NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6210 8.2649 122.4707 52.0785 19.7821 176.3039 2 T 4.1938 8.3509 119.7968 63.2972 70.0518 172.7580 3 K 5.2600 8.9358 124.3829 54.9787 37.3787 174.5620 4 A 5.4326 9.1487 123.6216 51.0385 23.5397 175.1396 5 V 5.1001 8.7592 116.8891 60.6478 35.3226 173.4913 6 A 5.0285 9.1920 124.0523 50.3438 22.4450 175.1092 7 V 4.3902 8.4016 122.8508 61.5913 33.1558 174.6693 8 L 4.6301 8.9847 130.0286 54.1354 42.7985 176.4253 9 K 4.9140 9.0106 122.7623 55.1578 36.8156 175.9854 10 G 4.6033 8.0235 107.2748 46.5491 0.0000 172.2194 11 D 4.7158 8.9858 118.2983 55.1179 41.7097 176.7415 12 G 4.4345 7.5275 109.0756 43.7788 0.0000 171.2903 13 P 4.4041 0.0000 0.0000 63.7059 32.0328 175.6147 14 V 4.5658 7.8051 120.5130 62.2005 31.9888 174.9243 15 Q 4.7806 8.0845 124.3044 55.5186 32.1680 173.5369 16 G 4.1918 8.1005 106.5384 46.3986 0.0000 171.6999 17 I 5.1434 7.9520 119.4485 59.4524 40.9201 175.0570 18 I 4.5705 8.8077 127.6740 59.5041 40.1785 174.4462 19 N 4.9528 8.5163 124.5264 51.5552 40.9087 174.0645 20 F 5.3645 8.9299 120.0312 55.8368 43.2515 173.7813 21 E 5.2048 9.5916 122.7881 54.8921 33.6051 173.7788 22 Q 4.8270 9.3464 127.3000 54.3799 31.3699 175.6487 23 K 4.0866 9.0759 127.5267 58.6507 32.6399 177.4814 24 E 4.8292 7.7834 114.8093 53.9155 32.5710 176.5489 25 S 4.1177 8.7956 114.7493 60.8477 63.1255 174.6805 26 N 4.7455 8.1395 116.0367 52.8066 38.8968 174.6767 27 G 4.0014 7.8339 108.9293 43.3207 0.0000 171.8224 28 P 4.6313 0.0000 0.0000 62.8786 32.3713 175.8168 29 V 4.5779 9.0096 121.5300 61.4708 33.4920 174.7145 30 K 4.8821 9.2926 128.4409 55.7168 33.8949 175.8983 31 V 4.8715 9.2239 125.1678 60.8136 34.2562 174.2509 32 W 5.8422 7.5817 123.4632 55.7756 31.9325 175.4851 33 G 3.6622 7.5705 106.3306 45.7830 0.0000 170.6649 34 S 5.1330 7.7325 113.7743 56.6266 66.3162 174.3400 35 I 5.1097 8.7929 126.8682 59.3536 40.7204 174.8665 36 K 4.7152 9.1766 125.7654 55.6652 35.9149 177.0149 37 G 3.8392 8.7658 105.8892 46.6319 0.0000 173.1721 38 L 4.5292 7.7386 119.9592 52.7239 43.1520 176.5628 39 T 4.3088 8.2360 112.3086 61.1347 69.4314 173.8125 40 E 4.0180 8.5975 124.3937 58.0691 30.5866 176.2102 41 G 3.8875 8.7702 110.5232 43.8423 0.0000 172.2154 42 L 4.6973 8.1668 119.6903 55.0862 42.7645 176.5957 43 H 5.0245 9.3140 119.6202 53.6443 32.9563 173.2838 44 G 4.0123 9.1879 111.1432 46.8882 0.0000 172.5034 45 F 5.3665 8.9332 125.2893 56.9851 42.2112 172.8536 46 H 5.2329 8.8910 122.6808 53.9384 33.8102 172.8260 47 V 4.4539 8.5877 121.4064 62.5151 32.7678 175.1021 48 H 5.0351 9.5458 125.9280 54.4851 30.6197 175.9807 49 E 3.7198 9.0112 122.4352 58.9635 29.8114 177.0820 50 F 4.9802 8.2858 118.4840 54.9256 41.5613 176.8082 51 G 4.4232 8.3799 111.9886 44.5630 0.0000 174.2561 52 D 4.7155 7.9542 118.4379 52.6508 42.2639 174.1222 53 N 5.2942 8.7999 124.2162 52.8260 39.0343 175.9442 54 T 3.9773 8.5530 109.6587 63.3055 69.4181 174.3506 55 A 4.7287 8.0951 125.5093 51.3967 20.0071 175.6216 56 G 3.7341 7.9908 113.0286 46.7105 0.0000 175.7495 57 A 4.0370 8.4549 121.4922 55.1252 18.8585 179.8583 58 T 3.9646 7.5922 112.8518 66.5874 67.9931 175.8750 59 S 4.5142 7.8946 113.1631 58.8451 63.4601 175.1133 60 A 4.4841 7.6571 126.2601 53.6113 18.4046 179.0301 61 G 3.7479 7.8163 107.0211 43.9963 0.0000 170.7641 62 P 4.6932 0.0000 0.0000 62.0419 33.9474 175.0027 63 H 4.4566 8.4551 116.5144 55.8728 29.4108 175.5713 64 F 4.2342 9.2428 126.0031 58.1474 40.2125 175.0719 65 N 5.0374 7.8289 125.8210 51.6958 38.7788 173.1522 66 P 4.1694 0.0000 0.0000 65.0141 32.1449 177.7831 67 L 4.2136 7.5969 116.9177 53.9292 42.3867 176.2521 68 S 3.5795 7.4601 