NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0734 8.0393 120.3112 61.6651 32.7130 174.3479 2 H 4.6669 8.6993 118.3567 53.2350 30.1285 171.8927 3 L 4.5112 8.1256 124.9961 53.4444 44.0351 178.4700 4 T 4.3113 8.6985 114.3865 60.4040 71.3866 174.1892 5 P 4.2092 0.0000 0.0000 65.6664 31.2543 179.2235 6 V 3.5553 7.6460 116.5520 66.0390 31.7059 177.7710 7 E 3.9144 7.8515 118.4629 59.2359 29.2708 179.5311 8 K 3.8640 8.1031 118.7148 59.5539 32.1899 179.6668 9 S 4.3386 8.2562 115.1363 60.4480 62.4296 176.3617 10 A 3.9655 8.0106 124.7350 55.2665 18.1237 180.0590 11 V 3.2796 7.5158 110.8879 64.4948 31.3904 179.0137 12 T 4.0291 7.9290 109.4609 64.5894 68.4530 176.7412 13 A 4.0325 8.0106 122.9479 54.8682 18.6641 179.0885 14 L 3.9732 7.7850 118.3090 58.0640 42.2637 178.9110 15 W 4.4456 8.8898 128.5468 60.4149 30.3949 177.7945 16 G 3.8441 8.0100 103.9593 46.4057 0.0000 174.0257 17 K 4.4531 8.0246 119.0880 56.1338 33.0595 176.5822 18 V 3.5279 7.3418 120.1961 62.1176 32.0238 175.7539 19 N 4.4903 8.1468 125.5104 52.1010 38.8125 175.2310 20 V 3.4729 8.0597 128.1345 66.1296 31.6193 176.9661 21 D 4.3484 8.1370 117.7602 57.6619 40.7315 178.3107 22 E 3.8515 8.2610 118.4995 59.7679 29.5191 179.8724 23 V 3.6067 7.9156 118.0337 65.5896 31.5960 178.5140 24 G 3.6370 8.4066 106.2402 47.8352 0.0000 176.0805 25 G 3.6054 8.0717 109.0064 47.0694 0.0000 175.4189 26 E 3.8653 8.2844 121.4175 59.0479 29.7566 178.8684 27 A 3.9292 8.2840 121.2417 55.0243 18.5501 179.4072 28 L 3.9852 7.8908 118.7894 58.1225 42.2771 179.4127 29 G 3.5774 8.0622 105.7450 47.9795 0.0000 175.9706 30 R 3.9271 7.9269 120.5821 58.6080 30.0057 178.9329 31 L 4.0677 7.8442 120.2295 58.2224 41.8414 179.1032 32 L 4.0932 7.7727 119.6964 56.7026 41.2419 179.5815 33 V 3.6132 7.1864 117.1884 65.6746 31.7452 177.9838 34 V 3.5285 7.8926 117.0127 64.2822 32.7257 175.5733 35 Y 3.7238 7.2952 116.3443 53.5472 37.9907 173.6879 36 P 4.4215 0.0000 0.0000 64.8267 31.2426 178.3145 37 W 4.3822 8.2127 115.5889 59.0713 27.6239 177.7062 38 T 4.2775 7.8898 110.6230 63.9111 68.2801 176.0904 39 Q 4.4227 8.3689 121.4516 57.8510 28.5048 177.9065 40 R 3.7351 7.4807 116.8728 58.4030 29.2487 177.6315 41 F 4.4059 7.0944 115.0948 56.9741 40.0258 175.5819 42 F 4.5585 7.7964 118.7446 56.7093 39.4365 177.3519 43 E 4.0783 8.2821 122.4449 59.4209 29.6575 179.8787 44 S 4.4045 8.0520 112.0559 60.6417 63.4224 175.3153 45 F 4.4251 8.2001 119.8965 59.2622 39.7084 175.7072 46 G 4.0803 7.5507 104.3618 43.7230 0.0000 174.9964 47 D 4.5221 8.6165 126.1637 53.5685 39.3807 176.3117 48 L 4.8680 8.2906 123.4198 54.5622 43.7249 177.9049 49 S 4.2832 8.5843 117.4491 61.1110 63.1191 175.1131 50 T 4.7316 7.4471 108.8550 58.6271 72.7588 172.7523 51 P 4.2057 0.0000 0.0000 66.0848 31.2435 178.7158 52 D 4.3126 8.0516 116.8524 57.2742 40.5688 178.5355 53 A 4.0156 7.6003 120.0415 54.8974 18.7737 179.7309 54 V 3.6805 7.9666 116.8089 66.6442 31.5408 178.3864 55 M 4.0593 8.2699 117.2490 57.7255 31.8886 177.5904 56 G 3.8308 7.5994 105.0605 45.4948 0.0000 173.8503 57 N 4.3948 7.8630 120.2221 52.7399 39.8514 173.5750 58 P 4.2151 0.0000 0.0000 65.9653 31.3688 178.7129 59 K 3.6460 8.1441 118.2928 58.8318 31.7549 179.4544 60 V 3.7052 7.5997 118.1160 65.8772 31.4770 178.1149 61 K 3.9024 7.7658 117.8027 59.3938 31.9260 179.0841 62 A 3.9542 7.8865 120.9643 55.6544 18.2388 179.2542 63 H 4.3709 8.4906 116.8047 59.1408 29.8380 177.7558 64 G 3.5483 8.3034 107.8676 47.5546 0.0000 175.5495 65 K 3.9253 8.2224 122.3066 59.2040 32.0791 178.8438 66 K 4.0356 7.9574 119.5177 59.2535 32.2188 179.1444 67 V 3.6368 7.9776 118.7871 65.9888 31.6250 177.6767 68 L 4.4130 8.3672 119.4262 57.0042 41.8407 178.9518 69 G 3.7012 8.0890 105.6947 48.1749 0.0000 175.7631 70 A 4.1938 7.8140 122.4678 54.5315 18.7000 179.2821 71 F 4.3609 8.3575 119.0518 61.6719 39.4130 177.1993 72 S 4.2192 8.6724 112.8197 61.7519 61.6961 175.8031 73 D 4.5534 8.2523 120.8979 56.6009 40.6076 178.6660 74 G 3.5692 8.0129 106.2377 46.9189 0.0000 175.4478 75 L 3.9103 7.1469 119.7506 56.4349 41.6685 178.1567 76 A 4.2664 7.2853 118.6155 52.7719 19.4201 176.7832 77 H 5.2369 7.7129 114.8136 53.7425 29.7638 175.7245 78 L 3.9355 