NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Y 4.7633 8.0027 121.6907 57.4754 40.0610 173.7427 4 N 4.0442 8.0930 124.4061 49.7915 41.8433 172.6784 5 K 3.7434 8.8531 130.6935 59.8549 32.5189 177.4381 6 E 3.9670 8.0837 117.8709 59.7982 29.2175 179.2839 7 E 4.0074 7.7545 116.2341 59.0987 29.7264 179.0011 8 K 4.2685 8.2796 121.3256 59.1001 32.3144 178.8827 9 I 3.8321 8.0373 120.1887 64.2941 36.8919 177.8496 10 K 4.2474 7.8161 117.9173 57.6954 31.9709 177.1022 11 S 4.7116 8.1043 112.8387 58.5757 63.3778 173.9059 12 L 4.3507 7.6810 120.8064 54.2048 42.6190 176.8498 13 N 4.6152 8.6902 118.7270 53.2917 40.9290 176.1319 14 R 4.0116 8.6548 123.7892 60.0545 30.1428 178.9449 15 M 4.3472 8.5397 117.4941 58.5078 32.3046 178.2838 16 Q 4.5717 7.9981 119.2991 58.1062 28.8558 177.7648 17 Y 3.9914 8.6991 121.1335 60.5230 39.0212 176.7047 18 E 3.9380 8.6819 120.6985 59.8217 29.4335 178.8990 19 V 3.8620 8.0785 118.3117 66.1673 31.7088 178.0153 20 T 4.1010 8.0111 108.8649 64.5857 68.4210 175.9250 21 Q 3.9532 8.2521 119.7739 57.0782 29.5308 176.2435 22 N 4.5537 7.6280 111.4910 52.3586 39.1236 174.2950 23 N 3.8602 7.4812 114.7704 54.1492 36.3482 174.0899 24 G 3.9559 7.8516 107.0402 44.6509 0.0000 173.3366 25 T 4.6190 8.0325 115.0168 61.3128 71.1461 174.2754 26 E 4.3173 9.0862 125.3935 55.0792 30.3782 175.1773 27 P 4.5751 0.0000 0.0000 62.1092 32.2240 174.3818 28 P 2.9700 0.0000 0.0000 62.8462 31.6985 178.3612 29 F 2.0000 6.0673 117.7279 57.6994 38.6883 176.0260 30 Q 4.5375 7.3794 120.7717 54.7673 27.5837 173.0070 31 N 5.1201 7.6268 114.2549 52.0074 43.3757 174.3530 32 E 4.2790 8.4852 117.7748 56.8970 30.5132 175.5595 33 Y 5.0266 7.5437 113.8974 57.4887 39.6746 177.1155 34 W 4.2843 8.4522 118.7699 58.7718 28.3774 176.6145 35 D 3.8648 6.3233 115.1684 52.2078 39.6232 175.8667 36 H 3.8515 6.9833 119.4833 57.3058 30.0009 174.6629 37 K 4.5370 8.0002 123.6003 56.0823 33.8781 175.9447 38 E 4.2245 7.6828 119.5368 55.5325 30.6778 175.0791 39 E 4.6125 9.7106 122.7953 54.1245 31.1710 176.4009 40 G 3.9614 8.0101 112.1875 44.2829 0.0000 171.5449 41 L 4.8263 7.1851 119.7622 54.1127 43.8736 176.3682 42 Y 4.9233 8.6973 119.2296 56.4437 39.8987 176.1216 43 V 4.2582 8.3412 118.7416 60.1016 34.1098 174.8848 44 D 4.7187 9.2064 122.8078 54.0558 41.2481 176.8197 45 I 3.6358 8.2641 127.4713 64.0973 38.1278 176.9344 46 V 4.0807 8.6807 121.5752 64.9489 31.9404 177.2576 47 S 4.0681 7.5757 113.1724 58.5381 63.3644 175.4276 48 G 3.9140 8.3630 108.5949 44.9203 0.0000 173.4435 49 K 4.2534 7.6897 122.1590 55.5583 33.3046 174.6093 50 P 4.3639 0.0000 0.0000 62.7671 31.8116 175.7983 51 L 4.1786 8.9079 121.9325 55.5933 44.8641 176.4609 52 F 4.8561 7.6317 114.5484 56.0876 43.6004 174.0096 53 T 5.1008 8.3373 116.1581 61.5759 71.4118 175.8141 54 S 4.6014 8.6784 117.8726 61.0144 63.4475 176.0768 55 K 4.1701 8.2652 120.3526 59.4098 31.9636 177.6346 56 D 4.7111 8.1719 117.2541 55.3356 41.5803 176.5273 57 K 3.9109 7.9203 120.8390 56.2376 32.6379 175.8110 58 F 5.0140 7.6313 119.2981 54.8232 40.7755 175.6326 59 D 4.4720 8.6339 122.7286 54.8425 38.2317 175.9403 60 S 4.7839 7.6048 117.8283 56.8997 64.1479 173.1745 61 Q 4.8845 8.3303 119.7267 55.9752 28.6935 176.0921 62 C 4.2304 7.4713 114.1289 59.4235 30.9715 174.2880 63 G 2.1847 7.8581 106.6802 44.2378 0.0000 172.9884 64 W 5.2084 