NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8825 8.3549 109.7365 44.8500 0.0000 173.6721 2 S 4.4001 7.8839 116.4214 54.2845 63.5162 171.3314 3 S 4.9505 8.4357 118.8836 55.9540 67.5869 175.4542 4 G 4.1223 8.3843 112.6983 45.0527 0.0000 174.0645 5 S 3.7177 8.8961 115.0076 59.8037 59.7671 172.2100 6 S 4.4072 9.2824 113.0698 60.7551 63.1438 172.2396 7 G 3.9553 7.9908 110.8052 45.5420 0.0000 171.8140 8 M 3.7656 7.5553 132.7660 54.8070 31.8588 175.5750 9 N 4.8252 8.3055 123.9205 51.5026 41.5546 175.4213 10 A 4.0756 8.3525 121.2313 54.7849 18.4875 179.2915 11 A 3.9295 8.0161 119.5185 55.2302 17.3507 179.7700 12 V 3.5809 7.8703 116.7441 64.7700 31.0234 178.5376 13 V 4.5163 7.0297 117.1098 65.1283 31.1428 177.8408 14 R 3.9357 8.0847 118.3174 59.3389 29.6816 178.5658 15 R 4.3973 7.9110 117.6829 59.2758 30.0368 178.9728 16 T 3.9005 7.3617 115.7603 66.7748 68.6372 176.6703 17 Q 4.0029 8.1730 120.2482 58.9765 28.3356 179.0668 18 E 4.1587 7.7674 117.9957 58.3804 30.0481 178.2685 19 A 3.9915 7.8367 120.9536 55.1483 18.7290 179.1407 20 L 4.3474 8.3454 116.9324 56.6670 41.8346 179.2954 21 G 4.1331 8.1230 106.1915 47.5927 0.0000 174.7291 22 K 4.1898 7.7657 119.4283 57.6610 32.2978 178.9245 23 V 3.7458 7.3877 119.9438 64.7728 31.9902 176.1627 24 I 4.7167 7.3937 109.0032 59.1491 40.5762 174.8873 25 R 4.4320 8.6162 119.2511 56.8825 31.5315 177.0334 26 R 4.7012 7.4972 111.5150 53.0802 32.3206 173.0464 27 P 4.5443 0.0000 0.0000 61.3906 32.2432 174.0478 28 P 4.3019 0.0000 0.0000 62.5562 31.5890 176.1579 29 L 4.3967 8.5634 123.4814 54.4071 41.4267 176.6382 30 T 4.6526 8.1054 114.6279 59.2936 72.2765 174.1682 31 E 3.9747 8.9641 123.8301 60.0915 29.7336 178.8452 32 K 4.0376 7.9652 119.2530 59.0550 32.2494 178.5107 33 L 3.9970 7.5547 119.9857 57.4218 41.6632 179.2808 34 L 4.1791 8.2859 118.1864 56.5608 41.7019 178.0711 35 S 4.5818 8.2549 112.0090 58.0173 63.6217 173.7366 36 K 4.5134 7.6760 122.1662 54.8240 32.4530 174.5038 37 P 4.1714 0.0000 0.0000 61.5459 31.5836 174.3270 38 P 4.4903 0.0000 0.0000 61.9702 32.3580 177.0494 39 F 3.9917 9.0893 122.1469 61.7985 39.1423 177.9772 40 R 3.8183 8.1361 117.6398 59.5367 29.6027 177.1503 41 Y 4.1029 7.9261 119.3323 61.1196 38.6337 178.2396 42 L 3.8829 8.0742 118.8501 58.0600 41.7833 178.6029 43 H 3.8131 7.6998 117.5405 59.5054 29.5616 176.6088 44 D 4.2930 7.8149 119.9897 57.5553 40.6502 178.6825 45 I 3.5576 7.0695 118.8088 64.5565 37.2239 178.0801 46 I 3.7386 7.8762 120.6539 65.0424 37.1598 178.3529 47 T 4.0610 8.0343 109.9978 64.9224 68.4986 175.8350 48 E 3.9289 8.4655 122.0831 59.2392 29.5467 179.3549 49 V 3.6065 7.9208 117.9409 66.5129 31.5383 178.2273 50 I 3.8088 7.5504 117.5598 63.7613 36.6503 177.7212 51 R 4.2883 7.6265 117.3859 57.5705 30.2640 177.5430 52 M 4.2757 8.4452 118.3434 57.6009 32.6386 177.4657 53 T 4.3851 8.1371 108.3188 63.1859 69.9913 175.1004 54 G 4.5402 8.8876 109.1555 46.4155 0.0000 173.1272 55 F 4.1170 7.6803 119.9778 59.5396 39.8058 175.0830 56 M 2.6821 7.7500 127.6472 56.2799 29.3699 178.0406 57 K 4.0189 7.7758 120.3845 58.9129 32.8299 177.3472 58 G 3.9974 7.7559 105.3453 45.2804 0.0000 174.1307 59 L 3.8933 7.7334 122.9139 56.7435 42.4192 176.4142 60 Y 5.2064 7.6324 113.3968 55.6645 40.3726 175.3304 61 T 4.5864 8.2906 113.0333 59.9371 71.4140 174.7934 62 D 4.4578 8.7894 120.4989 57.0020 39.1416 178.1700 63 A 4.0991 7.9512 121.5029 54.7746 18.2340 178.9234 64 E 3.9511 7.9064 115.7094 60.1736 29.5214 179.5506 65 M 4.3184 8.2825 117.2747 57.1690 32.1351 176.7046 66 K 4.2558 7.7263 118.5204 54.7478 32.2344 176.1080 67 S 3.9872 8.6747 120.3429 61.4193 62.4943 176.1226 68 D 4.3703 8.1009 118.2844 56.6523 39.1143 177.5527 69 N 4.2944 7.9124 116.5764 55.6096 38.6543 175.9765 70 V 3.7221 7.9651 118.2354 62.7157 31.9076 174.7367 71 K 4.2925 8.4591 125.7304 57.3113 34.7659 176.8371 72 D 4.5375 7.7315 117.9157 53.5234 42.8615 176.7310 73 K 3.7255 8.6141 123.7849 60.0760 32.3891 179.0141 74 D 4.4116 8.0555 118.2481 57.3644 40.8091 179.4133 75 A 3.9850 7.7612 121.1382 55.1680 18.6119 179.4464 76 K 3.8207 7.7607 117.0088 60.0370 