NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4695 8.1633 120.6125 55.4273 33.7893 173.4452 2 K 4.8964 8.4100 126.4485 54.8420 34.1168 174.2179 3 I 4.8449 8.7375 126.3472 59.4332 40.3274 174.0007 4 L 4.5316 8.4629 129.5171 53.7274 43.6355 175.1481 5 V 4.7510 8.6284 127.4063 61.6029 33.2935 174.1963 6 I 5.0116 8.8939 130.1227 59.8211 39.5606 174.7766 7 Q 4.7885 9.3835 126.6413 54.1542 31.2227 176.5594 8 G 4.2257 8.8882 115.4755 43.7259 0.0000 170.8067 9 P 4.3862 0.0000 0.0000 64.3624 31.4928 177.1822 10 N 4.4547 9.2118 117.0792 53.6817 38.0795 176.6197 11 L 3.9111 7.3480 118.3998 57.1702 41.8011 178.7648 12 N 4.4070 7.9555 114.6690 55.0667 37.3492 175.4106 13 M 4.3033 7.9515 118.3378 55.2040 32.5265 176.0782 14 L 3.9677 7.4535 120.5087 56.2742 42.6191 177.7151 15 G 4.2792 8.9512 114.9389 46.5231 0.0000 175.2895 16 H 4.1275 7.1147 112.9840 58.4462 28.7275 176.3669 17 R 4.3335 7.9763 114.7938 55.3606 30.4118 175.5198 18 D 4.5944 8.2345 118.1595 53.7867 39.0164 173.4724 19 P 4.6112 0.0000 0.0000 63.5988 29.3549 176.4133 20 R 4.0718 9.1578 121.5811 57.4655 30.6883 177.7441 21 L 4.0708 7.9163 118.3882 57.7659 42.0375 178.1955 22 Y 4.2452 7.8575 113.8640 58.2359 39.1344 174.1664 23 G 3.9548 7.0682 104.1910 44.5091 0.0000 172.8935 24 M 4.5052 8.5509 116.8318 55.1780 34.0442 176.1169 25 V 4.0771 7.5961 118.9493 62.1584 32.7054 176.2176 26 T 4.4475 8.0635 119.3521 60.0985 71.1983 175.7515 27 L 3.7099 8.0471 122.2717 58.1653 42.0360 178.5703 28 D 4.1332 7.8037 118.3798 57.4777 40.8108 178.5871 29 Q 4.2027 7.7621 117.9526 58.9487 28.6337 179.1021 30 I 3.5880 7.4587 120.8848 64.6334 37.0844 178.2060 31 H 3.8376 7.7520 117.0132 58.4825 28.1849 177.7381 32 E 3.9181 8.4568 120.8339 59.6181 29.3712 179.1854 33 I 3.7121 7.8325 119.7666 64.9252 37.1424 178.4146 34 M 4.4462 7.9056 120.4884 57.9592 31.7953 178.5897 35 Q 4.1191 8.2154 118.1561 59.4769 28.8945 178.8548 36 T 3.9256 8.1651 116.8184 67.0866 67.2304 176.0941 37 F 4.0546 8.4573 122.0190 61.3597 39.4640 177.3559 38 V 3.8054 8.0512 117.8807 65.8320 31.2631 178.1885 39 K 3.9797 8.4341 118.5800 59.5574 31.8437 179.1621 40 Q 4.3613 8.0518 114.8988 57.2068 28.7732 177.3502 41 G 3.8085 6.8866 104.1328 43.8062 0.0000 172.8089 42 N 4.2117 8.9483 116.3722 53.8867 36.8142 174.5114 43 L 4.0961 7.5144 116.9801 55.1342 42.6187 177.6725 44 D 4.6568 8.3107 123.0308 52.9193 39.7282 175.8799 45 V 4.7108 7.2627 118.6185 61.2488 35.2410 174.6051 46 E 4.6508 8.9662 127.6001 54.8317 31.4193 174.9458 47 L 4.8433 8.4033 124.5281 53.3800 43.4600 175.4271 48 E 4.4765 8.6551 124.2223 54.4112 31.8638 174.4300 49 F 5.3459 8.5951 125.3560 56.1306 41.3403 175.1602 50 F 5.0772 9.3248 124.5433 56.8997 42.9182 172.7079 51 Q 4.8934 8.1198 126.5253 54.6094 31.4851 174.0156 52 T 4.5997 8.4355 118.9959 61.2458 70.7530 173.0296 53 N 4.7327 9.1063 121.3724 53.1710 39.6436 175.2726 54 F 4.7983 8.7478 119.7756 55.5115 41.0034 175.6228 55 E 3.8048 9.0410 124.7700 59.6410 29.2419 179.2858 56 G 3.7025 8.1886 104.8008 47.7640 0.0000 175.4020 57 E 4.1063 8.3614 120.4339 59.2054 29.5416 178.9922 58 I 3.9056 7.9406 119.8177 64.6686 37.1739 178.4553 59 I 3.7026 7.7998 120.2816 64.5004 36.8763 177.9680 60 D 4.3715 8.4091 120.1050 57.5087 40.8132 179.1887 61 K 3.7851 8.3095 119.9501 59.4008 31.9806 178.7012 62 I 3.6820 7.7351 119.1917 64.7048 37.3312 178.0226 63 Q 4.1530 8.3507 118.8471 59.1042 28.3808 178.7313 64 E 4.0940 8.2960 118.3149 58.6097 29.2788 179.0025 65 S 4.5519 8.0163 114.0462 60.8036 62.8961 176.3816 66 V 3.7252 7.7245 122.2178 66.1102 31.4423 177.9879 67 G 3.7628 8.0165 104.6959 47.0223 0.0000 173.3288 68 S 4.5550 7.4452 114.2807 57.3020 64.7337 172.8374 69 D 4.6789 8.0366 117.6021 