NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 M 4.3866 8.1514 120.3594 54.8444 33.0808 174.4225 18 G 3.5527 7.9200 107.3841 47.1117 0.0000 173.6614 19 L 3.9693 8.1934 121.1144 57.3972 42.9440 177.3528 20 E 3.8585 8.1883 118.5864 59.5795 29.6850 177.5625 21 D 4.3466 9.0281 119.8200 56.9282 41.1457 178.5025 22 K 3.8323 8.2503 118.2580 59.7448 32.1606 179.3237 23 V 3.5399 7.6980 118.1900 66.0605 31.0978 178.1599 24 S 3.9383 8.1477 114.0820 61.4029 62.6642 176.6196 25 K 4.8746 8.5487 123.7621 58.6666 31.7518 178.8340 26 Q 3.9612 8.3694 120.2987 59.4106 28.9400 178.5690 27 L 4.0763 8.2669 120.0578 58.1106 41.6357 179.5379 28 E 4.0588 8.7051 119.0069 59.3324 29.1643 179.3841 29 S 4.1438 8.5974 113.8377 61.1768 62.9557 175.8705 30 K 4.4205 7.7988 118.6374 55.2250 32.0164 177.0630 31 G 3.9468 8.2198 107.2601 46.2728 0.0000 173.9838 32 I 3.8130 7.8404 120.8917 60.5643 37.4237 175.7258 33 K 4.0764 8.6245 127.3635 55.1230 31.9198 175.1888 34 F 5.0964 7.7021 120.7120 54.9279 40.7704 173.8710 35 E 4.7325 9.0237 119.6301 54.8935 31.0862 175.8158 36 Y 4.6191 8.8633 125.5458 56.8584 37.9361 174.3570 37 E 3.6812 8.4061 128.6703 57.1112 27.1076 176.2517 38 E 3.8183 8.4742 120.7823 57.7824 30.1520 176.4084 39 W 4.9136 7.9263 116.1082 54.6009 32.2217 174.5964 40 K 4.5802 8.6833 120.3738 54.6957 33.5638 176.0572 41 V 4.2609 8.2393 122.7744 60.6561 32.2835 173.7227 42 P 4.6399 0.0000 0.0000 62.6482 32.0432 175.1710 43 Y 4.8549 7.8769 118.2662 56.0493 40.4405 173.7023 44 S 4.4568 8.4787 115.4564 56.3295 65.1188 173.1662 45 N 4.6331 8.4223 122.7870 52.3028 38.7717 174.6419 46 N 4.5797 8.6626 124.4174 52.5398 36.4935 174.1712 47 Q 4.3195 8.2946 123.3176 55.1162 30.0648 176.0601 48 Q 4.4293 8.5491 120.9772 54.3510 29.4430 174.5599 49 N 4.8475 8.3855 121.5037 52.3051 40.3443 174.4521 50 Y 4.3413 8.3661 121.3259 56.3227 39.0420 175.5419 51 S 4.6749 8.2823 120.6756 57.2175 64.5512 174.0656 52 S 4.7378 8.0726 115.5140 57.0505 65.3479 172.8054 53 H 4.9446 8.4173 118.2933 54.9748 32.8769 172.2409 54 T 4.7359 8.3187 109.4828 60.0751 71.1068 172.7978 55 Y 4.7141 8.4154 122.8234 56.2078 41.0291 175.0200 56 T 4.1762 7.8968 124.1853 60.7904 68.8699 172.4151 57 P 4.8946 0.0000 0.0000 61.8662 32.1922 176.9458 58 D 4.1868 8.8301 121.8141 56.8142 41.0682 176.9874 59 F 4.8747 8.5059 116.4377 55.3694 42.7366 173.7865 60 L 4.6820 8.3951 124.5563 52.9624 43.5386 176.2842 61 L 4.2880 8.4832 127.0483 53.6706 42.2323 176.8334 62 P 4.3719 0.0000 0.0000 64.9669 31.5067 177.0368 63 N 4.5525 7.9304 114.4031 52.4821 37.9546 176.2679 64 G 3.9400 8.1575 107.3936 45.0716 0.0000 173.9208 65 I 3.9905 8.3446 122.4405 61.0730 38.3820 175.0069 66 F 5.0797 9.3922 126.1907 56.1808 41.1210 175.1047 67 V 5.0862 9.1398 122.3317 61.1245 35.3197 173.6205 68 E 5.1237 9.4002 128.3955 54.5300 32.1251 175.1850 69 T 4.7019 9.2456 118.0581 61.7030 70.6338 174.7520 70 K 3.7430 8.5605 124.2720 56.2454 34.7723 175.5586 71 G 3.9056 9.1721 119.5048 45.7117 0.0000 171.8636 72 L 4.6053 7.7601 121.5810 52.5438 43.6733 176.0414 73 W 4.7827 9.4972 135.0000 55.6416 31.5068 175.3793 74 E 4.2521 8.3884 125.9087 55.2646 30.8248 177.8455 75 S 3.7331 8.3709 112.8883 61.6850 62.3900 175.2654 76 D 4.2364 7.9640 121.0840 57.5655 40.5184 177.9509 77 D 4.3437 8.0370 117.6913 57.7809 41.0289 178.6255 78 R 3.2206 6.9260 117.5201 58.8948 29.8623 178.8609 79 K 3.7863 7.7508 118.0107 59.5272 32.2697 179.0015 80 K 3.7351 8.2986 119.8254 60.0114 31.9960 178.1892 81 H 3.7983 8.3634 118.4319 59.1723 29.5293 177.1100 82 L 4.1344 7.9820 120.8750 57.2890 41.4912 179.2901 83 L 4.0029 8.1129 119.2967 57.9206 41.5313 179.4817 84 I 3.7315 7.5007 119.2895 64.5449 36.7757 178.6194 85 R 3.9404 7.5538 117.5743 59.2292 29.9239 178.8193 86 E 4.1231 7.6981 117.4588 59.6418 29.7784 179.1797 87 Q 4.2070 8.4195 116.1609 57.7096 29.9405 176.5798 88 H 