31.9711 179.4918 77 I 3.8693 7.7198 119.0694 64.5777 37.0241 178.2966 78 S 4.1363 7.9856 113.4512 61.2416 60.8924 176.0656 79 F 4.3435 9.0462 123.9961 61.2242 39.1568 177.2914 80 L 4.1933 8.2680 118.2910 57.6430 41.3456 179.1640 81 Q 3.9987 8.4280 118.4206 59.1087 28.5917 179.0380 82 K 3.7465 7.6221 117.5703 59.7182 32.0659 178.9822 83 A 3.6865 7.3117 120.3646 55.3778 17.8969 179.4606 84 I 3.5867 8.0697 118.6116 65.1614 37.1291 178.0227 85 D 4.3457 8.4420 119.8634 57.1768 40.7378 178.4457 86 V 3.4741 7.6206 118.1935 66.3246 31.4601 178.2057 87 V 3.7270 8.0125 117.7642 66.3471 31.3925 178.3525 88 V 3.5813 7.5298 116.6909 66.2711 31.1864 177.8250 89 M 4.0588 7.8374 117.2472 58.7845 31.8628 178.5482 90 V 3.7786 8.2667 118.0790 65.5450 31.8519 177.6579 91 S 4.2975 8.2563 114.7168 60.8597 63.0580 176.2462 92 G 3.8958 9.0606 109.2094 45.4386 0.0000 172.8671 93 E 4.6016 7.8909 117.8885 53.0802 32.7605 174.0267 94 P 4.3589 0.0000 0.0000 62.6728 31.8697 175.7112 95 L 4.7357 8.3340 122.9461 53.1470 43.8946 175.9003 96 L 4.4095 8.3528 120.0966 56.5500 43.2172 177.2695 97 A 3.8614 7.4706 118.4962 51.8767 19.1951 176.5128 98 K 4.6673 8.4787 121.7973 53.8850 33.9700 175.7789 99 P 4.5064 0.0000 0.0000 64.5299 31.5865 177.6243 100 A 4.0357 7.9101 120.9599 53.7545 19.6120 178.9772 101 R 4.3898 7.9235 115.0492 58.7084 30.5752 178.6181 102 I 3.7759 7.8587 117.8309 64.5801 37.1903 178.1476 103 V 3.9576 7.3248 118.2064 64.8909 31.0457 177.9899 104 A 4.2591 7.8437 119.8718 55.2252 18.9088 177.1011 105 G 3.2921 7.2675 105.6039 46.1337 0.0000 172.8535 106 H 4.9311 7.7326 116.1348 53.5101 32.9612 173.0912 107 E 3.8485 8.7310 117.1321 56.9672 27.1572 175.2047 108 P 4.5562 0.0000 0.0000 65.3594 32.0235 177.5832 109 E 3.8976 8.2292 117.5271 59.3988 29.1244 179.5076 110 R 3.8609 8.0806 118.8578 59.0835 30.1429 178.8808 111 T 3.9034 7.4185 114.2879 66.9111 68.4598 175.5400 112 N 4.2947 8.0465 117.9780 56.6848 38.6518 176.8496 113 E 3.8956 8.3941 119.6945 59.5861 29.7587 179.0738 114 L 3.8941 7.9992 119.5327 58.5537 42.1057 179.1138 115 L 4.0370 7.7830 118.5763 57.8642 41.7038 179.3836 116 Q 4.0234 8.1503 118.0300 58.9914 28.7520 179.0962 117 I 3.6603 8.2795 120.9479 64.4325 37.0812 178.2191 118 I 3.7784 7.6402 120.3689 64.5837 37.0099 178.4169 119 G 3.7220 8.0630 106.0992 47.8491 0.0000 175.4665 120 K 3.8118 7.7849 120.4526 59.4314 32.1378 178.6975 121 C 3.6828 7.5950 116.3960 63.2992 28.0186 176.3699 122 C 3.9477 7.3113 117.6873 62.7085 27.4869 175.9418 123 L 4.0069 7.9251 119.8015 57.8642 41.2335 178.4643 124 N 4.7171 8.1142 113.9493 52.0905 38.8264 175.0417 125 K 3.7492 8.1266 118.2477 57.2905 30.3401 175.7318 126 L 4.3393 8.0863 119.7358 53.6138 41.2007 177.2860 127 S 4.8038 8.3915 120.1962 57.5583 64.0791 174.0649 128 S 4.7715 8.5635 115.9570 56.9576 64.4931 172.5389 129 D 4.6585 8.6716 122.9019 55.6944 43.2851 177.6889 130 D 4.0851 8.0743 117.1893 57.1294 41.3881 177.3731 131 A 3.8847 8.0493 120.6583 55.5888 18.3930 179.2878 132 V 3.2925 7.6420 115.4920 66.2631 31.5441 178.1018 133 R 3.7873 7.5131 117.7064 59.5498 29.9236 178.2536 134 R 4.0174 8.2730 118.5011 59.6918 30.1099 179.1173 135 V 3.5773 7.9317 118.3691 64.8080 31.1151 178.0835 136 L 3.9028 7.4413 118.1414 57.6695 41.6148 179.1772 137 A 4.2034 8.3087 119.2926 52.6817 18.8815 177.5125 138 G 3.7409 7.8333 104.4398 46.2769 0.0000 173.7116 139 E 4.3570 8.1027 118.0957 55.6687 30.6866 177.6716 140 K 4.1273 8.1787 118.7660 57.4806 32.3927 175.8400 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 1 G 8.35 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 2 S 7.88 4.40 0.00 3.90 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 3 S 8.44 4.95 0.00 3.93 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 4 G 8.38 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.90 3.72 0.00 4.04 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 6 S 9.28 4.41 0.00 3.81 3.85 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 7 G 7.99 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 0.00 0.00 0.00 8 M 7.56 3.77 0.00 1.99 2.10 