NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3591 8.3049 118.2010 54.9342 32.5312 174.5481 2 R 4.0683 8.6853 119.9165 55.3004 30.4040 175.2659 3 H 5.0618 9.5079 121.4644 54.4566 31.9234 173.7189 4 I 4.5518 8.1226 121.8542 59.7518 38.4223 177.1893 5 S 4.5603 8.4294 120.4472 57.2468 65.3587 173.3868 6 P 4.3061 0.0000 0.0000 65.7881 31.0122 178.8675 7 E 4.0377 8.1481 116.0512 59.2636 29.6208 178.6425 8 E 3.9251 8.3745 120.4060 58.8153 29.6031 178.4789 9 L 3.9991 8.2405 120.7432 58.2576 42.1257 178.9628 10 I 3.9988 8.1290 119.5382 64.6065 37.0307 178.2935 11 A 4.0001 8.3749 121.8146 54.9273 18.1683 179.4637 12 L 3.8340 8.1887 119.0340 58.4826 42.1379 178.3639 13 H 3.8627 8.1422 119.7243 58.7949 29.6148 176.8580 14 D 4.2291 8.3549 120.3443 57.2245 40.6099 178.6596 15 A 3.9916 8.2992 121.7039 54.9980 18.2480 179.2570 16 N 4.3818 8.0918 115.7233 56.8339 38.9652 177.1969 17 I 3.7847 7.8882 121.6013 64.4361 36.9635 178.2997 18 S 4.0232 7.7980 112.6731 61.3583 62.2785 175.8916 19 R 3.8476 7.7245 120.1247 58.7582 29.9902 177.0572 20 Y 4.6439 8.3426 113.8923 56.5357 39.4678 176.5664 21 G 3.8917 7.3455 105.5154 45.0681 0.0000 171.8125 22 G 4.2451 8.2473 103.8723 42.5069 0.0000 173.6366 23 L 4.1664 8.5486 121.6016 53.7310 42.0180 176.1195 24 P 4.4790 0.0000 0.0000 62.7170 32.5980 176.1592 25 G 4.0714 8.9574 104.5121 45.6637 0.0000 172.2375 26 M 4.9432 8.0050 118.0093 53.5707 33.5850 177.1702 27 S 4.2467 8.6111 119.5003 61.5421 63.3111 174.9951 28 D 4.4584 7.5839 118.8628 52.2917 43.6490 172.4797 29 P 4.2077 0.0000 0.0000 64.0786 32.0357 175.9640 30 G 4.0785 8.9612 110.5757 45.9162 0.0000 175.7302 31 R 3.8197 7.8331 119.5516 59.0737 29.8467 178.3060 32 A 3.8561 7.7804 120.1827 55.1780 18.4589 178.9579 33 E 3.8276 8.1494 116.9809 59.2866 29.7355 178.6604 34 A 3.9462 8.0258 120.6245 55.2678 18.4947 179.7576 35 I 3.6171 7.9487 118.4546 64.7301 37.2731 178.9189 36 I 3.8136 8.0626 121.0005 64.0509 36.8029 178.6385 37 G 3.6582 8.2110 106.7418 47.9754 0.0000 175.7551 38 R 3.8602 7.9952 120.6307 58.8937 30.0150 179.3188 39 V 3.3726 7.5134 117.8093 66.1112 31.5015 178.2072 40 Q 3.7882 7.9777 117.5079 58.6668 28.5061 178.3743 41 A 3.9808 8.1772 122.1408 55.2150 18.4480 179.6742 42 R 3.8637 8.1017 117.2273 59.5054 30.0792 178.7275 43 V 3.5663 7.9399 117.9335 65.9717 31.4629 177.9094 44 A 3.9634 8.0395 120.2758 55.3956 18.0881 179.0113 45 Y 3.8525 8.1994 117.4464 60.8091 38.9076 176.8662 46 E 4.1445 8.7895 116.2701 56.0750 30.2051 175.9446 47 E 3.6628 7.5039 117.2777 57.2792 27.2957 175.7934 48 I 4.1126 8.0594 119.7333 61.0741 37.3394 176.6211 49 T 4.3839 8.3251 115.1854 61.5456 70.3056 174.6103 50 D 4.5324 7.9600 122.9544 53.8694 42.0748 176.2322 51 L 4.1627 8.5532 127.8449 58.0356 41.6140 179.4863 52 F 4.4166 8.2558 117.8438 60.2444 38.8662 177.4327 53 E 3.9735 8.5465 118.6972 59.1925 29.5814 178.8490 54 V 3.4379 7.8635 118.2203 66.0328 31.5621 177.6760 55 S 3.9778 8.5108 113.0266 61.5723 62.2140 176.0254 56 A 4.0440 8.3163 123.3006 55.4850 17.9899 179.8061 57 T 3.7646 7.8679 114.1928 66.8690 68.4978 176.4379 58 Y 3.9456 7.8259 118.6007 60.9312 37.8343 178.4637 59 L 4.0797 8.1735 121.1606 58.3544 42.2700 179.2096 60 V 3.5396 8.3377 118.1498 65.9193 31.2646 177.7535 61 A 3.9753 8.0343 119.6981 55.5487 18.6259 179.4789 62 T 4.0360 8.0309 113.9610 66.5929 68.4183 177.0828 63 A 3.9492 8.0770 121.8748 54.6893 18.4844 179.0104 64 R 4.3153 7.9043 114.0282 56.8515 30.8115 178.2592 65 G 3.7385 7.6662 104.4932 44.7038 0.0000 173.0472 