0277 120.6011 59.6614 36.4026 174.4078 58 E 4.8773 8.6491 121.7765 55.4540 31.6348 175.4084 59 I 4.8878 9.5677 123.3768 59.4092 40.9647 174.2775 60 I 5.0038 8.6397 126.2006 58.7083 40.7871 174.2322 61 E 3.2023 9.5776 131.5317 56.9241 29.8943 175.9805 62 S 4.6751 7.6967 121.4679 56.4905 67.8623 173.6792 63 R 3.8849 8.4445 121.1849 55.4438 30.2904 174.1466 64 P 4.1276 0.0000 0.0000 63.6643 31.5832 176.1042 65 I 4.1010 8.0543 123.9646 62.4571 38.1140 175.6769 66 S 4.4744 7.0961 111.2515 58.2587 65.8598 175.3321 67 K 4.1619 7.5740 121.0745 56.3672 32.7599 177.0757 68 R 3.6253 8.6774 117.7300 56.2252 28.6398 176.1839 69 K 4.5939 7.8342 117.7181 55.4502 33.3831 175.8160 70 R 4.8120 8.2912 130.0333 54.4646 30.7305 174.6635 71 F 5.0357 8.0328 115.2959 56.6263 44.0220 174.8254 72 R 5.1245 8.6756 119.8577 54.1814 34.0825 175.2135 73 V 3.8891 7.9444 122.0207 62.6855 31.2094 175.7530 74 L 4.2482 8.7320 131.6081 57.7150 42.6687 176.4486 75 R 4.5944 7.4285 112.4780 55.8873 32.6617 172.2655 76 L 4.8121 8.6323 121.3615 54.1189 42.6177 176.0260 77 V 4.0335 9.0198 128.3379 64.9566 31.8417 175.6370 78 E 4.7603 7.8124 117.2373 54.8429 32.9384 174.1068 79 S 5.1221 8.3511 116.6399 56.2922 64.0792 172.6191 80 G 3.7960 8.8971 110.4961 44.9858 0.0000 173.5880 81 R 5.3633 7.7837 133.6174 56.7202 28.6235 174.4260 82 M 4.4115 7.5404 124.3452 57.0821 32.5887 176.8341 83 D 4.3083 8.1028 120.4539 56.6830 39.2548 178.6870 84 L 3.9257 7.6043 118.7273 57.6078 41.7964 179.2919 85 V 3.6716 7.9575 117.5900 66.4735 31.2006 177.5703 86 E 3.9375 9.1694 119.1200 59.1975 29.3143 179.0378 87 K 3.8578 7.9577 118.1191 60.0141 32.2662 178.1233 88 Y 4.1188 8.0335 119.1172 60.9960 38.7037 178.1306 89 L 3.6673 8.5594 119.8266 57.9372 41.7511 179.8475 90 I 3.6009 8.1910 119.7846 64.3363 36.8369 178.3662 91 R 3.8001 7.6993 118.4145 59.4058 29.5847 178.2387 92 R 3.0102 7.4059 118.4050 58.9964 29.9226 178.2962 93 Q 3.9556 7.8934 119.4191 58.9979 28.9682 177.7920 94 N 4.3246 8.4782 118.2227 56.5685 38.7099 176.6863 95 Y 4.2093 8.3771 116.9661 61.7972 37.6243 180.9544 96 Q 2.9831 8.0110 117.6184 57.2886 31.7788 176.8340 97 S 4.6773 7.6043 107.7167 58.0390 66.0271 175.7328 98 L 4.4863 7.8187 122.3232 55.8555 38.7075 176.3376 99 S 4.4043 7.6467 110.1335 58.4603 65.4289 174.5113 100 K 4.3568 8.5187 123.5840 55.6967 33.4133 176.0297 101 R 4.4185 8.4841 114.6965 53.6695 33.4437 174.7287 102 G 4.4194 7.9030 115.8089 44.7297 0.0000 174.3979 103 G 4.5982 8.1164 112.0332 44.3709 0.0000 172.0162 104 K 4.4911 8.5693 119.3151 54.5846 35.3945 176.0338 105 A 4.3351 8.6605 125.4529 52.2406 19.1903 175.9053 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 2 P 0.00 4.36 0.00 2.19 2.13 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 3 K 8.79 3.76 0.00 1.73 1.94 0.00 1.73 0.00 0.00 1.91 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.48 7.81 4 K 9.58 4.16 0.00 2.01 1.83 0.00 1.48 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.54 1.48 7.81 5 V 8.34 4.97 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 0.91 0.00 0.00 0.99 0.00 0.00 6 L 9.08 4.86 0.00 0.98 1.14 0.24 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.93 4.41 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 1.22 0.00 0.00 8 G 8.44 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 0.00 0.00 0.00 9 V 7.87 4.74 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 0.99 0.00 0.00 0.90 0.00 0.00 10 V 8.03 4.23 2.23 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 0.92 0.00 0.00 0.95 0.00 0.00 11 V 8.68 4.32 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 0.46 0.00 0.00 0.42 0.00 0.00 12 S 7.75 4.56 0.00 3.89 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 13 D 8.88 4.78 0.00 2.78 2.68 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 0.00 0.00 0.00 0.00 14 K 7.30 3.87 0.00 1.96 1.90 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.62 7.81 15 M 8.25 4.84 0.00 1.92 2.14 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 2.53 2.48 0.00 16 Q 8.58 4.08 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.34 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 17 K 9.24 4.63 0.00 2.00 1.86 0.00 1.69 0.00 0.00 1.87 