NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 G 3.9195 8.3393 109.7366 45.0182 0.0000 173.4735 -1 S 3.7842 8.5690 119.7139 58.2486 62.9931 172.5616 0 H 4.5494 8.6123 124.1330 55.2571 32.7150 173.2625 1 M 4.0938 8.4222 127.4693 54.9372 32.8650 175.2079 2 T 4.5977 7.8180 121.4459 61.8221 72.0789 172.6156 3 Y 4.7855 8.2242 119.3593 56.1972 41.5764 175.4355 4 V 4.4936 8.2798 120.4050 61.1962 34.5728 174.7756 5 I 4.5156 8.2915 127.0637 59.8996 38.7159 175.1233 6 L 4.7731 7.9999 122.7695 52.2893 45.6495 174.3506 7 P 4.2061 0.0000 0.0000 62.4362 31.7418 175.9375 8 L 4.3987 8.3805 125.2467 53.7664 41.8938 175.6065 9 E 4.4407 8.3658 127.1038 54.6267 28.7294 175.3136 10 M 4.6390 7.7696 121.5837 53.0051 35.4736 175.2496 11 K 4.1746 8.3116 119.8075 55.9164 33.6221 176.4826 12 K 5.0300 8.3846 121.3578 54.9326 35.7725 175.6418 13 G 4.1154 8.8258 110.9218 43.8852 0.0000 171.9565 14 R 3.7167 8.0330 118.0076 59.0976 29.9683 178.3190 15 G 4.1641 6.2581 106.2107 44.2846 0.0000 171.8887 16 Y 4.7876 6.8211 113.6871 55.6150 40.4593 172.7850 17 V 5.0384 8.5744 122.2761 61.5507 34.1596 173.8062 18 Y 4.8697 8.7191 124.6347 56.7252 42.1733 173.9940 19 Q 4.6399 8.5990 120.1321 55.4105 30.5286 172.0005 20 L 4.6052 8.6198 124.8744 52.6782 44.6009 175.0296 21 E 5.2284 8.3500 122.9547 54.6284 33.5826 174.7999 22 Y 5.2153 9.1367 119.8812 56.6373 42.8110 173.9883 23 H 5.2031 9.7008 124.1956 55.0347 31.3194 173.1342 24 L 5.4236 9.2678 129.2373 53.4757 44.5591 175.1708 25 I 5.4122 9.4347 126.1812 58.3517 41.4673 174.2818 26 W 5.4065 7.9593 120.8432 55.7310 31.5436 173.1985 27 C 5.2643 8.7702 118.6105 57.9820 31.4302 172.8848 28 V 4.6324 8.6880 120.0774 62.1124 32.6036 175.4771 29 K 3.8065 8.8677 128.2298 58.0853 32.3924 176.8298 30 Y 3.6908 8.4454 121.0803 57.8381 35.4334 169.3437 31 R 3.9251 8.1192 117.9368 57.2873 29.1879 175.9572 32 H 4.4667 7.8569 112.8839 55.8162 29.3364 177.1257 33 Q 4.4671 8.5489 125.1287 54.9101 26.9848 175.5987 34 V 4.1862 7.4999 111.7584 61.6996 34.1903 177.5321 35 L 4.3479 7.9445 122.1487 53.7768 39.5770 176.0225 36 V 4.7140 6.8820 114.0369 59.8495 37.3917 177.1509 37 G 3.6756 8.3763 109.7599 46.5529 0.0000 176.7060 38 E 3.9615 8.6535 121.8800 58.8116 30.2143 179.1632 39 V 2.5464 7.5221 118.0923 65.4247 31.4208 177.8345 40 A 3.9561 7.7384 119.9790 55.2449 18.4324 179.0875 41 D 4.4152 7.9905 117.1269 57.5694 40.9188 179.3397 42 G 3.9285 8.4614 107.8901 47.1659 0.0000 175.4099 43 L 4.1128 8.1315 122.7179 57.9305 42.0526 179.1577 44 K 3.9957 8.1253 118.3854 59.6446 32.0018 178.9877 45 D 4.3872 8.0839 118.7447 57.4100 40.6794 178.9234 46 I 3.7360 7.9735 120.1668 64.3812 37.1594 178.3461 47 L 4.0730 8.4911 120.0192 58.1861 41.4917 179.8915 48 R 4.0371 8.3282 118.0639 59.1980 29.8406 178.7606 49 D 4.2928 8.1999 117.8412 57.3933 41.3069 178.2600 50 I 4.0333 8.3133 121.6863 63.7369 37.1228 178.0975 51 A 3.9379 8.4572 121.6800 55.2434 18.2197 179.4612 52 A 3.9504 8.1640 119.1852 55.6146 18.3582 179.9051 53 Q 4.0359 8.5399 116.7319 58.4339 28.5020 177.7981 54 N 4.9240 7.8952 114.8051 51.8692 39.1055 174.9310 55 G 3.8976 7.8618 108.2486 46.6985 0.0000 173.6017 56 L 4.6153 8.1958 119.6837 52.5289 43.5746 176.1699 57 E 4.3017 8.6797 125.3635 55.3669 31.1457 175.0262 58 V 4.2228 8.3233 127.2817 62.3253 31.8593 175.2576 59 I 4.1645 8.9395 129.9586 63.7708 38.0164 176.7988 60 T 4.7327 7.6155 116.9429 62.0686 73.0681 172.8153 61 M 5.0641 8.5267 124.3889 54.0549 35.3340 173.5296 62 E 4.5665 9.3940 127.2404 54.3549 33.0916 174.1258 63 V 4.3728 8.4684 126.9091 61.5874 32.9565 174.8377 64 M 4.5261 8.7144 128.5386 52.6825 33.9884 175.3421 65 P 4.6658 0.0000 0.0000 64.7923 31.2728 176.9363 66 D 5.3794 7.7516 115.2318 52.8158 41.0438 174.9427 67 H 4.9870 7.8637 113.8984 55.2684 32.5013 172.7318 68 V 4.5021 7.9319 119.0478 61.1718 34.7800 173.9047 69 H 5.1526 8.8256 123.0704 54.0248 31.8211 172.6824 70 L 5.2517 9.1406 123.2487 52.7187 46.1393 175.7616 71 L 5.1819 8.8960 123.2423 53.6849 44.6263 175.1564 72 L 5.2041 8.9741 126.6958 53.0093 45.1962 175.5269 73 S 5.2927 8.8924 115.8329 56.6846 65.0359 