66 Y 3.6375 7.6546 117.2931 59.0953 35.7312 171.8696 67 I 3.6242 7.5586 120.9664 63.2600 37.8131 176.6759 68 F 5.3590 7.9746 117.0136 55.2301 41.7202 175.3684 69 N 4.5740 8.8374 120.2791 56.3205 37.1545 174.8947 70 D 4.5653 8.1476 115.0418 53.8250 44.3476 173.9403 71 A 3.9374 8.7191 121.5968 53.4437 16.2731 179.8980 72 N 4.4994 7.7425 118.2758 57.9941 38.4750 177.3674 73 K 3.9451 7.9165 119.3395 59.4903 32.1862 179.3613 74 R 3.8487 7.9276 117.8113 59.7531 29.5281 179.1599 75 T 3.8305 8.0414 115.1536 66.2143 68.3767 176.6485 76 A 4.0488 8.3268 123.1790 55.1182 18.5365 179.3207 77 L 3.8595 8.0952 118.7045 58.6047 42.2648 179.0209 78 N 4.3560 8.3720 116.7672 56.1271 38.4263 177.6992 79 S 4.0524 8.3074 115.6160 61.3939 63.1972 176.2582 80 A 4.0377 7.9900 124.7051 54.9310 18.0250 179.5363 81 L 3.9612 7.8898 116.9883 57.1998 41.6891 179.2394 82 L 3.8419 8.3259 120.9559 57.9517 41.8948 178.6012 83 F 3.8559 8.4891 120.8837 61.3165 39.2272 176.9884 84 L 3.6083 7.8575 118.2817 57.7501 41.4872 179.4502 85 R 4.2028 7.9550 120.1372 59.0722 29.7536 178.8009 86 R 3.9111 7.8801 116.7113 58.5334 29.9511 177.6457 87 N 4.6467 7.1218 114.4208 52.6829 38.7660 175.8826 88 G 3.7494 7.6205 107.7337 45.4471 0.0000 173.8043 89 V 4.0317 7.5929 120.6536 60.7664 31.9689 175.2412 90 Q 4.2622 8.7389 129.0990 56.2902 29.4927 175.5262 91 V 4.0039 8.0279 117.6538 59.5690 34.7892 174.4507 92 F 4.9643 7.2665 114.9522 55.5718 40.4746 173.4802 93 D 4.6335 8.6696 121.0829 54.2452 42.0749 175.4105 94 S 4.8092 8.3086 118.2510 55.7785 65.5043 172.8148 95 P 4.5413 0.0000 0.0000 64.4709 31.5364 176.9046 96 E 4.2251 8.3028 119.1390 58.2555 30.1908 178.8274 97 L 4.0242 7.9343 119.1703 57.4337 41.5011 179.0142 98 A 3.9636 7.9259 120.2293 55.5369 18.3868 179.3688 99 D 4.2971 8.0419 116.7022 57.1227 40.8672 178.6493 100 L 3.9325 7.7888 120.5854 58.5466 42.0642 179.3040 101 T 3.8835 7.9911 115.6211 66.4646 68.4168 176.9411 102 V 3.6619 8.0345 120.4474 66.0775 31.5579 178.2928 103 G 3.6417 8.3931 105.3753 47.7136 0.0000 175.4954 104 A 4.1748 8.2642 122.9099 54.9992 18.2032 179.6112 105 A 3.9595 7.9580 118.6033 55.1177 18.5632 179.1469 106 T 4.2737 7.9084 105.6910 61.9648 69.4042 175.9305 107 G 3.9205 7.8665 112.1866 46.4229 0.0000 175.0305 108 E 4.1820 8.1022 116.4427 57.1360 30.1038 181.5434 109 I 4.5204 7.4819 118.3857 59.2601 39.4683 176.2479 110 S 4.4283 8.4036 120.4190 57.4851 65.2037 175.2229 111 V 3.5705 8.3012 121.1927 66.5772 31.1059 177.9899 112 S 4.1670 8.1155 113.9906 61.9678 62.6993 176.9488 113 S 4.1334 8.3260 117.7703 61.4220 62.4732 176.8199 114 V 3.5708 8.1907 121.1499 66.0190 31.2035 177.8902 115 A 4.2123 8.5117 120.8682 55.3930 18.1927 179.3024 116 D 4.2802 8.2079 117.3783 57.7634 40.7869 179.2982 117 T 3.8027 7.8775 116.1448 66.6082 68.4512 176.8646 118 L 4.0029 8.1950 121.2415 57.8564 41.6200 179.6501 119 R 2.5100 8.0429 118.9458 58.6337 29.6867 178.5354 120 R 3.7137 7.4358 117.5282 59.3291 30.1724 178.2368 121 L 3.8507 7.5449 117.3966 57.2959 41.6510 178.2537 122 Y 5.0432 7.6117 112.7852 57.5997 39.5262 176.1036 123 G 3.8320 7.9644 114.0865 45.7318 0.0000 173.5681 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 M 8.30 4.36 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.68 0.00 2 R 8.69 4.07 0.00 1.66 1.85 0.00 3.14 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 3 H 9.51 5.06 0.00 3.28 3.47 0.00 5.67 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 I 8.12 4.55 1.66 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.31 0.91 0.00 0.00 5 S 8.43 4.56 0.00 4.09 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 6 P 0.00 4.31 0.00 2.21 2.24 0.00 3.63 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 2.13 2.17 0.00 7 E 8.15 4.04 0.00 2.32 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 0.00 2.36 1.93 0.00 8 E 8.37 3.93 0.00 2.10 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 2.31 2.32 0.00 9 L 8.24 4.00 0.00 1.99 1.98 1.