NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9644 8.3544 109.7363 45.1920 0.0000 175.6943 2 S 4.4717 8.5109 117.9015 55.5426 65.2034 171.0664 3 S 4.6223 8.5985 119.8893 57.3717 66.3106 173.3264 4 G 4.0959 8.1194 115.0787 46.4930 0.0000 170.0558 5 S 4.4903 8.8912 113.8439 59.1980 70.0800 172.6618 6 S 3.4961 8.3980 127.2962 57.5863 60.8915 172.7588 7 G 3.8523 8.3965 114.8304 45.1697 0.0000 170.7974 8 H 4.9423 8.1500 121.6783 52.9325 30.7539 174.8600 9 S 4.3090 8.4888 116.3877 58.4242 63.0556 172.5972 10 H 4.8987 8.3593 125.1585 54.3001 31.4765 175.2745 11 S 4.3005 8.0069 121.0700 59.2499 63.9778 173.5990 12 D 4.3442 8.3218 115.5911 55.5848 37.6063 174.0144 13 K 4.4919 6.9875 122.2434 53.2152 32.2576 176.2797 14 H 4.4437 7.4422 110.5391 54.9682 30.2771 173.2282 15 P 4.3623 0.0000 0.0000 65.1737 32.4982 176.1888 16 V 4.7632 7.6748 119.5105 60.9956 32.7671 175.2983 17 T 4.6120 9.0194 117.9807 60.1953 72.2677 172.4971 18 W 4.9627 9.0149 126.0131 55.0344 31.1496 174.8528 19 Q 4.8668 9.1380 124.0349 53.1326 32.6746 173.6576 20 P 4.9818 0.0000 0.0000 62.5177 33.3104 176.1888 21 S 4.5178 8.7678 116.1384 57.2292 64.5806 174.9207 22 K 3.8423 8.7474 118.9804 60.0194 31.4014 178.0557 23 D 4.3693 7.3541 117.4366 56.3366 41.4165 175.5620 24 G 3.6049 7.7743 110.4096 45.9891 0.0000 175.2348 25 D 4.5694 8.3067 120.3800 56.4752 41.8270 176.8154 26 R 5.1090 7.8068 115.9872 54.1287 33.6029 174.8498 27 L 4.9117 9.4595 124.3642 53.5086 44.9784 175.2681 28 I 4.5738 9.5230 129.4330 60.0637 38.4737 174.7803 29 G 2.6864 8.6222 116.0921 44.0681 0.0000 171.5782 30 R 4.7596 8.9694 124.8507 54.4111 32.5617 175.1880 31 I 4.7019 8.0299 124.8311 59.4219 40.4086 174.6142 32 L 5.0747 7.7874 122.4190 53.5684 45.2751 175.4355 33 L 4.8435 9.0828 123.9893 53.0179 46.0901 174.9619 34 N 5.4130 8.7260 119.6371 52.1759 41.8897 173.5973 35 K 4.4292 8.6411 117.7485 58.0680 35.7158 177.0462 36 R 3.8043 8.2522 119.1754 55.9537 29.6999 176.0451 37 L 4.0512 8.9831 124.2321 54.2561 42.3480 178.4432 38 K 3.8082 8.7861 119.9264 60.0735 31.9037 177.2487 39 D 4.4284 8.1346 116.6931 57.1415 40.7510 177.2109 40 G 4.3103 8.1509 108.0300 45.8620 0.0000 173.5475 41 S 4.6250 8.0534 114.5172 55.9286 66.4701 173.9951 42 V 3.9221 8.3218 125.1117 61.9597 31.7059 174.3055 43 P 4.6442 0.0000 0.0000 61.9763 32.7535 176.8470 44 R 3.5943 8.6284 116.3963 57.1736 29.9850 176.3972 45 D 5.3777 6.3527 128.3393 53.7488 41.9492 177.4720 46 S 4.5921 8.4039 123.8709 57.4517 62.4658 174.4168 47 G 3.7011 8.0256 109.6205 45.4179 0.0000 173.3359 48 A 3.7744 8.2661 127.7519 55.6721 18.6365 178.6949 49 M 4.3084 7.9666 112.0445 54.9735 32.0353 176.1162 50 L 4.0844 8.6932 124.5449 53.5069 41.1481 176.1255 51 G 4.9095 7.4887 116.3483 45.7043 0.0000 172.0770 52 L 4.9362 7.7224 119.0685 54.2427 42.6808 176.0466 53 K 4.5299 9.2225 122.6965 55.0252 34.2131 175.1019 54 V 4.6965 8.2347 126.1975 60.9723 34.3690 174.5355 55 V 4.2655 8.6646 127.5505 61.4939 33.4287 174.9186 56 G 4.1308 8.5051 116.6015 45.1282 0.0000 173.4366 57 G 4.2352 8.1364 106.2673 45.9419 0.0000 173.6730 58 K 4.1392 7.7268 120.9802 56.1323 32.6122 175.9739 59 M 4.6310 8.6439 126.7795 55.0358 32.3003 176.4308 60 T 4.3885 8.4427 116.7883 60.8842 71.1341 174.0204 61 E 4.3323 8.6644 117.8559 57.4344 30.1879 176.5096 62 S 4.4884 8.0458 114.6194 58.1653 63.5190 174.8445 63 G 3.8967 8.2433 108.2587 45.6676 0.0000 173.5722 64 R 4.5676 7.5521 119.1193 54.5950 32.3731 174.7988 65 L 5.6398 7.7652 117.9326 53.2351 44.4692 175.6122 66 C 4.7774 8.4815 116.5758 58.7770 32.4306 173.0098 67 A 4.7171 7.9504 123.9378 50.7018 20.6878 176.1180 68 F 5.4150 8.7765 120.0950 55.3859 44.0048 174.4500 69 I 4.3905 9.0865 123.9294 62.0826 37.3625 176.8437 70 T 4.2224 8.6989 118.1860 