53.9113 39.6802 175.8363 70 Y 4.6381 7.2343 116.8831 58.3599 38.9208 175.8612 71 E 4.3312 9.2704 125.5310 58.8511 30.6944 176.7766 72 G 4.2565 7.7863 103.9582 45.4095 0.0000 172.1226 73 I 5.2033 8.8175 121.0051 59.3392 40.8158 174.7355 74 I 4.9166 8.6481 127.6104 59.6646 39.4755 174.6044 75 I 5.0940 9.0786 126.9670 59.3390 41.9187 173.3551 76 N 5.2830 9.1593 127.7262 50.3651 40.3775 172.9005 77 P 4.5135 0.0000 0.0000 62.4096 32.8189 178.2103 78 G 3.7538 8.7014 108.2972 45.8068 0.0000 175.0395 79 A 4.3676 8.3896 121.2625 54.9663 18.6733 179.4926 80 F 4.8808 7.7956 114.0245 59.8223 38.8859 177.6003 81 S 4.5381 8.4147 117.4026 61.2927 62.3989 175.9653 82 H 4.8144 7.9574 117.3506 56.5566 28.7780 176.1810 83 T 4.7096 7.9940 108.5903 61.8234 70.9100 174.8190 84 S 4.4114 8.4287 117.8412 56.5686 61.0642 173.8992 85 I 3.3893 7.6937 128.3592 63.6743 37.0011 177.2382 86 A 3.9293 7.8372 120.9715 55.4477 18.1903 179.6666 87 I 3.6512 8.1507 118.3758 64.2013 37.1217 178.3712 88 A 4.0397 8.0054 121.7619 55.3815 18.2365 179.3813 89 D 4.2377 8.5023 117.3107 57.5070 40.7222 178.5900 90 A 3.9912 7.8509 119.8571 55.6135 18.6585 179.4125 91 I 3.8215 8.1742 118.3071 64.9257 36.9688 178.6845 92 M 4.2022 7.9529 118.5838 57.3815 31.3418 177.6785 93 L 4.4781 7.6600 118.1016 55.8519 40.8275 178.0886 94 A 4.1437 7.9592 122.3008 52.9307 19.0999 177.7146 95 G 4.0114 7.4375 106.7533 45.3928 0.0000 172.8169 96 K 4.3716 7.2973 112.8274 54.8120 35.2378 173.3362 97 P 4.3902 0.0000 0.0000 63.0231 32.6958 175.3456 98 V 4.8772 8.4792 123.3786 61.0854 34.8305 173.8656 99 I 4.9228 8.8593 128.5795 59.4719 40.1865 174.0501 100 E 4.8790 8.8397 128.7646 55.2130 30.7459 174.9607 101 V 4.7819 8.7203 126.7282 61.3372 34.8839 173.8132 102 H 5.0283 9.1835 123.4322 54.0178 32.2478 174.0345 103 L 4.1625 9.1029 123.6993 57.9986 42.1614 177.7399 104 T 4.4123 7.7202 106.4635 60.0262 70.5994 174.5744 105 N 4.4760 8.1213 121.5567 52.4278 37.4019 175.4344 106 I 3.8199 7.8850 118.0079 62.5779 38.0528 177.9733 107 Q 3.9372 7.9041 119.9809 58.2863 28.5740 176.8475 108 A 4.5694 8.2586 119.2584 51.6805 19.3122 176.3752 109 R 4.7552 7.2317 118.6423 55.3996 33.2831 175.3427 110 E 3.8008 8.2440 117.0428 57.1124 30.2060 177.7430 111 E 3.7979 8.6631 121.8535 59.3899 29.6707 178.9465 112 F 4.4675 7.6812 110.9380 58.5342 37.9895 175.5420 113 R 3.8787 7.0903 119.2879 56.1594 30.9772 177.6855 114 K 4.1289 7.8486 117.9779 59.1376 32.0281 177.6072 115 N 4.1454 8.0015 117.5835 53.6937 39.4032 173.3235 116 S 4.8119 8.2498 118.5616 55.8316 64.2199 173.7538 117 Y 4.2711 8.1975 127.4886 61.4312 38.0993 178.5942 118 T 4.2036 8.1962 110.1142 64.9297 68.8086 176.4479 119 G 3.6490 8.4115 108.4905 47.4117 0.0000 175.4982 120 A 4.0643 7.9761 122.0305 54.7985 18.4729 179.1014 121 A 4.1921 7.6707 117.3932 53.4040 18.8921 177.7065 122 C 4.4554 7.0642 114.6232 58.8871 29.2578 174.1002 123 G 3.7943 8.4249 109.2098 49.4648 0.0000 173.8993 124 G 4.4059 7.7228 105.3356 45.0988 0.0000 172.1703 125 V 5.0844 8.1819 119.0022 61.0915 35.0857 174.3387 126 I 4.8699 9.0491 127.9485 59.6926 40.3326 174.3725 127 M 5.0853 8.8272 123.4360 54.5574 34.2527 175.3124 128 G 3.6937 9.1571 109.4122 45.8140 0.0000 173.6820 129 F 4.7384 8.0652 115.0516 56.1084 40.0604 177.6789 130 G 3.9513 8.0493 111.1843 45.2256 0.0000 172.8915 131 P 4.5369 0.0000 0.0000 65.7086 31.8500 178.0965 132 L 4.0691 8.2948 119.3926 58.0997 41.7625 178.8182 133 G 3.7323 8.2598 105.7081 48.3023 0.0000 175.1390 134 Y 4.0473 8.0981 118.6937 60.9503 37.3683 178.4592 135 N 3.9283 8.0474 116.9651 56.2728 38.5991 177.2285 136 M 3.8842 7.8689 120.0013 58.0501 31.8797 178.6973 137 A 3.9208 7.8498 120.9964 54.9561 18.5450 179.4221 138 L 