NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4883 8.3049 120.3258 55.4170 33.4812 174.3811 3 Q 3.9781 8.7254 117.5229 58.6715 29.2281 175.1842 4 D 4.6935 8.3981 118.4032 50.3882 42.8577 172.5496 5 P 4.2118 0.0000 0.0000 65.4650 31.6627 177.5285 6 I 3.6339 7.7528 117.4695 64.3659 36.9827 178.1795 7 A 3.9456 8.0777 121.5445 55.0721 18.1678 178.8698 8 D 4.2232 8.0647 116.0408 57.7357 41.1936 177.6975 9 M 3.8980 8.2723 118.7345 58.8425 32.1895 177.8447 10 L 3.8865 7.9285 120.0142 58.6901 42.1971 179.2149 11 T 3.8821 8.1471 115.7784 66.6927 68.1843 177.0390 12 R 4.2500 8.7083 119.9378 58.6754 29.8921 178.7277 13 I 4.0789 7.4973 119.3664 63.2823 37.2901 178.0158 14 R 4.1559 7.7808 121.0627 58.9959 29.8228 178.0915 15 N 4.5098 8.8572 117.2532 56.1857 38.9578 177.2628 16 G 3.7490 7.7430 106.5066 47.6468 0.0000 175.8145 17 Q 5.0565 8.8183 121.4299 58.6151 28.4755 178.3569 18 A 4.0321 7.7353 121.5544 54.4954 18.5095 178.4789 19 A 4.2442 7.5529 114.9249 51.1522 20.0017 176.5388 20 N 3.4186 7.9562 113.8997 53.7995 36.4372 174.8988 21 K 4.2879 8.1234 116.1512 55.7923 33.7133 177.8570 22 A 4.3977 8.8488 124.7800 54.7403 19.0719 177.1009 23 A 5.2449 7.8798 113.6275 50.4327 22.9551 175.2925 24 V 4.6013 8.7274 118.2487 61.4957 35.3261 174.3727 25 T 4.8620 8.4847 116.8521 61.0359 71.0447 173.7104 26 M 4.7965 8.1729 121.8436 53.4955 36.3489 171.8723 27 P 4.5493 0.0000 0.0000 63.6109 31.4286 176.3218 28 S 4.3596 8.8849 120.7996 58.7788 63.9326 174.0660 29 S 4.6187 8.5022 113.0615 56.5677 65.1288 177.2599 30 K 3.8236 8.5946 129.1877 59.9156 31.7842 178.1256 31 L 3.9131 7.8969 119.5923 58.0478 42.0316 178.7889 32 K 3.8564 7.9011 117.8361 59.5808 32.0972 179.1588 33 V 3.3582 7.9968 118.2934 65.9353 31.1756 177.7367 34 A 3.9946 7.9208 119.6301 55.2229 18.4745 179.5290 35 I 3.6995 7.7130 117.8410 64.6024 37.3172 178.3610 36 A 3.8010 8.1261 121.8709 55.3362 17.8845 179.4231 37 N 4.2960 7.9664 115.1981 56.4960 38.5267 177.9174 38 V 3.7570 7.9493 120.4879 64.5486 31.5570 178.5017 39 L 4.2902 7.8726 119.6212 57.4632 41.0219 179.3745 40 K 4.3293 8.0075 120.2042 59.5404 32.4965 179.2465 41 E 4.0145 7.8501 118.4720 59.1391 29.4778 178.9723 42 E 4.0296 8.3052 117.9791 57.4716 29.4361 177.9507 43 G 3.8821 7.3903 105.6027 45.5946 0.0000 174.4515 44 F 4.6195 8.1368 120.9070 58.3087 39.5072 176.1853 45 I 4.7376 7.3270 112.2232 58.5544 40.6919 175.7066 46 E 4.0169 8.9750 123.0895 57.6198 30.1808 176.7565 47 D 4.6584 7.4084 115.8128 55.4009 45.9233 173.8218 48 F 5.5342 8.5653 112.1610 57.5306 40.9816 173.4928 49 K 4.3718 8.2399 116.2598 55.3870 35.5328 175.2027 50 V 4.3716 8.2499 123.1474 61.8825 32.2196 174.6406 51 E 4.6637 9.3278 125.5599 53.8353 34.1031 173.7128 52 G 4.8492 8.9083 109.4849 45.2177 0.0000 173.8459 53 D 4.5081 8.9945 125.2408 57.1631 41.1317 177.3504 54 T 4.3937 7.7650 109.0789 61.9774 69.8935 173.5694 55 K 4.4272 7.8173 121.4970 53.7343 33.3254 173.6207 56 P 4.8296 0.0000 0.0000 63.2287 32.3537 175.2902 57 E 5.2125 9.8517 123.5973 54.4914 34.2027 175.0766 58 L 5.3024 8.5486 120.2341 52.3520 43.3180 173.9036 59 E 4.2994 9.1800 122.8009 56.4622 30.8637 174.8174 60 L 4.6868 9.3293 131.2526 54.2695 43.7888 175.4974 61 T 4.9130 8.4504 122.8932 60.8241 67.1508 173.8968 62 L 4.6269 8.3639 128.1561 54.1415 42.5909 176.7190 63 K 4.7068 8.0236 118.9789 55.4393 35.8009 174.7604 64 Y 4.9143 8.3684 116.5766 56.6105 42.1076 173.6800 65 F 5.0261 8.2693 121.9551 56.2031 42.8232 173.9625 66 Q 3.9874 7.4125 121.8940 57.2709 28.4172 174.9554 67 G 4.1356 8.6011 113.5129 44.6070 0.0000 173.3949 68 K 4.6981 7.5615 115.8217 53.7791 36.0573 174.9094 69 A 4.8012 8.3649 122.3668 50.7739 20.1389 177.5257 70 