8.1253 120.7877 57.5040 41.8874 178.8656 79 D 4.4915 7.9944 117.8601 55.6855 40.1519 175.3208 80 N 5.1631 8.5443 118.7666 51.2634 39.8438 174.2883 81 L 4.0592 8.1149 122.9630 57.0268 42.0247 178.3929 82 K 4.0147 8.1159 117.1941 59.6573 31.8048 179.0628 83 G 3.6938 8.2855 105.7054 48.1098 0.0000 175.8740 84 T 3.7003 7.5217 117.0805 65.4151 68.5648 175.8558 85 F 4.8288 8.0958 117.7879 57.0948 39.4856 177.6387 86 A 4.0318 7.5998 122.3522 55.8441 18.2192 180.8414 87 T 3.8699 7.8377 113.7251 66.7907 68.5396 176.8845 88 L 4.1599 7.9616 120.2511 57.3237 41.8123 179.3795 89 S 4.3140 8.0840 113.6834 61.4915 62.3425 175.9690 90 E 3.9134 8.1930 121.3448 59.1028 29.1805 178.9581 91 L 3.8943 8.0699 120.3626 58.7626 42.1335 178.8842 92 H 4.1300 8.5561 116.1230 59.1673 28.1427 176.9851 93 C 3.5630 7.7001 120.5630 62.1271 31.0766 175.3255 94 D 4.2986 8.1942 121.1997 56.4084 40.6338 177.5271 95 K 4.1773 7.6225 118.4642 58.1263 33.0552 177.2775 96 L 4.1366 7.7481 116.6807 55.2755 42.1829 176.4088 97 H 4.1558 7.2437 113.3305 56.6611 26.5776 175.0681 98 V 3.9409 7.9617 118.4585 61.0027 32.5997 174.7398 99 D 4.4028 8.7161 127.2388 53.5812 41.6972 174.9536 100 P 3.2376 0.0000 0.0000 65.1805 31.1929 177.9489 101 E 3.8526 7.9848 117.7467 59.3053 29.2842 178.5946 102 N 4.3122 8.0237 116.7277 56.0845 38.4927 177.3346 103 F 4.4713 7.4358 119.4301 60.4008 39.0681 177.9350 104 R 3.9361 7.8345 117.2907 59.2660 30.0165 178.7599 105 L 3.7804 7.8104 118.6318 57.7901 41.5443 179.4149 106 L 4.0783 8.2461 120.4363 57.9589 42.1067 179.1275 107 G 3.6938 8.1742 105.6781 48.1528 0.0000 175.4737 108 N 4.4827 8.1008 118.9027 55.7709 38.4862 177.8311 109 V 3.6405 7.8921 119.9052 65.7987 31.5466 177.7909 110 L 3.8822 8.3142 120.6184 58.1008 41.8792 179.1191 111 V 3.5503 7.7339 117.7524 66.3051 31.4838 177.8588 112 C 4.1470 7.9039 116.4208 62.7031 27.9064 176.3092 113 V 3.5288 7.7900 119.9906 65.9103 31.0175 178.1699 114 L 3.8189 7.9845 118.8673 57.4261 41.3170 179.3798 115 A 3.6548 7.3975 120.7561 55.2744 18.1227 179.1314 116 H 4.1210 7.9676 115.6521 59.5975 29.9498 176.7230 117 H 4.0106 7.9740 119.1212 58.8260 30.1894 176.6251 118 F 4.5526 8.4365 118.4945 56.6450 39.6514 177.1529 119 G 3.8551 9.1527 108.4893 46.2099 0.0000 177.5022 120 K 4.1624 8.8551 123.6537 58.7659 32.4612 177.6283 121 E 4.0947 8.0763 119.8383 58.3375 30.0060 176.9594 122 F 4.6110 8.0352 123.0140 57.0687 37.8430 175.3860 123 T 4.1813 7.3881 115.6662 60.2012 71.3437 173.5421 124 P 4.1638 0.0000 0.0000 65.3327 31.3693 177.2015 125 P 4.3074 0.0000 0.0000 65.8254 31.1996 178.6720 126 V 3.5334 7.3277 116.6954 65.5342 31.3131 177.8069 127 Q 3.5189 7.9130 119.4668 59.0516 28.4095 177.8774 128 A 3.9709 8.3887 121.9057 55.3633 18.2725 179.5467 129 A 3.9030 7.9576 118.9386 55.5677 18.4352 179.5551 130 Y 3.9727 8.2949 115.3087 61.1967 38.0345 178.6898 131 Q 4.1787 8.6774 119.5794 58.8410 28.6809 179.0065 132 K 3.9909 7.8069 118.8883 59.3404 32.0050 179.6021 133 V 3.4802 7.5767 118.1302 66.0499 31.4263 178.2744 134 V 3.7225 8.3793 118.2308 65.8975 31.3112 177.9195 135 A 4.1208 8.1294 120.4961 54.9959 18.2488 179.7721 136 G 3.5548 8.3290 104.5958 47.9837 0.0000 176.0897 137 V 3.3475 8.0947 120.7260 65.5276 31.5175 178.0215 138 A 3.9232 7.7908 120.2220 55.1962 18.2137 179.3999 139 N 4.2949 8.3830 114.8742 56.3422 38.3863 177.4922 140 A 4.0256 7.9569 121.3666 55.2904 18.5816 179.4882 141 L 3.9813 7.8998 116.4041 57.3745 41.8642 178.9671 142 A 4.0688 8.1660 120.2569 53.7996 18.3938 178.6668 143 H 4.0159 7.8305 117.3276 59.5311 29.8085 175.8954 144 K 4.4391 8.3453 115.2982 56.4543 31.9725 176.6469 145 Y 4.2355 8.0890 117.9198 58.4355 38.4137 175.7007 146 H 4.4745 8.3328 117.4678 56.1439 28.3747 173.2462 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 V 8.04 4.07 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 0.91 0.00 0.00 0.94 0.00 0.00 2 H 8.70 4.67 0.00 3.28 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.13 4.51 0.00 1.55 1.54 0.84 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 4 T 8.70 4.31 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 1.22 0.00 0.00 5 P 0.00 4.21 0.00 2.16 2.13 0.00 3.59 