NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3133 8.4444 121.5210 55.8889 31.5686 175.2635 3 Q 4.4398 8.0108 119.2806 54.2701 31.3674 172.6293 4 Y 3.7468 9.3684 126.5278 57.9807 39.3882 174.2403 5 Y 4.9306 7.9251 123.8961 54.8027 42.8205 174.4171 6 G 3.5067 5.3800 105.0892 45.5587 0.0000 173.8027 7 T 4.3971 7.5059 123.9996 63.5211 70.8091 172.9929 8 G 4.7849 7.6755 113.3759 46.8634 0.0000 172.3601 9 R 5.4558 8.5190 123.7540 52.6111 34.1086 175.3214 10 R 4.3889 7.9854 120.7005 55.4595 30.5578 173.2680 11 K 3.8135 8.0978 123.6747 56.9389 31.3165 175.7330 12 E 3.6027 8.7202 122.1781 57.1978 28.4368 174.2817 13 A 5.3421 8.4011 121.3816 49.3834 21.3101 175.8443 14 V 4.5079 8.1950 121.7184 60.9279 34.5655 174.2695 15 A 5.0594 8.7442 128.8610 50.2685 21.4206 175.7369 16 R 4.3447 9.0386 122.2995 56.3503 31.9167 176.2396 17 V 4.9065 7.5600 121.3575 61.2381 35.1856 174.2125 18 F 5.3648 9.3868 125.0013 55.7780 43.5740 174.0260 19 L 5.2111 9.3146 121.7937 53.3633 45.1431 175.9983 20 R 4.5313 9.0206 125.2093 54.1945 31.8223 173.5021 21 P 3.4325 0.0000 0.0000 61.5289 30.7736 175.3583 22 G 3.7497 8.2584 111.2888 45.2088 0.0000 170.4419 23 N 3.9002 8.9842 113.1544 56.4514 36.3496 175.4944 24 G 4.0692 8.6709 110.0171 45.0487 0.0000 173.8581 25 K 4.0840 7.9487 118.9730 56.7593 33.9078 175.8963 26 V 4.8958 8.2914 119.1619 61.6785 35.7804 173.7690 27 T 5.0611 8.8213 121.6992 61.7441 71.9053 172.9717 28 V 4.4211 9.5104 127.3398 61.8359 33.8844 174.7044 29 N 3.8749 9.8300 123.5627 56.0220 35.8346 173.7012 30 G 4.1667 7.9933 103.5788 45.7130 0.0000 170.5292 31 Q 4.3923 7.8547 118.8422 53.4156 32.4433 173.5887 32 D 5.3534 9.0387 123.5554 54.7937 41.7722 176.4391 33 F 3.3325 8.0647 123.2041 59.1157 41.5196 176.3104 34 N 4.1617 9.1714 121.3713 56.1460 39.4674 176.7147 35 E 4.1366 8.7417 119.1186 58.4812 30.0553 176.9168 36 Y 4.2935 7.9022 117.1254 58.6440 38.9682 175.4233 37 F 4.8994 7.4096 117.9956 57.5904 40.4493 174.0000 38 Q 4.3822 7.6125 122.3603 58.3118 28.5204 175.1199 39 G 3.9226 8.7997 113.3242 45.4885 0.0000 173.2063 40 L 4.2488 7.6387 121.1261 53.3316 41.0843 177.6787 41 V 4.1217 7.8537 129.5108 61.3904 30.3757 175.0765 42 R 4.6325 7.3317 118.4340 57.5878 37.3946 175.3910 43 A 3.9147 7.8283 121.4500 55.2134 18.2878 179.5833 44 V 3.9545 7.9216 105.9240 63.2388 32.2375 176.7279 45 A 4.3051 8.8038 124.1428 54.2776 19.9675 178.3092 46 A 4.4609 7.7970 118.0568 51.3812 17.2889 177.1241 47 L 4.3644 7.5515 119.3127 54.7902 48.0556 177.2281 48 E 4.0112 9.2030 122.1208 58.8590 29.9935 176.9028 49 P 4.3948 0.0000 0.0000 66.1293 30.9832 177.7722 50 L 4.1143 7.9346 116.5578 55.8199 41.3559 178.2275 51 R 4.5612 9.0702 117.6580 55.8426 30.8449 176.2253 52 A 4.4184 8.0603 122.8656 53.8940 20.3245 179.5145 53 V 3.9094 7.7029 105.2220 60.9666 31.7564 175.6128 54 D 4.3446 7.3998 117.1996 55.4912 39.1781 173.8752 55 A 4.7046 7.6125 118.2049 52.0260 19.0973 179.5198 56 L 4.1341 8.1093 120.3670 57.9137 42.0918 177.6152 57 G 4.0141 8.8967 105.9663 44.4968 0.0000 170.8798 58 H 4.8822 7.7570 134.9349 56.5348 32.8885 173.9400 59 F 4.5517 7.5861 117.5997 55.7062 42.4298 172.9623 60 D 5.0532 8.8334 124.2618 52.7797 42.7871 175.3685 61 A 5.2427 8.2891 125.0327 50.4153 22.1699 174.6249 62 Y 4.9588 9.4670 123.8371 56.1889 40.8807 174.2440 63 I 5.0670 9.0168 128.4204 59.7574 40.7118 175.3648 64 T 4.8468 8.8060 122.4062 61.9385 71.5674 173.8122 65 V 4.6345 8.0514 126.5376 60.8801 34.1531 176.4226 66 R 4.2381 9.0667 117.4121 59.5067 32.8274 173.2150 67 G 4.2038 9.6794 113.6260 44.8777 0.0000 173.0081 68 G 4.0435 8.6647 109.1193 44.9636 0.0000 173.6550 69 G 3.9727 8.0969 104.1971 43.0885 0.0000 174.4641 70 K 3.8736 8.5339 