V 3.7209 8.5861 122.2988 65.6772 31.5055 176.7923 71 V 4.3049 7.3008 119.6933 60.5783 30.5525 174.4306 72 E 4.1769 8.6311 123.5793 58.4665 30.1167 177.4048 73 S 4.7234 7.5118 111.6462 56.7628 66.5118 172.5898 74 I 5.0254 7.9763 122.6460 61.5254 40.4401 173.3016 75 Q 4.6603 8.3765 127.4288 54.4551 33.5720 174.2233 76 R 4.4658 8.5600 122.0040 55.8333 30.9314 176.8960 77 V 3.9075 7.6712 120.8653 62.2680 32.5845 175.8301 78 S 4.3607 7.2220 114.9976 56.7186 61.6884 173.1621 79 R 4.6581 7.9168 126.7455 53.2607 32.6028 175.7443 80 P 4.2473 0.0000 0.0000 65.8497 31.4919 178.1745 81 G 3.6037 8.0704 107.1215 47.8045 0.0000 173.0851 82 L 4.3376 7.3840 122.2014 53.2395 43.2371 175.5503 83 R 4.0460 8.2438 125.1687 55.6826 31.1183 176.2946 84 I 4.4553 7.4557 112.9236 59.2417 40.7116 173.8273 85 Y 5.4702 8.4704 122.1060 56.0226 41.2966 174.8069 86 K 5.7325 9.4737 122.6018 54.1945 36.0592 176.1578 87 R 4.6316 8.4758 118.4753 54.7335 31.1472 177.2306 88 K 3.7636 8.6919 117.9590 59.8985 31.9434 177.8859 89 D 4.6043 7.9270 115.1706 55.1805 41.5211 176.8464 90 E 4.0717 8.7859 120.7667 57.5458 29.9745 175.1234 91 L 4.0247 8.0194 118.1404 54.4524 41.5626 174.9807 92 P 4.3978 0.0000 0.0000 62.1722 32.1882 176.2085 93 K 4.2823 8.3173 120.7434 54.8211 32.4955 176.7580 94 V 3.4973 8.3311 125.1649 63.8809 32.4332 175.6425 95 M 3.3513 9.2780 127.9151 58.1423 30.8105 175.8906 96 A 4.0871 9.1287 114.0141 53.3471 16.8407 176.7413 97 G 4.3223 8.7282 111.6430 46.8132 0.0000 174.9474 98 L 4.0275 7.4618 118.5934 57.4188 41.7097 178.0592 99 G 4.3784 7.5973 103.2843 45.0937 0.0000 172.0370 100 I 5.0875 8.3296 112.4608 58.9417 42.0848 173.6042 101 A 5.2643 9.3242 123.6120 50.0819 22.6012 175.3248 102 V 4.7185 8.3023 121.4690 60.1851 33.4328 175.3974 103 V 4.8668 9.1410 125.5087 59.6855 34.6429 175.1095 104 S 4.9777 8.8674 118.1965 57.3276 64.1977 173.1172 105 T 4.6179 8.0492 115.9316 59.4332 71.4583 175.6794 106 S 4.0999 8.6768 115.6228 61.2372 63.0232 175.8825 107 K 3.9675 7.4641 118.3798 57.0145 31.7540 175.6915 108 G 3.8128 7.9701 105.2051 43.0818 0.0000 173.1523 109 V 4.2016 8.1204 119.3610 62.1568 31.8806 175.5279 110 M 4.8675 9.0297 123.8309 54.1498 37.5408 174.0623 111 T 5.1511 8.1766 114.8641 60.6663 69.5916 175.0904 112 D 4.4082 8.9044 122.4052 57.7119 40.6989 179.4685 113 R 3.9252 7.9891 117.5353 59.2001 30.1835 178.8668 114 A 3.9761 7.9837 119.9041 55.1184 18.4477 179.4214 115 A 3.9796 8.7197 119.6963 55.1083 18.2578 179.8078 116 R 3.8386 8.3097 116.8466 59.4564 30.1958 178.3625 117 Q 4.0540 8.0779 118.1987 59.3145 29.2671 177.6673 118 A 4.1205 7.6289 120.3944 52.9961 19.0426 177.3936 119 G 3.7247 9.6697 103.7903 45.6246 0.0000 172.9110 120 L 4.5937 7.4417 115.4488 53.2446 46.0257 175.3306 121 G 4.4903 7.3935 108.3030 42.9200 0.0000 172.0474 122 G 4.0832 7.6592 102.9516 46.5385 0.0000 172.0482 123 E 5.2622 8.0496 124.3327 55.2222 30.6163 177.6185 124 I 4.0619 8.3674 128.3585 61.4558 36.6157 176.6326 125 I 3.5905 8.4969 128.4106 63.3569 37.6486 176.0477 126 C 4.3507 7.2339 113.1843 57.8855 33.0722 171.0078 127 Y 5.1461 8.4744 116.2984 56.2552 40.7360 176.9003 128 V 4.8248 8.4782 115.5086 60.4594 32.2467 175.4767 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 M 8.30 4.49 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.63 0.00 3 Q 8.73 3.98 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 7.18 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 4 D 8.40 4.69 0.00 2.67 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.21 0.00 2.17 2.11 0.00 3.64 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 2.12 2.21 0.00 6 I 7.75 3.63 1.83 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 