NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3278 8.2644 123.5884 52.1845 19.9532 175.9241 2 S 4.4985 7.7875 111.0667 56.3224 64.7997 174.6131 3 N 4.9980 9.3480 122.8120 52.7152 39.1500 174.7586 4 F 5.0049 7.7673 122.5266 57.3104 37.6431 173.2916 5 T 4.6923 7.6017 112.6648 58.9521 72.4680 173.8972 6 Q 4.6501 8.5138 122.7780 56.4749 29.7629 174.8633 7 F 4.9791 8.6110 119.4048 55.5294 42.1213 173.2251 8 V 4.0864 8.3787 120.1131 62.4399 31.2481 175.4001 9 L 4.1419 8.4507 130.9178 56.7114 42.5483 176.9124 10 V 4.1476 7.3142 117.9872 60.7893 33.4775 173.3216 11 D 4.8993 8.6376 127.0085 53.1134 41.0769 176.2696 12 N 4.8888 9.0090 129.7382 52.3595 39.5640 177.1129 13 G 3.8835 9.9755 110.0147 45.5331 0.0000 174.9607 14 G 4.1081 8.6661 103.3628 46.1155 0.0000 173.0565 15 T 4.2125 7.3510 108.3528 62.1685 70.7997 175.6583 16 G 3.6366 8.4047 112.0425 45.6853 0.0000 172.4283 17 D 4.3034 7.6009 119.9193 54.1834 40.7904 176.7485 18 V 3.8376 8.4917 125.7641 62.1603 32.4847 174.6905 19 T 4.8495 8.2467 125.0148 61.5942 71.3950 173.7935 20 V 4.4131 8.0621 124.6393 59.7192 34.1402 174.4582 21 A 5.2217 8.6338 125.4249 49.0280 22.3595 173.6820 22 P 3.9659 0.0000 0.0000 63.3630 31.3160 176.4232 23 S 4.5337 8.7119 114.6827 59.6162 66.0418 173.7527 24 N 4.7440 7.8533 115.1331 52.0656 41.9590 174.1728 25 F 5.5642 8.5759 123.8315 55.9292 39.8843 174.0492 26 A 4.4424 8.6488 125.2396 52.0776 20.8181 177.2802 27 N 4.2893 9.2855 116.6214 54.6323 36.0211 175.2023 28 G 3.8748 8.1614 101.3849 46.0832 0.0000 173.6632 29 V 4.5507 7.7389 119.5965 60.6658 33.5651 174.6746 30 A 3.5985 8.6077 131.0345 51.3787 19.7282 175.6378 31 E 5.3371 8.8252 121.5320 54.3092 33.5027 174.2522 32 W 5.3015 10.0270 126.1960 55.0993 32.8852 174.6514 33 I 5.3807 8.9327 123.8377 59.5106 41.0665 175.3448 34 S 4.9147 8.6248 120.7875 57.2512 64.1481 173.6938 35 S 4.2056 8.3604 115.4949 58.7531 62.9218 173.5764 36 N 4.3493 7.6934 120.6997 52.5555 37.0027 173.8903 37 S 3.8497 7.7299 112.3532 57.6957 62.3031 175.5303 38 R 3.9231 8.9557 127.2539 59.2842 30.0336 178.5164 39 S 4.1933 8.1350 111.2416 60.6197 62.9167 174.8111 40 Q 4.4196 7.9770 117.6116 55.2847 29.1827 175.0983 41 A 4.5981 7.5604 120.0158 51.4677 20.1208 177.6401 42 Y 4.3799 9.3476 117.5852 57.4346 39.8071 174.8392 43 K 5.2336 8.5882 122.8068 54.8388 36.2952 175.1511 44 V 5.1988 9.0895 125.8198 61.6692 35.1598 174.0016 45 T 5.9587 9.2468 117.0898 59.5820 72.6839 172.1660 46 C 5.6346 8.7972 120.6589 59.5099 35.2703 172.4630 47 S 4.9541 8.3958 116.2778 57.6126 65.5631 173.6616 48 V 4.6030 7.9728 120.4107 61.4786 34.5530 174.3825 49 R 4.3574 7.8689 123.5000 55.5010 34.1442 174.1996 50 Q 4.4459 8.7234 126.1988 55.6481 27.8580 175.8696 51 S 4.2546 8.5780 119.9653 60.4376 63.4643 174.2064 52 S 4.6613 7.4100 112.8836 55.9520 65.7641 172.9549 53 A 4.0763 8.7704 121.7660 55.1081 18.2740 178.4895 54 Q 4.3898 8.0289 111.8296 55.6101 30.1354 174.4283 55 N 5.4885 7.8227 115.6396 51.3934 42.1541 173.6940 56 R 4.7600 8.6365 120.9173 54.3794 33.6162 175.1237 57 K 4.9897 8.8301 122.9212 55.1614 35.5576 174.6520 58 Y 4.7275 9.5198 125.8093 57.5102 40.1889 175.1228 59 T 5.0283 9.0146 119.3805 62.0940 71.4631 172.8405 60 I 4.8300 8.5747 127.7044 59.9932 39.7436 175.1833 61 K 5.1768 8.9829 125.9243 55.2304 35.9408 174.9691 62 V 5.0952 9.2289 126.8264 61.1887 35.3811 173.8400 63 E 4.9180 9.1873 125.1225 54.4989 33.2597 174.7127 64 V 4.0364 8.5487 125.3586 60.3451 33.5368 172.9579 65 P 4.5823 0.0000 0.0000 61.6808 33.3370 175.8060 66 K 3.7432 7.6577 123.2655 54.0624 32.5357 175.0620 67 V 3.8233 7.8380 126.7101 63.2341 32.0928 174.6519 68 A 4.5614 8.5633 127.0525 51.5243 23.1710 