3.9398 7.9921 117.7553 58.2748 41.7693 179.2611 139 M 4.1186 8.4307 117.8954 58.9191 32.0697 178.1727 140 A 3.9855 8.0840 120.6348 55.1891 18.4562 179.0942 141 M 3.9399 8.6987 117.1583 58.9550 32.2284 178.5721 142 V 3.6133 7.9735 118.2247 66.2346 31.6801 177.7656 143 N 4.3721 8.2850 116.1926 56.3376 38.3624 177.5708 144 I 3.7865 8.1098 121.7337 64.1535 37.1555 178.5851 145 L 3.9516 8.3281 119.9463 57.7034 41.4880 178.9494 146 A 3.9921 8.2022 121.1102 55.6402 18.1299 179.3688 147 E 3.9671 8.3084 117.2129 59.3137 29.3049 178.8543 148 M 4.1572 8.0286 119.1440 58.1424 31.8065 178.5464 149 K 4.1325 8.0052 117.2030 58.3722 32.6850 178.8206 150 A 4.1755 8.2074 121.6340 55.3503 18.1208 179.3853 151 F 4.3261 7.8815 117.6223 61.3593 39.4915 176.4834 152 Q 3.9120 7.5798 117.8639 59.5764 28.8851 177.3304 153 E 4.2056 7.5935 120.8441 56.6743 29.6465 176.7621 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 8.16 4.47 0.00 2.45 2.07 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.61 0.00 2 K 8.41 4.90 0.00 2.01 1.95 0.00 1.16 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.47 1.45 7.81 3 I 8.74 4.84 1.86 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 1.15 1.05 0.96 0.00 0.00 4 L 8.46 4.53 0.00 0.81 1.18 0.71 0.13 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 5 V 8.63 4.75 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 1.23 0.00 0.00 0.98 0.00 0.00 6 I 8.89 5.01 1.97 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 1.42 0.64 1.09 0.00 0.00 7 Q 9.38 4.79 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 8 G 8.89 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 0.00 0.00 0.00 0.00 9 P 0.00 4.39 0.00 1.83 1.79 0.00 3.58 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.44 0.00 10 N 9.21 4.45 0.00 2.78 2.86 0.00 0.00 6.93 6.34 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 11 L 7.35 3.91 0.00 1.73 1.66 0.98 0.52 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 12 N 7.96 4.41 0.00 2.78 3.01 0.00 0.00 6.04 7.66 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 13 M 7.95 4.30 0.00 2.01 2.14 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 2.52 2.58 0.00 14 L 7.45 3.97 0.00 1.70 1.72 0.90 0.98 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 15 G 8.95 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 0.00 0.00 0.00 0.00 16 H 7.11 4.13 0.00 3.19 3.36 0.00 5.66 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.98 4.33 0.00 1.79 1.96 0.00 3.53 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 18 D 8.23 4.59 0.00 2.91 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 19 P 0.00 4.61 0.00 2.13 2.13 0.00 3.83 0.00 0.00 3.53 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 20 R 9.16 4.07 0.00 2.08 1.94 0.00 3.13 0.00 0.00 3.16 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 21 L 7.92 4.07 0.00 1.18 1.39 1.20 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.86 4.25 0.00 2.92 3.03 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 23 G 7.07 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 24 M 8.55 4.51 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 25 V 7.60 4.08 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 0.87 0.00 0.00 0.94 0.00 0.00 26 T 8.06 4.45 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 1.11 0.00 0.00 27 L 8.05 3.71 0.00 1.73 1.52 0.72 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 28 D 7.80 4.13 0.00 2.63 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 29 Q 7.76 4.20 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 30 I 7.46 3.59 1.60 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 1.42 0.87 0.35 0.00 0.00 31 H 7.75 3.84 0.00 2.66 1.47 