NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2137 8.3144 121.7899 55.6242 33.0836 175.1816 2 E 3.7762 8.6853 126.5514 54.7782 30.1928 174.9891 3 S 4.2884 8.9332 123.0308 58.0666 66.1736 174.6321 4 A 4.0810 8.6029 124.9191 55.3260 18.1616 180.0560 5 A 3.9397 8.0033 118.5386 55.3723 18.4854 179.5959 6 A 3.9961 8.3079 119.5389 55.0706 18.3432 179.7190 7 K 4.0956 8.5633 119.9870 59.0762 32.2688 178.7888 8 F 4.0974 8.5767 121.1053 61.3638 39.4447 176.9201 9 E 4.0236 8.4616 118.2708 59.3640 29.0315 179.3835 10 R 3.8206 8.0444 117.9642 59.6504 30.3013 178.3385 11 Q 4.0183 8.0230 116.5730 57.9846 28.8434 176.4536 12 H 4.6632 7.8193 113.0820 54.7768 30.8113 172.9456 13 M 4.5612 7.6530 119.5193 53.6623 33.8070 176.2299 14 D 4.7787 8.1863 122.6826 52.9856 41.3046 175.0775 15 S 4.2461 8.0861 117.0135 60.7877 63.6547 175.8798 16 G 4.0183 7.9461 106.6722 45.3031 0.0000 172.7991 17 N 5.0165 7.5893 115.5414 51.3951 43.0138 173.3570 18 S 4.6801 8.3509 115.0342 56.0265 63.5952 173.4045 19 P 4.3913 0.0000 0.0000 64.9130 31.3145 176.9299 20 S 4.5257 7.5859 112.7335 58.0619 63.3789 174.2765 21 S 4.2720 7.6868 116.8612 58.5897 62.5372 173.9970 22 S 4.5160 8.5909 120.8428 59.1193 63.6922 174.7919 23 S 4.5499 7.8828 114.4216 58.6875 63.4407 174.5833 24 N 4.6796 7.9036 118.8839 54.0216 38.9201 175.1628 25 Y 3.9964 7.9823 120.7354 62.0749 38.7623 178.6631 26 C 4.1711 8.4743 117.0318 59.9696 39.6373 175.6908 27 N 4.4342 8.2682 117.5645 56.5970 38.1815 177.2601 28 L 3.9961 7.7214 120.0250 57.8280 41.7357 179.1928 29 M 3.6869 7.8997 118.5338 58.6024 31.9113 178.1517 30 M 4.1038 8.1490 119.3496 58.3182 31.9819 178.3576 31 C 4.2076 7.6261 118.8658 62.1276 31.6373 174.8523 32 C 3.8666 8.1148 119.6957 62.5931 31.0744 174.6051 33 R 4.4022 8.2070 115.8311 55.7054 29.5410 176.2888 34 K 3.8904 7.7866 115.7259 58.5290 29.7898 176.3011 35 M 4.6373 8.4058 115.6621 55.3864 32.5076 177.3217 36 T 4.7455 7.8278 107.3980 61.3612 69.5360 172.8018 37 Q 4.5059 8.2371 121.2597 56.3590 29.9656 174.6290 38 G 4.2508 10.9038 114.5694 45.3309 0.0000 173.2876 39 K 3.7331 6.9319 114.7595 55.2713 35.0060 175.5363 40 C 4.6390 8.5957 117.8892 55.7428 40.4533 173.8587 41 K 4.1370 8.7106 127.6252 55.9253 32.2058 174.8921 42 P 4.7062 0.0000 0.0000 65.4423 32.6205 176.5107 43 V 4.9546 7.6175 118.6985 61.1932 34.5783 174.0379 44 N 4.7455 9.1653 125.0082 52.6434 42.7987 172.8031 45 T 4.6970 7.7402 121.6221 61.6569 70.9079 173.4767 46 F 4.7410 8.8279 124.7189 55.7007 41.6413 174.6981 47 V 4.5143 8.4037 122.5896 61.6821 32.9452 174.8707 48 H 4.9368 8.9610 123.7362 55.7384 29.6920 174.8216 49 E 4.2870 8.1419 118.4392 55.3281 30.4330 177.0494 50 S 4.3290 8.3120 114.9651 58.3374 64.9410 174.9001 51 L 3.9463 8.5513 124.4932 58.3373 41.8475 179.1789 52 A 3.9946 7.9880 120.1650 55.4298 18.1505 179.1941 53 D 4.3296 8.0156 116.1086 57.4199 41.2168 178.9859 54 V 3.7589 7.8867 118.8330 65.9184 31.7057 178.1191 55 K 3.8882 8.5385 118.4999 59.5788 31.8528 179.0774 56 A 4.0328 8.1439 120.6101 54.7416 18.1073 179.6585 57 V 3.6892 7.6118 117.0047 66.3402 31.2861 177.2507 58 C 3.7040 7.8563 114.7798 58.3227 39.9368 174.3557 59 S 4.5418 7.5620 113.7963 57.8999 63.7335 174.9483 60 Q 4.5701 7.6483 122.1059 55.8669 28.3482 175.9565 61 K 4.2446 8.3751 126.1470 56.8937 33.2221 177.1717 62 K 4.0961 8.7361 127.9046 56.7731 32.3838 176.7443 63 V 4.6314 8.1048 117.5769 59.1425 36.1882 175.5323 64 T 3.8814 8.3550 112.1737 62.0639 69.3163 174.8354 65 C 4.7176 8.0767 122.1494 55.9942 41.2484 175.0708 66 K 3.7342 9.1989 123.4875 59.3146 31.7324 177.7409 67 N 4.5910 8.1487 113.5241 52.3311 37.4841 175.9276 68 G 3.8633 8.1194 106.7091 45.9590 0.0000 174.0914 69 Q 4.3201 8.3261 119.6823 55.8993 29.4037 176.0544 70 T 5.1089 8.1779 107.4578 61.8315 69.2186 174.0014 71 N 5.0709 8.0846 116.7168 53.8952 39.0547 173.8044 72 C 5.3327 7.9696 116.1365 56.6370 43.7386 172.2908 73 Y 5.2434 8.9328 118.9449 56.3920 41.7603 173.8526 74 Q 5.1267 9.2967 124.9549 54.0060 31.5437 174.8876 75 S 4.6547 8.8779 122.1780 58.2004 63.0730 174.7988 76 K 4.1189 9.5175 123.4195 59.0846 32.6078 177.1813 77 S 4.8853 7.6291 113.3375 56.0146 66.0218 173.5731 78 T 4.1098 8.1399 112.1416 62.2817 69.5851 173.3320 79 M 5.0269 8.8923 121.7792 53.3908 36.6882 175.1303 80 R 4.6021 9.4001 121.7466 56.2551 31.1720 175.8882 81 I 5.0891 9.0115 117.3099 59.4322 42.0723 174.1033 82 T 4.9937 9.1246 119.2310 61.8498 71.4930 172.7275 