114.4156 59.9416 60.5660 170.5853 69 R 4.5974 8.2237 117.7679 54.1362 32.8554 176.3593 70 K 4.4458 8.8105 118.3924 55.7909 33.7648 176.5524 71 H 3.9983 8.7279 123.0561 56.8426 30.4967 174.7116 72 G 4.0880 7.4728 109.9662 45.4702 0.0000 172.1421 73 G 4.1175 9.2121 109.2534 43.5372 0.0000 173.3529 74 P 4.3768 0.0000 0.0000 65.4038 31.2718 177.9058 75 K 4.1724 7.9151 116.6127 58.0349 32.4493 176.9462 76 D 4.5932 7.6815 119.1049 53.6405 41.5123 176.2654 77 E 3.8972 8.7320 123.7588 59.0676 29.7382 176.6535 78 E 4.2180 7.9891 122.0934 55.5472 28.6009 174.8792 79 R 4.6487 7.5740 119.7549 55.7079 32.3194 174.7289 80 H 4.4642 9.0149 116.9268 55.4064 29.4677 176.6964 81 V 3.5081 8.3931 123.0006 66.3944 31.5789 177.1077 82 G 3.8731 8.5007 105.0992 47.2401 0.0000 173.5122 83 D 5.0982 8.1650 121.5235 53.7388 39.7245 176.0628 84 L 4.4308 8.5375 120.0700 53.2051 42.6289 177.9245 85 G 4.1145 8.5628 107.7517 45.6988 0.0000 174.0335 86 N 5.6844 8.6173 120.8005 51.3656 41.8372 173.3531 87 V 4.3860 8.5715 113.8714 59.9647 35.2791 174.8179 88 T 5.0163 8.2267 118.4603 61.8574 71.2387 173.0109 89 A 4.8369 8.8918 129.1186 50.6140 21.1776 177.2224 90 D 4.9954 8.7934 122.2899 52.0793 41.1828 177.1329 91 K 4.0477 8.4567 117.1269 59.3897 32.6440 177.2409 92 D 4.5059 8.2601 117.8585 54.3343 41.3823 177.0109 93 G 4.3392 8.5554 108.5876 44.4820 0.0000 172.5024 94 V 4.6783 8.2064 120.2242 61.0417 33.4592 174.5430 95 A 5.0360 9.0769 130.5865 50.0083 20.3321 175.9013 96 D 4.9519 8.5793 123.3549 53.8694 40.8614 176.2666 97 V 3.7147 8.7659 124.9777 62.5932 33.0220 175.2150 98 S 4.6231 8.4313 122.6158 57.7009 64.1282 172.7556 99 I 4.8068 9.4204 128.2566 59.2933 41.2969 174.3353 100 E 5.1778 8.8109 125.0510 54.5674 32.3111 174.2572 101 D 4.9843 9.2912 125.8149 52.7973 44.7791 175.8525 102 S 4.7075 8.9730 119.1723 58.5405 63.9906 174.6359 103 V 4.1443 7.9570 119.7521 64.2786 32.5012 176.3093 104 I 3.9850 7.9916 111.9519 61.1858 38.0794 174.8849 105 S 4.7047 8.2734 114.6890 57.0991 65.4841 174.0947 106 L 4.5200 8.9940 123.6055 54.5548 41.7195 176.2738 107 S 4.5369 7.6059 112.4848 57.5683 66.6846 174.7256 108 G 3.8844 8.5049 108.6235 44.8361 0.0000 173.5462 109 D 4.4377 8.7592 117.2657 57.6690 40.8830 176.9566 110 H 5.0110 8.1774 113.5980 55.5704 28.8249 174.9168 111 A 4.2693 7.7991 123.3527 52.4279 18.8058 178.5308 112 I 3.8415 8.2900 114.9430 60.4140 38.3852 175.9418 113 I 3.6643 7.2735 123.0216 63.0118 37.4901 176.1841 114 G 3.7905 9.3752 113.0135 45.6479 0.0000 172.7523 115 R 5.0601 7.3859 118.8733 54.4495 34.1370 174.3067 116 T 4.9457 8.0192 115.2647 62.0170 71.3308 173.6654 117 L 4.7127 8.7962 129.3195 54.3018 43.8026 175.4478 118 V 4.9855 8.8736 126.2344 60.9831 34.9689 174.1799 119 V 5.1219 8.6013 127.0008 60.5351 33.6890 174.7923 120 H 5.3177 8.9728 121.2550 53.9958 30.9105 174.5749 121 E 4.2035 9.4053 121.6909 58.9541 30.0014 176.4895 122 K 4.8096 8.6434 117.2110 53.6606 36.5641 175.7234 123 A 4.3700 8.3779 123.4482 52.4170 18.8317 176.2282 124 D 4.7916 9.2860 122.5184 53.7556 41.7819 176.0631 125 D 4.6088 9.3279 125.6963 53.0613 39.6926 176.6621 126 L 3.7376 9.6453 118.7245 56.2467 39.5382 175.5247 127 G 3.9474 8.5356 104.6445 46.0248 0.0000 174.8790 128 K 4.4987 8.1016 117.0810 56.0133 32.1564 177.6239 129 G 3.8197 8.0048 110.0354 45.2746 0.0000 176.3071 130 G 3.8957 8.3513 107.0329 45.5811 0.0000 172.4909 131 N 5.0379 7.2384 115.7737 50.1903 39.8588 174.5687 132 E 4.0727 8.7526 117.5989 59.7312 29.7887 179.5759 133 E 4.0063 8.1499 118.5191 59.0673 29.5269 178.4150 134 S 4.1082 8.4328 113.7278 61.4660 62.3883 175.6372 135 T 4.2438 7.6901 109.1580 62.6440 