NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4649 8.3044 120.3265 55.4084 33.3930 174.1809 2 S 4.4549 8.2809 115.8483 56.2813 65.6964 171.5478 3 S 4.5998 8.8185 117.0783 57.7638 63.2171 172.9845 4 G 3.9694 7.6690 108.3951 44.2461 0.0000 173.7623 5 T 4.3427 8.2207 119.6991 60.0265 68.5761 172.6534 6 P 4.4758 0.0000 0.0000 62.9290 32.0749 175.6182 7 T 4.6220 7.9386 113.6265 59.6320 70.3305 171.6260 8 P 4.3879 0.0000 0.0000 62.1267 31.9160 175.9389 9 S 4.4927 8.5438 117.4560 56.6018 63.6725 172.4239 10 N 5.1074 8.5991 122.7053 52.0405 39.3026 173.9040 11 V 5.0335 7.8708 112.3711 59.8751 34.7691 175.2949 12 V 4.6173 8.5563 116.8341 59.4056 35.8293 174.1344 13 L 5.1253 8.4461 124.5353 53.3399 44.3388 175.6069 14 I 3.7300 8.1869 127.4810 60.1232 37.8518 174.8704 15 G 4.0324 9.5505 114.6106 45.9219 0.0000 173.9553 16 K 4.5798 9.1187 121.0601 55.6315 32.8031 175.8448 17 K 4.2985 7.9700 118.5112 54.9469 33.0950 175.2121 18 P 4.4710 0.0000 0.0000 62.5084 32.1326 178.0443 19 V 3.9552 8.5488 121.5388 65.2417 30.7914 178.4864 20 M 4.1314 8.0539 117.0473 58.0133 30.5414 177.7855 21 N 4.2345 8.2004 118.3645 56.2948 39.0618 176.4048 22 Y 4.2113 7.5619 117.7788 60.3903 38.2744 177.6858 23 V 3.6156 7.9306 119.2388 66.2637 31.7150 178.2596 24 L 3.9768 7.6772 117.8955 57.3763 41.3642 179.4673 25 A 3.9337 7.6329 120.2173 55.1359 18.1730 179.5710 26 A 3.9848 8.1363 119.3084 55.2257 17.8677 179.9081 27 L 3.7933 7.7208 117.1864 58.1318 41.4710 179.8385 28 T 3.8925 7.8522 115.8079 66.4523 68.2402 176.8148 29 L 3.9918 7.8858 121.1037 57.4625 41.4400 179.2928 30 L 4.4249 7.5136 121.6303 57.7691 41.9499 178.2793 31 N 4.6257 7.5850 112.0546 54.4413 38.7022 176.0583 32 Q 4.3305 8.4497 120.9055 56.4753 29.6940 174.5633 33 G 3.2458 6.7885 109.2904 44.8854 0.0000 173.5981 34 V 4.1143 8.1131 122.8954 61.3840 31.5743 175.9586 35 S 4.3929 8.5335 123.3312 59.7109 64.7645 173.3728 36 E 5.4403 8.4744 119.4949 53.5207 31.6029 175.4867 37 I 4.7617 8.3563 117.8520 58.8757 41.4921 174.4679 38 V 4.7500 8.8123 124.4589 61.3494 34.0144 174.1710 39 I 4.5001 8.6291 129.7322 60.1329 38.9342 174.8703 40 K 5.0677 9.0579 126.9427 54.5926 34.7861 175.3472 41 A 5.2129 8.7407 125.4827 50.5903 23.5942 174.4394 42 R 4.8629 8.5025 113.0429 55.4562 32.6338 176.9681 43 G 3.8332 9.3058 112.6500 47.2119 0.0000 176.4252 44 R 4.0537 8.8628 121.1443 56.4734 30.0979 177.0795 45 A 4.2638 7.8802 120.6966 53.3417 18.6091 179.1720 46 I 3.6341 7.2453 118.9556 64.3176 37.1186 178.2177 47 S 4.0904 7.9959 113.4951 61.3060 62.1844 176.2222 48 K 4.0269 7.9540 120.7027 58.9320 31.7292 179.1810 49 A 3.8857 7.8587 121.0766 55.0992 18.2737 179.9130 50 V 3.5942 7.5490 117.7916 64.8618 31.5340 177.9965 51 D 4.3112 8.0754 118.7692 57.3404 40.9985 178.5149 52 T 3.8975 8.2768 116.4886 66.9360 68.6039 177.3012 53 V 3.6957 7.6258 113.8250 64.1228 31.2606 178.4016 54 E 3.9456 8.2844 118.9840 59.2174 29.8033 178.6047 55 I 3.8621 7.5205 119.8841 64.5415 37.0058 178.5379 56 V 3.6731 7.9099 119.2294 65.6911 31.3653 177.4223 57 R 4.5034 8.1121 115.2592 56.1719 29.5168 176.9596 58 N 4.9574 7.8405 116.5922 53.0300 39.3605 174.5282 59 R 4.4511 7.6865 116.4931 57.5807 32.6288 175.9067 60 F 4.1387 8.3510 119.4075 59.9499 39.8808 175.9478 61 L 4.6239 7.8080 121.5933 53.2013 43.8070 176.2914 62 A 5.2208 8.4350 125.3759 53.5584 20.3176 178.6894 63 D 4.2079 7.9943 113.9592 57.1110 41.1300 178.1205 64 K 4.1836 7.8912 116.4217 57.8330 32.6653 176.8796 65 I 4.1760 6.9660 119.0951 60.6872 38.8818 174.7207 66 E 4.7609 9.0626 127.5930 54.5146 33.3565 173.9874 67 