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.13 4.00 2.12 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 1.66 0.89 1.12 0.00 0.00 11 A 8.37 4.00 1.35 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 0.00 0.00 0.00 12 L 8.19 3.83 0.00 1.83 1.86 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 13 H 8.14 3.86 0.00 2.30 2.92 0.00 5.69 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 14 D 8.35 4.23 0.00 2.85 2.70 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 0.00 0.00 0.00 0.00 15 A 8.30 3.99 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 16 N 8.09 4.38 0.00 2.90 2.89 0.00 0.00 7.17 7.56 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 17 I 7.89 3.78 1.89 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 1.17 0.54 0.93 0.00 0.00 18 S 7.80 4.02 0.00 3.93 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 19 R 7.72 3.85 0.00 1.63 1.66 0.00 3.03 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.09 0.00 20 Y 8.34 4.64 0.00 3.07 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 G 7.35 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 22 G 8.25 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 0.00 0.00 0.00 0.00 23 L 8.55 4.17 0.00 1.70 1.66 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.48 0.00 2.22 2.08 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 25 G 8.96 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 26 M 8.01 4.94 0.00 1.88 1.98 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.35 0.00 27 S 8.61 4.25 0.00 3.89 3.94 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 28 D 7.58 4.46 0.00 2.68 2.42 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 29 P 0.00 4.21 0.00 2.06 1.97 0.00 3.68 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 2.02 2.08 0.00 30 G 8.96 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 31 R 7.83 3.82 0.00 1.78 1.81 0.00 3.20 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 32 A 7.78 3.86 1.24 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 0.00 0.00 0.00 33 E 8.15 3.83 0.00 2.04 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 0.00 2.37 2.38 0.00 34 A 8.03 3.95 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 35 I 7.95 3.62 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.57 0.87 0.00 0.00 36 I 8.06 3.81 1.91 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 1.72 1.20 1.09 0.00 0.00 37 G 8.21 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 38 R 8.00 3.86 0.00 2.19 1.93 0.00 3.25 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 39 V 7.51 3.37 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 0.18 0.00 0.00 0.73 0.00 0.00 40 Q 7.98 3.79 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.18 2.37 0.00 41 A 8.18 3.98 1.35 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 0.00 0.00 0.00 42 R 8.10 3.86 0.00 1.91 2.11 0.00 3.11 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 43 V 7.94 3.57 2.20 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 1.16 0.00 0.00 0.94 0.00 0.00 44 A 8.04 3.96 