63.7235 69.9170 175.0913 71 K 4.6893 7.7408 121.2742 54.6561 36.1262 174.6505 72 V 4.6421 8.1521 124.0247 60.5893 33.8772 175.0415 73 K 3.9818 8.5497 129.4554 56.7245 32.9628 176.4986 74 K 4.4380 8.6266 127.8119 58.6933 31.7372 176.7893 75 G 4.0642 9.4392 119.1221 46.0334 0.0000 171.2824 76 S 4.6621 7.6820 111.4576 55.5123 65.8704 173.0142 77 L 3.7267 8.1363 119.7406 59.1136 42.0841 178.1533 78 A 4.6256 7.6320 123.4170 49.9719 16.8725 175.2860 79 D 4.6907 7.4478 132.6972 54.6477 43.8991 178.4477 80 T 4.0292 8.6701 108.2310 63.3446 69.5443 175.8143 81 V 4.0777 7.6362 113.4142 62.3825 33.2121 177.3338 82 G 3.6146 8.3608 108.8473 47.4340 0.0000 174.9428 83 H 4.9076 8.1727 112.6427 55.8762 26.1637 174.7316 84 L 4.3802 7.1479 119.2944 55.6246 42.1313 176.3133 85 R 4.6541 8.0404 117.2441 54.2660 34.0563 172.8901 86 P 4.4294 0.0000 0.0000 63.7606 31.3199 175.0905 87 G 3.3920 7.8220 114.5665 45.0870 0.0000 172.8902 88 D 4.9208 7.8314 120.4302 53.5612 43.3618 175.0379 89 E 4.9464 8.6206 120.4066 54.3946 32.2498 175.1632 90 V 4.1618 8.3576 128.5428 62.8301 31.0274 176.0429 91 L 4.1462 9.7835 129.8467 57.3371 42.2513 177.2012 92 E 5.2144 8.0257 115.8765 54.3487 34.4441 174.9415 93 W 4.5272 9.0441 130.6788 56.9730 31.9948 174.1924 94 N 4.0581 10.6376 122.7198 54.1814 36.0972 175.6966 95 G 3.9707 8.3769 104.9442 45.2580 0.0000 174.2720 96 R 4.3286 8.3897 120.7620 54.3219 30.2836 175.7109 97 L 4.4712 8.4415 125.9919 55.1284 42.7329 176.5443 98 L 4.2814 9.3277 126.3489 55.5296 42.6118 175.6842 99 Q 4.0308 7.9571 116.9463 59.3052 28.3399 174.9991 100 G 4.0570 9.0463 112.1129 45.2832 0.0000 173.1718 101 A 3.9618 7.8335 122.2432 52.8308 18.8835 177.4082 102 T 4.3885 8.2257 111.9960 60.8579 71.2836 175.5164 103 F 4.1170 8.8258 122.1978 61.5551 38.7375 176.8756 104 E 3.8644 8.2506 117.5453 59.3042 29.4912 178.4239 105 E 3.9862 8.0514 118.7016 59.6491 29.4715 179.6156 106 V 3.3967 7.8275 117.8433 66.1913 31.5686 177.2679 107 Y 3.5505 7.4041 118.7761 60.6222 38.4151 177.4959 108 N 4.3232 9.2272 118.1258 57.5419 38.7035 176.4249 109 I 3.5608 7.9332 118.9351 64.8348 37.2024 177.8636 110 I 3.3486 7.1110 121.3173 64.5933 37.1875 178.1427 111 L 4.0213 7.7459 121.0348 58.1510 41.9234 178.7745 112 E 4.3960 9.0440 118.2683 58.2613 29.3543 177.8888 113 S 4.8345 7.9900 114.6538 58.1324 64.0383 175.4127 114 K 4.2689 8.8939 123.8109 58.2724 31.9701 176.6969 115 P 4.4211 0.0000 0.0000 64.4924 31.7652 176.2317 116 E 4.0599 8.1932 118.3882 56.1463 30.2690 175.2788 117 P 4.5772 0.0000 0.0000 65.2178 32.6632 175.6792 118 Q 5.0194 7.5022 113.3441 54.1528 32.4326 175.4530 119 V 4.1483 9.3452 119.7002 61.6457 34.4477 173.3073 120 E 4.6898 9.3011 131.0454 54.7182 30.8857 175.1835 121 L 4.3961 8.5531 127.8852 53.7018 44.6049 176.5497 122 V 4.3874 8.3480 120.3746 62.0061 34.3396 174.0554 123 V 5.2981 8.8908 128.6487 59.8078 34.8189 175.4678 124 S 5.0973 8.4725 117.3117 57.7604 65.9713 173.8018 125 R 4.8750 9.3163 122.5776 54.2467 32.6537 175.6246 126 S 4.5941 8.6450 115.9042 57.3482 63.6353 174.7441 127 G 4.0644 8.6885 116.1729 45.0717 0.0000 169.5922 128 P 4.5351 0.0000 0.0000 62.8636 32.0432 176.4859 129 S 4.6817 7.9752 111.3869 58.3423 63.6138 175.0367 130 S 4.4323 8.4316 118.6836 58.9439 63.3131 174.1342 131 G 3.7515 7.6653 112.2186 46.0006 0.0000 172.4523 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 G 8.35 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 0.00 0.00 0.00 2 S 8.51 4.47 0.00 3.85 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.60 4.62 0.00 3.82 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 4 G 8.12 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.89 4.49 0.00 3.93 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 6 S 8.40 3.50 0.00 