NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4846 8.2893 120.3260 55.5818 33.3998 173.7633 2 E 4.5320 8.0936 116.5884 52.7257 32.6433 173.1535 3 P 4.3500 0.0000 0.0000 62.3823 34.1302 178.6240 4 A 4.0030 8.7401 122.8563 55.5951 18.1760 180.1205 5 A 4.2435 7.9323 119.8572 54.6475 18.4640 179.7258 6 R 3.8692 7.8908 117.0406 59.3179 30.2956 178.2441 7 R 3.9476 7.9568 118.6268 59.7914 29.9754 178.7238 8 R 4.0224 8.3857 117.6423 59.1248 29.9418 178.8276 9 A 4.1591 8.1448 120.2007 55.3618 18.4185 179.5440 10 R 3.9447 8.3725 117.1777 59.3827 30.1967 178.3007 11 E 4.0829 8.3875 118.5354 60.0428 29.5219 179.2688 12 C 4.4906 8.5677 116.3807 62.8813 28.1501 176.1295 13 A 3.7920 8.4571 122.7120 54.9022 17.8230 179.7268 14 V 3.4567 7.9262 116.8717 66.2776 31.5358 178.2932 15 Q 3.8629 7.8353 117.2689 59.0348 28.5828 178.7969 16 A 4.0374 8.1203 122.1249 54.7892 18.3065 179.4661 17 L 3.9620 8.3066 119.4659 58.4204 42.1914 178.3245 18 Y 4.0065 8.2550 119.6966 60.9383 38.6692 178.1944 19 S 4.2856 8.4065 115.9213 61.7147 63.0119 176.7343 20 W 4.2697 8.4007 130.6845 60.5714 30.2306 177.8549 21 Q 3.5415 8.3294 117.3164 58.9040 28.1994 178.6879 22 L 4.0002 7.4918 118.7813 57.3966 41.9019 179.1348 23 S 4.2517 8.4616 113.2864 58.9583 63.2973 175.1515 24 Q 3.4011 7.9090 118.5259 56.1674 26.6925 173.3853 25 N 4.5757 7.9810 115.3811 52.7862 39.3352 175.0222 26 D 4.5394 8.6957 119.2011 54.8609 42.6954 177.3282 27 I 3.3151 8.5854 125.5829 64.0757 37.8636 177.9022 28 A 3.9468 8.6437 122.1315 55.1656 18.1404 179.3806 29 D 4.5066 8.0870 117.0596 57.3057 40.9230 178.8829 30 V 3.6841 8.0494 118.9498 65.9466 31.5739 177.5990 31 E 4.0631 8.3543 119.0661 59.5294 29.5115 177.9869 32 Y 4.3468 8.1110 119.3778 61.1503 38.7667 178.2964 33 Q 3.6238 8.5889 119.2529 58.6081 28.7812 178.4357 34 F 4.0064 8.6481 122.0551 61.4539 39.3420 177.3025 35 L 4.0350 8.1036 116.5854 57.2561 41.4543 178.8396 36 A 4.1384 7.6683 120.0129 53.6438 18.5288 177.7215 37 E 4.4098 7.6213 114.3713 55.9883 31.7075 176.0611 38 Q 4.2369 7.4093 117.4102 53.6253 30.5303 175.1175 39 D 4.4421 8.3179 120.6938 54.4090 40.9820 175.9994 40 V 4.4557 8.0322 120.4663 60.8056 32.4808 178.2264 41 K 4.0647 8.2003 121.7101 59.1051 32.3658 177.2869 42 D 4.8618 8.0836 118.3430 52.7186 39.6770 175.2457 43 V 4.4517 7.3465 118.6035 61.5652 33.6188 176.3561 44 D 4.6501 8.6694 126.0534 53.7196 39.8746 177.0091 45 V 3.7483 8.1438 125.8771 65.2689 31.7826 176.9614 46 L 3.9990 8.0190 119.8767 58.3475 41.9226 178.1700 47 Y 4.0984 8.3756 119.3839 60.5732 38.7385 177.5869 48 F 3.9370 8.4216 121.5817 61.5288 39.4986 177.3407 49 R 3.7161 8.4232 117.7473 59.1948 29.8186 179.0277 50 E 3.8253 8.1854 118.3849 59.1951 29.3912 179.3871 51 L 3.4819 7.4712 119.1114 57.5108 41.5617 179.4908 52 L 3.4207 7.0489 118.4588 57.6608 41.5060 179.5629 53 A 3.7680 7.5936 120.6358 54.8251 18.0043 180.0178 54 G 3.0842 7.3834 104.7006 47.1773 0.0000 175.8788 55 V 3.4354 7.0981 121.1739 65.3865 31.2705 177.8883 56 A 3.7034 7.4957 119.7131 55.0358 18.2203 178.6818 57 T 4.2949 7.6138 108.2613 62.6366 67.7059 174.4632 58 N 5.2130 7.7781 116.5332 53.4975 40.1963 176.5148 59 T 3.9632 8.2911 112.4063 64.8858 68.6705 175.8290 60 A 3.9997 8.0621 123.1489 55.0179 18.5408 178.7143 61 Y 4.1263 8.1056 117.5403 60.9828 38.9539 178.2602 62 L 3.7918 8.3330 120.0306 57.9355 41.7655 179.3166 63 D 4.5195 8.5902 119.3048 57.0453 40.4554 179.0212 64 G 3.6140 8.1098 105.9630 47.8385 0.0000 175.4076 65 L 4.0876 7.5014 120.4259 57.7012 41.9751 179.0493 66 M 4.3580 8.0548 118.2191 58.0870 32.0791 177.8563 67 K 3.8147 8.0531 120.1749 59.4486 31.9541 176.7492 68 P 4.0936 0.0000 0.0000 65.6469 31.2647 177.4332 69 Y 4.4454 7.6714 113.4191 58.9762 38.0801 176.4852 70 L 4.9123 7.9289 120.2439 54.4160 42.1573 178.1420 71 S 4.1567 7.7129 114.5945 60.8866 62.9983 175.3826 72 R 4.2328 7.8671 118.8749 56.8425 30.3931 176.2066 73 L 4.1417 7.6085 118.1750 55.2397 41.9368 177.2946 74 L 4.2220 8.4748 122.8686 56.1566 42.2051 176.7059 75 E 4.7752 7.6533 