NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3616 0.0000 0.0000 61.7000 32.6184 175.9373 3 K 3.9716 8.6754 123.5117 55.4447 32.5410 175.2633 4 K 3.9802 9.6310 127.7125 57.0731 33.7309 175.0703 5 V 4.9465 8.4072 126.1797 61.1653 33.7725 174.4530 6 L 4.8570 9.3126 126.9726 53.1488 46.0572 175.3749 7 T 5.0748 8.3361 117.6194 62.0172 71.1208 173.6163 8 G 4.0800 8.5551 112.1646 45.6543 0.0000 171.0424 9 V 4.6077 8.0346 119.0239 60.8149 34.3901 175.7422 10 V 4.1608 8.6788 127.6919 63.1683 31.6231 176.0121 11 V 4.1919 8.1894 120.9036 60.7567 32.4083 176.2333 12 S 4.4053 7.2968 112.4906 57.3649 65.6517 175.4003 13 D 5.1312 8.7620 128.6735 54.1211 41.6427 175.8902 14 K 4.3449 7.8552 115.3292 56.4967 32.1750 176.4217 15 M 4.7379 7.5869 117.8975 53.2013 34.6689 175.0538 16 Q 4.3812 8.4417 118.7772 55.9727 28.8876 176.4411 17 K 4.8932 9.1219 121.1825 56.8930 30.3299 175.1838 18 T 5.2535 7.4636 114.1339 62.1751 72.6689 173.9321 19 V 4.7138 8.9841 118.0078 59.9163 36.2224 174.7131 20 T 4.7887 8.7754 121.3438 62.6180 70.0102 173.8063 21 V 4.5039 8.9391 127.5558 61.0640 34.0710 174.3794 22 L 4.7063 8.9790 131.3507 53.9308 42.5028 174.8225 23 V 4.4694 8.9255 127.6923 61.8758 32.8947 174.4049 24 E 5.2892 8.6562 128.0669 54.7718 32.6907 174.8006 25 R 4.7656 8.9820 119.0639 55.3536 33.2254 174.1632 26 Q 5.2780 9.4335 120.1171 52.7464 32.0660 174.4438 27 F 5.2132 7.7836 119.3625 56.1204 39.4094 171.6574 28 P 4.9598 0.0000 0.0000 63.0156 32.3421 175.4390 29 H 4.4918 9.0285 122.8710 55.1571 30.3533 174.4095 30 P 4.2553 0.0000 0.0000 65.0537 31.0626 176.5249 31 L 4.3755 8.0235 118.1340 55.9637 44.0101 176.3181 32 Y 4.5698 7.6638 113.9014 57.4705 38.5272 177.7679 33 G 4.1999 8.4896 112.1415 46.1606 0.0000 174.8485 34 K 4.0245 8.1237 119.1554 57.0878 33.5118 176.9418 35 V 4.3111 8.4083 123.4197 62.9888 32.0144 175.0363 36 I 4.5375 8.6374 120.9594 58.8383 40.6264 175.0297 37 K 4.2095 8.4545 126.0727 56.3155 33.5358 175.4324 38 R 4.6083 8.0575 119.9007 55.8605 34.1515 173.3519 39 S 5.2050 8.4397 118.3204 57.4663 66.8919 172.2599 40 K 4.3809 8.8029 117.7068 55.6742 35.8635 173.9309 41 K 5.0337 8.4533 124.7670 54.8923 34.2374 175.0942 42 Y 4.5166 9.0180 122.6834 56.2286 41.0524 175.3011 43 L 4.9832 8.6470 123.4272 53.5784 41.6474 175.6921 44 A 4.7112 8.7812 126.2822 51.2758 20.4916 175.8320 45 H 4.7744 9.0868 121.5878 56.3132 31.3261 174.0547 46 D 4.9433 9.5271 125.4493 51.3722 40.9443 173.6087 47 P 4.1890 0.0000 0.0000 65.0535 31.7710 177.3172 48 E 4.4454 8.1445 114.1638 55.4619 29.4812 175.7100 49 E 3.9923 8.1302 116.1983 57.2958 27.1303 176.0337 50 K 3.9481 8.4045 119.3179 57.7047 32.8473 175.6392 51 Y 4.7595 8.3544 116.4028 56.3425 40.3105 175.2187 52 K 4.6981 9.4220 123.6333 53.8813 34.7242 175.2736 53 L 4.1689 8.3866 122.3880 58.7975 41.4641 176.1151 54 G 3.8920 8.5463 115.2631 45.6660 0.0000 173.0005 55 D 4.6534 8.3635 120.8398 54.4812 42.4534 176.0612 56 V 4.4187 8.5967 122.2680 61.7375 32.7731 175.2368 57 V 4.6595 8.1006 121.5635 59.7684 34.9015 174.4470 58 E 5.0252 8.7847 121.0397 54.8653 32.0000 175.5007 59 I 4.8311 9.1162 125.2980 59.5008 40.2241 174.3647 60 I 4.9922 8.7906 126.1445 58.7257 40.9464 174.2632 61 E 3.0773 8.9982 130.7894 56.5793 29.9208 175.9194 62 S 4.7118 8.2959 121.9063 56.3172 67.7108 173.6782 63 R 3.9402 8.4822 121.1847 55.3522 30.3672 174.1220 64 P 4.3278 0.0000 0.0000 63.4946 31.8418 175.7584 65 I 4.2543 8.2033 122.7803 62.4319 38.9405 175.5421 66 S 4.5280 7.4120 111.5490 56.7307 65.5894 173.8308 67 K 3.9811 8.2431 121.4575 57.6356 32.4341 177.3791 68 R 4.1697 8.6975 124.4955 56.1777 30.3867 176.0762 69 K 4.7408 7.7897 117.6194 55.1404 32.9729 176.4144 70 R 4.6451 8.6416 120.4888 55.7005 33.4492 174.4792 71 F 5.2810 8.2968 117.0054 55.8970 43.8411 173.7092 72 R 4.9742 8.9492 119.6403 54.1159 34.0825 175.1583 73 V 3.8365 8.0111 