174.7162 69 T 4.8214 8.3903 115.8839 61.9519 70.8037 174.0287 70 Q 4.5549 9.1353 127.7036 54.7485 31.1982 174.0440 71 T 5.0558 8.5104 123.3727 61.8246 70.7421 174.4765 72 V 4.1604 8.6309 126.3017 62.4345 34.2415 175.3181 73 G 3.6292 9.4999 114.7001 46.0931 0.0000 174.0537 74 G 3.8477 8.4304 106.4533 44.6886 0.0000 173.4505 75 V 4.3646 7.6557 121.1407 61.0631 33.1320 174.1357 76 E 5.2351 8.7788 126.2035 54.7419 31.6002 175.2624 77 L 4.8932 8.8743 122.5527 52.2103 45.9089 173.9458 78 P 4.7200 0.0000 0.0000 62.7772 32.2755 176.0050 79 V 4.5072 8.7292 117.1842 60.0185 36.6923 173.2357 80 A 4.7282 8.3704 122.3504 50.4508 20.0302 176.2010 81 A 4.1963 8.4911 126.1641 55.2881 19.2031 176.8911 82 W 4.7921 6.8097 109.6352 56.2986 31.3366 173.4344 83 R 5.0612 8.8688 117.4893 54.6279 33.7977 174.7360 84 S 4.8534 9.1292 117.2814 57.0309 64.4128 172.2001 85 Y 5.1143 8.8328 124.5480 56.1488 40.0721 174.5963 86 L 4.7409 9.2165 126.7615 53.4198 44.6889 175.1603 87 S 5.1547 8.9085 122.0612 57.1101 65.4327 172.9823 88 M 4.8904 8.9234 122.6121 53.3126 34.3345 174.7837 89 E 5.1902 8.7131 119.1572 54.6685 33.1740 174.6081 90 L 4.7167 9.0259 127.1117 53.5824 44.5402 174.8843 91 T 5.1325 8.6276 122.9874 62.0254 70.6652 174.0409 92 I 4.6381 8.7137 126.6829 58.6982 41.0020 173.5628 93 P 5.2718 0.0000 0.0000 61.9107 32.3286 177.4220 94 I 3.8575 8.2891 115.2277 62.2657 37.5974 176.8493 95 F 4.4993 7.3981 118.7479 58.3693 39.4363 175.7564 96 A 4.2927 7.7102 124.9354 52.3015 18.6488 178.2272 97 T 4.4450 9.0433 114.8869 60.5530 71.9589 175.7551 98 N 4.3954 8.5756 117.4703 56.4304 38.3929 177.9090 99 S 4.1259 7.9869 116.3058 61.6738 63.0611 176.0675 100 D 4.3983 7.8875 121.6420 57.6933 40.5150 178.7917 101 C 4.1841 8.1819 117.2011 62.7794 28.0886 175.9294 102 E 3.9397 8.2412 120.3105 59.1506 28.9396 179.2153 103 L 3.9181 7.8749 120.2915 58.2552 42.2496 178.9470 104 I 3.6563 7.7013 119.7808 64.4630 36.9659 178.6015 105 V 3.5098 7.9142 118.9395 65.9769 31.2997 178.2220 106 K 4.0648 8.2410 118.0445 59.3861 31.7863 179.1890 107 A 3.9724 8.1142 121.2415 55.4176 18.0708 179.6420 108 M 4.0094 7.6753 116.2047 58.5914 31.8200 178.7547 109 Q 4.2161 8.3953 118.5799 58.7467 28.8626 178.9247 110 G 3.6041 8.4067 107.2059 47.6214 0.0000 175.2240 111 L 3.9673 7.7887 121.8899 57.5833 42.0943 178.2708 112 L 4.4850 7.1214 113.9204 53.2395 42.6756 176.7062 113 K 4.0014 7.3998 121.8293 56.0956 32.7575 175.8390 114 D 4.5439 8.5362 124.7973 56.3721 41.1402 176.5608 115 G 4.0430 8.9518 111.7304 45.7597 0.0000 174.2011 116 N 4.6022 7.8442 116.5644 52.1501 40.5836 173.6013 117 P 4.0878 0.0000 0.0000 66.4876 31.3939 178.7948 118 I 3.6936 7.6304 117.4231 64.0347 37.2837 176.6868 119 P 4.2942 0.0000 0.0000 66.0166 30.7294 178.4722 120 S 4.1741 8.1823 113.6171 60.6753 62.8957 176.4837 121 A 4.1039 8.0098 124.7667 55.0750 18.3221 179.5222 122 I 3.6362 7.7957 118.1227 64.5704 37.0834 178.5162 123 A 4.1290 8.0514 120.3007 54.1502 18.2903 177.6878 124 A 4.7097 7.1266 118.7539 51.8633 19.3924 175.6543 125 N 4.2070 7.9728 113.2243 55.9128 36.8595 174.2957 126 S 4.8855 8.1358 112.4918 56.7900 66.4784 173.2999 127 G 4.4686 8.3201 109.7495 44.9348 0.0000 172.2737 128 I 4.3287 8.1474 121.4343 60.4314 38.8326 175.2734 129 Y 4.3865 7.6343 120.6111 57.7361 37.2007 174.1688 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 A 8.26 4.33 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 S 7.79 4.50 0.00 3.95 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 3 N 9.35 5.00 0.00 2.90 2.93 0.00 0.00 6.04 7.43 0.00 0.00 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 F 7.77 5.00 0.00 2.85 3.07 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 5 T 7.60 4.69 4.31 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 1.28 0.00 0.00 6 Q 8.51 4.65 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 7 F 8.61 4.98 0.00 3.