116.6034 53.4871 32.5596 175.4239 76 E 3.9737 8.5654 119.0021 56.1029 30.0087 176.7710 77 L 3.8271 8.5318 123.3108 55.2752 42.7377 177.6909 78 G 4.1131 8.3991 113.1816 44.3825 0.0000 174.5645 79 Q 4.0155 8.6333 121.5336 58.7139 28.7780 179.3810 80 V 3.7388 7.9265 118.8080 66.1809 31.6475 177.7749 81 E 4.0455 8.2477 117.8758 59.2024 29.2422 179.1022 82 K 3.9696 8.4032 119.6110 59.4172 32.2847 178.7489 83 A 4.0825 8.1074 121.0387 55.1837 18.2701 179.7497 84 V 3.5669 8.1005 117.0064 66.2920 31.5614 178.3246 85 L 4.0179 8.3630 119.0532 57.6097 41.3709 179.5659 86 R 3.9789 8.3361 118.4252 59.4457 29.9895 179.1629 87 I 3.7414 7.9774 119.1936 64.2866 37.0252 178.3927 88 A 4.0145 8.2625 121.7473 55.2887 18.2302 179.7435 89 L 3.9270 8.3119 117.9065 57.8642 41.2670 179.1460 90 Y 4.0516 8.3329 119.6658 60.8206 38.8275 178.0128 91 E 3.9680 8.6752 119.8565 59.4434 29.3589 179.3474 92 L 4.0332 8.0001 118.2463 57.9141 41.7188 179.4504 93 S 4.3847 8.0704 114.2324 60.4915 63.0362 175.2986 94 K 4.3593 8.0842 118.1214 55.7686 34.7496 176.6999 95 R 4.7199 7.5168 118.3676 54.8107 29.4911 176.7004 96 S 4.3819 7.8061 110.6258 59.4156 63.7828 175.8756 97 D 4.3836 8.0192 120.6288 55.2719 39.5157 176.1437 98 V 4.0691 7.7456 121.1883 60.6474 32.4245 174.3249 99 P 4.4032 0.0000 0.0000 62.5778 33.0837 176.1352 100 Y 4.1869 8.7252 122.7378 61.4014 38.5656 179.3026 101 K 4.0247 8.2497 118.3692 59.1304 32.1031 179.5461 102 V 3.5372 7.7573 118.0963 65.8967 31.7202 177.6149 103 A 3.9970 7.9854 120.4972 55.2752 18.1591 179.7852 104 I 3.5242 7.3657 117.6529 64.5650 37.2547 178.1796 105 N 4.2945 8.3792 118.2399 56.8368 38.6704 176.7582 106 E 4.0160 8.6954 120.1979 59.0408 29.4623 179.0537 107 A 4.0261 7.9082 120.5823 55.2884 18.3882 179.7537 108 I 3.6979 7.7530 118.2460 64.6130 37.1815 178.5786 109 E 3.9849 8.4035 119.4723 59.3717 29.1893 179.4270 110 L 4.2051 8.4179 119.1938 57.7968 41.6175 179.4082 111 A 4.1112 8.3894 120.9039 55.1318 18.0897 179.7977 112 K 3.8598 8.1409 116.3589 59.5283 32.1392 179.3012 113 S 4.0567 8.0996 112.5035 60.8243 62.5225 175.3589 114 F 4.8192 8.3520 117.1713 57.4750 39.8572 176.8935 115 G 3.9128 8.6043 106.7024 46.4292 0.0000 174.7070 116 A 4.1263 8.7329 124.3681 51.1804 18.9540 176.3781 117 E 3.9992 8.7172 123.1693 58.2010 30.2152 177.1344 118 D 4.7170 8.9775 123.2097 54.9423 39.2853 175.7246 119 S 4.2584 8.7881 117.4610 62.3069 62.7762 176.4405 120 H 4.4230 8.3852 116.9024 58.5805 28.3327 177.7059 121 K 3.8771 7.7245 120.8681 58.9763 31.9616 178.9190 122 F 4.1029 8.1641 120.7036 61.2801 39.3748 177.3571 123 V 3.4469 8.1004 118.0041 65.9087 31.2830 177.2882 124 N 4.2798 8.3625 117.0745 56.7520 38.2433 177.0135 125 G 3.4199 7.9968 106.9498 47.6044 0.0000 175.8613 126 V 3.1047 7.2661 120.6149 65.6571 31.4542 178.2668 127 L 3.7601 7.7418 118.5587 57.4195 41.1353 178.8549 128 D 4.2480 7.8748 117.7056 57.0543 41.1250 178.1321 129 K 4.1362 7.2837 116.7173 59.0326 32.6567 178.7649 130 A 4.2693 8.0387 122.1891 53.9356 18.3736 179.4558 131 A 3.9480 8.1419 119.6540 55.0491 18.6348 178.2102 132 P 4.4621 0.0000 0.0000 65.2029 31.1581 179.0550 133 V 3.6890 7.7311 116.6013 65.8524 31.6285 177.6649 134 I 4.1611 7.5891 118.2751 62.9290 38.1205 176.6440 135 R 4.5747 8.2229 121.1125 53.0848 30.1300 174.2800 136 P 4.7271 0.0000 0.0000 64.3954 31.7102 177.5459 137 N 4.3842 8.0456 113.6260 52.9800 37.7113 174.8310 138 K 2.4800 7.6563 117.8428 57.0029 30.2329 175.3730 139 K 4.1586 7.8109 122.2111 56.6753 32.8665 176.5004 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 8.29 4.48 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.55 0.00 2 E 8.09 4.53 0.00 2.04 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 2.16 2.36 0.00 3 P 0.00 4.35 0.00 2.16 2.00 0.00 3.55 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 4 A 8.74 4.00 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 5 A 7.93 4.24 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 6 R 7.89 3.87 0.00 1.83 1.94 0.00 2.83 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.38 