122.7157 59.8220 32.1423 178.8537 71 S 4.1084 7.9902 112.6763 61.1687 62.3802 176.1402 72 G 3.5548 7.9474 108.0942 47.5421 0.0000 175.2480 73 Q 4.0442 8.2250 120.6514 59.1779 28.8458 179.6720 74 I 3.6507 7.1466 118.9896 64.4248 36.9528 178.0363 75 D 4.2987 7.8340 116.9191 56.5924 40.3603 177.9179 76 A 4.1329 7.8359 121.5087 55.1491 18.8450 179.2078 77 I 4.1136 7.9393 118.4239 64.8273 37.0176 178.1942 78 K 3.8021 7.8842 119.1270 59.1995 32.0591 177.8865 79 L 4.2517 9.3227 120.5869 57.0365 42.2185 178.6415 80 G 4.0512 7.8304 105.3049 48.8458 0.0000 175.2208 81 I 3.7704 7.8450 119.6795 62.0235 37.1507 176.6320 82 A 4.5752 7.3577 120.8575 53.9477 20.3549 178.7734 83 R 3.9958 8.4587 114.9982 58.4492 30.1850 176.8047 84 A 5.1176 8.3405 120.0588 51.8468 17.2390 177.5097 85 L 4.9036 7.8778 114.9765 55.3412 42.6868 178.8462 86 V 3.8900 7.7986 119.4487 64.4954 31.5903 177.5113 87 Q 3.9989 7.2699 120.9237 59.1616 29.2639 178.0284 88 Y 4.1284 7.7393 115.8597 57.0224 37.9856 176.4145 89 N 5.1699 8.1657 125.0350 52.6903 41.7801 173.4283 90 P 4.9402 0.0000 0.0000 65.2744 30.7689 178.5004 91 D 4.4604 8.4223 118.8777 56.8233 40.7999 175.5615 92 Y 4.3827 8.0478 116.2899 58.6627 36.4000 174.8284 93 R 4.6041 8.0881 121.6025 57.0755 35.9433 174.9757 94 A 4.5392 7.2239 122.6720 48.4230 16.5857 176.3282 95 K 4.8162 7.4301 130.5988 57.1302 30.4690 177.4923 96 L 4.0707 7.4171 121.4572 57.7589 42.4496 177.6967 97 K 4.0649 8.7608 119.2258 58.8767 31.7295 175.6571 98 P 3.7801 0.0000 0.0000 66.8788 31.8449 176.0690 99 L 4.0622 7.8257 116.6252 55.1906 42.7375 179.1960 100 G 3.9889 8.9242 108.9509 46.3980 0.0000 174.9739 101 F 4.0415 8.9315 119.4628 59.0294 39.2931 175.8594 102 L 4.5085 7.7539 121.0836 56.2204 43.4365 176.9204 103 T 4.0092 7.8206 114.9255 63.0998 68.8139 174.4802 104 R 4.1482 8.3037 125.5790 56.1066 31.1862 175.7670 105 D 4.7063 8.1248 118.4523 52.1702 40.7181 175.3496 106 A 4.3114 7.9804 128.5446 50.5731 16.3167 176.0974 107 R 4.3117 7.5855 117.5072 55.0015 33.1084 174.6513 108 V 4.3520 7.9415 121.8025 60.1001 34.7761 174.8175 109 V 3.6633 8.1414 121.1940 62.2217 30.9147 175.1114 110 E 3.9802 8.6059 129.0312 55.7943 30.0639 176.5497 111 R 3.8672 8.4680 125.8221 56.5824 30.5804 175.7866 112 K 4.3191 8.2716 123.4604 54.7492 31.9319 176.2265 113 K 4.1756 8.3760 126.6467 55.5508 33.0728 177.1271 114 Y 4.3361 8.2842 120.9827 57.7006 38.4969 177.3477 115 G 4.1516 8.8001 108.8526 45.7803 0.0000 174.0240 116 K 4.6415 8.0459 117.3144 54.4825 35.3157 176.1877 117 H 4.4739 8.6409 119.1229 58.8097 28.9817 178.4664 118 K 4.5314 7.7166 117.8213 55.9167 32.7775 178.3976 119 A 4.1817 8.5076 124.0136 52.6344 18.1849 179.3066 120 R 4.3619 8.2861 111.5913 57.6995 32.8663 176.2791 121 R 3.7959 8.0667 118.2702 56.7019 30.2423 174.6392 122 A 4.7924 8.3975 128.5490 49.5314 20.4376 174.6703 123 P 4.2112 0.0000 0.0000 62.7990 31.5450 175.9974 124 Q 4.1235 8.5965 121.3546 56.8096 29.4848 175.0701 125 Y 4.8735 8.3712 121.7275 55.9955 40.3778 173.7108 126 S 4.5376 8.4328 118.6741 55.7669 66.3746 174.5552 127 K 4.5140 8.4134 127.4555 56.5728 32.2462 176.6427 128 R 4.2116 7.6832 117.5457 56.1693 29.6897 175.8197 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 E 8.44 4.31 0.00 2.04 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 0.00 2.24 2.35 0.00 3 Q 8.01 4.44 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.79 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 4 Y 9.37 3.75 0.00 2.83 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 5 Y 7.93 4.93 0.00 2.91 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 G 5.38 3.51 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 0.00 7 T 7.51 4.40 