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.38 4.09 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 0.76 0.00 0.00 0.89 0.00 0.00 9 L 8.45 4.14 0.00 1.21 1.44 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.31 4.15 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.78 0.00 0.00 11 D 8.64 4.90 0.00 2.63 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 12 N 9.01 4.89 0.00 2.73 2.73 0.00 0.00 6.75 7.49 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 13 G 9.98 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 0.00 0.00 0.00 14 G 8.67 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 15 T 7.35 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 1.20 0.00 0.00 16 G 8.40 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 7.60 4.30 0.00 2.62 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 18 V 8.49 3.84 1.68 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 -0.08 0.00 0.00 0.64 0.00 0.00 19 T 8.25 4.85 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 1.15 0.00 0.00 20 V 8.06 4.41 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 -0.21 0.00 0.00 0.99 0.00 0.00 21 A 8.63 5.22 1.20 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 22 P 0.00 3.97 0.00 1.34 0.49 0.00 3.46 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.32 0.00 23 S 8.71 4.53 0.00 3.81 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 24 N 7.85 4.74 0.00 2.79 2.68 0.00 0.00 6.58 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 25 F 8.58 5.56 0.00 2.21 2.59 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 26 A 8.65 4.44 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 27 N 9.29 4.29 0.00 2.85 2.89 0.00 0.00 6.94 7.65 0.00 0.00 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 G 8.16 3.87 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 0.00 0.00 0.00 29 V 7.74 4.55 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 1.02 0.00 0.00 1.00 0.00 0.00 30 A 8.61 3.60 0.20 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 31 E 8.83 5.34 0.00 2.08 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 2.28 2.40 0.00 32 W 10.03 5.30 0.00 3.30 2.84 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 0.00 0.00 0.00 33 I 8.93 5.38 1.91 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 1.36 1.36 1.00 0.00 0.00 34 S 8.62 4.91 0.00 3.86 3.85 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 35 S 8.36 4.21 0.00 3.83 3.80 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 36 N 7.69 4.35 0.00 2.93 2.91 0.00 0.00 6.92 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 37 S 7.73 3.85 0.00 3.88 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 38 R 8.96 3.92 0.00 1.89 1.94 0.00 3.26 0.00 0.00 3.41 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 39 S 8.14 4.19 0.00 3.99 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 40 Q 7.98 4.42 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.31 2.21 0.00 41 A 7.56 4.60 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 Y 9.35 4.38 0.00 2.82 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 43 K 8.59 5.23 0.00 1.81 1.63 0.00 1.65 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.46 7.81 44 V 9.09 5.20 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 0.81 0.00 0.00 1.00 0.00 0.00 45 T 9.25 5.96 4.42 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 1.35 0.00 0.00 46 C 8.80 5.63 0.00 3.20 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 