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 2.60 2.60 0.00 9 N 8.31 4.83 0.00 2.95 2.66 0.00 0.00 7.01 8.16 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 10 A 8.35 4.08 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 11 A 8.02 3.93 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 12 V 7.87 3.58 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 0.87 0.00 0.00 1.02 0.00 0.00 13 V 7.03 4.52 2.29 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 0.98 0.00 0.00 1.07 0.00 0.00 14 R 8.08 3.94 0.00 1.96 2.05 0.00 3.19 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 15 R 7.91 4.40 0.00 2.11 2.05 0.00 3.26 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 16 T 7.36 3.90 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 1.25 0.00 0.00 17 Q 8.17 4.00 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.72 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 18 E 7.77 4.16 0.00 2.36 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 2.43 2.35 0.00 19 A 7.84 3.99 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 20 L 8.35 4.35 0.00 1.70 1.72 0.94 0.93 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 21 G 8.12 4.13 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 0.00 0.00 0.00 22 K 7.77 4.19 0.00 1.74 1.78 0.00 1.74 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.43 7.81 23 V 7.39 3.75 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 0.88 0.00 0.00 0.94 0.00 0.00 24 I 7.39 4.72 1.86 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 1.35 0.88 0.91 0.00 0.00 25 R 8.62 4.43 0.00 1.80 2.00 0.00 3.31 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 26 R 7.50 4.70 0.00 1.86 1.86 0.00 3.03 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 27 P 0.00 4.54 0.00 2.44 2.15 0.00 3.54 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.44 0.00 28 P 0.00 4.30 0.00 2.24 2.14 0.00 3.87 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 29 L 8.56 4.40 0.00 1.70 1.75 1.03 0.95 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 30 T 8.11 4.65 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 1.22 0.00 0.00 31 E 8.96 3.97 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 2.30 2.34 0.00 32 K 7.97 4.04 0.00 1.82 1.66 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.49 7.81 33 L 7.55 4.00 0.00 1.38 0.77 0.85 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.29 4.18 0.00 1.79 1.74 0.94 0.88 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 35 S 8.25 4.58 0.00 3.78 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 36 K 7.68 4.51 0.00 1.64 1.63 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.26 1.40 7.81 37 P 0.00 4.17 0.00 2.39 2.26 0.00 3.92 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 2.03 2.10 0.00 38 P 0.00 4.49 0.00 2.33 2.26 0.00 3.70 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.98 0.00 39 F 9.09 3.99 0.00 3.12 3.12 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 0.00 0.00 0.00 40 R 8.14 3.82 0.00 2.03 1.98 0.00 3.27 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 41 Y 7.93 4.10 0.00 3.12 3.20 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 0.00 42 L 8.07 3.88 0.00 1.65 1.69 0.99 1.04 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 43 H 7.70 3.81 0.00 2.95 3.20 0.00 5.60 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 7.81 4.29 0.00 2.77 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 45 I 7.07 3.56 1.89 0.00 0.00 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 1.30 0.22 0.88 0.00 0.00 46 I 7.88 3.74 2.09 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 1.62 1.35 1.10 0.00 0.00 47 T 8.03 4.06 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 1.35 0.00 0.00 48 E 8.47 3.93 0.00 2.13 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 2.50 2.65 0.00 49 V 7.92 3.61 2.32 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 1.25 0.00 0.00 1.06 0.00 0.00 50 I 7.55 3.81 2.05 0.00 0.00 1.00 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 0.67 0.98 0.00 0.00 51 R 7.63 4.29 0.00 1.85 2.10 0.00 3.42 