122.7809 63.2483 31.3405 175.5223 74 L 4.3431 9.2249 131.9162 57.0703 42.1259 176.6311 75 R 4.7894 7.3917 112.9910 54.8792 32.5334 173.0373 76 L 4.4344 8.7756 123.0708 55.5027 42.4147 176.2194 77 V 4.3425 8.9940 125.7864 64.2662 33.5920 176.1174 78 E 4.6369 7.6633 117.4794 55.2854 32.2805 175.3127 79 S 4.8663 8.6356 119.6719 57.5719 63.8852 174.8656 80 G 3.6249 8.5079 106.2454 46.3378 0.0000 174.7121 81 R 5.1015 7.1310 127.0978 55.7576 30.7258 174.6697 82 M 4.3000 7.5508 125.3609 57.6281 32.0786 176.8868 83 D 4.4387 8.1689 120.0402 56.6603 39.0677 178.7897 84 L 4.0096 7.7812 119.7800 57.5473 41.7262 179.4050 85 V 3.6556 7.7300 117.6608 65.9702 31.4043 177.3489 86 E 3.9523 9.8870 118.1664 60.0419 29.3117 178.9603 87 K 3.7464 7.7837 117.0994 60.0054 32.1238 178.0682 88 Y 4.2220 8.0373 119.0313 61.2592 38.8194 178.8187 89 L 3.6288 8.1888 119.4531 57.8025 41.7064 179.7451 90 I 4.3673 7.7268 120.8783 63.9343 36.8355 178.1859 91 R 3.7195 7.7223 118.4137 59.4574 29.9620 178.1725 92 R 3.1045 7.3838 118.0015 59.3719 30.1092 178.2175 93 Q 3.9024 8.2600 118.0457 59.4522 28.4807 179.2522 94 N 4.4150 8.0879 116.3130 56.9536 38.4685 175.9923 95 Y 4.4211 8.2984 117.7670 60.8962 38.3922 175.9090 96 Q 4.3832 8.0326 129.6804 56.2142 27.6178 176.5372 97 S 5.3982 7.6938 125.7548 59.1386 64.0531 179.4286 98 L 4.6700 7.8888 124.6330 54.7658 39.7637 176.2568 99 S 4.3903 7.8598 109.7225 58.9669 65.0070 174.9527 100 K 4.2209 8.8231 121.8848 56.4862 33.1210 176.0042 101 R 4.3800 8.2546 115.1168 54.6229 33.0175 176.0170 102 G 4.2400 7.4505 106.2603 45.6416 0.0000 173.9668 103 G 4.7077 7.6784 108.8365 44.4449 0.0000 176.3765 104 K 4.6929 8.1957 128.4828 54.3723 34.7781 175.1058 105 A 4.1817 8.4921 120.3978 52.6110 18.1774 177.5877 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 P 0.00 4.36 0.00 2.05 2.07 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 K 8.68 3.97 0.00 1.69 1.71 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.47 7.81 4 K 9.63 3.98 0.00 1.91 1.83 0.00 1.49 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.55 1.51 7.81 5 V 8.41 4.95 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 0.92 0.00 0.00 0.98 0.00 0.00 6 L 9.31 4.86 0.00 1.06 1.15 -0.04 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.34 5.07 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 1.22 0.00 0.00 8 G 8.56 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 0.00 0.00 0.00 9 V 8.03 4.61 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 0.96 0.00 0.00 0.91 0.00 0.00 10 V 8.68 4.16 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 0.92 0.00 0.00 0.94 0.00 0.00 11 V 8.19 4.19 1.64 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 0.40 0.00 0.00 0.42 0.00 0.00 12 S 7.30 4.41 0.00 3.88 3.65 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 0.00 0.00 0.00 0.00 13 D 8.76 5.13 0.00 2.66 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 14 K 7.86 4.34 0.00 1.76 1.84 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.43 7.81 15 M 7.59 4.74 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 16 Q 8.44 4.38 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.30 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 17 K 9.12 4.89 0.00 2.09 2.00 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.57 1.39 7.81 18 T 7.46 5.25 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 19 V 8.98 4.71 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 0.96 0.00 0.00 20 T 8.78 4.79 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 1.13 0.00 0.00 21 V 8.94 4.50 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 0.88 0.00 0.00 0.83 0.00 0.00 22 L 8.98 4.71 0.00 1.47 1.41 0.89 0.74 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 23 V 8.93 4.47 2.28 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 0.93 0.00 0.00 0.78 0.00 0.00 