I 4.3903 8.3894 125.4982 60.5459 39.0003 174.4660 68 K 4.3965 8.5053 129.0781 57.2841 33.3535 175.7553 69 E 4.9181 7.5667 117.6292 55.3902 33.0337 173.9564 70 I 5.0323 8.3414 117.5331 59.4471 40.3409 174.5398 71 R 4.7155 8.9521 125.5389 54.1466 34.1044 174.4477 72 V 4.7851 8.1529 122.5790 60.9830 34.4863 174.5812 73 G 4.1492 8.6651 113.5623 45.7235 0.0000 172.1584 74 S 4.9787 8.7709 115.9958 57.8398 63.9776 173.2847 75 Q 4.5693 9.2171 126.3132 54.3080 31.5722 174.6265 76 V 4.4756 8.3161 125.3295 62.1162 31.9586 175.1606 77 V 4.6712 8.8816 121.9677 59.6166 35.3509 174.8732 78 T 4.9254 8.2274 112.2245 60.5948 70.1002 175.1503 79 S 4.5210 9.0076 121.3981 57.6226 64.1783 175.0654 80 Q 4.0765 8.6122 119.5583 59.5253 28.5842 178.5137 81 D 4.3965 8.0781 116.6591 58.1737 41.4634 176.0867 82 G 3.5999 6.6040 105.2347 46.0479 0.0000 173.8077 83 R 4.6546 7.8627 118.1206 53.9610 33.5794 176.8985 84 Q 4.6367 8.7607 122.6558 56.0114 29.3237 175.2347 85 S 4.7490 9.4391 120.3070 56.3512 65.1323 172.9568 86 R 4.9373 8.5878 126.1142 55.4445 31.3321 176.0235 87 V 4.5218 8.7567 123.3384 60.6711 35.5047 174.3806 88 S 4.7642 8.8642 122.3067 59.1396 63.7711 172.9343 89 T 5.0551 9.1166 116.1673 59.9224 71.7449 173.4226 90 I 5.0326 8.7368 123.0655 59.4589 41.9229 173.4769 91 E 5.0313 9.3001 128.9778 54.7723 32.1070 174.9566 92 I 4.5554 8.7609 126.5037 59.5274 39.6427 174.5757 93 A 5.2055 8.9173 130.3196 50.0305 21.0342 175.2796 94 I 4.8218 8.4341 115.6564 58.9895 41.6299 174.5269 95 R 4.8008 9.2372 123.7843 54.6707 32.3683 174.2987 96 K 4.8979 9.1138 127.1562 54.7139 33.7337 177.0771 97 K 4.1403 8.3725 122.7973 57.2850 32.4400 175.7744 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 8.30 4.46 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 2 S 8.28 4.45 0.00 3.84 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 3 S 8.82 4.60 0.00 3.85 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 4 G 7.67 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 5 T 8.22 4.34 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 6 P 0.00 4.48 0.00 2.08 1.97 0.00 3.67 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 2.02 2.07 0.00 7 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 8 P 0.00 4.39 0.00 2.08 1.97 0.00 3.67 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 2.02 2.06 0.00 9 S 8.54 4.49 0.00 3.76 3.73 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 0.00 0.00 0.00 0.00 10 N 8.60 5.11 0.00 2.96 2.95 0.00 0.00 5.94 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 11 V 7.87 5.03 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 0.74 0.00 0.00 0.93 0.00 0.00 12 V 8.56 4.62 2.17 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 0.87 0.00 0.00 0.98 0.00 0.00 13 L 8.45 5.13 0.00 1.60 1.54 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 14 I 8.19 3.73 1.70 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.65 0.64 0.00 0.00 15 G 9.55 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 0.00 0.00 0.00 16 K 9.12 4.58 0.00 1.73 1.82 0.00 1.66 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.50 7.81 17 K 7.97 4.30 0.00 1.52 1.47 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.24 7.81 18 P 0.00 4.47 0.00 2.15 1.98 0.00 3.54 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 19 V 8.55 3.96 2.15 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 0.97 0.00 0.00 1.07 0.00 0.00 20 M 8.05 4.13 0.00 2.27 2.36 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 21 N 8.20 4.23 0.00 2.63 2.55 0.00 0.00 6.91 6.83 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 