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.66 1.46 7.81 18 T 7.53 5.22 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 1.31 0.00 0.00 19 V 8.79 4.68 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 0.90 0.00 0.00 0.96 0.00 0.00 20 T 8.28 4.74 4.20 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 0.00 0.00 0.00 1.13 0.00 0.00 21 V 8.97 4.54 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 0.91 0.00 0.00 0.83 0.00 0.00 22 L 8.75 4.49 0.00 1.46 1.36 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.91 4.56 2.28 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 0.93 0.00 0.00 0.77 0.00 0.00 24 E 8.74 4.70 0.00 2.02 1.82 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 2.27 2.32 0.00 25 R 9.49 4.88 0.00 1.91 1.95 0.00 3.10 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.70 0.00 26 Q 8.55 5.18 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 27 F 8.08 4.82 0.00 3.16 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 28 P 0.00 5.00 0.00 2.18 2.15 0.00 3.66 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.90 0.00 29 H 8.85 4.37 0.00 3.37 3.39 0.00 5.61 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 30 P 0.00 4.32 0.00 2.15 2.16 0.00 3.42 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.88 0.00 31 L 7.88 4.52 0.00 1.34 1.04 0.91 0.69 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 32 Y 8.03 4.81 0.00 2.78 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 33 G 8.02 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.55 4.00 0.00 1.88 1.73 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.49 7.81 35 V 8.51 4.09 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 0.79 0.00 0.00 0.93 0.00 0.00 36 I 8.67 4.39 1.68 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 -0.36 0.94 0.00 0.00 37 K 8.34 4.77 0.00 1.69 1.67 0.00 1.73 0.00 0.00 2.00 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.30 1.39 7.81 38 R 8.59 4.89 0.00 2.25 1.93 0.00 3.36 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 39 S 8.36 5.10 0.00 3.98 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 40 K 9.06 4.57 0.00 1.80 1.69 0.00 1.51 0.00 0.00 1.59 0.00 0.00 2.13 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.65 1.15 7.81 41 K 8.49 4.92 0.00 1.60 1.65 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.20 1.39 7.81 42 Y 8.97 4.49 0.00 2.71 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 43 L 8.70 4.95 0.00 1.72 1.69 1.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.72 4.91 1.26 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 0.00 0.00 45 H 9.41 4.88 0.00 3.27 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.48 5.09 0.00 2.85 2.54 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 47 P 0.00 4.17 0.00 2.08 2.15 0.00 3.72 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 48 E 7.82 4.40 0.00 1.90 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 2.24 2.37 0.00 49 E 7.91 3.94 0.00 2.04 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 2.30 2.24 0.00 50 K 8.21 3.93 0.00 1.52 1.51 0.00 1.58 0.00 0.00 1.35 0.00 0.00 2.69 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.48 1.12 7.81 51 Y 8.47 4.62 0.00 2.94 2.89 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 52 K 9.50 5.03 0.00 1.74 1.70 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.33 7.81 53 L 8.50 4.18 0.00 1.60 1.61 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.72 3.88 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 0.00 0.00 0.00 55 D 7.84 4.80 0.00 2.84 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 56 V 8.56 4.03 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 0.99 0.00 0.00 0.97 0.00 0.00 57 V 9.03 4.92 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 0.76 0.00 0.00 0.79 0.00 0.00 58 E 8.65 4.88 0.00 1.89 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 59 I 9.57 4.89 1.57 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 0.88 0.79 0.25 0.00 0.00 60 I 8.64 5.00 1.90 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 1.14 1.79 0.98 0.00 0.00 61 E 9.58 3.20 0.00 1.89 1.74 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 2.11 1.89 0.00 62 