24 E 8.66 5.29 0.00 1.99 1.79 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 2.19 2.39 0.00 25 R 8.98 4.77 0.00 1.96 2.03 0.00 2.89 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.91 0.00 26 Q 9.43 5.28 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.19 0.00 0.00 0.00 0.00 0.00 2.23 2.16 0.00 27 F 7.78 5.21 0.00 3.21 3.24 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 28 P 0.00 4.96 0.00 2.19 2.17 0.00 4.02 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 29 H 9.03 4.49 0.00 3.40 3.42 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.26 0.00 2.15 2.15 0.00 3.43 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 31 L 8.02 4.38 0.00 1.32 1.08 0.79 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.66 4.57 0.00 2.90 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 33 G 8.49 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 34 K 8.12 4.02 0.00 1.88 2.01 0.00 1.20 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.50 7.81 35 V 8.41 4.31 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 0.76 0.00 0.00 0.94 0.00 0.00 36 I 8.64 4.54 1.69 0.00 0.00 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 0.67 -0.19 0.96 0.00 0.00 37 K 8.45 4.21 0.00 1.73 1.70 0.00 1.80 0.00 0.00 2.13 0.00 0.00 2.74 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.40 7.81 38 R 8.06 4.61 0.00 1.91 1.86 0.00 3.34 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 1.61 1.60 0.00 39 S 8.44 5.21 0.00 3.97 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 40 K 8.80 4.38 0.00 1.77 1.64 0.00 1.50 0.00 0.00 1.49 0.00 0.00 2.22 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.46 1.09 7.81 41 K 8.45 5.03 0.00 1.56 1.60 0.00 1.66 0.00 0.00 1.49 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.15 1.34 7.81 42 Y 9.02 4.52 0.00 2.69 2.66 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 43 L 8.65 4.98 0.00 1.59 1.69 0.94 0.81 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 A 8.78 4.71 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 45 H 9.09 4.77 0.00 3.29 3.23 0.00 5.73 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.53 4.94 0.00 2.79 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 47 P 0.00 4.19 0.00 2.05 2.11 0.00 3.67 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.64 0.00 48 E 8.14 4.45 0.00 1.92 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 2.25 2.31 0.00 49 E 8.13 3.99 0.00 2.02 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 0.00 2.26 2.23 0.00 50 K 8.40 3.95 0.00 1.54 1.64 0.00 1.58 0.00 0.00 1.46 0.00 0.00 2.80 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.48 1.12 7.81 51 Y 8.35 4.76 0.00 2.97 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 52 K 9.42 4.70 0.00 1.77 1.71 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.32 7.81 53 L 8.39 4.17 0.00 1.60 1.65 1.03 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.55 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 0.00 0.00 0.00 55 D 8.36 4.65 0.00 2.79 2.71 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 0.00 0.00 0.00 0.00 56 V 8.60 4.42 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 1.00 0.00 0.00 0.96 0.00 0.00 57 V 8.10 4.66 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 0.65 0.00 0.00 0.73 0.00 0.00 58 E 8.78 5.03 0.00 1.85 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 2.19 2.23 0.00 59 I 9.12 4.83 1.47 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.98 0.73 0.00 0.00 60 I 8.79 4.99 1.89 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 1.13 2.02 0.95 0.00 0.00 61 E 9.00 3.08 0.00 1.95 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 0.00 2.02 1.78 0.00 62 S 8.30 4.71 0.00 3.62 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 63 R 8.48 3.94 0.00 1.73 1.80 0.00 3.26 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 64 