NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3364 8.2649 123.5853 51.6421 19.9508 176.7028 3 R 4.1433 8.3493 119.9347 56.1782 30.1221 173.6399 4 I 4.3587 8.2883 121.1023 62.0867 41.2716 177.1903 5 A 4.2960 7.9975 122.9194 51.0179 20.2158 175.8702 6 G 4.1151 8.3988 108.9398 46.1071 0.0000 173.6111 7 V 3.3762 8.1695 120.9191 61.6952 29.6766 173.1628 8 E 4.5906 9.1705 118.7192 55.6291 31.0290 177.0314 9 I 4.6822 7.7646 122.6699 59.7495 38.8500 172.5172 10 P 4.3469 0.0000 0.0000 62.4009 32.7865 176.4981 11 R 4.5175 7.8923 120.3289 54.8510 33.5159 173.3570 12 N 4.1664 8.8126 113.4784 53.8805 37.8314 173.0668 13 K 4.7661 7.6142 114.0151 53.4317 35.9770 175.6273 14 R 4.3261 8.5357 118.7090 57.1104 31.7756 178.2149 15 V 3.4819 8.5047 122.0150 65.9704 31.3807 178.2104 16 D 4.4915 7.7705 117.0083 55.4291 39.5555 177.9439 17 V 3.9606 7.5325 118.9239 65.3868 31.9164 176.5590 18 A 4.2213 8.7840 120.4271 55.7067 18.0529 179.4464 19 L 3.9873 8.3335 115.6068 58.2903 41.7112 179.9786 20 T 4.0521 7.4542 115.6119 66.0011 68.3854 174.9789 21 Y 4.3192 8.8168 114.6843 58.9879 37.5072 175.7258 22 I 5.4247 7.6628 121.3513 59.0033 39.2021 175.8941 23 Y 4.1750 10.1997 124.9219 61.0885 38.6812 177.6609 24 G 3.8260 8.0235 105.7949 45.2514 0.0000 172.7182 25 I 4.1497 7.4522 120.9557 58.9039 39.7424 175.1802 26 G 4.0592 7.8287 112.1017 42.8555 0.0000 173.2911 27 K 3.9056 8.5571 117.7261 59.2659 31.6203 178.2138 28 A 4.2503 7.2295 121.2162 54.0018 18.3152 179.1154 29 R 3.8252 7.6807 114.9887 58.9347 29.6782 178.6240 30 A 4.0838 8.4189 121.0572 55.5652 18.3343 179.8445 31 K 4.0538 7.9706 114.8053 59.1766 32.0756 179.3572 32 E 3.9652 8.2259 119.6343 59.3860 29.3772 178.4808 33 A 4.5351 8.9378 121.1913 55.5702 18.4677 179.6965 34 L 4.0341 7.8370 116.4770 57.8517 41.8097 178.5070 35 E 3.8827 8.4916 119.5358 59.6889 29.2665 179.1525 36 K 3.7182 8.1746 117.7104 59.4455 32.2384 178.1206 37 T 4.1281 7.4603 112.6722 62.3610 68.9508 174.9681 38 G 3.9651 7.6865 110.2465 46.9135 0.0000 174.4473 39 I 4.4111 7.5415 116.3825 58.8243 39.9985 175.9426 40 N 4.1706 8.9192 123.3317 53.7318 38.9193 173.4805 41 P 4.2337 0.0000 0.0000 65.6930 31.6393 178.3873 42 A 4.0797 8.1185 119.3198 54.5218 18.5932 177.7311 43 T 3.9209 7.5836 107.5490 61.3196 69.2471 173.9533 44 R 4.2200 8.6111 126.7455 55.9084 31.1023 176.9055 45 V 3.4658 8.5954 125.7216 66.0840 31.6367 178.2853 46 K 4.0053 8.0681 117.2148 59.6346 32.4212 177.0637 47 D 4.6923 8.7056 118.1523 54.0066 41.0491 176.5372 48 L 4.3043 7.6011 120.7901 54.7567 42.3547 177.1255 49 T 4.1260 10.7198 120.3802 62.9930 69.0555 175.3595 50 E 4.0611 9.0256 125.8764 60.0182 29.6196 178.6927 51 A 4.1125 8.0535 120.6547 54.1413 18.5865 178.7915 52 E 3.8496 8.0932 115.1469 59.7240 29.7568 179.9566 53 V 3.6631 8.2455 118.1848 66.2702 31.4841 178.2494 54 V 3.6373 8.2829 118.2103 65.6913 31.3390 178.4023 55 R 3.8916 7.7654 117.4934 59.1534 30.3093 178.2281 56 L 4.0370 8.3221 120.5023 58.2945 42.0016 179.0379 57 R 3.8891 8.1812 118.3506 59.5892 30.0957 178.3141 58 E 3.9704 8.2368 118.2839 60.3284 29.2684 177.9002 59 Y 4.2114 8.6710 119.0782 59.0463 38.8752 177.8386 60 V 3.0144 7.7498 117.8756 66.0375 31.9122 178.3393 61 E 4.2267 7.8351 116.4620 58.5405 30.1580 178.8097 62 N 4.6479 7.6580 121.6497 51.8261 38.0105 174.4248 63 T 4.5190 6.9801 129.5064 62.1236 68.0194 172.6839 64 W 5.1807 7.2271 117.2575 54.4541 32.7338 174.4688 65 K 4.3852 8.6947 121.7462 55.5757 32.4612 175.7908 66 L 4.9068 8.1314 125.8144 55.0880 46.5020 176.9966 67 E 3.8948 8.7232 116.3395 56.2987 30.7731 178.0176 68 G 3.8598 8.7991 114.3873 49.3812 0.0000 174.0054 69 E 4.0396 8.3324 