83 D 4.8960 9.1667 127.0545 53.3004 43.1257 174.1969 84 C 5.5315 9.1689 123.7068 55.3686 39.4610 173.0730 85 R 5.2897 8.7342 122.9298 53.8444 33.2093 174.9957 86 E 4.0929 9.1101 125.7553 56.5784 30.1698 176.8315 87 T 4.2091 8.8743 117.7065 60.9648 70.1192 176.0016 88 G 3.6100 8.7050 110.9158 48.4048 0.0000 175.0067 89 S 4.3439 7.3431 114.3411 59.5479 63.4135 174.7678 90 S 4.0239 7.2516 115.7665 58.3367 62.5066 173.5536 91 K 4.4242 8.6324 127.8549 54.8133 34.7439 174.5104 92 Y 4.2865 8.8145 127.6407 57.9549 38.9755 173.8083 93 P 3.3629 0.0000 0.0000 62.5344 31.8648 176.7059 94 N 4.6023 7.9231 119.9315 52.3729 37.0134 171.6768 95 C 4.6125 8.1728 117.0045 56.1634 38.9265 172.9957 96 A 5.0982 8.6566 126.9770 50.2191 21.5114 174.3947 97 Y 5.1659 9.3204 119.3728 55.9030 41.9467 175.1908 98 K 4.3518 9.3635 125.1035 56.2839 33.6835 175.4721 99 T 5.0086 8.6086 124.3753 62.7493 69.9821 174.1955 100 T 4.6348 8.8171 123.0794 61.6439 71.8679 173.2735 101 Q 4.5023 8.7774 126.1390 55.8192 29.4628 175.9597 102 V 4.5731 8.9694 116.6615 59.6260 36.6950 174.6696 103 E 5.4577 8.7357 121.8201 53.9418 31.4907 175.2535 104 K 4.7478 8.2757 122.7173 54.5696 37.4865 175.5372 105 H 4.8187 8.9458 119.1444 55.8979 29.9310 174.8320 106 I 4.7726 8.5884 115.7423 59.4833 40.3474 174.3725 107 I 4.8755 8.3294 125.1594 59.6941 39.7496 175.0716 108 V 4.7165 8.6588 119.4753 59.2750 35.9325 174.6379 109 A 4.8943 8.8856 125.6466 51.6334 20.1071 175.7904 110 C 5.4610 9.0895 119.3560 55.4945 44.5021 173.4975 111 G 4.0148 9.2597 108.5602 46.3572 0.0000 173.0796 112 G 4.3196 9.2973 106.8995 44.8374 0.0000 172.6941 113 K 4.5866 8.0242 116.7879 53.6179 34.2715 175.0245 114 P 4.3396 0.0000 0.0000 62.2116 31.9613 176.1338 115 S 4.6565 8.3212 115.0023 58.1141 62.6404 173.4638 116 V 4.6196 8.6412 119.9702 58.4504 36.1358 173.4368 117 P 4.7993 0.0000 0.0000 63.3775 31.1941 176.8233 118 V 4.4985 9.1207 115.9621 61.3045 33.9634 175.3198 119 H 4.8006 7.9357 119.7011 54.8312 33.4246 171.7530 120 F 4.4128 8.5969 128.2512 57.7092 39.4292 174.3160 121 D 4.6638 8.3675 126.7088 56.0446 41.8186 175.9936 122 A 4.7311 6.8169 117.0499 51.1792 22.5758 174.6108 123 S 5.3605 8.9155 114.1087 56.4774 65.7898 174.5117 124 V 4.1507 8.8165 122.5314 61.9565 31.5510 175.1155 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 K 8.31 4.21 0.00 1.74 1.79 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.39 7.81 2 E 8.69 3.78 0.00 2.12 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 2.40 2.37 0.00 3 S 8.93 4.29 0.00 4.10 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 4 A 8.60 4.08 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 5 A 8.00 3.94 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 A 8.31 4.00 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 7 K 8.56 4.10 0.00 1.89 2.05 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.31 7.81 8 F 8.58 4.10 0.00 3.17 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 9 E 8.46 4.02 0.00 2.28 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 2.48 2.67 0.00 10 R 8.04 3.82 0.00 1.76 2.07 0.00 3.23 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 11 Q 8.02 4.02 0.00 1.66 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.48 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 12 H 7.82 4.66 0.00 1.90 2.73 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.65 4.56 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.66 0.00 14 D 8.19 4.78 0.00 2.51 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.09 4.25 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 16 G 7.95 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 0.00 0.00 0.00 17 N 7.59 5.02 0.00 3.03 2.66 0.00 0.00 6.88 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.35 4.68 0.00 3.85 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 19 P 0.00 4.39 0.00 2.21 2.16 0.00 3.80 0.00 0.00 3.70 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 20 S 7.59 4.53 0.00 3.94 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 21 S 7.69 4.27 0.00 3.90 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 22 S 8.59 4.52 0.00 4.00 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 23 S 7.88 4.55 0.00 4.05 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 24 N 7.90 4.68 0.00 2.87 2.84 0.00 0.00 6.77 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 25 Y 7.98 4.00 0.00 3.08 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 