1.53 0.55 0.85 0.00 0.00 7 A 8.08 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 8 D 8.06 4.22 0.00 2.78 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 9 M 8.27 3.90 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 10 L 7.93 3.89 0.00 1.82 1.84 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.15 3.88 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 12 R 8.71 4.25 0.00 1.92 1.99 0.00 3.56 0.00 0.00 3.16 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 13 I 7.50 4.08 1.95 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 1.64 0.89 0.89 0.00 0.00 14 R 7.78 4.16 0.00 1.97 2.10 0.00 3.13 0.00 0.00 3.19 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.49 0.00 15 N 8.86 4.51 0.00 2.75 2.80 0.00 0.00 7.14 8.36 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 16 G 7.74 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 17 Q 8.82 5.06 0.00 2.54 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.62 2.33 0.00 18 A 7.74 4.03 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 19 A 7.55 4.24 1.31 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 20 N 7.96 3.42 0.00 2.63 2.34 0.00 0.00 6.95 7.28 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 21 K 8.12 4.29 0.00 1.85 1.78 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.54 7.81 22 A 8.85 4.40 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 23 A 7.88 5.24 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 24 V 8.73 4.60 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 1.07 0.00 0.00 0.98 0.00 0.00 25 T 8.48 4.86 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 1.29 0.00 0.00 26 M 8.17 4.80 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 27 P 0.00 4.55 0.00 2.11 2.09 0.00 3.83 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.03 0.00 28 S 8.88 4.36 0.00 3.85 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 29 S 8.50 4.62 0.00 3.81 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 30 K 8.59 3.82 0.00 1.87 1.83 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.55 7.81 31 L 7.90 3.91 0.00 1.71 1.63 0.89 0.57 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 32 K 7.90 3.86 0.00 1.93 1.80 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.43 7.81 33 V 8.00 3.36 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 1.24 0.00 0.00 1.08 0.00 0.00 34 A 7.92 3.99 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 35 I 7.71 3.70 1.93 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 1.71 1.03 0.83 0.00 0.00 36 A 8.13 3.80 0.60 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 37 N 7.97 4.30 0.00 3.01 2.90 0.00 0.00 6.65 7.07 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 38 V 7.95 3.76 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 0.97 0.00 0.00 0.99 0.00 0.00 39 L 7.87 4.29 0.00 1.87 1.84 0.86 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.01 4.33 0.00 2.10 2.18 0.00 1.84 0.00 0.00 2.15 0.00 0.00 3.10 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.70 1.39 7.81 41 E 7.85 4.01 0.00 1.97 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 2.61 2.51 0.00 42 E 8.31 4.03 0.00 1.81 1.52 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 2.66 2.66 0.00 43 G 7.39 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 44 F 8.14 4.62 0.00 3.17 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 45 I 7.33 4.74 1.91 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 1.48 1.02 0.94 0.00 0.00 46 E 8.97 4.02 0.00 2.00 2.22 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 2.35 2.28 0.00 47 D 7.41 4.66 0.00 2.91 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 48 F 8.57 5.53 0.00 