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 52 M 8.45 4.28 0.00 2.09 2.18 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 2.59 2.73 0.00 53 T 8.14 4.39 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 1.22 0.00 0.00 54 G 8.89 4.54 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 0.00 0.00 0.00 55 F 7.68 4.12 0.00 2.89 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 56 M 7.75 2.68 0.00 1.73 1.77 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.31 0.00 57 K 7.78 4.02 0.00 1.89 1.79 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.38 7.81 58 G 7.76 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.73 3.89 0.00 1.18 1.14 -0.76 0.59 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 60 Y 7.63 5.21 0.00 3.02 2.80 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 61 T 8.29 4.59 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 1.25 0.00 0.00 62 D 8.79 4.46 0.00 2.87 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 63 A 7.95 4.10 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 64 E 7.91 3.95 0.00 2.40 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 0.00 2.48 2.50 0.00 65 M 8.28 4.32 0.00 1.98 2.44 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 3.05 0.00 66 K 7.73 4.26 0.00 1.89 2.21 0.00 1.73 0.00 0.00 1.63 0.00 0.00 3.37 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.36 7.81 67 S 8.67 3.99 0.00 3.12 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.10 4.37 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 7.91 4.29 0.00 2.96 2.95 0.00 0.00 7.40 7.63 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 70 V 7.97 3.72 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 0.52 0.00 0.00 0.88 0.00 0.00 71 K 8.46 4.29 0.00 1.64 1.67 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.25 1.37 7.81 72 D 7.73 4.54 0.00 2.69 2.52 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 73 K 8.61 3.73 0.00 1.79 1.75 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.57 7.81 74 D 8.06 4.41 0.00 2.79 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 75 A 7.76 3.98 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 76 K 7.76 3.82 0.00 1.71 1.57 0.00 1.25 0.00 0.00 1.00 0.00 0.00 2.28 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.62 7.81 77 I 7.72 3.87 1.92 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 1.57 0.77 0.97 0.00 0.00 78 S 7.99 4.14 0.00 4.11 4.05 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 79 F 9.05 4.34 0.00 3.14 3.43 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 80 L 8.27 4.19 0.00 2.04 1.80 1.20 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.43 4.00 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.71 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 82 K 7.62 3.75 0.00 1.98 1.67 0.00 2.08 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.76 7.81 83 A 7.31 3.69 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 84 I 8.07 3.59 2.00 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 1.55 1.18 0.92 0.00 0.00 85 D 8.44 4.35 0.00 2.90 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.62 3.47 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 0.75 0.00 0.00 0.82 0.00 0.00 87 V 8.01 3.73 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 1.02 0.00 0.00 1.06 0.00 0.00 88 V 7.53 3.58 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 0.98 0.00 0.00 1.02 0.00 0.00 89 M 7.84 4.06 0.00 2.02 2.23 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.58 0.00 90 V 8.27 3.78 2.31 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 0.98 0.00 0.00 1.23 0.00 0.00 91 S 8.26 4.30 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.06 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 0.00 0.00 0.00 93 E 7.89 4.60 0.00 1.91 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 2.20 2.26 0.00 94 P 0.00 4.36 0.00 2.18 2.08 0.00 3.74 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 1.99 1.99 0.00 95 L 8.33 4.74 0.00 1.66 1.63 0.94 1.02 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 96 L 8.35 4.41 0.00 1.63 