172.8370 74 A 5.3002 9.0539 127.9302 50.6086 22.9918 175.1615 75 T 3.6856 9.1341 109.6500 59.5626 70.2966 174.5439 76 P 4.0872 0.0000 0.0000 65.3390 31.2823 177.8954 77 Q 3.9992 7.0698 114.6549 57.0188 28.8621 176.4122 78 Q 4.2821 7.5702 117.4490 54.1161 27.8156 175.4961 79 A 4.0143 8.0880 125.0146 51.4500 20.3815 177.1877 80 I 2.0000 7.9796 125.2336 63.7733 37.1901 176.9849 81 P 3.8788 0.0000 0.0000 65.4275 30.9817 178.4174 82 D 4.1984 7.5895 117.3421 57.3649 40.9432 178.7063 83 F 4.2312 7.4520 114.2159 59.3420 37.7901 177.7386 84 V 3.3057 7.1754 119.4943 65.4527 31.1956 177.7453 85 K 3.6691 7.8032 119.1739 59.3332 32.0112 178.3470 86 A 3.9365 8.0356 121.1520 55.2602 18.1693 179.5989 87 L 3.8505 7.7160 117.0629 57.8780 41.7238 180.0220 88 K 3.5668 7.7686 118.5943 59.1633 32.1074 179.5619 89 G 3.7033 8.3094 106.0802 48.0562 0.0000 175.4974 90 A 4.1033 7.8698 123.8131 54.5749 18.3360 179.8644 91 S 4.1850 8.1215 112.8417 61.4504 63.0734 176.6351 92 A 3.5934 8.4639 124.4354 55.0135 18.2175 179.1288 93 R 3.9082 7.9414 116.7488 59.9781 30.0487 178.6913 94 R 3.9867 8.4400 117.5541 59.6436 30.1790 179.1281 95 M 4.1416 8.4492 118.7167 58.5456 31.6022 178.8592 96 F 4.4600 8.0669 117.9365 60.3785 38.7850 178.0067 97 V 3.6327 7.6031 116.4483 66.1545 31.5455 177.8454 98 A 3.9692 8.0202 119.2089 53.7996 19.2903 177.2303 99 Y 4.8136 8.2772 114.6582 54.7175 38.4803 174.1702 100 P 4.6359 0.0000 0.0000 64.6160 32.0172 177.6796 101 Q 4.1340 8.3150 115.7701 58.7316 28.2790 178.4860 102 L 4.1460 8.3731 121.6137 57.5489 41.4340 178.8195 103 K 5.1255 8.1925 118.5476 57.9929 31.9659 178.5285 104 E 4.2769 8.1937 118.8715 58.5099 29.4982 177.6169 105 K 4.7121 8.2561 115.7360 56.3642 34.2554 176.1660 106 L 4.5145 8.3138 119.1072 52.2392 41.7471 176.3965 107 W 4.7213 7.4132 118.0152 56.0694 29.3271 178.3252 108 G 3.5975 7.6420 107.3033 46.4156 0.0000 174.5095 109 G 3.8150 8.0629 107.9410 45.0476 0.0000 173.1008 110 N 5.0596 7.6878 115.5468 51.2792 42.0957 173.7115 111 L 4.1719 8.6067 124.1794 56.0527 43.6729 176.0563 112 W 5.6927 7.6109 116.3407 54.6680 31.5254 175.8616 113 N 4.6055 9.0992 122.0179 53.0454 38.7598 173.5535 114 P 4.4835 0.0000 0.0000 64.1406 31.7303 176.1013 115 S 4.8595 8.8709 115.9225 57.0650 65.1802 172.6506 116 Y 5.1853 7.7244 119.2891 55.5010 41.4913 173.8131 117 C 4.8759 9.4321 120.9891 57.6766 34.5016 172.5405 118 I 5.3870 8.4135 125.1318 59.5270 41.0866 173.9286 119 L 5.1312 9.0312 127.9236 52.9875 45.8602 176.0853 120 T 4.4829 8.6650 112.7152 61.6825 69.9522 173.9160 121 V 4.5662 8.4141 123.6442 61.1626 34.1464 174.8581 122 S 4.8154 8.5208 121.1082 56.0307 65.9143 173.7915 123 E 4.0073 8.8488 122.5475 58.7267 29.8325 175.9908 124 N 5.0661 7.7091 115.3734 51.5934 39.9753 173.9282 125 T 4.6164 7.9446 107.2416 60.0069 72.7195 174.6848 126 R 3.8394 8.4531 120.7897 59.7437 30.1480 178.2909 127 A 4.1672 7.9853 119.7877 55.4312 18.4092 179.4808 128 Q 3.9971 7.9724 116.0040 59.1648 28.7059 179.0677 129 I 3.8069 8.3268 121.2724 64.5307 37.1333 178.5156 130 Q 4.0437 8.5121 119.2536 58.8957 28.4617 179.0760 131 K 4.0543 8.0929 119.3263 59.3243 31.8595 178.7545 132 Y 4.0653 7.9034 119.1200 60.7074 39.0332 177.8951 133 I 3.6946 8.0715 120.7994 64.4800 37.1403 178.0093 134 E 3.9726 8.1859 120.2652 59.1973 29.2434 178.5517 135 S 4.3257 7.9417 112.4060 60.1866 63.2634 175.5297 136 Q 3.8840 7.6304 122.8510 57.7333 29.2009 175.6139 137 H 4.3305 7.2393 117.1170 56.4379 29.5396 174.8140 138 D 4.7190 8.6841 121.1069 54.8995 41.9906 173.3095 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 G 8.34 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 -1 S 8.57 3.78 0.00 4.06 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 0 H 8.61 4.55 0.00 3.04 3.19 0.00 5.92 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.42 4.09 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.45 0.00 2 T 7.82 4.60 4.13 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 1.22 0.00 0.00 3 Y 8.22 4.79 0.00 2.93 2.86 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 4 V 8.28 4.49 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 