4.04 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 7 G 8.40 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.15 4.94 0.00 3.24 3.30 0.00 5.53 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.49 4.31 0.00 3.86 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 10 H 8.36 4.90 0.00 3.14 3.16 0.00 5.78 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 11 S 8.01 4.30 0.00 3.78 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.32 4.34 0.00 2.75 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 13 K 6.99 4.49 0.00 1.79 1.77 0.00 1.57 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.21 1.21 7.81 14 H 7.44 4.44 0.00 3.19 3.27 0.00 5.54 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 15 P 0.00 4.36 0.00 2.11 2.31 0.00 3.71 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 2.08 1.96 0.00 16 V 7.67 4.76 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 1.02 0.00 0.00 1.01 0.00 0.00 17 T 9.02 4.61 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 0.92 0.00 0.00 18 W 9.01 4.96 0.00 3.11 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 19 Q 9.14 4.87 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 20 P 0.00 4.98 0.00 2.10 2.09 0.00 3.79 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 2.01 1.99 0.00 21 S 8.77 4.52 0.00 4.03 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 22 K 8.75 3.84 0.00 1.77 1.94 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.45 7.81 23 D 7.35 4.37 0.00 2.62 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 7.77 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 8.31 4.57 0.00 2.71 2.76 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 26 R 7.81 5.11 0.00 1.78 1.84 0.00 3.26 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 27 L 9.46 4.91 0.00 1.69 1.68 1.14 0.19 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 28 I 9.52 4.57 1.90 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 1.25 0.87 0.89 0.00 0.00 29 G 8.62 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 0.00 0.00 0.00 30 R 8.97 4.76 0.00 1.58 1.60 0.00 2.94 0.00 0.00 3.03 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.36 0.00 31 I 8.03 4.70 1.71 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.64 0.83 0.00 0.00 32 L 7.79 5.07 0.00 1.48 1.40 0.86 0.82 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 33 L 9.08 4.84 0.00 1.40 1.41 0.78 0.42 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 34 N 8.73 5.41 0.00 2.63 2.64 0.00 0.00 6.79 6.73 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 35 K 8.64 4.43 0.00 1.72 1.76 0.00 1.94 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.47 7.81 36 R 8.25 3.80 0.00 1.78 1.83 0.00 3.22 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 37 L 8.98 4.05 0.00 1.68 1.65 0.93 0.62 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 38 K 8.79 3.81 0.00 1.68 1.86 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.55 7.81 39 D 8.13 4.43 0.00 2.70 2.73 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 40 G 8.15 4.31 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 0.00 0.00 0.00 41 S 8.05 4.62 0.00 3.83 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 42 V 8.32 3.92 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 0.81 0.00 0.00 0.95 0.00 0.00 43 P 0.00 4.64 0.00 2.26 2.21 0.00 3.75 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 2.07 1.98 0.00 44 R 8.63 3.59 0.00 1.83 2.05 0.00 3.53 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 45 D 6.35 5.38 0.00 2.70 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.40 4.59 0.00 3.83 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 47 G 8.03 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 48 A 8.27 3.77 