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 1.30 0.00 0.00 8 G 7.68 4.78 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 0.00 9 R 8.52 5.46 0.00 1.65 1.79 0.00 3.22 0.00 0.00 2.25 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.44 0.00 10 R 7.99 4.39 0.00 1.72 1.82 0.00 3.62 0.00 0.00 3.11 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.51 0.00 11 K 8.10 3.81 0.00 1.97 1.93 0.00 1.91 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.43 7.81 12 E 8.72 3.60 0.00 2.13 2.03 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 2.22 2.23 0.00 13 A 8.40 5.34 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 14 V 8.20 4.51 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.96 0.00 0.00 15 A 8.74 5.06 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 16 R 9.04 4.34 0.00 2.15 2.33 0.00 3.59 0.00 0.00 3.31 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.75 0.00 17 V 7.56 4.91 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 0.91 0.00 0.00 0.85 0.00 0.00 18 F 9.39 5.36 0.00 3.38 3.10 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 0.00 0.00 0.00 19 L 9.31 5.21 0.00 1.43 1.64 0.79 0.77 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 20 R 9.02 4.53 0.00 1.66 1.80 0.00 3.11 0.00 0.00 3.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 21 P 0.00 3.43 0.00 1.64 1.39 0.00 3.55 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.26 0.00 22 G 8.26 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 23 N 8.98 3.90 0.00 2.85 2.91 0.00 0.00 5.64 6.92 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 24 G 8.67 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 25 K 7.95 4.08 0.00 1.87 2.02 0.00 1.46 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.68 1.51 7.81 26 V 8.29 4.90 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 1.02 0.00 0.00 0.90 0.00 0.00 27 T 8.82 5.06 4.40 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 1.34 0.00 0.00 28 V 9.51 4.42 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 1.07 0.00 0.00 1.26 0.00 0.00 29 N 9.83 3.87 0.00 2.21 2.41 0.00 0.00 7.26 8.17 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 30 G 7.99 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 0.00 0.00 0.00 31 Q 7.85 4.39 0.00 1.91 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 32 D 9.04 5.35 0.00 2.76 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.06 3.33 0.00 3.17 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 34 N 9.17 4.16 0.00 2.97 2.98 0.00 0.00 6.44 7.66 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 35 E 8.74 4.14 0.00 1.97 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 2.28 2.25 0.00 36 Y 7.90 4.29 0.00 2.57 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 37 F 7.41 4.90 0.00 2.77 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.61 4.38 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.19 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 39 G 8.80 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 40 L 7.64 4.25 0.00 1.50 1.49 0.80 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.85 4.12 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 0.75 0.00 0.00 0.97 0.00 0.00 42 R 7.33 4.63 0.00 1.70 1.74 0.00 3.24 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.56 0.00 43 A 7.83 3.91 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 44 V 7.92 3.95 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 0.79 0.00 0.00 0.96 0.00 0.00 45 A 8.80 4.31 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 46 A 7.80 4.46 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 47 L 7.55 4.36 0.00 1.69 1.56 1.06 0.49 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 