0.86 0.00 0.00 0.95 0.00 0.00 5 I 8.29 4.52 1.89 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 1.44 0.63 0.93 0.00 0.00 6 L 8.00 4.77 0.00 1.56 1.48 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 7 P 0.00 4.21 0.00 2.02 2.03 0.00 3.63 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 2.01 2.06 0.00 8 L 8.38 4.40 0.00 1.53 1.56 0.84 0.89 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 9 E 8.37 4.44 0.00 1.93 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 2.18 2.21 0.00 10 M 7.77 4.64 0.00 1.89 1.88 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 11 K 8.31 4.17 0.00 0.79 0.74 0.00 1.33 0.00 0.00 1.47 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.30 7.81 12 K 8.38 5.03 0.00 1.55 1.63 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.26 1.33 7.81 13 G 8.83 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 14 R 8.03 3.72 0.00 1.64 1.70 0.00 3.14 0.00 0.00 3.18 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 15 G 6.26 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 6.82 4.79 0.00 3.26 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 17 V 8.57 5.04 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 0.91 0.00 0.00 0.96 0.00 0.00 18 Y 8.72 4.87 0.00 3.08 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 19 Q 8.60 4.64 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.84 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 20 L 8.62 4.61 0.00 1.87 1.45 0.86 0.86 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 21 E 8.35 5.23 0.00 1.95 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 2.26 2.25 0.00 22 Y 9.14 5.22 0.00 2.95 2.92 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 23 H 9.70 5.20 0.00 3.20 3.25 0.00 5.56 0.00 0.00 0.00 0.00 6.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 9.27 5.42 0.00 1.97 1.69 1.15 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 25 I 9.43 5.41 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.56 0.72 0.00 0.00 26 W 7.96 5.41 0.00 3.19 3.14 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 0.00 27 C 8.77 5.26 0.00 2.97 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 28 V 8.69 4.63 2.27 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 1.09 0.00 0.00 1.12 0.00 0.00 29 K 8.87 3.81 0.00 1.86 1.39 0.00 1.33 0.00 0.00 1.57 0.00 0.00 2.66 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.67 0.21 7.81 30 Y 8.45 3.69 0.00 2.80 2.81 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 0.00 31 R 8.12 3.93 0.00 1.92 1.99 0.00 3.28 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 32 H 7.86 4.47 0.00 3.21 3.24 0.00 5.70 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.55 4.47 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 34 V 7.50 4.19 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 0.74 0.00 0.00 0.88 0.00 0.00 35 L 7.94 4.35 0.00 1.95 1.62 1.19 1.10 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 36 V 6.88 4.71 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 1.02 0.00 0.00 0.90 0.00 0.00 37 G 8.38 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.65 3.96 0.00 2.02 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 2.52 2.38 0.00 39 V 7.52 2.55 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 0.63 0.00 0.00 0.61 0.00 0.00 40 A 7.74 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 41 D 7.99 4.42 0.00 2.91 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 42 G 8.46 3.93 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 0.00 0.00 0.00 43 L 8.13 4.11 0.00 1.95 1.95 1.31 0.78 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 44 K 8.13 4.00 0.00 2.05 1.87 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.72 7.81 45 D 8.08 4.39 0.00 2.94 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 46 I 7.97 3.74 2.14 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 1.58 0.98 1.01 0.00 0.00 47 L 8.49 4.07 0.00 1.86 1.82 1.06 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 48 R 8.33 4.04 0.00 1.86 2.00 0.00 3.14 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 