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 2.11 2.14 0.00 6 V 7.65 3.56 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 1.04 0.00 0.00 0.91 0.00 0.00 7 E 7.85 3.91 0.00 2.14 1.89 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 2.27 2.30 0.00 8 K 8.10 3.86 0.00 1.89 1.79 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.38 1.60 7.81 9 S 8.26 4.34 0.00 4.07 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 10 A 8.01 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.52 3.28 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 0.38 0.00 0.00 0.63 0.00 0.00 12 T 7.93 4.03 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 1.22 0.00 0.00 13 A 8.01 4.03 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 14 L 7.79 3.97 0.00 1.98 2.02 0.82 -0.29 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 15 W 8.89 4.45 0.00 3.88 3.34 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 16 G 8.01 3.84 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 0.00 0.00 0.00 17 K 8.02 4.45 0.00 2.08 2.08 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.55 7.81 18 V 7.34 3.53 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 -0.17 0.00 0.00 0.76 0.00 0.00 19 N 8.15 4.49 0.00 2.68 2.55 0.00 0.00 6.83 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 20 V 8.06 3.47 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 1.27 0.00 0.00 0.96 0.00 0.00 21 D 8.14 4.35 0.00 2.86 2.68 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 22 E 8.26 3.85 0.00 2.04 1.89 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 2.27 2.39 0.00 23 V 7.92 3.61 1.89 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 1.01 0.00 0.00 0.62 0.00 0.00 24 G 8.41 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 25 G 8.07 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 26 E 8.28 3.87 0.00 2.19 1.88 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 2.25 2.40 0.00 27 A 8.28 3.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 3.99 0.00 1.79 1.64 0.87 0.96 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 29 G 8.06 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.93 3.93 0.00 1.85 1.93 0.00 3.07 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 31 L 7.84 4.07 0.00 1.91 1.87 1.01 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.77 4.09 0.00 1.96 1.68 0.88 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.19 3.61 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 0.71 0.00 0.00 0.96 0.00 0.00 34 V 7.89 3.53 1.52 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 0.06 0.00 0.00 0.78 0.00 0.00 35 Y 7.30 3.72 0.00 2.61 1.43 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 0.00 0.00 0.00 0.00 36 P 0.00 4.42 0.00 2.34 2.34 0.00 3.57 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 2.36 2.00 0.00 37 W 8.21 4.38 0.00 3.53 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.89 4.28 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 1.11 0.00 0.00 39 Q 8.37 4.42 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 40 R 7.48 3.74 0.00 1.56 1.94 0.00 3.03 0.00 0.00 2.77 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.50 0.00 41 F 7.09 4.41 0.00 1.69 2.33 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 42 F 7.80 4.56 0.00 2.67 1.48 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.28 4.08 0.00 2.02 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 2.38 2.23 0.00 44 S 8.05 4.40 0.00 4.11 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 45 F 8.20 4.43 0.00 3.28 3.21 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 46 G 7.55 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 47 D 8.62 4.52 0.00 2.80 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 48 L 8.29 4.87 0.00 1.64 1.67 1.06 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.58 4.28 0.00 3.87 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 50 T 7.45 4.73 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 1.21 0.00 0.00 51 P 0.00 4.21 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.05 4.31 0.00 2.67 2.70 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 53 A 7.60 4.02 