5.2134 8.6784 116.9315 52.4878 29.7693 172.0396 89 P 4.3059 0.0000 0.0000 65.4196 32.0180 178.6077 90 E 4.0564 8.2824 116.8077 58.8198 29.5878 177.0693 91 L 4.0897 7.4345 118.9828 54.3639 42.3062 176.1014 92 D 4.7410 8.7493 123.4943 53.0867 41.8905 174.1396 93 I 5.1392 8.2288 126.0873 59.4753 39.3912 175.4261 94 R 4.9094 9.2055 125.6475 54.4533 34.2246 174.5351 95 I 4.8109 8.2935 121.9402 59.7012 40.2371 175.0774 96 V 4.8252 8.2334 124.8404 61.4316 34.0193 174.6028 97 F 5.8486 9.4532 127.2211 55.6909 40.5116 177.5376 98 S 4.3552 8.9160 117.0948 61.6539 64.1693 174.4640 99 S 4.5594 8.0135 114.9023 57.4582 63.7011 174.5243 100 S 3.9700 9.9099 124.1480 60.0355 63.1751 175.8793 101 R 4.1561 7.3487 117.8682 57.1922 30.2175 176.8670 102 T 3.8772 7.1292 116.3016 62.9059 69.0416 174.2336 103 K 4.6683 7.9032 123.9785 55.4477 33.2655 177.4049 104 L 4.2009 8.2535 122.3090 57.7652 41.9076 177.3029 105 Y 4.7089 7.4687 113.6688 55.5726 42.0106 174.0281 106 K 3.9434 8.7367 123.1018 58.3222 32.4430 177.3869 107 G 4.0180 8.9543 114.0604 45.5794 0.0000 173.6331 108 S 4.2210 7.9142 115.4287 57.7425 62.7258 172.4731 109 P 4.4067 0.0000 0.0000 65.7037 31.8098 177.2461 110 T 4.2323 7.9367 116.6218 63.2682 69.1642 173.4563 111 S 5.1661 8.8848 120.8368 56.4880 66.9342 174.2738 112 Y 4.5941 8.7915 120.2119 61.9201 37.5481 179.4141 113 G 2.9079 7.9140 105.6899 47.8450 0.0000 175.1330 114 E 4.0092 8.0406 120.7364 59.0227 29.6320 179.1496 115 F 4.0512 8.8854 120.7965 61.8138 39.4402 177.0778 116 C 4.4168 8.6882 116.5265 62.6527 27.9643 175.8338 117 E 4.0239 8.5894 121.6162 59.2128 29.1079 178.7933 118 K 3.9908 8.4784 118.4872 58.6482 32.2017 176.7969 119 H 4.6217 7.5120 113.3489 54.9168 29.3547 174.0446 120 G 3.7791 7.9188 106.9193 46.7449 0.0000 174.2672 121 I 4.3540 8.4029 122.5814 59.0003 37.3925 176.1571 122 K 4.5551 8.5281 126.1488 56.8232 33.1813 176.4633 123 F 6.2778 8.6164 117.4121 57.1008 41.5450 171.8151 124 A 4.2674 8.6172 118.7234 51.9586 22.2947 174.4623 125 D 5.3555 8.4600 117.8582 54.0331 42.9592 177.4029 126 K 4.1096 9.6268 127.5207 57.6707 31.6776 175.8753 127 L 4.6379 7.1181 113.8272 52.5924 45.6632 175.8936 128 I 3.4049 8.0123 121.6544 60.4298 37.3509 174.6633 129 P 3.8360 0.0000 0.0000 62.7724 31.8008 177.4066 130 A 4.0085 8.5414 124.4076 55.1368 17.9792 179.5199 131 E 3.9788 8.0054 116.2499 59.2882 29.7480 179.0067 132 W 5.4877 8.0704 120.2567 59.8232 29.0308 178.5945 133 I 3.7314 8.0088 117.6834 64.0886 36.5987 177.6564 134 K 4.2604 7.6840 116.8311 56.3879 32.8014 177.1887 135 E 4.1486 7.8840 120.6279 55.0930 30.0493 174.6550 136 P 4.4326 0.0000 0.0000 62.6194 31.7094 175.9357 137 K 4.1091 8.6843 123.6397 57.1864 32.4605 175.5365 138 K 4.7829 9.0772 124.8986 54.7744 35.6845 175.9825 139 E 4.2299 8.8355 120.9415 56.5904 30.4389 176.5404 140 V 4.2109 7.9220 121.1384 60.4294 34.4490 175.0953 141 P 4.5773 0.0000 0.0000 61.4798 29.7351 176.6201 142 F 4.2479 7.7639 123.2485 61.4352 39.7555 177.7653 143 D 4.4380 8.3857 119.4971 57.6457 40.6049 178.2593 144 R 4.0599 7.6680 115.9198 58.0736 30.2281 176.9468 145 L 4.6605 7.5357 117.4170 53.0336 43.5192 175.6416 146 K 4.6674 8.3299 119.4413 54.6565 34.9814 175.2533 147 R 4.6872 8.2182 116.4294 54.1700 32.2169 176.0925 148 K 4.1533 8.4075 115.9066 57.0412 32.9123 176.4218 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 17 M 8.15 4.39 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 18 G 7.92 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 19 L 8.19 3.97 0.00 1.76 1.69 0.92 0.77 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 20 E 8.19 3.86 0.00 2.11 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 0.00 2.55 2.45 0.00 21 D 9.03 4.35 0.00 3.00 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 22 K 8.25 3.83 0.00 2.02 1.88 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.68 7.81 