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 45 Y 8.20 3.85 0.00 2.97 3.05 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 46 E 8.79 4.14 0.00 2.09 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 2.49 2.55 0.00 47 E 7.50 3.66 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 48 I 8.06 4.11 1.89 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 1.37 0.50 0.98 0.00 0.00 49 T 8.33 4.38 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 1.23 0.00 0.00 50 D 7.96 4.53 0.00 2.80 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.55 4.16 0.00 1.28 1.41 0.70 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.26 4.42 0.00 3.36 3.32 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 53 E 8.55 3.97 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 54 V 7.86 3.44 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 0.57 0.00 0.00 1.03 0.00 0.00 55 S 8.51 3.98 0.00 4.21 4.15 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 0.00 0.00 0.00 0.00 56 A 8.32 4.04 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 0.00 0.00 0.00 0.00 0.00 57 T 7.87 3.76 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 1.06 0.00 0.00 58 Y 7.83 3.95 0.00 3.06 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 59 L 8.17 4.08 0.00 1.89 1.86 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.34 3.54 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 0.95 0.00 0.00 0.97 0.00 0.00 61 A 8.03 3.98 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 62 T 8.03 4.04 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 1.37 0.00 0.00 63 A 8.08 3.95 1.35 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 0.00 0.00 0.00 64 R 7.90 4.32 0.00 1.87 2.03 0.00 3.17 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 1.79 1.74 0.00 65 G 7.67 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 66 Y 7.65 3.64 0.00 3.07 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 67 I 7.56 3.62 1.17 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 1.22 0.55 -0.20 0.00 0.00 68 F 7.97 5.36 0.00 3.20 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 69 N 8.84 4.57 0.00 2.93 2.96 0.00 0.00 6.67 7.34 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 70 D 8.15 4.57 0.00 2.70 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 71 A 8.72 3.94 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 72 N 7.74 4.50 0.00 2.70 2.81 0.00 0.00 7.07 7.56 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 73 K 7.92 3.95 0.00 1.77 1.83 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.48 7.81 74 R 7.93 3.85 0.00 1.78 1.89 0.00 3.25 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 75 T 8.04 3.83 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 76 A 8.33 4.05 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.10 3.86 0.00 1.74 1.77 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.37 4.36 0.00 2.81 2.83 0.00 0.00 6.88 8.07 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 79 S 8.31 4.05 0.00 4.01 4.17 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 80 A 7.99 4.04 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.89 3.96 0.00 1.82 1.57 0.98 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.33 3.84 0.00 1.75 1.82 0.87 0.83 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 F 8.49 3.86 0.00 2.75 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 84 L 7.86 3.61 0.00 1.74 1.53 1.01 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 85 R 7.96 4.20 0.00 1.80 1.95 0.00 3.10 