3.18 2.93 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 49 K 8.24 4.37 0.00 1.71 1.77 0.00 1.50 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.42 7.81 50 V 8.25 4.37 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 0.65 0.00 0.00 0.95 0.00 0.00 51 E 9.33 4.66 0.00 2.08 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 2.20 2.28 0.00 52 G 8.91 4.85 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 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.99 4.51 0.00 2.68 2.75 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 54 T 7.76 4.39 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 1.21 0.00 0.00 55 K 7.82 4.43 0.00 1.86 1.72 0.00 1.73 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.41 7.81 56 P 0.00 4.83 0.00 2.13 2.21 0.00 3.64 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 57 E 9.85 5.21 0.00 1.98 1.88 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 2.22 2.50 0.00 58 L 8.55 5.30 0.00 1.62 1.69 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 59 E 9.18 4.30 0.00 2.15 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 2.35 0.00 60 L 9.33 4.69 0.00 1.81 1.56 1.02 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.45 4.91 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 62 L 8.36 4.63 0.00 1.69 1.23 0.99 1.31 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 63 K 8.02 4.71 0.00 1.84 1.73 0.00 1.55 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 1.39 7.81 64 Y 8.37 4.91 0.00 3.04 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 65 F 8.27 5.03 0.00 3.06 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 66 Q 7.41 3.99 0.00 2.11 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 67 G 8.60 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 0.00 0.00 0.00 0.00 68 K 7.56 4.70 0.00 1.96 1.95 0.00 1.54 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.47 7.81 69 A 8.36 4.80 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 70 V 8.59 3.72 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 0.92 0.00 0.00 0.96 0.00 0.00 71 V 7.30 4.30 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 0.73 0.00 0.00 0.97 0.00 0.00 72 E 8.63 4.18 0.00 2.01 2.03 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 2.36 2.54 0.00 73 S 7.51 4.72 0.00 3.83 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 74 I 7.98 5.03 1.71 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.95 0.85 0.00 0.00 75 Q 8.38 4.66 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.87 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 76 R 8.56 4.47 0.00 1.75 1.79 0.00 3.07 0.00 0.00 3.43 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 77 V 7.67 3.91 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 0.25 0.00 0.00 1.05 0.00 0.00 78 S 7.22 4.36 0.00 3.61 3.72 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 79 R 7.92 4.66 0.00 1.81 1.76 0.00 3.31 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.49 0.00 80 P 0.00 4.25 0.00 2.16 2.17 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 81 G 8.07 3.60 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 82 L 7.38 4.34 0.00 1.52 1.51 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.24 4.05 0.00 1.61 1.33 0.00 3.45 0.00 0.00 3.39 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 84 I 7.46 4.46 1.78 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.58 0.82 0.00 0.00 85 Y 8.47 5.47 0.00 2.87 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 86 K 9.47 5.73 0.00 1.81 2.01 0.00 1.71 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.23 7.81 87 R 8.48 4.63 0.00 2.03 2.12 0.00 3.02 0.00 0.00 3.35 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 