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.97 3.68 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 1.07 0.00 0.00 1.03 0.00 0.00 55 M 8.27 4.06 0.00 2.00 2.09 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 2.60 2.82 0.00 56 G 7.60 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 57 N 7.86 4.39 0.00 3.06 2.82 0.00 0.00 6.84 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 58 P 0.00 4.22 0.00 2.22 2.24 0.00 3.70 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 1.99 2.01 0.00 59 K 8.14 3.65 0.00 1.34 0.74 0.00 1.71 0.00 0.00 1.35 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.13 1.20 7.81 60 V 7.60 3.71 2.26 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 1.06 0.00 0.00 1.10 0.00 0.00 61 K 7.77 3.90 0.00 1.90 1.80 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.58 7.81 62 A 7.89 3.95 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 63 H 8.49 4.37 0.00 3.56 3.49 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.30 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.22 3.93 0.00 1.83 2.03 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.65 7.81 66 K 7.96 4.04 0.00 1.90 1.97 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.50 7.81 67 V 7.98 3.64 2.23 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 0.98 0.00 0.00 0.87 0.00 0.00 68 L 8.37 4.41 0.00 1.94 1.76 0.65 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.09 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 70 A 7.81 4.19 1.47 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 71 F 8.36 4.36 0.00 3.14 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 72 S 8.67 4.22 0.00 4.66 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 0.00 73 D 8.25 4.55 0.00 2.82 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 0.00 74 G 8.01 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.15 3.91 0.00 1.50 1.52 -0.06 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.29 4.27 1.16 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 77 H 7.71 5.24 0.00 3.04 3.15 0.00 5.65 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.13 3.94 0.00 1.55 1.66 0.78 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.99 4.49 0.00 2.80 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 80 N 8.54 5.16 0.00 2.69 2.63 0.00 0.00 7.06 7.33 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 81 L 8.11 4.06 0.00 1.76 1.84 0.89 1.01 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 82 K 8.12 4.01 0.00 1.67 1.77 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.16 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.26 1.47 7.81 83 G 8.29 3.69 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 0.00 0.00 0.00 0.00 84 T 7.52 3.70 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 0.48 0.00 0.00 85 F 8.10 4.83 0.00 2.99 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 86 A 7.60 4.03 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 87 T 7.84 3.87 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 1.22 0.00 0.00 88 L 7.96 4.16 0.00 1.85 1.84 1.13 0.93 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 89 S 8.08 4.31 0.00 4.17 4.18 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 90 E 8.19 3.91 0.00 2.24 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 2.32 2.45 0.00 91 L 8.07 3.89 0.00 1.86 1.82 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.56 4.13 0.00 3.54 3.74 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.70 3.56 0.00 1.23 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.19 4.30 0.00 2.72 2.67 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 95 K 7.62 4.18 0.00 1.66 1.93 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.42 7.81 96 L 7.75 4.14 0.00 1.76 1.61 0.70 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.24 4.16 0.00 3.40 3.43 0.00 5.84 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.96 3.94 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 0.12 0.00 0.00 0.48 0.00 0.00 99 D 8.72 4.40 0.00 2.86 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 0.00 100 P 0.00 3.24 0.00 1.92 1.89 0.00 3.38 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 