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 49 M 7.97 4.31 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.32 0.00 50 L 8.69 4.08 0.00 1.84 1.85 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 51 G 7.49 4.91 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 52 L 7.72 4.94 0.00 1.82 1.87 1.08 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 53 K 9.22 4.53 0.00 1.79 1.72 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.51 7.81 54 V 8.23 4.70 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 0.74 0.00 0.00 1.01 0.00 0.00 55 V 8.66 4.27 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 1.20 0.00 0.00 1.07 0.00 0.00 56 G 8.51 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.14 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 58 K 7.73 4.14 0.00 2.09 2.24 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.53 1.54 7.81 59 M 8.64 4.63 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.50 0.00 60 T 8.44 4.39 4.31 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 1.49 0.00 0.00 61 E 8.66 4.33 0.00 2.10 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 0.00 2.23 2.33 0.00 62 S 8.05 4.49 0.00 3.91 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 63 G 8.24 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 0.00 0.00 0.00 0.00 64 R 7.55 4.57 0.00 1.84 1.90 0.00 3.28 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 65 L 7.77 5.64 0.00 1.64 1.59 1.04 1.13 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 66 C 8.48 4.78 0.00 2.95 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 0.00 0.00 0.00 67 A 7.95 4.72 1.09 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 0.00 0.00 68 F 8.78 5.41 0.00 2.96 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 69 I 9.09 4.39 2.14 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.04 1.07 0.00 0.00 70 T 8.70 4.22 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 1.34 0.00 0.00 71 K 7.74 4.69 0.00 1.84 1.65 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.46 7.81 72 V 8.15 4.64 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 0.93 0.00 0.00 1.03 0.00 0.00 73 K 8.55 3.98 0.00 1.98 1.72 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.46 7.81 74 K 8.63 4.44 0.00 1.76 1.74 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.43 7.81 75 G 9.44 4.06 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 0.00 0.00 0.00 76 S 7.68 4.66 0.00 3.81 3.68 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 77 L 8.14 3.73 0.00 1.85 1.64 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.63 4.63 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 79 D 7.45 4.69 0.00 2.79 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 80 T 8.67 4.03 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 81 V 7.64 4.08 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 0.80 0.00 0.00 0.91 0.00 0.00 82 G 8.36 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 83 H 8.17 4.91 0.00 3.47 3.48 0.00 5.77 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.15 4.38 0.00 1.80 1.74 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.04 4.65 0.00 1.86 1.79 0.00 3.24 0.00 0.00 3.40 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 86 P 0.00 4.43 0.00 2.21 2.19 0.00 3.79 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 2.01 1.99 0.00 87 G 7.82 3.39 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 0.00 0.00 0.00 0.00 0.00 0.00 88 D 7.83 4.92 0.00 2.99 2.76 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 89 E 8.62 4.95 0.00 2.28 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 2.05 1.64 0.00 90 V 8.36 4.16 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 1.02 0.00 0.00 1.03 0.00 0.00 91 L 9.78 4.15 0.00 1.71 1.66 0.98 0.73 