48 E 9.20 4.01 0.00 2.35 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 2.69 2.44 0.00 49 P 0.00 4.39 0.00 2.36 2.69 0.00 3.84 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 50 L 7.93 4.11 0.00 1.90 1.71 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 51 R 9.07 4.56 0.00 2.07 1.92 0.00 3.24 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 52 A 8.06 4.42 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 53 V 7.70 3.91 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 1.03 0.00 0.00 54 D 7.40 4.34 0.00 2.86 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 55 A 7.61 4.70 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 56 L 8.11 4.13 0.00 1.76 1.74 0.93 1.00 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 57 G 8.90 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 58 H 7.76 4.88 0.00 3.30 3.46 0.00 5.77 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 7.59 4.55 0.00 2.94 2.77 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 60 D 8.83 5.05 0.00 2.90 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.29 5.24 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 62 Y 9.47 4.96 0.00 2.99 3.01 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 63 I 9.02 5.07 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.79 1.02 0.00 0.00 64 T 8.81 4.85 4.18 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 1.20 0.00 0.00 65 V 8.05 4.63 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 0.81 0.00 0.00 1.03 0.00 0.00 66 R 9.07 4.24 0.00 1.87 1.84 0.00 3.09 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 67 G 9.68 4.20 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 0.00 68 G 8.66 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 69 G 8.10 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 70 K 8.53 3.87 0.00 1.84 1.80 0.00 1.63 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.47 7.81 71 S 7.99 4.11 0.00 3.82 3.76 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 72 G 7.95 3.55 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 0.00 0.00 0.00 73 Q 8.22 4.04 0.00 2.32 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.61 2.65 0.00 74 I 7.15 3.65 1.73 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 0.56 0.28 0.76 0.00 0.00 75 D 7.83 4.30 0.00 2.60 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.84 4.13 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 I 7.94 4.11 2.11 0.00 0.00 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 1.49 0.91 0.99 0.00 0.00 78 K 7.88 3.80 0.00 1.62 1.91 0.00 1.47 0.00 0.00 0.90 0.00 0.00 2.72 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 1.01 7.81 79 L 9.32 4.25 0.00 1.65 1.68 0.89 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.83 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 0.00 0.00 0.00 81 I 7.84 3.77 1.84 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 1.69 0.80 0.84 0.00 0.00 82 A 7.36 4.58 1.38 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 83 R 8.46 4.00 0.00 1.85 1.88 0.00 3.25 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 84 A 8.34 5.12 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 85 L 7.88 4.90 0.00 1.65 1.75 1.03 1.23 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 86 V 7.80 3.89 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 0.83 0.00 0.00 1.03 0.00 0.00 87 Q 7.27 4.00 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.20 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 88 Y 7.74 4.13 0.00 1.63 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 0.00 0.00 0.00 0.00 89 N 8.17 5.17 0.00 2.29 1.92 0.00 0.00 6.79 8.24 