7.3377 118.0140 53.5849 33.3956 172.8703 65 P 4.0544 0.0000 0.0000 63.7108 31.5365 175.2810 66 S 4.9758 7.7968 121.0415 57.2621 65.1951 173.4356 67 F 5.5339 9.0989 120.4712 56.4228 42.9944 175.4836 68 T 4.8450 8.8318 110.7828 62.9679 69.9054 175.0529 69 K 4.3981 8.0530 121.5369 54.2183 35.1880 173.4124 70 P 4.3283 0.0000 0.0000 61.2646 33.4939 174.8475 71 I 4.0601 7.2562 118.0160 60.3709 37.9085 173.8772 72 E 4.1657 8.6164 124.8187 57.6476 28.3897 176.0815 73 E 3.6105 8.5668 113.0798 57.2594 26.9703 174.3140 74 E 4.6506 7.9047 121.4076 54.8689 32.9056 174.0212 75 V 4.7070 7.6500 118.4000 61.3652 34.0217 174.3941 76 E 4.8323 9.5977 127.3926 54.7337 32.9436 174.4705 77 E 5.0789 8.6314 120.9369 54.8335 31.2511 175.4769 78 K 4.6024 9.4342 126.4221 54.0473 35.9467 174.7924 79 L 4.3065 8.5922 128.7578 55.2242 42.7572 175.2517 80 D 4.9934 9.1788 127.4651 52.0975 43.6227 176.4958 81 T 5.6009 8.5776 118.0803 60.4513 69.5878 174.2598 82 S 4.3810 7.8726 116.1548 59.5361 64.3388 173.0826 83 H 3.8206 9.5297 115.0070 56.9194 26.0172 176.3573 84 G 3.9091 8.4711 105.4176 45.8668 0.0000 173.7904 85 M 4.5935 7.7862 119.3736 53.8024 34.3125 175.0445 86 I 4.7823 7.9321 120.4874 59.1944 38.0405 174.8856 87 R 4.5332 9.0303 124.0313 54.3858 33.5393 174.9957 88 T 4.7106 7.8126 114.8967 61.6265 70.2886 173.7500 89 E 4.2490 9.0609 129.0081 55.8175 31.3598 175.5058 90 V 5.1777 8.6095 125.7998 61.1176 34.4102 174.4917 91 R 5.0716 8.7398 122.9847 54.5058 33.6671 174.0631 92 S 4.9691 9.0994 116.0193 57.8033 62.7675 175.2071 93 R 3.9546 8.7514 124.2510 59.8165 29.2594 177.9866 94 T 4.0855 8.1996 116.2153 65.9463 69.0835 176.1854 95 A 3.9026 8.0389 124.6533 52.8308 18.7802 176.7035 96 D 5.1473 7.1748 113.3336 53.8760 40.5711 173.3279 97 S 4.8060 7.7490 111.7433 57.3496 64.8871 173.7185 98 H 4.5258 8.6638 124.2799 56.7177 30.0736 173.9325 99 L 4.4949 9.0147 123.8352 53.9556 44.1534 176.3595 100 G 4.4930 6.7766 108.0565 46.2817 0.0000 171.7922 101 H 5.1655 8.0323 120.4222 53.8789 33.6816 171.8939 102 V 4.5020 8.0045 120.3069 61.1772 33.0555 174.9192 103 F 4.7689 8.7531 125.8317 55.7123 42.6553 174.7287 104 N 5.5205 8.7689 119.6881 49.5807 36.5778 175.3695 105 D 4.5774 7.6112 122.5589 52.1810 39.5588 176.1401 106 G 4.1759 7.6745 106.9271 42.9466 0.0000 172.5961 107 P 3.8556 0.0000 0.0000 63.8267 31.1851 177.8002 108 G 3.9588 7.8706 103.1245 43.9329 0.0000 171.4903 109 P 4.3928 0.0000 0.0000 64.7926 31.4878 177.4430 110 N 4.3499 8.3937 117.4009 54.5548 37.4454 176.1925 111 G 4.2711 8.2659 105.5817 45.8539 0.0000 172.0599 112 L 5.1622 7.3236 115.7430 52.6536 44.9323 175.9276 113 R 5.1610 9.2572 123.9013 54.5056 30.8105 172.1876 114 Y 4.5370 9.8651 120.3245 57.8526 39.0839 174.0586 115 C 4.7783 9.3983 127.0859 58.3084 32.7224 172.4311 116 I 4.9926 8.1262 126.7021 59.3665 40.0601 175.2876 117 N 4.8416 8.7054 122.4841 53.2133 39.4113 176.8517 118 S 4.3531 10.7700 120.2832 61.9648 63.3872 176.6463 119 A 4.2256 9.1293 119.2373 53.2267 17.6062 177.6570 120 A 4.9715 8.1945 117.6979 52.0506 21.0646 176.3191 121 L 5.1371 8.7626 115.6329 52.8565 45.5715 175.9435 122 R 4.8351 8.8157 123.7072 54.7158 32.3851 174.3182 123 F 4.7306 8.9478 128.4419 56.7530 40.7991 174.7458 124 V 3.8054 7.6172 126.8958 60.1773 33.0277 172.7919 125 P 3.8298 0.0000 0.0000 62.5428 31.7682 