22 Y 7.56 4.21 0.00 3.16 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 23 V 7.93 3.62 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 1.13 0.00 0.00 1.07 0.00 0.00 24 L 7.68 3.98 0.00 1.73 1.65 1.00 0.70 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 25 A 7.63 3.93 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 26 A 8.14 3.98 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 27 L 7.72 3.79 0.00 1.63 1.29 0.56 0.59 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 28 T 7.85 3.89 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 1.18 0.00 0.00 29 L 7.89 3.99 0.00 1.85 1.71 0.93 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.51 4.42 0.00 1.63 1.79 0.94 0.54 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 31 N 7.59 4.63 0.00 2.72 2.84 0.00 0.00 7.01 7.62 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 32 Q 8.45 4.33 0.00 2.12 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 33 G 6.79 3.25 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 34 V 8.11 4.11 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 0.97 0.00 0.00 1.00 0.00 0.00 35 S 8.53 4.39 0.00 4.12 4.10 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 36 E 8.47 5.44 0.00 1.83 1.90 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 2.19 2.10 0.00 37 I 8.36 4.76 1.87 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 1.23 1.02 0.91 0.00 0.00 38 V 8.81 4.75 2.07 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 0.95 0.00 0.00 0.93 0.00 0.00 39 I 8.63 4.50 1.82 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 1.21 0.51 0.78 0.00 0.00 40 K 9.06 5.07 0.00 1.63 1.66 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.33 7.81 41 A 8.74 5.21 1.12 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 42 R 8.50 4.86 0.00 2.00 2.00 0.00 3.11 0.00 0.00 3.33 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 43 G 9.31 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 0.00 0.00 0.00 44 R 8.86 4.05 0.00 1.92 2.05 0.00 3.03 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 45 A 7.88 4.26 1.32 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 46 I 7.25 3.63 1.85 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 1.38 1.08 0.89 0.00 0.00 47 S 8.00 4.09 0.00 3.87 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 48 K 7.95 4.03 0.00 1.90 1.75 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.44 7.81 49 A 7.86 3.89 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 50 V 7.55 3.59 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 1.05 0.00 0.00 0.92 0.00 0.00 51 D 8.08 4.31 0.00 2.97 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 52 T 8.28 3.90 4.35 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 1.29 0.00 0.00 53 V 7.63 3.70 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 0.97 0.00 0.00 1.03 0.00 0.00 54 E 8.28 3.95 0.00 2.08 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 2.33 2.36 0.00 55 I 7.52 3.86 2.04 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 1.43 0.82 0.95 0.00 0.00 56 V 7.91 3.67 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 1.15 0.00 0.00 1.03 0.00 0.00 57 R 8.11 4.50 0.00 2.11 2.17 0.00 3.04 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.55 0.00 58 N 7.84 4.96 0.00 2.84 2.82 0.00 0.00 6.63 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 59 R 7.69 4.45 0.00 1.78 1.98 0.00 3.33 0.00 0.00 3.25 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 60 F 8.35 4.14 0.00 3.00 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 