0.00 7 R 7.96 3.95 0.00 1.96 2.14 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.74 0.00 8 R 8.39 4.02 0.00 2.06 2.02 0.00 3.65 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.83 0.00 9 A 8.14 4.16 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 10 R 8.37 3.94 0.00 2.11 2.20 0.00 3.20 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 11 E 8.39 4.08 0.00 2.42 2.21 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 2.58 2.61 0.00 12 C 8.57 4.49 0.00 3.21 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 13 A 8.46 3.79 1.21 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 0.00 0.00 0.00 14 V 7.93 3.46 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 0.73 0.00 0.00 0.95 0.00 0.00 15 Q 7.84 3.86 0.00 2.52 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 16 A 8.12 4.04 0.78 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 0.00 0.00 17 L 8.31 3.96 0.00 1.76 1.88 1.23 0.81 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 18 Y 8.26 4.01 0.00 3.17 3.17 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 19 S 8.41 4.29 0.00 4.32 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 20 W 8.40 4.27 0.00 3.39 3.42 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 21 Q 8.33 3.54 0.00 1.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.21 2.52 0.00 22 L 7.49 4.00 0.00 1.61 1.59 0.80 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.46 4.25 0.00 4.12 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 0.00 24 Q 7.91 3.40 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.96 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 25 N 7.98 4.58 0.00 2.88 2.87 0.00 0.00 6.81 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 26 D 8.70 4.54 0.00 2.77 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.59 3.32 1.02 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.81 0.67 0.00 0.00 28 A 8.64 3.95 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 29 D 8.09 4.51 0.00 2.98 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 30 V 8.05 3.68 2.21 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 1.21 0.00 0.00 1.20 0.00 0.00 31 E 8.35 4.06 0.00 2.01 2.14 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 2.46 2.49 0.00 32 Y 8.11 4.35 0.00 3.05 3.24 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 33 Q 8.59 3.62 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.45 0.00 34 F 8.65 4.01 0.00 3.34 3.21 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 0.00 35 L 8.10 4.04 0.00 1.85 1.76 1.12 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.67 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 7.62 4.41 0.00 1.80 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 2.11 2.20 0.00 38 Q 7.41 4.24 0.00 1.39 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.00 0.00 0.00 0.00 0.00 0.00 1.42 1.16 0.00 39 D 8.32 4.44 0.00 2.58 2.55 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 0.00 0.00 0.00 0.00 40 V 8.03 4.46 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 0.81 0.00 0.00 0.87 0.00 0.00 41 K 8.20 4.06 0.00 1.89 1.94 0.00 1.57 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.38 7.81 42 D 8.08 4.86 0.00 2.84 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 43 V 7.35 4.45 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 0.83 0.00 0.00 0.95 0.00 0.00 44 D 8.67 4.65 0.00 2.80 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 45 V 8.14 3.75 2.14 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 1.15 0.00 0.00 0.98 0.00 0.00 46 L 8.02 4.00 0.00 1.79 1.75 0.98 0.89 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 47 Y 8.38 4.10 0.00 3.33 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 48 F 8.42 3.94 0.00 3.23 3.27 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 0.00 49 R 8.42 3.72 0.00 2.03 1.93 0.00 3.24 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.09 0.00 50 E 8.19 3.83 0.00 1.99 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 51 L 