88 K 8.69 3.76 0.00 1.77 1.97 0.00 1.74 0.00 0.00 1.91 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.52 7.81 89 D 7.93 4.60 0.00 2.67 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 90 E 8.79 4.07 0.00 1.99 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 0.00 2.33 2.30 0.00 91 L 8.02 4.02 0.00 1.68 1.70 1.01 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.40 0.00 2.10 2.04 0.00 3.87 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 93 K 8.32 4.28 0.00 1.75 1.81 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.36 7.81 94 V 8.33 3.50 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 0.95 0.00 0.00 0.93 0.00 0.00 95 M 9.28 3.35 0.00 2.30 2.00 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 2.58 2.52 0.00 96 A 9.13 4.09 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.73 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 98 L 7.46 4.03 0.00 1.76 1.80 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 99 G 7.60 4.38 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 0.00 100 I 8.33 5.09 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.96 1.04 0.00 0.00 101 A 9.32 5.26 1.56 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 0.00 0.00 102 V 8.30 4.72 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 0.70 0.00 0.00 0.90 0.00 0.00 103 V 9.14 4.87 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 0.81 0.00 0.00 0.99 0.00 0.00 104 S 8.87 4.98 0.00 3.92 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 0.00 105 T 8.05 4.62 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 1.25 0.00 0.00 106 S 8.68 4.10 0.00 3.99 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 0.00 107 K 7.46 3.97 0.00 1.85 1.92 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.53 7.81 108 G 7.97 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 0.00 0.00 0.00 109 V 8.12 4.20 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 0.78 0.00 0.00 0.96 0.00 0.00 110 M 9.03 4.87 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.49 0.00 111 T 8.18 5.15 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 1.29 0.00 0.00 112 D 8.90 4.41 0.00 2.77 2.75 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 0.00 113 R 7.99 3.93 0.00 1.87 1.98 0.00 3.13 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 114 A 7.98 3.98 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 0.00 115 A 8.72 3.98 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 0.00 116 R 8.31 3.84 0.00 1.92 2.14 0.00 3.33 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 1.65 1.69 0.00 117 Q 8.08 4.05 0.00 2.16 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 118 A 7.63 4.12 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 0.00 119 G 9.67 3.72 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 0.00 0.00 0.00 120 L 7.44 4.59 0.00 1.58 1.53 0.95 0.89 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 0.00 121 G 7.39 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.66 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 0.00 0.00 0.00 123 E 8.05 5.26 0.00 2.44 1.95 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 2.21 2.03 0.00 124 I 8.37 4.06 1.70 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 1.35 0.66 0.52 0.00 0.00 125 I 8.50 3.59 1.93 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 1.23 1.30 0.82 0.00 0.00 126 C 7.23 4.35 0.00 2.95 2.85 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 0.00 0.00 0.00 127 Y 8.47 5.15 0.00 2.89 2.75 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 0.00 128 V 8.48 4.82 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 0.53 0.00 0.00 0.72 0.00 0.00