S 7.70 4.68 0.00 3.60 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 63 R 8.44 3.88 0.00 1.73 1.80 0.00 3.24 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 64 P 0.00 4.13 0.00 2.05 2.00 0.00 3.68 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 65 I 8.05 4.10 1.82 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 1.16 0.26 0.71 0.00 0.00 66 S 7.10 4.47 0.00 3.91 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 67 K 7.57 4.16 0.00 1.94 1.73 0.00 1.78 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.37 7.81 68 R 8.68 3.63 0.00 1.87 1.91 0.00 3.35 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 1.54 1.66 0.00 69 K 7.83 4.59 0.00 1.90 1.71 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.17 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.74 7.81 70 R 8.29 4.81 0.00 1.69 1.66 0.00 3.22 0.00 0.00 3.31 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 71 F 8.03 5.04 0.00 2.97 2.81 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 0.00 0.00 0.00 0.00 72 R 8.68 5.12 0.00 1.81 1.83 0.00 3.17 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 73 V 7.94 3.89 1.58 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 -0.31 0.00 0.00 0.68 0.00 0.00 74 L 8.73 4.25 0.00 1.69 1.65 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.43 4.59 0.00 1.93 2.04 0.00 3.02 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 76 L 8.63 4.81 0.00 1.93 1.71 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 77 V 9.02 4.03 2.23 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 0.81 0.00 0.00 0.92 0.00 0.00 78 E 7.81 4.76 0.00 2.03 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 2.26 2.31 0.00 79 S 8.35 5.12 0.00 3.86 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 80 G 8.90 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 0.00 0.00 0.00 81 R 7.78 5.36 0.00 2.35 2.19 0.00 3.21 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.37 0.00 82 M 7.54 4.41 0.00 2.07 2.15 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 2.70 2.54 0.00 83 D 8.10 4.31 0.00 2.87 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 84 L 7.60 3.93 0.00 1.77 1.75 0.92 0.78 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 85 V 7.96 3.67 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 1.14 0.00 0.00 1.00 0.00 0.00 86 E 9.17 3.94 0.00 2.17 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 2.50 0.00 87 K 7.96 3.86 0.00 2.04 1.94 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.69 7.81 88 Y 8.03 4.12 0.00 3.04 3.19 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 89 L 8.56 3.67 0.00 1.80 1.65 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.19 3.60 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 1.37 0.66 0.87 0.00 0.00 91 R 7.70 3.80 0.00 1.85 1.84 0.00 3.07 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 92 R 7.41 3.01 0.00 1.21 1.54 0.00 2.87 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.36 0.00 93 Q 7.89 3.96 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 94 N 8.48 4.32 0.00 3.02 2.97 0.00 0.00 6.91 7.30 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 95 Y 8.38 4.21 0.00 3.21 2.94 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 96 Q 8.01 2.98 0.00 2.37 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.05 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 97 S 7.60 4.68 0.00 4.12 3.81 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 0.00 0.00 0.00 0.00 98 L 7.82 4.49 0.00 1.75 1.75 0.78 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.65 4.40 0.00 3.95 3.74 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 0.00 100 K 8.52 4.36 0.00 1.75 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.43 7.81 101 R 8.48 4.42 0.00 1.76 1.77 0.00 3.49 0.00 0.00 3.23 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 102 G 7.90 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 0.00 0.00 0.00 103 G 8.12 4.60 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 0.00 0.00 0.00 104 K 8.57 4.49 0.00 1.69 1.68 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.34 7.81 105 A 8.66 4.34 1.21 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 0.00 0.00