121.7015 58.9037 29.4522 178.4857 70 L 4.0244 8.2381 120.5389 58.1116 42.3605 178.7381 71 R 3.9541 8.2602 117.7350 59.4399 29.9919 178.6655 72 A 3.9537 8.4224 120.6101 56.0406 18.2128 178.4587 73 E 3.8031 8.1034 115.2044 59.7743 29.6765 179.3529 74 V 3.1929 8.3605 114.6079 65.7526 32.1435 178.0329 75 A 3.9241 8.5769 119.6339 55.6072 18.3052 179.5965 76 A 3.9815 8.1061 117.8639 55.4171 18.5508 179.3184 77 N 4.3748 8.8264 115.5976 56.4445 38.4606 177.2774 78 I 3.5433 7.7135 120.1556 64.5621 37.3565 177.7258 79 K 4.0072 8.0111 120.0509 60.3222 31.7060 177.7700 80 R 3.7550 8.3830 117.6179 60.2341 29.8429 177.5002 81 L 3.8500 7.9122 119.9442 58.4104 40.9653 178.6670 82 M 4.2766 7.5612 117.7030 56.7138 32.5350 176.1408 83 D 4.6688 9.0360 118.2491 55.8001 42.3925 177.0658 84 I 4.1439 7.7406 112.6173 59.9226 38.6978 177.4642 85 G 3.9242 9.0691 112.6680 49.0065 0.0000 173.2923 86 C 3.5337 8.1729 119.3231 57.0874 31.8093 173.5433 87 Y 4.1416 9.1453 128.4802 61.1290 38.1915 177.8406 88 R 3.8282 8.3110 117.6044 59.5263 30.1158 178.2151 89 G 4.0437 7.7638 105.9528 47.3179 0.0000 175.1497 90 L 3.9192 7.8743 122.5499 57.7278 41.8354 179.8229 91 R 3.7461 8.0660 117.6940 59.7495 29.9126 178.7069 92 H 4.1543 8.2919 115.8594 58.9608 28.5488 177.5405 93 R 3.8563 7.9956 118.0043 60.0121 30.0707 178.8009 94 R 4.0251 8.3180 117.0771 57.5512 30.1768 178.2211 95 G 3.9026 8.2979 105.9870 45.2836 0.0000 173.5283 96 L 4.4125 7.0203 118.2204 52.3748 42.8599 174.8113 97 P 4.2647 0.0000 0.0000 63.3977 31.6736 176.6327 98 V 3.6819 8.2721 121.3004 65.7666 31.9267 179.1877 99 R 4.1260 7.8550 118.6057 56.9678 28.8866 177.5773 100 G 3.9568 8.2304 103.0858 46.7066 0.0000 172.6021 101 Q 4.4654 7.7947 122.9111 54.4788 32.7782 174.8371 102 R 4.4590 8.3755 114.5383 56.5717 30.6751 175.9495 103 T 4.6559 8.1581 107.4513 61.5915 69.6449 174.5276 104 R 4.4308 8.1486 122.8446 57.8634 31.6083 176.4001 105 T 4.2884 7.3926 110.4453 61.6639 69.5834 174.0094 106 N 3.8761 7.9532 118.6053 53.4273 38.1478 173.2225 107 A 4.5607 8.3935 125.8031 52.2348 21.4093 177.7301 108 R 3.9746 7.9159 119.1585 60.7975 30.3976 178.7063 109 T 3.8828 8.0765 110.4750 65.2221 67.0398 174.2266 110 R 4.3553 7.4234 116.2218 56.1172 30.1826 176.0216 111 K 4.3333 8.9861 118.0576 56.1218 34.3363 174.9267 112 G 3.8229 8.0830 102.4621 43.4905 0.0000 171.1321 113 P 4.4292 0.0000 0.0000 61.5933 32.0796 176.2683 114 R 3.8765 8.4906 121.5834 56.9900 30.6744 177.8705 115 K 4.4562 8.2737 128.2732 54.8829 31.1387 176.2209 116 T 3.8364 7.3927 115.1058 63.9042 69.5974 173.7553 117 V 4.3812 7.8344 122.3072 60.8664 34.9318 174.1330 118 A 4.2506 8.4127 123.8573 52.3543 18.7700 175.9962 119 G 3.9957 7.9258 107.0608 45.2798 0.0000 172.4348 120 K 4.4820 8.4378 120.4043 54.3617 33.9478 174.0653 121 K 3.7758 8.6292 127.2900 56.9678 31.3387 176.4897 122 K 3.6136 8.6599 131.2781 59.5218 33.0714 174.8634 123 A 4.2355 9.3484 135.0000 57.5425 18.9963 178.9083 124 P 3.9644 0.0000 0.0000 63.4566 27.5529 176.9825 125 R 4.2488 7.9469 112.9103 56.4107 30.0423 177.8746 126 K 4.0709 7.5626 124.1175 57.2169 31.9860 176.4788 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 A 8.26 4.34 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 3 R 8.35 4.14 0.00 1.91 1.94 0.00 3.16 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 4 I 8.29 4.36 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.79 0.96 0.00 0.00 5 A 8.00 4.30 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 6 G 8.40 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 7 V 8.17 3.38 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 0.70 0.00 0.00 0.93 0.00 0.00 8 E 