47 S 8.40 4.95 0.00 4.01 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 48 V 7.97 4.60 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 -0.21 0.00 0.00 0.69 0.00 0.00 49 R 7.87 4.36 0.00 1.75 1.63 0.00 3.28 0.00 0.00 3.06 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.64 0.00 50 Q 8.72 4.45 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.58 0.00 51 S 8.58 4.25 0.00 4.01 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 52 S 7.41 4.66 0.00 3.89 3.87 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 53 A 8.77 4.08 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 8.03 4.39 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 55 N 7.82 5.49 0.00 2.61 2.67 0.00 0.00 6.77 7.54 0.00 0.00 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 R 8.64 4.76 0.00 1.86 1.68 0.00 2.97 0.00 0.00 3.04 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.48 0.00 57 K 8.83 4.99 0.00 1.76 1.58 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.44 7.81 58 Y 9.52 4.73 0.00 2.94 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 9.01 5.03 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 60 I 8.57 4.83 1.92 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 1.17 1.11 1.00 0.00 0.00 61 K 8.98 5.18 0.00 1.88 1.70 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.62 7.81 62 V 9.23 5.10 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 1.04 0.00 0.00 0.99 0.00 0.00 63 E 9.19 4.92 0.00 1.86 1.58 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 1.81 2.27 0.00 64 V 8.55 4.04 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 0.80 0.00 0.00 0.99 0.00 0.00 65 P 0.00 4.58 0.00 1.77 1.67 0.00 2.20 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.63 0.00 66 K 7.66 3.74 0.00 0.79 0.74 0.00 1.15 0.00 0.00 1.16 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.46 0.83 7.81 67 V 7.84 3.82 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 0.79 0.00 0.00 0.83 0.00 0.00 68 A 8.56 4.56 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 69 T 8.39 4.82 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 1.20 0.00 0.00 70 Q 9.14 4.55 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 71 T 8.51 5.06 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 72 V 8.63 4.16 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 0.95 0.00 0.00 0.94 0.00 0.00 73 G 9.50 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.43 3.85 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 0.00 0.00 0.00 75 V 7.66 4.36 2.19 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 1.05 0.00 0.00 0.96 0.00 0.00 76 E 8.78 5.24 0.00 1.99 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 2.18 2.31 0.00 77 L 8.87 4.89 0.00 1.53 1.54 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.72 0.00 1.92 1.97 0.00 3.61 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 79 V 8.73 4.51 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 0.88 0.00 0.00 0.96 0.00 0.00 80 A 8.37 4.73 1.08 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 81 A 8.49 4.20 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 82 W 6.81 4.79 0.00 3.44 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 83 R 8.87 5.06 0.00 1.42 1.09 0.00 3.17 0.00 0.00 3.07 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.46 0.00 84 S 9.13 4.85 0.00 4.06 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 85 Y 8.83 5.11 0.00 2.86 2.90 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 86 L 9.22 4.74 0.00 1.76 1.56 0.96 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.91 5.15 0.00 3.79 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 88 M 8.92 4.89 