23 V 7.70 3.54 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 1.03 0.00 0.00 0.98 0.00 0.00 24 S 8.15 3.94 0.00 4.11 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 25 K 8.55 4.87 0.00 1.93 1.91 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.46 1.43 7.81 26 Q 8.37 3.96 0.00 2.08 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 27 L 8.27 4.08 0.00 2.09 2.07 0.42 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.71 4.06 0.00 2.19 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 0.00 2.33 2.63 0.00 29 S 8.60 4.14 0.00 3.98 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 30 K 7.80 4.42 0.00 1.77 1.90 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.46 7.81 31 G 8.22 3.95 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 0.00 0.00 0.00 32 I 7.84 3.81 2.11 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 1.34 0.91 1.02 0.00 0.00 33 K 8.62 4.08 0.00 1.66 1.72 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.28 7.81 34 F 7.70 5.10 0.00 3.15 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 35 E 9.02 4.73 0.00 2.22 2.13 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 2.38 2.44 0.00 36 Y 8.86 4.62 0.00 3.38 3.11 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 37 E 8.41 3.68 0.00 1.80 1.76 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 1.66 1.47 0.00 38 E 8.47 3.82 0.00 1.81 1.86 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 2.07 1.47 0.00 39 W 7.93 4.91 0.00 3.29 3.16 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 40 K 8.68 4.58 0.00 1.80 1.78 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.41 7.81 41 V 8.24 4.26 2.13 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 0.87 0.00 0.00 0.97 0.00 0.00 42 P 0.00 4.64 0.00 2.12 1.98 0.00 3.83 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 43 Y 7.88 4.85 0.00 3.05 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 44 S 8.48 4.46 0.00 3.95 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 45 N 8.42 4.63 0.00 2.71 2.78 0.00 0.00 7.12 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 46 N 8.66 4.58 0.00 2.89 2.89 0.00 0.00 6.29 7.39 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 47 Q 8.29 4.32 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 48 Q 8.55 4.43 0.00 2.16 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 49 N 8.39 4.85 0.00 2.68 2.67 0.00 0.00 7.02 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 50 Y 8.37 4.34 0.00 2.90 2.89 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 51 S 8.28 4.67 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 52 S 8.07 4.74 0.00 3.91 3.79 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 53 H 8.42 4.94 0.00 3.14 3.24 0.00 5.64 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.32 4.74 4.27 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 0.00 0.00 0.00 1.24 0.00 0.00 55 Y 8.42 4.71 0.00 2.73 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 56 T 7.90 4.18 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 1.10 0.00 0.00 57 P 0.00 4.89 0.00 2.26 2.08 0.00 3.53 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 58 D 8.83 4.19 0.00 2.75 1.85 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 59 F 8.51 4.87 0.00 3.08 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 60 L 8.40 4.68 0.00 1.29 1.48 -0.06 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.48 4.29 0.00 1.85 1.55 0.99 1.10 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 62 P 0.00 4.37 0.00 2.03 2.12 0.00 3.65 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 2.02 2.08 0.00 63 N 7.93 4.55 0.00 2.92 3.04 0.00 0.00 6.45 7.30 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 64 G 8.16 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 0.00 0.00 0.00 65 I 8.34 3.99 1.92 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.60 