9.17 4.59 0.00 2.25 1.91 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 2.53 2.48 0.00 9 I 7.76 4.68 1.86 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 1.47 0.26 0.91 0.00 0.00 10 P 0.00 4.35 0.00 2.29 2.19 0.00 3.94 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 11 R 7.89 4.52 0.00 1.78 1.73 0.00 3.32 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 12 N 8.81 4.17 0.00 2.80 2.79 0.00 0.00 6.71 6.68 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 13 K 7.61 4.77 0.00 2.06 1.73 0.00 1.86 0.00 0.00 1.89 0.00 0.00 3.22 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.41 7.81 14 R 8.54 4.33 0.00 1.88 2.29 0.00 3.15 0.00 0.00 3.28 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.75 0.00 15 V 8.50 3.48 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 1.11 0.00 0.00 1.03 0.00 0.00 16 D 7.77 4.49 0.00 2.93 2.82 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 17 V 7.53 3.96 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 1.11 0.00 0.00 0.94 0.00 0.00 18 A 8.78 4.22 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.33 3.99 0.00 1.79 1.85 1.06 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.45 4.05 4.02 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 0.00 0.00 0.99 0.00 0.00 21 Y 8.82 4.32 0.00 3.16 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 22 I 7.66 5.42 1.99 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.53 1.04 0.00 0.00 23 Y 10.20 4.18 0.00 3.24 3.09 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 24 G 8.02 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 0.00 0.00 0.00 25 I 7.45 4.15 2.01 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.26 0.86 0.00 0.00 26 G 7.83 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 0.00 0.00 0.00 27 K 8.56 3.91 0.00 1.73 1.88 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.38 7.81 28 A 7.23 4.25 1.18 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 0.00 0.00 0.00 29 R 7.68 3.83 0.00 1.23 0.66 0.00 2.50 0.00 0.00 2.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.16 0.00 30 A 8.42 4.08 1.42 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 31 K 7.97 4.05 0.00 1.93 1.91 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.46 7.81 32 E 8.23 3.97 0.00 2.15 2.44 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 2.54 2.47 0.00 33 A 8.94 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 34 L 7.84 4.03 0.00 1.97 1.92 1.04 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.49 3.88 0.00 2.25 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 0.00 2.33 2.41 0.00 36 K 8.17 3.72 0.00 1.26 1.35 0.00 1.30 0.00 0.00 1.22 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.32 7.81 37 T 7.46 4.13 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 1.19 0.00 0.00 38 G 7.69 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 0.00 0.00 0.00 39 I 7.54 4.41 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.83 0.98 0.00 0.00 40 N 8.92 4.17 0.00 2.75 2.74 0.00 0.00 7.18 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 41 P 0.00 4.23 0.00 2.24 2.10 0.00 3.68 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 42 A 8.12 4.08 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 43 T 7.58 3.92 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 44 R 8.61 4.22 0.00 2.05 1.86 0.00 3.29 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.72 0.00 45 V 8.60 3.47 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 1.01 0.00 0.00 1.07 0.00 0.00 46 K 8.07 4.01 0.00 1.91 1.94 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.48 7.81 47 D 8.71 4.69 0.00 2.72 