P 0.00 4.33 0.00 2.05 2.01 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 65 I 8.20 4.25 1.83 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 1.29 0.73 0.74 0.00 0.00 66 S 7.41 4.53 0.00 3.94 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 67 K 8.24 3.98 0.00 1.81 1.73 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.44 7.81 68 R 8.70 4.17 0.00 1.99 2.11 0.00 3.32 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.72 0.00 69 K 7.79 4.74 0.00 1.97 1.76 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.68 1.42 7.81 70 R 8.64 4.65 0.00 1.84 1.68 0.00 3.14 0.00 0.00 3.38 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 71 F 8.30 5.28 0.00 2.92 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 72 R 8.95 4.97 0.00 1.74 1.81 0.00 3.17 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 73 V 8.01 3.84 1.79 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 -0.56 0.00 0.00 0.70 0.00 0.00 74 L 9.22 4.34 0.00 1.69 1.71 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.39 4.79 0.00 1.94 2.00 0.00 3.03 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 76 L 8.78 4.43 0.00 2.03 1.73 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.99 4.34 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 0.84 0.00 0.00 0.92 0.00 0.00 78 E 7.66 4.64 0.00 2.05 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 0.00 2.27 2.30 0.00 79 S 8.64 4.87 0.00 3.92 3.82 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 80 G 8.51 3.62 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 0.00 0.00 0.00 81 R 7.13 5.10 0.00 2.41 2.08 0.00 2.97 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.37 0.00 82 M 7.55 4.30 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.17 4.44 0.00 2.87 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 84 L 7.78 4.01 0.00 1.84 1.75 0.92 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.73 3.66 2.21 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 1.22 0.00 0.00 0.99 0.00 0.00 86 E 9.89 3.95 0.00 2.39 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 0.00 2.35 2.52 0.00 87 K 7.78 3.75 0.00 2.06 1.88 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.63 7.81 88 Y 8.04 4.22 0.00 2.96 3.24 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 89 L 8.19 3.63 0.00 1.82 1.63 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 90 I 7.73 4.37 1.96 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 1.51 1.09 0.87 0.00 0.00 91 R 7.72 3.72 0.00 1.80 1.76 0.00 3.11 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 92 R 7.38 3.10 0.00 1.20 1.66 0.00 2.98 0.00 0.00 3.05 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.37 0.00 93 Q 8.26 3.90 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.59 0.00 94 N 8.09 4.41 0.00 2.92 2.97 0.00 0.00 7.05 7.04 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 95 Y 8.30 4.42 0.00 3.16 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 96 Q 8.03 4.38 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.14 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 97 S 7.69 5.40 0.00 4.20 4.09 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 0.00 0.00 0.00 98 L 7.89 4.67 0.00 1.73 1.77 0.86 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.86 4.39 0.00 3.93 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 0.00 100 K 8.82 4.22 0.00 1.76 1.89 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.35 7.81 101 R 8.25 4.38 0.00 1.72 1.79 0.00 3.39 0.00 0.00 3.23 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 102 G 7.45 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 0.00 0.00 0.00 0.00 103 G 7.68 4.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.20 4.69 0.00 1.66 1.70 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.44 7.81 105 A 8.49 4.18 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