49 D 8.20 4.29 0.00 2.88 2.87 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 0.00 0.00 0.00 50 I 8.31 4.03 2.04 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.61 0.92 0.00 0.00 51 A 8.46 3.94 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 52 A 8.16 3.95 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 53 Q 8.54 4.04 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 54 N 7.90 4.92 0.00 2.70 2.84 0.00 0.00 7.00 7.72 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 55 G 7.86 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 56 L 8.20 4.62 0.00 1.51 1.46 0.75 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.68 4.30 0.00 2.09 1.82 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 2.27 2.25 0.00 58 V 8.32 4.22 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 0.85 0.00 0.00 0.93 0.00 0.00 59 I 8.94 4.16 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.94 0.89 0.00 0.00 60 T 7.62 4.73 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 61 M 8.53 5.06 0.00 1.94 1.87 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 62 E 9.39 4.57 0.00 2.00 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 2.13 2.21 0.00 63 V 8.47 4.37 2.04 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 0.85 0.00 0.00 0.89 0.00 0.00 64 M 8.71 4.53 0.00 2.01 1.65 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 65 P 0.00 4.67 0.00 2.22 2.33 0.00 3.77 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 2.09 1.95 0.00 66 D 7.75 5.38 0.00 2.80 2.94 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 67 H 7.86 4.99 0.00 3.16 3.34 0.00 5.20 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 7.93 4.50 0.67 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 0.38 0.00 0.00 0.54 0.00 0.00 69 H 8.83 5.15 0.00 2.97 3.10 0.00 5.61 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 9.14 5.25 0.00 1.58 1.54 1.18 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.90 5.18 0.00 1.68 1.57 0.97 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.97 5.20 0.00 1.54 1.39 0.54 0.70 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 73 S 8.89 5.29 0.00 3.86 3.77 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 74 A 9.05 5.30 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 75 T 9.13 3.69 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 1.26 0.00 0.00 76 P 0.00 4.09 0.00 1.38 1.82 0.00 2.68 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.50 0.00 77 Q 7.07 4.00 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.07 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 78 Q 7.57 4.28 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.29 0.00 79 A 8.09 4.01 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 80 I 7.98 2.00 1.55 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 0.98 0.48 0.50 0.00 0.00 81 P 0.00 3.88 0.00 1.99 1.98 0.00 3.35 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 82 D 7.59 4.20 0.00 2.74 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 83 F 7.45 4.23 0.00 3.05 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 84 V 7.18 3.31 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 0.20 0.00 0.00 0.20 0.00 0.00 85 K 7.80 3.67 0.00 1.81 1.84 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.38 7.81 86 A 8.04 3.94 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 87 L 7.72 3.85 0.00 1.55 1.48 0.99 0.75 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 88 K 7.77 3.57 0.00 1.41 1.43 0.00 0.76 0.00 0.00 1.06 0.00 0.00 2.59 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.30 0.21 7.81 89 G 8.31 3.70 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 0.00 0.00 0.00 90 A 7.87 4.10 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 91 S 8.12 4.19 0.00 4.37 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 0.00 92 A 8.46 3.59 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 93 R 7.94 3.91 0.00 2.04 2.19 0.00 3.21 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 94 R 8.44 3.99 0.00 1.94 2.01 0.00 3.23 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 