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.46 3.92 0.00 2.06 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 2.32 2.30 0.00 33 I 7.83 3.71 2.04 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 1.54 1.04 0.99 0.00 0.00 34 M 7.91 4.45 0.00 2.31 2.50 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.54 0.00 35 Q 8.22 4.12 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 2.83 2.69 0.00 36 T 8.17 3.93 4.49 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 0.00 0.00 0.00 1.27 0.00 0.00 37 F 8.46 4.05 0.00 3.29 3.28 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 0.00 38 V 8.05 3.81 2.32 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 1.11 0.00 0.00 1.14 0.00 0.00 39 K 8.43 3.98 0.00 1.83 1.83 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.51 7.81 40 Q 8.05 4.36 0.00 1.87 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 41 G 6.89 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 0.00 0.00 0.00 42 N 8.95 4.21 0.00 2.78 2.88 0.00 0.00 6.97 5.48 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 43 L 7.51 4.10 0.00 1.70 1.63 0.88 0.74 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 44 D 8.31 4.66 0.00 2.61 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 45 V 7.26 4.71 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 0.94 0.00 0.00 0.97 0.00 0.00 46 E 8.97 4.65 0.00 1.97 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 0.00 2.24 2.27 0.00 47 L 8.40 4.84 0.00 0.97 0.73 1.07 0.85 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 48 E 8.66 4.48 0.00 2.14 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 2.23 2.34 0.00 49 F 8.60 5.35 0.00 2.96 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 50 F 9.32 5.08 0.00 3.07 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 51 Q 8.12 4.89 0.00 1.97 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.53 0.00 0.00 0.00 0.00 0.00 2.28 2.16 0.00 52 T 8.44 4.60 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 1.37 0.00 0.00 53 N 9.11 4.73 0.00 2.66 2.66 0.00 0.00 6.86 7.45 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 54 F 8.75 4.80 0.00 3.13 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 55 E 9.04 3.80 0.00 1.23 1.73 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 2.13 1.69 0.00 56 G 8.19 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 57 E 8.36 4.11 0.00 2.26 2.39 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 2.60 2.42 0.00 58 I 7.94 3.91 2.15 0.00 0.00 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 1.72 1.06 1.03 0.00 0.00 59 I 7.80 3.70 1.88 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 1.52 0.91 0.91 0.00 0.00 60 D 8.41 4.37 0.00 2.97 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 61 K 8.31 3.79 0.00 1.95 1.76 0.00 1.39 0.00 0.00 0.85 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 1.22 7.81 62 I 7.74 3.68 2.01 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 1.54 0.82 0.93 0.00 0.00 63 Q 8.35 4.15 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 64 E 8.30 4.09 0.00 1.88 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 2.32 2.34 0.00 65 S 8.02 4.55 0.00 4.08 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 66 V 7.72 3.73 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 0.84 0.00 0.00 1.00 0.00 0.00 67 G 8.02 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.45 4.55 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 69 D 8.04 4.68 0.00 2.69 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 70 Y 7.23 4.64 0.00 3.25 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 71 E 9.27 4.33 0.00 1.89 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 0.00 2.35 2.44 0.00 72 G 7.79 