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 90 P 0.00 4.94 0.00 2.19 2.19 0.00 3.40 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.96 0.00 91 D 8.42 4.46 0.00 2.87 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 92 Y 8.05 4.38 0.00 3.14 3.01 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 93 R 8.09 4.60 0.00 1.97 1.83 0.00 3.26 0.00 0.00 3.38 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 94 A 7.22 4.54 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 95 K 7.43 4.82 0.00 1.79 1.92 0.00 1.34 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.91 1.02 7.81 96 L 7.42 4.07 0.00 1.64 1.87 1.02 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.76 4.06 0.00 1.69 1.94 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.45 7.81 98 P 0.00 3.78 0.00 1.97 1.90 0.00 3.71 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 2.03 2.10 0.00 99 L 7.83 4.06 0.00 1.24 1.53 0.86 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.92 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 0.00 0.00 0.00 101 F 8.93 4.04 0.00 3.02 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 0.00 102 L 7.75 4.51 0.00 1.65 1.70 0.95 0.98 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 0.00 103 T 7.82 4.01 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 1.22 0.00 0.00 104 R 8.30 4.15 0.00 1.76 1.86 0.00 3.18 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 105 D 8.12 4.71 0.00 2.60 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.98 4.31 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 0.00 107 R 7.59 4.31 0.00 1.84 1.82 0.00 3.14 0.00 0.00 3.44 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 108 V 7.94 4.35 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 0.80 0.00 0.00 0.93 0.00 0.00 109 V 8.14 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 0.81 0.00 0.00 0.93 0.00 0.00 110 E 8.61 3.98 0.00 1.96 1.84 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 2.29 2.30 0.00 111 R 8.47 3.87 0.00 1.79 1.82 0.00 3.22 0.00 0.00 3.11 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 112 K 8.27 4.32 0.00 1.75 1.73 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.39 1.41 7.81 113 K 8.38 4.18 0.00 1.84 1.83 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.17 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.45 7.81 114 Y 8.28 4.34 0.00 3.07 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 0.00 115 G 8.80 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 0.00 0.00 0.00 116 K 8.05 4.64 0.00 1.69 1.87 0.00 1.72 0.00 0.00 1.99 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.37 7.81 117 H 8.64 4.47 0.00 3.21 3.32 0.00 5.59 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.72 4.53 0.00 1.79 1.77 0.00 1.76 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.42 7.81 119 A 8.51 4.18 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 0.00 120 R 8.29 4.36 0.00 1.74 1.93 0.00 3.19 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 121 R 8.07 3.80 0.00 1.83 1.88 0.00 3.39 0.00 0.00 3.44 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 122 A 8.40 4.79 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 0.00 123 P 0.00 4.21 0.00 2.11 1.85 0.00 3.72 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.02 0.00 124 Q 8.60 4.12 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 125 Y 8.37 4.87 0.00 2.92 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.43 4.54 0.00 3.96 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 K 8.41 4.51 0.00 1.83 1.87 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.26 1.41 7.81 128 R 7.68 4.21 0.00 1.94 1.86 0.00 3.49 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00