68.5566 175.4474 136 K 4.2926 7.7019 119.3413 57.8303 34.5232 176.7187 137 T 4.0389 7.9048 106.2720 60.0615 70.2123 175.1714 138 G 3.7215 8.0382 110.7512 45.7374 0.0000 173.6528 139 N 4.2911 7.7407 114.0337 54.0256 36.7020 175.3807 140 A 4.4175 7.0632 119.9378 51.9622 19.5287 180.0329 141 G 3.7679 7.9806 103.8070 45.2484 0.0000 173.4868 142 S 4.4278 8.6266 115.4314 58.4175 64.8045 174.2879 143 R 4.4083 8.3791 120.3276 55.5854 29.6427 176.3420 144 L 4.3851 8.9881 125.5685 57.0202 43.2698 176.9890 145 A 4.8333 7.7469 117.5283 51.0837 22.8339 175.0458 146 A 5.0731 9.0206 120.2405 51.3263 23.4039 175.7178 147 G 4.6334 8.5579 104.7941 45.6563 0.0000 173.0108 148 V 4.2381 8.3542 124.3003 62.6039 32.7718 175.4772 149 I 4.1302 9.0361 129.5659 60.9669 37.8554 175.2685 150 G 4.3770 8.9349 115.2154 43.9727 0.0000 172.2679 151 I 4.2454 8.3072 121.9944 61.1872 37.6259 175.4355 152 A 4.8182 8.4971 128.0518 49.6526 22.1443 176.2304 153 Q 4.0700 8.5026 118.7117 56.4530 29.2150 175.9689 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 A 8.26 4.62 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 2 T 8.35 4.19 4.27 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 1.22 0.00 0.00 3 K 8.94 5.26 0.00 1.86 1.72 0.00 1.72 0.00 0.00 1.98 0.00 0.00 3.11 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.55 1.49 7.81 4 A 9.15 5.43 1.13 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 5 V 8.76 5.10 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 0.81 0.00 0.00 0.93 0.00 0.00 6 A 9.19 5.03 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 7 V 8.40 4.39 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 8.98 4.63 0.00 1.71 1.60 1.05 0.51 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 9 K 9.01 4.91 0.00 1.66 1.63 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.36 7.81 10 G 8.02 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 11 D 8.99 4.72 0.00 2.68 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 12 G 7.53 4.43 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 0.00 13 P 0.00 4.40 0.00 2.23 2.30 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.94 0.00 14 V 7.81 4.57 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 0.85 0.00 0.00 0.93 0.00 0.00 15 Q 8.08 4.78 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 16 G 8.10 4.19 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 0.00 0.00 0.00 17 I 7.95 5.14 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 1.20 1.52 0.83 0.00 0.00 18 I 8.81 4.57 1.85 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 1.26 1.36 0.50 0.00 0.00 19 N 8.52 4.95 0.00 1.44 1.53 0.00 0.00 6.37 8.79 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 20 F 8.93 5.36 0.00 2.89 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 9.59 5.20 0.00 2.45 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 0.00 2.32 2.39 0.00 22 Q 9.35 4.83 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 23 K 9.08 4.09 0.00 1.81 1.88 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.39 7.81 24 E 7.78 4.83 0.00 2.06 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 2.26 2.22 0.00 25 S 8.80 4.12 0.00 4.01 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 26 N 8.14 4.75 0.00 2.72 2.87 0.00 0.00 6.85 7.65 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 27 G 7.83 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 28 P 0.00 4.63 0.00 2.13 2.10 0.00 3.77 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 29 V 9.01 4.58 2.24 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 1.30 0.00 0.00 1.06 0.00 0.00 30 K 9.29 4.88 0.00 1.93 1.86 0.00 1.52 0.00 0.00 