26 C 8.47 4.17 0.00 3.15 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 27 N 8.27 4.43 0.00 3.10 2.93 0.00 0.00 7.15 6.74 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 28 L 7.72 4.00 0.00 1.51 1.57 0.87 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 29 M 7.90 3.69 0.00 0.88 0.67 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.18 0.00 30 M 8.15 4.10 0.00 1.80 1.88 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 2.46 0.00 31 C 7.63 4.21 0.00 3.10 3.13 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 32 C 8.11 3.87 0.00 2.82 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 33 R 8.21 4.40 0.00 2.02 2.02 0.00 3.56 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.91 0.00 34 K 7.79 3.89 0.00 1.95 1.95 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.55 7.81 35 M 8.41 4.64 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.42 0.00 36 T 7.83 4.75 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 1.44 0.00 0.00 37 Q 8.24 4.51 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.77 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 38 G 10.90 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 39 K 6.93 3.73 0.00 1.66 1.46 0.00 1.53 0.00 0.00 1.64 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.21 1.39 7.81 40 C 8.60 4.64 0.00 3.11 3.15 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 41 K 8.71 4.14 0.00 1.84 1.80 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.23 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.40 7.81 42 P 0.00 4.71 0.00 2.19 2.32 0.00 3.74 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 2.10 1.99 0.00 43 V 7.62 4.95 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 9.17 4.75 0.00 2.64 2.24 0.00 0.00 6.70 6.73 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 45 T 7.74 4.70 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 0.82 0.00 0.00 46 F 8.83 4.74 0.00 3.02 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 47 V 8.40 4.51 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 0.86 0.00 0.00 1.04 0.00 0.00 48 H 8.96 4.94 0.00 3.14 3.27 0.00 5.71 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.14 4.29 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 2.34 2.26 0.00 50 S 8.31 4.33 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 51 L 8.55 3.95 0.00 1.79 1.72 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.99 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 53 D 8.02 4.33 0.00 2.84 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 54 V 7.89 3.76 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 1.08 0.00 0.00 1.02 0.00 0.00 55 K 8.54 3.89 0.00 1.99 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.60 7.81 56 A 8.14 4.03 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 57 V 7.61 3.69 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 1.17 0.00 0.00 1.00 0.00 0.00 58 C 7.86 3.70 0.00 2.90 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 59 S 7.56 4.54 0.00 3.89 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 60 Q 7.65 4.57 0.00 2.22 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 61 K 8.38 4.24 0.00 1.90 1.71 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.42 7.81 62 K 8.74 4.10 0.00 1.60 1.58 0.00 1.47 0.00 0.00 1.18 0.00 0.00 2.73 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.95 1.30 7.81 63 V 8.10 4.63 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 0.71 0.00 0.00 0.84 0.00 0.00 64 T 8.35 3.88 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 1.17 0.00 0.00 65 C 8.08 4.72 0.00 2.95 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 66 K 9.20 3.73 0.00 1.86 1.89 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.54 7.81 67 N 8.15 4.59 0.00 2.80 2.89 0.00 0.00 6.07 7.00 0.00 0.00 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 8.12 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 Q 8.33 4.32 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 70 T 8.18 5.11 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 1.17 0.00 0.00 71 N 8.08 5.07 0.00 2.98 3.03 0.00 0.00 6.05 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 72 C 7.97 5.33 0.00 2.95 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 73 Y 8.93 5.24 0.00 2.87 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 74 Q 9.30 5.13 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 75 S 