1.29 0.83 0.00 101 E 7.98 3.85 0.00 2.10 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 2.39 0.00 102 N 8.02 4.31 0.00 2.45 2.74 0.00 0.00 6.90 8.66 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 0.00 103 F 7.44 4.47 0.00 3.12 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 0.00 104 R 7.83 3.94 0.00 2.05 1.94 0.00 3.20 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 105 L 7.81 3.78 0.00 1.67 1.27 0.65 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.25 4.08 0.00 1.80 1.87 0.92 1.20 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 G 8.17 3.69 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 0.00 0.00 0.00 0.00 108 N 8.10 4.48 0.00 2.82 2.95 0.00 0.00 6.73 6.96 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 0.00 109 V 7.89 3.64 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 1.04 0.00 0.00 1.12 0.00 0.00 110 L 8.31 3.88 0.00 1.76 1.79 0.90 0.21 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 0.00 111 V 7.73 3.55 2.33 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 1.34 0.00 0.00 1.14 0.00 0.00 112 C 7.90 4.15 0.00 3.10 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 0.00 113 V 7.79 3.53 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 0.98 0.00 0.00 0.99 0.00 0.00 114 L 7.98 3.82 0.00 1.08 1.12 0.64 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.40 3.65 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 0.00 116 H 7.97 4.12 0.00 3.18 3.43 0.00 5.78 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 0.00 117 H 7.97 4.01 0.00 2.93 3.09 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.44 4.55 0.00 3.28 3.09 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 0.00 119 G 9.15 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 0.00 120 K 8.86 4.16 0.00 1.92 2.00 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.47 7.81 121 E 8.08 4.09 0.00 2.10 2.23 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 2.28 2.26 0.00 122 F 8.04 4.61 0.00 3.07 3.18 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 0.00 123 T 7.39 4.18 4.21 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 1.27 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.13 0.00 3.57 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 125 P 0.00 4.31 0.00 2.22 2.27 0.00 3.58 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 126 V 7.33 3.53 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 1.13 0.00 0.00 0.89 0.00 0.00 127 Q 7.91 3.52 0.00 1.60 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 128 A 8.39 3.97 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 0.00 129 A 7.96 3.90 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 0.00 130 Y 8.29 3.97 0.00 3.32 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 0.00 131 Q 8.68 4.18 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 132 K 7.81 3.99 0.00 1.99 1.81 0.00 1.71 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.42 7.81 133 V 7.58 3.48 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 0.91 0.00 0.00 0.72 0.00 0.00 134 V 8.38 3.72 2.45 0.00 0.00 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 1.12 0.00 0.00 135 A 8.13 4.12 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.33 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.09 3.35 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 0.54 0.00 0.00 0.75 0.00 0.00 138 A 7.79 3.92 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 0.00 139 N 8.38 4.29 0.00 2.94 2.89 0.00 0.00 6.91 7.36 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 0.00 140 A 7.96 4.03 1.47 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 0.00 141 L 7.90 3.98 0.00 1.39 1.16 0.66 0.12 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 0.00 142 A 8.17 4.07 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.83 4.02 0.00 3.37 3.60 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.35 4.44 0.00 1.84 1.85 0.00 1.77 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.55 1.75 7.81 145 Y 8.09 4.24 0.00 3.04 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 0.00 146 H 8.33 4.47 0.00 3.21 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00