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 0.00 0.00 0.00 0.00 73 I 8.82 5.20 1.87 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 1.12 0.71 0.91 0.00 0.00 74 I 8.65 4.92 1.97 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.82 1.02 0.00 0.00 75 I 9.08 5.09 1.92 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 1.24 1.84 0.98 0.00 0.00 76 N 9.16 5.28 0.00 2.83 3.01 0.00 0.00 7.10 8.47 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 77 P 0.00 4.51 0.00 2.41 2.21 0.00 3.81 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.14 0.00 78 G 8.70 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 0.00 0.00 0.00 79 A 8.39 4.37 1.28 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 0.00 0.00 0.00 80 F 7.80 4.88 0.00 3.29 2.99 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 81 S 8.41 4.54 0.00 3.57 3.96 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 82 H 7.96 4.81 0.00 3.33 3.53 0.00 5.56 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 83 T 7.99 4.71 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 1.36 0.00 0.00 84 S 8.43 4.41 0.00 3.81 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 85 I 7.69 3.39 1.65 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.73 0.00 0.00 86 A 7.84 3.93 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 87 I 8.15 3.65 1.91 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 1.47 0.56 0.98 0.00 0.00 88 A 8.01 4.04 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 89 D 8.50 4.24 0.00 2.81 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 90 A 7.85 3.99 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 91 I 8.17 3.82 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.09 0.95 0.00 0.00 92 M 7.95 4.20 0.00 2.01 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 93 L 7.66 4.48 0.00 1.94 1.89 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.96 4.14 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 95 G 7.44 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.30 4.37 0.00 2.02 1.76 0.00 1.63 0.00 0.00 1.89 0.00 0.00 3.25 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.40 7.81 97 P 0.00 4.39 0.00 2.11 2.04 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 98 V 8.48 4.88 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 1.04 0.00 0.00 1.02 0.00 0.00 99 I 8.86 4.92 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 1.11 0.55 0.88 0.00 0.00 100 E 8.84 4.88 0.00 2.07 1.80 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 2.13 2.30 0.00 101 V 8.72 4.78 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.65 0.00 0.00 102 H 9.18 5.03 0.00 3.07 3.19 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 9.10 4.16 0.00 1.76 1.83 1.15 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 104 T 7.72 4.41 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 0.74 0.00 0.00 105 N 8.12 4.48 0.00 2.57 2.63 0.00 0.00 6.65 7.82 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 0.00 106 I 7.89 3.82 2.00 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 1.26 0.61 0.78 0.00 0.00 107 Q 7.90 3.94 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.32 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 108 A 8.26 4.57 1.14 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 0.00 0.00 109 R 7.23 4.76 0.00 1.58 1.67 0.00 3.07 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.61 0.00 110 E 8.24 3.80 0.00 1.16 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 2.19 2.17 0.00 111 E 8.66 3.80 0.00 1.98 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 2.38 2.37 0.00 112 F 7.68 4.47 0.00 3.11 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 0.00 113 R 7.09 