1.70 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.47 3.86 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 98 K 8.48 4.67 0.00 1.89 1.75 0.00 1.79 0.00 0.00 1.89 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.48 7.81 99 P 0.00 4.51 0.00 2.33 2.39 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 100 A 7.91 4.04 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 0.00 101 R 7.92 4.39 0.00 1.93 2.05 0.00 3.37 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.84 0.00 102 I 7.86 3.78 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.39 0.99 0.00 0.00 103 V 7.32 3.96 2.38 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 0.79 0.00 0.00 0.86 0.00 0.00 104 A 7.84 4.26 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 0.00 105 G 7.27 3.29 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 0.00 106 H 7.73 4.93 0.00 3.14 3.20 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.73 3.85 0.00 2.13 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 2.36 2.25 0.00 108 P 0.00 4.56 0.00 2.27 2.51 0.00 3.93 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.89 0.00 109 E 8.23 3.90 0.00 2.22 2.38 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 2.39 2.47 0.00 110 R 8.08 3.86 0.00 1.87 2.04 0.00 3.35 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 111 T 7.42 3.90 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 1.27 0.00 0.00 112 N 8.05 4.29 0.00 3.01 3.07 0.00 0.00 7.34 7.72 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 0.00 113 E 8.39 3.90 0.00 2.21 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 2.35 2.49 0.00 114 L 8.00 3.89 0.00 1.77 1.99 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.78 4.04 0.00 1.84 1.72 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 8.15 4.02 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.66 0.00 117 I 8.28 3.66 2.00 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 1.70 1.43 0.91 0.00 0.00 118 I 7.64 3.78 2.03 0.00 0.00 0.91 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 0.91 1.03 0.00 0.00 119 G 8.06 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 K 7.78 3.81 0.00 2.00 1.82 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.52 7.81 121 C 7.59 3.68 0.00 2.42 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 0.00 0.00 0.00 122 C 7.31 3.95 0.00 2.94 2.90 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 0.00 123 L 7.93 4.01 0.00 1.67 1.71 0.89 0.98 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 0.00 124 N 8.11 4.72 0.00 2.59 2.78 0.00 0.00 7.33 7.29 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 0.00 125 K 8.13 3.75 0.00 1.79 1.85 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.52 7.81 126 L 8.09 4.34 0.00 1.48 1.59 0.85 0.83 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 0.00 127 S 8.39 4.80 0.00 3.91 3.86 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 0.00 128 S 8.56 4.77 0.00 3.72 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.67 4.66 0.00 2.67 2.66 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 0.00 130 D 8.07 4.09 0.00 2.70 2.63 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 0.00 131 A 8.05 3.88 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 0.00 132 V 7.64 3.29 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 0.94 0.00 0.00 0.74 0.00 0.00 133 R 7.51 3.79 0.00 1.73 1.94 0.00 3.33 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 134 R 8.27 4.02 0.00 2.01 1.98 0.00 3.31 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 135 V 7.93 3.58 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 0.80 0.00 0.00 0.92 0.00 0.00 136 L 7.44 3.90 0.00 1.76 1.76 0.89 0.66 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 0.00 137 A 8.31 4.20 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 0.00 138 G 7.83 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 0.00 0.00 0.00 139 E 8.10 4.36 0.00 1.94 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 2.33 2.39 0.00 140 K 8.18 4.13 0.00 1.80 1.70 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.43 7.81