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 E 8.03 5.21 0.00 1.84 1.81 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 2.27 2.25 0.00 93 W 9.04 4.53 0.00 3.30 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 94 N 10.64 4.06 0.00 3.03 2.91 0.00 0.00 7.41 7.67 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 95 G 8.38 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.39 4.33 0.00 2.17 1.93 0.00 3.31 0.00 0.00 3.11 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 97 L 8.44 4.47 0.00 1.58 1.58 0.97 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 98 L 9.33 4.28 0.00 1.74 1.60 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 7.96 4.03 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.55 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 100 G 9.05 4.06 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 0.00 0.00 0.00 101 A 7.83 3.96 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 0.00 102 T 8.23 4.39 4.31 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 1.29 0.00 0.00 103 F 8.83 4.12 0.00 3.16 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 0.00 104 E 8.25 3.86 0.00 2.09 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 2.41 2.63 0.00 105 E 8.05 3.99 0.00 2.27 2.00 0.00 0.00 0.00 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 2.35 0.00 106 V 7.83 3.40 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.91 0.00 0.00 107 Y 7.40 3.55 0.00 2.75 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 0.00 108 N 9.23 4.32 0.00 3.03 2.86 0.00 0.00 7.04 7.19 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 0.00 109 I 7.93 3.56 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.66 0.91 0.00 0.00 110 I 7.11 3.35 1.31 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.60 0.00 0.00 111 L 7.75 4.02 0.00 2.01 1.70 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 112 E 9.04 4.40 0.00 1.96 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 2.36 2.47 0.00 113 S 7.99 4.83 0.00 4.15 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 0.00 114 K 8.89 4.27 0.00 1.85 1.85 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.51 7.81 115 P 0.00 4.42 0.00 2.23 2.18 0.00 3.82 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 116 E 8.19 4.06 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 117 P 0.00 4.58 0.00 2.10 2.29 0.00 3.62 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 118 Q 7.50 5.02 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.66 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 119 V 9.35 4.15 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 0.04 0.00 0.00 0.91 0.00 0.00 120 E 9.30 4.69 0.00 1.87 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 0.00 2.03 2.12 0.00 121 L 8.55 4.40 0.00 1.37 1.42 -1.15 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 122 V 8.35 4.39 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 0.84 0.00 0.00 0.81 0.00 0.00 123 V 8.89 5.30 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 0.79 0.00 0.00 1.24 0.00 0.00 124 S 8.47 5.10 0.00 3.74 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 0.00 125 R 9.32 4.87 0.00 1.90 2.17 0.00 3.35 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 126 S 8.64 4.59 0.00 3.93 3.99 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 0.00 127 G 8.69 4.06 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 0.00 0.00 0.00 128 P 0.00 4.54 0.00 2.19 2.08 0.00 3.82 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 1.95 0.00 129 S 7.98 4.68 0.00 3.83 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 0.00 130 S 8.43 4.43 0.00 3.87 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 7.67 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