0.74 0.00 0.00 66 F 9.39 5.08 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 67 V 9.14 5.09 2.31 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 1.25 0.00 0.00 1.15 0.00 0.00 68 E 9.40 5.12 0.00 2.15 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 2.39 2.27 0.00 69 T 9.25 4.70 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 1.50 0.00 0.00 70 K 8.56 3.74 0.00 1.49 0.96 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.69 1.31 7.81 71 G 9.17 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 0.00 0.00 0.00 72 L 7.76 4.61 0.00 1.70 1.68 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 73 W 9.50 4.78 0.00 2.32 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 0.00 0.00 0.00 0.00 74 E 8.39 4.25 0.00 1.96 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 2.40 2.23 0.00 75 S 8.37 3.73 0.00 3.87 3.79 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 76 D 7.96 4.24 0.00 2.66 2.65 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 77 D 8.04 4.34 0.00 2.69 2.48 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 78 R 6.93 3.22 0.00 1.41 1.24 0.00 2.21 0.00 0.00 2.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 79 K 7.75 3.79 0.00 1.86 1.81 0.00 1.62 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.39 7.81 80 K 8.30 3.74 0.00 1.80 1.88 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.20 1.38 7.81 81 H 8.36 3.80 0.00 3.51 3.53 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.98 4.13 0.00 1.94 1.70 0.89 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.11 4.00 0.00 1.78 1.70 0.88 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.50 3.73 1.82 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.74 0.87 0.00 0.00 85 R 7.55 3.94 0.00 1.96 2.03 0.00 3.29 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.00 0.00 86 E 7.70 4.12 0.00 2.10 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 2.47 0.00 87 Q 8.42 4.21 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.23 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 88 H 8.68 5.21 0.00 3.24 3.10 0.00 5.63 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.31 0.00 2.18 2.19 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 90 E 8.28 4.06 0.00 2.13 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 0.00 2.36 2.28 0.00 91 L 7.43 4.09 0.00 1.60 1.51 0.56 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.75 4.74 0.00 2.73 2.61 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 93 I 8.23 5.14 1.92 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.74 1.08 0.00 0.00 94 R 9.21 4.91 0.00 1.23 1.53 0.00 2.21 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.35 0.00 95 I 8.29 4.81 1.43 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.89 -0.62 0.00 0.00 96 V 8.23 4.83 2.11 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 0.97 0.00 0.00 1.07 0.00 0.00 97 F 9.45 5.85 0.00 3.09 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 98 S 8.92 4.36 0.00 3.89 3.98 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 99 S 8.01 4.56 0.00 3.82 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 0.00 100 S 9.91 3.97 0.00 3.86 4.29 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 0.00 101 R 7.35 4.16 0.00 1.82 1.97 0.00 3.16 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 102 T 7.13 3.88 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 0.76 0.00 0.00 103 K 7.90 4.67 0.00 1.67 1.80 0.00 1.98 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.33 1.38 7.81 104 L 8.25 4.20 0.00 1.75 1.57 1.02 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 105 Y 7.47 4.71 0.00 3.05 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 0.00 106 K 8.74 3.94 0.00 1.75 1.81 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.48 7.81 107 G 8.95 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 0.00 