3.88 0.00 1.63 1.76 0.00 3.06 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.10 0.00 114 K 7.85 4.13 0.00 1.78 1.79 0.00 1.64 0.00 0.00 1.56 0.00 0.00 3.13 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.49 1.41 7.81 115 N 8.00 4.15 0.00 2.67 2.57 0.00 0.00 6.55 7.63 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 0.00 116 S 8.25 4.81 0.00 3.89 3.71 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 0.00 117 Y 8.20 4.27 0.00 3.13 3.01 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 0.00 0.00 0.00 118 T 8.20 4.20 4.32 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 1.32 0.00 0.00 119 G 8.41 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 0.00 0.00 0.00 120 A 7.98 4.06 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 0.00 121 A 7.67 4.19 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 0.00 122 C 7.06 4.46 0.00 3.13 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 0.00 123 G 8.42 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 0.00 0.00 0.00 124 G 7.72 4.41 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 0.00 125 V 8.18 5.08 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 0.94 0.00 0.00 0.95 0.00 0.00 126 I 9.05 4.87 1.82 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.49 0.96 0.00 0.00 127 M 8.83 5.09 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 128 G 9.16 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 0.00 129 F 8.07 4.74 0.00 2.96 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 0.00 130 G 8.05 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 0.00 131 P 0.00 4.54 0.00 2.24 2.16 0.00 3.68 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 2.15 2.14 0.00 132 L 8.29 4.07 0.00 1.79 2.00 0.86 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.26 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 0.00 0.00 0.00 134 Y 8.10 4.05 0.00 3.25 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 0.00 135 N 8.05 3.93 0.00 2.49 1.59 0.00 0.00 7.15 7.66 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 0.00 136 M 7.87 3.88 0.00 1.83 2.03 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.26 0.00 137 A 7.85 3.92 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 0.00 138 L 7.99 3.94 0.00 1.72 1.87 1.06 1.12 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 0.00 139 M 8.43 4.12 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.60 0.00 140 A 8.08 3.99 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 0.00 141 M 8.70 3.94 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.63 0.00 142 V 7.97 3.61 2.37 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 1.11 0.00 0.00 1.00 0.00 0.00 143 N 8.29 4.37 0.00 3.04 2.86 0.00 0.00 7.06 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 0.00 144 I 8.11 3.79 2.06 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 1.53 0.82 0.92 0.00 0.00 145 L 8.33 3.95 0.00 1.70 1.73 0.95 1.22 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 0.00 146 A 8.20 3.99 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 0.00 147 E 8.31 3.97 0.00 2.25 1.96 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 2.30 2.36 0.00 148 M 8.03 4.16 0.00 2.18 2.32 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 2.74 2.62 0.00 149 K 8.01 4.13 0.00 1.77 1.88 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.64 7.81 150 A 8.21 4.18 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 151 F 7.88 4.33 0.00 2.97 3.31 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 0.00 152 Q 7.58 3.91 0.00 2.09 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 153 E 7.59 4.21 0.00 2.13 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 0.00 2.33 2.31 0.00