7.47 3.48 0.00 1.32 1.28 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.05 3.42 0.00 1.12 1.22 -0.01 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.59 3.77 1.15 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 0.00 0.00 54 G 7.38 3.08 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 55 V 7.10 3.44 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 1.00 0.00 0.00 0.61 0.00 0.00 56 A 7.50 3.70 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.61 4.29 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 1.26 0.00 0.00 58 N 7.78 5.21 0.00 3.11 3.04 0.00 0.00 6.69 6.64 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 59 T 8.29 3.96 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 1.66 0.00 0.00 60 A 8.06 4.00 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 61 Y 8.11 4.13 0.00 3.00 3.23 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 62 L 8.33 3.79 0.00 1.79 1.74 1.15 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.59 4.52 0.00 2.75 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 64 G 8.11 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.50 4.09 0.00 1.68 1.70 0.50 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 66 M 8.05 4.36 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.67 0.00 67 K 8.05 3.81 0.00 2.05 1.78 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.51 7.81 68 P 0.00 4.09 0.00 1.44 1.80 0.00 3.60 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.03 0.00 69 Y 7.67 4.45 0.00 3.17 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 70 L 7.93 4.91 0.00 1.82 1.75 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 71 S 7.71 4.16 0.00 3.97 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 72 R 7.87 4.23 0.00 1.83 2.05 0.00 3.31 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 73 L 7.61 4.14 0.00 1.78 1.71 0.79 0.64 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 74 L 8.47 4.22 0.00 1.62 1.71 0.92 0.88 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 75 E 7.65 4.78 0.00 1.86 1.78 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 2.17 2.22 0.00 76 E 8.57 3.97 0.00 2.04 1.94 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 2.26 2.28 0.00 77 L 8.53 3.83 0.00 1.60 1.64 0.90 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.40 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 79 Q 8.63 4.02 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.22 0.00 80 V 7.93 3.74 2.18 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 1.28 0.00 0.00 1.00 0.00 0.00 81 E 8.25 4.05 0.00 2.30 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 2.47 2.54 0.00 82 K 8.40 3.97 0.00 1.92 1.99 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.49 7.81 83 A 8.11 4.08 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.10 3.57 2.28 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 1.21 0.00 0.00 1.06 0.00 0.00 85 L 8.36 4.02 0.00 1.85 1.73 1.06 0.93 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 86 R 8.34 3.98 0.00 2.03 2.04 0.00 3.32 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 87 I 7.98 3.74 2.04 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 1.39 0.78 0.97 0.00 0.00 88 A 8.26 4.01 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 89 L 8.31 3.93 0.00 1.77 1.72 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 8.33 4.05 0.00 3.21 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 91 E 8.68 3.97 0.00 2.22 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 2.59 2.72 0.00 92 L 8.00 4.03 0.00 1.78 1.75 0.80 0.96 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 93 S 8.07 4.38 0.00 3.88 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 94 K 8.08 4.36 0.00 0.79 1.46 0.00 1.56 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.03 1.17 7.81 95 R 7.52 4.72 0.00 1.89 2.12 0.00 3.33 0.00 0.00 3.40 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.93 0.00 96 S 7.81 4.38 0.00 3.98 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 97 D 8.02 4.38 