1.43 0.00 0.00 2.75 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.45 1.42 7.81 31 V 9.22 4.87 2.16 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 0.69 0.00 0.00 1.06 0.00 0.00 32 W 7.58 5.84 0.00 3.51 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 33 G 7.57 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 0.00 0.00 0.00 34 S 7.73 5.13 0.00 3.81 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 35 I 8.79 5.11 1.81 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 1.29 0.63 0.96 0.00 0.00 36 K 9.18 4.72 0.00 1.77 1.89 0.00 1.33 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.34 7.81 37 G 8.77 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 38 L 7.74 4.53 0.00 1.80 1.41 0.83 0.27 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 39 T 8.24 4.31 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 1.25 0.00 0.00 40 E 8.60 4.02 0.00 1.96 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 2.30 2.46 0.00 41 G 8.77 3.89 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 0.00 0.00 0.00 42 L 8.17 4.70 0.00 1.52 1.76 0.92 0.92 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 43 H 9.31 5.02 0.00 3.02 3.32 0.00 5.63 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 G 9.19 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 0.00 0.00 0.00 45 F 8.93 5.37 0.00 3.01 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 46 H 8.89 5.23 0.00 3.08 3.01 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.59 4.45 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 0.84 0.00 0.00 0.90 0.00 0.00 48 H 9.55 5.04 0.00 3.08 3.44 0.00 5.70 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 9.01 3.72 0.00 1.63 1.12 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 1.47 2.09 0.00 50 F 8.29 4.98 0.00 3.12 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 51 G 8.38 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 0.00 0.00 0.00 52 D 7.95 4.72 0.00 2.62 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 53 N 8.80 5.29 0.00 2.71 2.75 0.00 0.00 7.37 7.70 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 54 T 8.55 3.98 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 1.24 0.00 0.00 55 A 8.10 4.73 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 56 G 7.99 3.73 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 0.00 0.00 0.00 57 A 8.45 4.04 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 58 T 7.59 3.96 4.35 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 1.23 0.00 0.00 59 S 7.89 4.51 0.00 4.05 4.09 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 60 A 7.66 4.48 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 61 G 7.82 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 62 P 0.00 4.69 0.00 2.03 2.20 0.00 3.61 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 1.98 0.00 63 H 8.46 4.46 0.00 2.84 3.20 0.00 5.73 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 64 F 9.24 4.23 0.00 2.89 2.96 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 65 N 7.83 5.04 0.00 2.61 2.43 0.00 0.00 6.93 7.71 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 66 P 0.00 4.17 0.00 1.97 1.89 0.00 2.98 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.99 0.00 67 L 7.60 4.21 0.00 1.56 1.68 0.92 0.93 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 68 S 7.46 3.58 0.00 3.96 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 69 R 8.22 4.60 0.00 1.88 1.97 0.00 3.25 0.00 0.00 3.39 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 70 K 8.81 4.45 0.00 1.63 1.69 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.51 7.81 71 H 8.73 4.00 0.00 