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 89 E 8.71 5.19 0.00 1.85 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 2.24 2.30 0.00 90 L 9.03 4.72 0.00 1.75 1.57 0.92 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.63 5.13 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 1.24 0.00 0.00 92 I 8.71 4.64 1.99 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 1.27 1.12 0.96 0.00 0.00 93 P 0.00 5.27 0.00 2.21 2.12 0.00 3.93 0.00 0.00 3.83 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 94 I 8.29 3.86 1.62 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 -0.36 0.78 0.00 0.00 95 F 7.40 4.50 0.00 3.13 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 96 A 7.71 4.29 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 9.04 4.44 4.26 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 1.30 0.00 0.00 98 N 8.58 4.40 0.00 2.84 2.92 0.00 0.00 6.83 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 99 S 7.99 4.13 0.00 3.87 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 0.00 100 D 7.89 4.40 0.00 2.87 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 0.00 101 C 8.18 4.18 0.00 3.14 2.96 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 0.00 102 E 8.24 3.94 0.00 2.19 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 0.00 2.31 2.47 0.00 103 L 7.87 3.92 0.00 1.78 1.85 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 104 I 7.70 3.66 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.89 0.87 0.00 0.00 105 V 7.91 3.51 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 1.04 0.00 0.00 0.87 0.00 0.00 106 K 8.24 4.06 0.00 2.00 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.65 7.81 107 A 8.11 3.97 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 0.00 108 M 7.68 4.01 0.00 1.99 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.55 0.00 109 Q 8.40 4.22 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.65 0.00 110 G 8.41 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 0.00 111 L 7.79 3.97 0.00 1.73 1.93 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.12 4.49 0.00 1.68 1.67 0.92 0.87 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 0.00 113 K 7.40 4.00 0.00 1.90 1.75 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.41 7.81 114 D 8.54 4.54 0.00 2.68 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 0.00 115 G 8.95 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 0.00 116 N 7.84 4.60 0.00 2.91 2.73 0.00 0.00 6.79 7.90 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 0.00 117 P 0.00 4.09 0.00 2.11 2.03 0.00 3.57 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 118 I 7.63 3.69 1.86 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 1.68 0.68 0.91 0.00 0.00 119 P 0.00 4.29 0.00 2.26 2.39 0.00 3.62 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.18 0.00 120 S 8.18 4.17 0.00 4.11 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 0.00 121 A 8.01 4.10 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.80 3.64 2.03 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.27 0.94 0.00 0.00 123 A 8.05 4.13 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 0.00 124 A 7.13 4.71 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 0.00 125 N 7.97 4.21 0.00 2.88 2.86 0.00 0.00 6.66 6.85 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 0.00 126 S 8.14 4.89 0.00 4.06 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 0.00 127 G 8.32 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.15 4.33 1.88 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 1.47 0.89 0.84 0.00 0.00 129 Y 7.63 4.39 0.00 3.06 2.90 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