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.47 0.00 86 R 7.88 3.91 0.00 1.65 1.82 0.00 3.12 0.00 0.00 3.14 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.76 0.00 87 N 7.12 4.65 0.00 2.07 2.50 0.00 0.00 7.14 8.99 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 88 G 7.62 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 89 V 7.59 4.03 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 1.07 0.00 0.00 0.74 0.00 0.00 90 Q 8.74 4.26 0.00 2.38 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.56 0.00 0.00 0.00 0.00 0.00 2.34 1.95 0.00 91 V 8.03 4.00 1.53 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 0.38 0.00 0.00 0.79 0.00 0.00 92 F 7.27 4.96 0.00 3.17 3.04 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 93 D 8.67 4.63 0.00 2.74 2.70 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 0.00 0.00 0.00 0.00 94 S 8.31 4.81 0.00 3.91 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 95 P 0.00 4.54 0.00 2.23 2.18 0.00 3.86 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 2.00 2.01 0.00 96 E 8.30 4.23 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 97 L 7.93 4.02 0.00 1.73 1.73 1.06 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 98 A 7.93 3.96 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 99 D 8.04 4.30 0.00 2.70 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 0.00 100 L 7.79 3.93 0.00 1.90 1.87 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 101 T 7.99 3.88 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 1.25 0.00 0.00 102 V 8.03 3.66 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 1.02 0.00 0.00 0.95 0.00 0.00 103 G 8.39 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 0.00 0.00 0.00 104 A 8.26 4.17 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 0.00 105 A 7.96 3.96 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 0.00 106 T 7.91 4.27 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 1.26 0.00 0.00 107 G 7.87 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 0.00 108 E 8.10 4.18 0.00 2.02 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 2.25 2.15 0.00 109 I 7.48 4.52 1.88 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 1.09 0.92 0.00 0.00 110 S 8.40 4.43 0.00 4.05 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 0.00 111 V 8.30 3.57 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 1.11 0.00 0.00 0.92 0.00 0.00 112 S 8.12 4.17 0.00 3.91 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 0.00 113 S 8.33 4.13 0.00 3.98 3.91 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 0.00 114 V 8.19 3.57 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 1.15 0.00 0.00 0.99 0.00 0.00 115 A 8.51 4.21 1.44 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 0.00 0.00 0.00 0.00 0.00 116 D 8.21 4.28 0.00 2.88 2.70 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 0.00 0.00 0.00 0.00 117 T 7.88 3.80 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 1.16 0.00 0.00 118 L 8.20 4.00 0.00 2.03 2.15 1.10 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 119 R 8.04 2.51 0.00 1.54 1.79 0.00 3.02 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.09 0.00 120 R 7.44 3.71 0.00 1.76 1.96 0.00 3.27 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 121 L 7.54 3.85 0.00 0.73 0.13 0.69 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 122 Y 7.61 5.04 0.00 3.23 3.06 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 0.00 123 G 7.96 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