3.15 3.27 0.00 5.95 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 72 G 7.47 4.09 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 0.00 0.00 0.00 73 G 9.21 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 74 P 0.00 4.38 0.00 2.23 2.38 0.00 3.79 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 75 K 7.92 4.17 0.00 1.77 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.68 4.59 0.00 2.83 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 77 E 8.73 3.90 0.00 1.90 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 2.28 2.34 0.00 78 E 7.99 4.22 0.00 2.06 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 2.34 2.31 0.00 79 R 7.57 4.65 0.00 1.84 1.87 0.00 2.94 0.00 0.00 2.92 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.56 0.00 80 H 9.01 4.46 0.00 3.47 3.39 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.39 3.51 1.55 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 0.81 0.00 0.00 0.61 0.00 0.00 82 G 8.50 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 0.00 0.00 0.00 83 D 8.16 5.10 0.00 2.71 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 84 L 8.54 4.43 0.00 1.94 1.93 0.97 1.03 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 85 G 8.56 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.62 5.68 0.00 2.59 2.71 0.00 0.00 6.60 7.68 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 87 V 8.57 4.39 1.80 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 -0.20 0.00 0.00 0.73 0.00 0.00 88 T 8.23 5.02 4.21 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 1.20 0.00 0.00 89 A 8.89 4.84 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 90 D 8.79 5.00 0.00 2.90 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 91 K 8.46 4.05 0.00 1.89 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.26 4.51 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 93 G 8.56 4.34 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 0.00 94 V 8.21 4.68 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 1.00 0.00 0.00 0.92 0.00 0.00 95 A 9.08 5.04 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.58 4.95 0.00 2.56 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 97 V 8.77 3.71 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 0.63 0.00 0.00 0.57 0.00 0.00 98 S 8.43 4.62 0.00 3.90 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 99 I 9.42 4.81 1.98 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 1.16 0.51 1.02 0.00 0.00 100 E 8.81 5.18 0.00 1.95 1.81 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 2.21 2.32 0.00 101 D 9.29 4.98 0.00 2.88 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.97 4.71 0.00 3.91 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 0.00 103 V 7.96 4.14 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 0.86 0.00 0.00 0.95 0.00 0.00 104 I 7.99 3.99 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.82 1.05 0.00 0.00 105 S 8.27 4.70 0.00 3.85 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 0.00 106 L 8.99 4.52 0.00 1.77 1.65 1.04 0.90 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 0.00 107 S 7.61 4.54 0.00 3.92 3.79 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 0.00 0.00 0.00 108 G 8.50 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 0.00 109 D 8.76 4.44 0.00 2.71 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 0.00 110 H 8.18 5.01 0.00 3.16 3.37 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.80 4.27 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 0.00 112 I 8.29 3.84 1.63 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.25 0.99 0.00 0.00 113 I 7.27 3.66 1.78 