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 48 L 7.60 4.30 0.00 1.89 1.62 0.95 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 49 T 10.72 4.13 4.39 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 1.27 0.00 0.00 50 E 9.03 4.06 0.00 1.94 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 2.31 2.48 0.00 51 A 8.05 4.11 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 52 E 8.09 3.85 0.00 2.14 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 2.42 2.42 0.00 53 V 8.25 3.66 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 1.01 0.00 0.00 1.02 0.00 0.00 54 V 8.28 3.64 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 0.98 0.00 0.00 1.02 0.00 0.00 55 R 7.77 3.89 0.00 2.04 1.94 0.00 3.17 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 56 L 8.32 4.04 0.00 1.92 1.73 0.98 0.95 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 57 R 8.18 3.89 0.00 2.14 2.06 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.66 0.00 58 E 8.24 3.97 0.00 2.18 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 0.00 2.70 2.47 0.00 59 Y 8.67 4.21 0.00 2.69 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 60 V 7.75 3.01 2.17 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 1.10 0.00 0.00 1.00 0.00 0.00 61 E 7.84 4.23 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 2.36 2.60 0.00 62 N 7.66 4.65 0.00 2.86 2.75 0.00 0.00 6.99 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 63 T 6.98 4.52 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 -0.34 0.00 0.00 64 W 7.23 5.18 0.00 3.42 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 65 K 8.69 4.39 0.00 1.77 1.77 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.43 1.89 7.81 66 L 8.13 4.91 0.00 1.78 1.65 1.06 1.15 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 67 E 8.72 3.89 0.00 2.11 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 2.43 2.48 0.00 68 G 8.80 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 0.00 0.00 0.00 69 E 8.33 4.04 0.00 2.06 2.17 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 2.42 2.41 0.00 70 L 8.24 4.02 0.00 2.03 2.05 0.98 1.35 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 71 R 8.26 3.95 0.00 1.86 1.85 0.00 2.91 0.00 0.00 2.83 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.22 0.00 72 A 8.42 3.95 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 73 E 8.10 3.80 0.00 2.03 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 2.34 2.35 0.00 74 V 8.36 3.19 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 0.98 0.00 0.00 1.04 0.00 0.00 75 A 8.58 3.92 1.42 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 76 A 8.11 3.98 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 77 N 8.83 4.37 0.00 2.90 2.85 0.00 0.00 6.91 7.83 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 78 I 7.71 3.54 1.77 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 1.43 0.64 0.47 0.00 0.00 79 K 8.01 4.01 0.00 1.96 1.94 0.00 1.61 0.00 0.00 2.05 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.59 7.81 80 R 8.38 3.76 0.00 1.98 1.95 0.00 3.16 0.00 0.00 3.22 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 81 L 7.91 3.85 0.00 1.88 1.94 0.94 0.49 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 82 M 7.56 4.28 0.00 2.02 2.27 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.50 0.00 83 D 9.04 4.67 0.00 2.63 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 84 I 7.74 4.14 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.98 0.92 0.00 0.00 85 G 9.07 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 86 C 8.17 3.53 0.00 3.04 3.22 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 0.00 87 Y 9.15 4.14 