8.88 4.65 0.00 3.96 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 76 K 9.52 4.12 0.00 1.88 2.01 0.00 1.56 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.68 1.44 7.81 77 S 7.63 4.89 0.00 3.85 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 78 T 8.14 4.11 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 0.96 0.00 0.00 79 M 8.89 5.03 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 80 R 9.40 4.60 0.00 1.83 1.91 0.00 3.05 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 81 I 9.01 5.09 1.96 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.73 1.03 0.00 0.00 82 T 9.12 4.99 4.46 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 1.37 0.00 0.00 83 D 9.17 4.90 0.00 2.72 2.56 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 0.00 0.00 0.00 0.00 84 C 9.17 5.53 0.00 2.93 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 85 R 8.73 5.29 0.00 1.80 1.85 0.00 3.33 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 86 E 9.11 4.09 0.00 2.05 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 2.05 1.68 0.00 87 T 8.87 4.21 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 1.22 0.00 0.00 88 G 8.71 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 89 S 7.34 4.34 0.00 3.68 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 90 S 7.25 4.02 0.00 3.77 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 91 K 8.63 4.42 0.00 1.78 1.58 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.39 7.81 92 Y 8.81 4.29 0.00 2.95 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 93 P 0.00 3.36 0.00 1.75 1.05 0.00 3.64 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 94 N 7.92 4.60 0.00 2.89 2.75 0.00 0.00 7.04 8.52 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 95 C 8.17 4.61 0.00 3.10 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 96 A 8.66 5.10 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 97 Y 9.32 5.17 0.00 2.94 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 98 K 9.36 4.35 0.00 1.88 1.75 0.00 1.55 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.52 7.81 99 T 8.61 5.01 4.33 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 1.31 0.00 0.00 100 T 8.82 4.63 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 1.23 0.00 0.00 101 Q 8.78 4.50 0.00 1.92 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 102 V 8.97 4.57 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 0.81 0.00 0.00 0.96 0.00 0.00 103 E 8.74 5.46 0.00 1.80 1.86 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 2.19 2.13 0.00 104 K 8.28 4.75 0.00 1.69 1.81 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.48 7.81 105 H 8.95 4.82 0.00 3.10 3.35 0.00 5.59 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.59 4.77 1.76 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 1.26 1.19 1.13 0.00 0.00 107 I 8.33 4.88 1.70 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 1.16 0.68 0.91 0.00 0.00 108 V 8.66 4.72 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 0.57 0.00 0.00 0.94 0.00 0.00 109 A 8.89 4.89 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 0.00 110 C 9.09 5.46 0.00 2.88 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 0.00 111 G 9.26 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 0.00 112 G 9.30 4.32 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 0.00 0.00 0.00 113 K 8.02 4.59 0.00 1.69 1.71 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.34 7.81 114 P 0.00 4.34 0.00 2.15 2.04 0.00 3.76 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 115 S 8.32 4.66 0.00 3.87 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 0.00 116 V 8.64 4.62 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 0.72 0.00 0.00 1.00 0.00 0.00 117 P 0.00 4.80 0.00 1.96 2.02 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 118 V 9.12 4.50 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 0.72 0.00 0.00 1.05 0.00 0.00 119 H 7.94 4.80 0.00 3.24 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.60 4.41 0.00 3.04 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 0.00 121 D 8.37 4.66 0.00 2.63 2.60 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 0.00 122 A 6.82 4.73 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 0.00 123 S 8.92 5.36 0.00 3.97 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 0.00 124 V 8.82 4.15 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 0.73 0.00 0.00 0.94 0.00 0.00