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 1.24 0.79 0.83 0.00 0.00 114 G 9.38 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.39 5.06 0.00 1.60 1.82 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.36 0.00 116 T 8.02 4.95 4.23 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 1.18 0.00 0.00 117 L 8.80 4.71 0.00 1.77 1.53 0.41 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.87 4.99 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 0.72 0.00 0.00 0.76 0.00 0.00 119 V 8.60 5.12 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 0.70 0.00 0.00 1.02 0.00 0.00 120 H 8.97 5.32 0.00 3.24 3.58 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.41 4.20 0.00 2.09 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 0.00 2.37 2.34 0.00 122 K 8.64 4.81 0.00 1.69 1.68 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.48 7.81 123 A 8.38 4.37 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 124 D 9.29 4.79 0.00 2.72 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 0.00 125 D 9.33 4.61 0.00 2.86 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 0.00 126 L 9.65 3.74 0.00 1.78 1.80 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.54 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 0.00 128 K 8.10 4.50 0.00 1.89 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.53 7.81 129 G 8.00 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 0.00 0.00 0.00 130 G 8.35 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 0.00 131 N 7.24 5.04 0.00 2.89 2.80 0.00 0.00 6.88 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 0.00 132 E 8.75 4.07 0.00 2.05 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 2.40 2.31 0.00 133 E 8.15 4.01 0.00 2.07 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 2.41 2.40 0.00 134 S 8.43 4.11 0.00 4.15 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 0.00 135 T 7.69 4.24 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 0.00 136 K 7.70 4.29 0.00 1.77 1.80 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.21 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.32 1.62 7.81 137 T 7.90 4.04 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 1.19 0.00 0.00 138 G 8.04 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 0.00 139 N 7.74 4.29 0.00 2.84 2.91 0.00 0.00 6.85 7.24 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 0.00 140 A 7.06 4.42 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 0.00 141 G 7.98 3.77 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 0.00 0.00 0.00 142 S 8.63 4.43 0.00 3.95 4.04 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 0.00 0.00 0.00 143 R 8.38 4.41 0.00 1.67 1.83 0.00 3.24 0.00 0.00 3.08 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.65 0.00 144 L 8.99 4.39 0.00 1.69 1.70 0.97 0.80 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 0.00 145 A 7.75 4.83 1.20 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 0.00 0.00 146 A 9.02 5.07 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.56 4.63 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 0.00 0.00 0.00 148 V 8.35 4.24 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 0.76 0.00 0.00 0.94 0.00 0.00 149 I 9.04 4.13 1.79 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.32 0.37 0.00 0.00 150 G 8.93 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 0.00 151 I 8.31 4.25 1.85 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 1.25 0.54 0.91 0.00 0.00 152 A 8.50 4.82 1.20 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 0.00 0.00 153 Q 8.50 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00