0.00 3.07 2.98 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 88 R 8.31 3.83 0.00 1.88 1.99 0.00 3.32 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 1.62 1.71 0.00 89 G 7.76 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 0.00 0.00 0.00 90 L 7.87 3.92 0.00 1.70 1.72 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.07 3.75 0.00 1.63 1.73 0.00 2.86 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.22 0.00 92 H 8.29 4.15 0.00 3.33 3.31 0.00 5.65 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 93 R 8.00 3.86 0.00 1.96 2.01 0.00 3.22 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 94 R 8.32 4.03 0.00 1.76 1.99 0.00 3.36 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 95 G 8.30 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 96 L 7.02 4.41 0.00 1.66 1.59 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.26 0.00 2.50 2.04 0.00 3.74 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 1.95 0.00 98 V 8.27 3.68 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 0.71 0.00 0.00 0.50 0.00 0.00 99 R 7.85 4.13 0.00 1.84 1.94 0.00 3.40 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 100 G 8.23 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 0.00 101 Q 7.79 4.47 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.90 0.00 0.00 0.00 0.00 0.00 2.25 2.49 0.00 102 R 8.38 4.46 0.00 1.92 1.93 0.00 2.98 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 1.57 1.61 0.00 103 T 8.16 4.66 4.25 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 1.22 0.00 0.00 104 R 8.15 4.43 0.00 1.79 1.98 0.00 3.20 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 105 T 7.39 4.29 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 0.00 106 N 7.95 3.88 0.00 2.75 2.80 0.00 0.00 6.56 7.35 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 0.00 107 A 8.39 4.56 1.23 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 0.00 0.00 108 R 7.92 3.97 0.00 1.85 2.00 0.00 3.33 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 109 T 8.08 3.88 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 0.00 110 R 7.42 4.36 0.00 1.89 1.89 0.00 3.24 0.00 0.00 3.11 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 111 K 8.99 4.33 0.00 1.81 1.86 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.33 7.81 112 G 8.08 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 0.00 113 P 0.00 4.43 0.00 2.05 1.99 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 114 R 8.49 3.88 0.00 1.77 1.86 0.00 3.21 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 115 K 8.27 4.46 0.00 1.77 1.75 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.65 7.81 116 T 7.39 3.84 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 0.00 117 V 7.83 4.38 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 0.82 0.00 0.00 0.98 0.00 0.00 118 A 8.41 4.25 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 0.00 119 G 7.93 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 0.00 120 K 8.44 4.48 0.00 1.71 1.70 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.43 7.81 121 K 8.63 3.78 0.00 1.76 1.60 0.00 1.85 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.47 7.81 122 K 8.66 3.61 0.00 1.69 1.80 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.43 1.54 7.81 123 A 9.35 4.24 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 0.00 124 P 0.00 3.96 0.00 2.24 2.15 0.00 3.60 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 2.08 2.11 0.00 125 R 7.95 4.25 0.00 1.90 2.04 0.00 3.10 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 126 K 7.56 4.07 0.00 1.73 1.78 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.40 7.81