0.00 2.80 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 98 V 7.75 4.07 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 0.80 0.00 0.00 0.92 0.00 0.00 99 P 0.00 4.40 0.00 2.22 2.00 0.00 3.67 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 2.21 2.15 0.00 100 Y 8.73 4.19 0.00 2.99 2.95 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 0.00 101 K 8.25 4.02 0.00 1.90 1.88 0.00 1.80 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.67 1.71 7.81 102 V 7.76 3.54 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 1.16 0.00 0.00 0.94 0.00 0.00 103 A 7.99 4.00 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 0.00 104 I 7.37 3.52 1.67 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 1.11 0.30 0.79 0.00 0.00 105 N 8.38 4.29 0.00 2.88 2.81 0.00 0.00 7.32 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.70 4.02 0.00 2.10 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 2.51 2.66 0.00 107 A 7.91 4.03 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 0.00 108 I 7.75 3.70 2.03 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 1.52 0.68 0.97 0.00 0.00 109 E 8.40 3.98 0.00 2.16 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 2.53 2.51 0.00 110 L 8.42 4.21 0.00 1.91 1.90 1.04 1.24 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 0.00 111 A 8.39 4.11 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 0.00 112 K 8.14 3.86 0.00 1.92 1.82 0.00 1.64 0.00 0.00 1.50 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.13 1.44 7.81 113 S 8.10 4.06 0.00 3.79 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 0.00 114 F 8.35 4.82 0.00 3.14 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 0.00 115 G 8.60 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 0.00 0.00 0.00 116 A 8.73 4.13 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 0.00 117 E 8.72 4.00 0.00 1.93 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 2.32 2.45 0.00 118 D 8.98 4.72 0.00 2.96 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 0.00 119 S 8.79 4.26 0.00 4.01 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 0.00 120 H 8.39 4.42 0.00 3.48 3.66 0.00 5.46 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 7.72 3.88 0.00 1.94 1.86 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.12 7.81 122 F 8.16 4.10 0.00 3.19 3.28 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 0.00 123 V 8.10 3.45 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 0.93 0.00 0.00 1.09 0.00 0.00 124 N 8.36 4.28 0.00 2.89 2.90 0.00 0.00 7.14 8.01 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 0.00 125 G 8.00 3.42 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 0.00 126 V 7.27 3.10 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 0.66 0.00 0.00 0.22 0.00 0.00 127 L 7.74 3.76 0.00 1.58 1.52 0.83 0.71 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 0.00 128 D 7.87 4.25 0.00 2.71 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.28 4.14 0.00 1.60 1.96 0.00 1.78 0.00 0.00 1.93 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.51 7.81 130 A 8.04 4.27 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 8.14 3.95 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 0.00 132 P 0.00 4.46 0.00 2.21 2.15 0.00 3.67 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 133 V 7.73 3.69 2.30 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 0.92 0.00 0.00 1.04 0.00 0.00 134 I 7.59 4.16 2.06 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 1.57 0.81 0.99 0.00 0.00 135 R 8.22 4.57 0.00 1.99 2.02 0.00 3.43 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 136 P 0.00 4.73 0.00 2.02 2.11 0.00 3.72 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 137 N 8.05 4.38 0.00 2.76 2.89 0.00 0.00 6.10 7.13 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 0.00 138 K 7.66 2.48 0.00 1.53 1.17 0.00 1.51 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.89 1.13 7.81 139 K 7.81 4.16 0.00 1.66 1.62 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.45 7.81