95 M 8.45 4.14 0.00 1.80 2.04 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.90 0.00 96 F 8.07 4.46 0.00 3.37 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 97 V 7.60 3.63 2.25 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 0.80 0.00 0.00 0.99 0.00 0.00 98 A 8.02 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Y 8.28 4.81 0.00 3.09 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 0.00 100 P 0.00 4.64 0.00 2.21 2.17 0.00 3.94 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.30 0.00 101 Q 8.32 4.13 0.00 2.31 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.90 0.00 0.00 0.00 0.00 0.00 2.55 2.50 0.00 102 L 8.37 4.15 0.00 1.96 1.79 0.69 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.19 5.13 0.00 1.92 1.98 0.00 1.63 0.00 0.00 1.45 0.00 0.00 2.37 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.58 7.81 104 E 8.19 4.28 0.00 2.12 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 0.00 2.42 2.67 0.00 105 K 8.26 4.71 0.00 1.72 1.57 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.28 1.48 7.81 106 L 8.31 4.51 0.00 2.04 1.91 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 107 W 7.41 4.72 0.00 3.48 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 0.00 108 G 7.64 3.60 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 0.00 0.00 0.00 109 G 8.06 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 0.00 0.00 0.00 0.00 110 N 7.69 5.06 0.00 2.60 2.67 0.00 0.00 6.92 7.85 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 0.00 111 L 8.61 4.17 0.00 0.84 0.83 0.27 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 112 W 7.61 5.69 0.00 3.18 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 0.00 113 N 9.10 4.61 0.00 2.80 2.92 0.00 0.00 7.17 7.79 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 0.00 114 P 0.00 4.48 0.00 2.22 2.16 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 115 S 8.87 4.86 0.00 3.92 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 0.00 116 Y 7.72 5.19 0.00 2.91 2.79 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 0.00 117 C 9.43 4.88 0.00 2.94 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 0.00 118 I 8.41 5.39 2.14 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 1.60 1.44 1.14 0.00 0.00 119 L 9.03 5.13 0.00 1.73 1.55 0.92 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.66 4.48 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 1.25 0.00 0.00 121 V 8.41 4.57 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 0.79 0.00 0.00 0.99 0.00 0.00 122 S 8.52 4.82 0.00 3.94 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 0.00 123 E 8.85 4.01 0.00 1.91 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 0.00 2.26 2.27 0.00 124 N 7.71 5.07 0.00 2.83 2.80 0.00 0.00 5.85 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 0.00 125 T 7.94 4.62 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 0.00 126 R 8.45 3.84 0.00 1.90 1.99 0.00 3.20 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 127 A 7.99 4.17 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 0.00 128 Q 7.97 4.00 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 129 I 8.33 3.81 2.04 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.73 0.96 0.00 0.00 130 Q 8.51 4.04 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.71 0.00 131 K 8.09 4.05 0.00 2.03 1.87 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.71 7.81 132 Y 7.90 4.07 0.00 2.99 3.26 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 0.00 133 I 8.07 3.69 2.06 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 1.51 0.86 0.89 0.00 0.00 134 E 8.19 3.97 0.00 2.10 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 0.00 2.32 2.38 0.00 135 S 7.94 4.33 0.00 4.17 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 0.00 136 Q 7.63 3.88 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.91 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 137 H 7.24 4.33 0.00 3.24 3.17 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 D 8.68 4.72 0.00 2.81 2.63 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