0.00 0.00 108 S 7.91 4.22 0.00 3.97 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 0.00 109 P 0.00 4.41 0.00 2.24 2.18 0.00 3.86 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 110 T 7.94 4.23 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 1.35 0.00 0.00 111 S 8.88 5.17 0.00 4.13 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 0.00 112 Y 8.79 4.59 0.00 2.53 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 0.00 0.00 0.00 113 G 7.91 2.91 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 0.00 0.00 0.00 114 E 8.04 4.01 0.00 2.36 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 0.00 2.37 2.35 0.00 115 F 8.89 4.05 0.00 3.21 3.48 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 0.00 116 C 8.69 4.42 0.00 2.75 3.29 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 0.00 117 E 8.59 4.02 0.00 2.36 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 2.42 2.45 0.00 118 K 8.48 3.99 0.00 1.74 1.72 0.00 1.72 0.00 0.00 1.44 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.18 1.36 7.81 119 H 7.51 4.62 0.00 3.00 3.21 0.00 5.98 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 G 7.92 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.40 4.35 2.17 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.77 1.05 0.00 0.00 122 K 8.53 4.56 0.00 1.62 1.79 0.00 1.47 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.47 7.81 123 F 8.62 6.28 0.00 3.59 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 0.00 124 A 8.62 4.27 0.74 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 0.00 0.00 125 D 8.46 5.36 0.00 2.55 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 0.00 126 K 9.63 4.11 0.00 1.82 1.91 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.41 7.81 127 L 7.12 4.64 0.00 1.45 1.37 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 128 I 8.01 3.40 1.77 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.33 1.09 0.00 0.00 129 P 0.00 3.84 0.00 0.95 1.47 0.00 2.20 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.38 0.00 130 A 8.54 4.01 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.01 3.98 0.00 1.96 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 2.27 2.33 0.00 132 W 8.07 5.49 0.00 3.58 3.17 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 0.00 133 I 8.01 3.73 2.02 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 1.69 0.70 0.92 0.00 0.00 134 K 7.68 4.26 0.00 1.97 1.87 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.71 7.81 135 E 7.88 4.15 0.00 2.11 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 0.00 2.37 2.65 0.00 136 P 0.00 4.43 0.00 2.17 2.08 0.00 3.80 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 137 K 8.68 4.11 0.00 1.79 1.78 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.47 7.81 138 K 9.08 4.78 0.00 1.68 1.69 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.42 7.81 139 E 8.84 4.23 0.00 1.86 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 2.32 2.26 0.00 140 V 7.92 4.21 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 0.45 0.00 0.00 0.78 0.00 0.00 141 P 0.00 4.58 0.00 2.23 2.16 0.00 3.63 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 142 F 7.76 4.25 0.00 3.27 3.19 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 0.00 0.00 0.00 0.00 143 D 8.39 4.44 0.00 2.70 2.78 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 0.00 0.00 0.00 144 R 7.67 4.06 0.00 1.86 2.04 0.00 3.33 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 145 L 7.54 4.66 0.00 1.93 1.66 0.97 0.44 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 0.00 146 K 8.33 4.67 0.00 1.72 1.72 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.40 7.81 147 R 8.22 4.69 0.00 1.88 1.93 0.00 3.02 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 148 K 8.41 4.15 0.00 1.85 1.81 0.00 1.48 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.47 7.81