61 L 7.81 4.62 0.00 1.91 1.57 1.21 0.88 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 62 A 8.44 5.22 1.32 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 63 D 7.99 4.21 0.00 2.66 2.74 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 0.00 0.00 0.00 0.00 64 K 7.89 4.18 0.00 1.77 2.11 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.42 7.81 65 I 6.97 4.18 2.02 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 1.13 0.91 0.99 0.00 0.00 66 E 9.06 4.76 0.00 2.03 1.70 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 2.20 2.24 0.00 67 I 8.39 4.39 1.87 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 1.23 0.84 0.91 0.00 0.00 68 K 8.51 4.40 0.00 1.79 1.94 0.00 2.00 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.36 7.81 69 E 7.57 4.92 0.00 2.07 1.70 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 2.20 2.28 0.00 70 I 8.34 5.03 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 1.34 0.83 0.90 0.00 0.00 71 R 8.95 4.72 0.00 1.74 1.80 0.00 3.06 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 72 V 8.15 4.79 2.07 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 0.90 0.00 0.00 0.92 0.00 0.00 73 G 8.67 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 74 S 8.77 4.98 0.00 3.88 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 75 Q 9.22 4.57 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.87 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 76 V 8.32 4.48 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 0.84 0.00 0.00 0.93 0.00 0.00 77 V 8.88 4.67 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 0.75 0.00 0.00 0.98 0.00 0.00 78 T 8.23 4.93 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 1.27 0.00 0.00 79 S 9.01 4.52 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 80 Q 8.61 4.08 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.09 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 81 D 8.08 4.40 0.00 2.65 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 82 G 6.60 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 83 R 7.86 4.65 0.00 1.75 1.81 0.00 3.13 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 84 Q 8.76 4.64 0.00 1.92 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.68 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 85 S 9.44 4.75 0.00 3.82 3.67 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 0.00 0.00 0.00 86 R 8.59 4.94 0.00 1.73 1.84 0.00 3.20 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 1.59 1.61 0.00 87 V 8.76 4.52 2.07 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 0.95 0.00 0.00 0.93 0.00 0.00 88 S 8.86 4.76 0.00 3.93 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 89 T 9.12 5.06 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 1.27 0.00 0.00 90 I 8.74 5.03 1.85 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 1.20 1.58 0.92 0.00 0.00 91 E 9.30 5.03 0.00 1.90 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 2.20 2.23 0.00 92 I 8.76 4.56 1.85 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 1.14 0.68 0.90 0.00 0.00 93 A 8.92 5.21 1.22 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 0.00 0.00 94 I 8.43 4.82 1.88 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 1.11 1.07 0.91 0.00 0.00 95 R 9.24 4.80 0.00 1.83 1.93 0.00 3.08 0.00 0.00 3.40 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 96 K 9.11 4.90 0.00 1.75 1.74 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.52 7.81 97 K 8.37 4.14 0.00 1.81 1.72 0.00 1.61 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.47 7.81