177.7406 126 K 3.4380 8.5188 124.4494 58.8838 32.1991 177.2105 127 H 4.6501 7.8684 111.7627 55.5743 29.2093 175.3344 128 K 4.4916 7.5010 119.3846 56.2674 32.9762 178.1448 129 L 4.0329 7.8514 121.7025 57.9320 41.7912 179.1494 130 K 3.9972 7.9477 118.9298 59.1363 31.9023 178.3762 131 E 4.0234 8.0001 118.8289 58.9611 29.8492 177.5858 132 E 4.2713 7.9674 115.4008 56.3690 29.9491 177.3754 133 G 3.7598 7.5526 106.8170 45.3611 0.0000 173.5269 134 Y 4.7836 7.8893 119.3879 57.5984 37.8717 177.0907 135 E 4.2275 8.0337 123.1215 59.1468 30.4736 177.8308 136 S 4.4590 8.0625 109.4624 59.1142 63.0045 174.3211 137 Y 4.8069 7.8965 118.3444 58.2559 39.5444 177.4179 138 L 4.3391 7.7002 118.1200 58.2375 41.4730 178.8534 139 H 4.4552 8.5735 113.7585 58.6710 28.2162 176.6039 140 L 4.0401 7.6418 118.9253 55.3830 41.4179 176.9177 141 F 4.4502 8.4896 124.0542 57.5870 39.5471 174.8093 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 3 Y 8.00 4.76 0.00 3.01 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 4 N 8.09 4.04 0.00 2.72 2.49 0.00 0.00 6.82 6.36 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 5 K 8.85 3.74 0.00 1.75 1.72 0.00 1.84 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.55 1.65 7.81 6 E 8.08 3.97 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 7 E 7.75 4.01 0.00 1.95 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 2.57 2.44 0.00 8 K 8.28 4.27 0.00 2.11 1.99 0.00 1.95 0.00 0.00 1.96 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.48 7.81 9 I 8.04 3.83 2.12 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.68 1.23 0.00 0.00 10 K 7.82 4.25 0.00 1.93 1.97 0.00 1.56 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.45 7.81 11 S 8.10 4.71 0.00 4.03 4.05 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 0.00 0.00 0.00 0.00 12 L 7.68 4.35 0.00 1.93 1.77 1.07 1.13 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 13 N 8.69 4.62 0.00 2.89 2.81 0.00 0.00 7.46 7.37 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 14 R 8.65 4.01 0.00 1.94 2.05 0.00 3.18 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 15 M 8.54 4.35 0.00 2.21 2.11 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 2.67 2.69 0.00 16 Q 8.00 4.57 0.00 2.46 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.72 0.00 0.00 0.00 0.00 0.00 2.64 2.35 0.00 17 Y 8.70 3.99 0.00 3.13 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 18 E 8.68 3.94 0.00 2.24 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 2.36 2.42 0.00 19 V 8.08 3.86 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 1.06 0.00 0.00 1.11 0.00 0.00 20 T 8.01 4.10 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 1.28 0.00 0.00 21 Q 8.25 3.95 0.00 0.95 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.96 0.00 0.00 0.00 0.00 0.00 1.99 2.15 0.00 22 N 7.63 4.55 0.00 2.85 2.81 0.00 0.00 6.90 8.00 0.00 0.00 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 N 7.48 3.86 0.00 2.73 2.64 0.00 0.00 6.83 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 24 G 7.85 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 25 T 8.03 4.62 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 0.86 0.00 0.00 26 E 9.09 4.32 0.00 2.23 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 0.00 2.80 2.76 0.00 27 P 0.00 4.58 0.00 2.16 2.12 0.00 3.84 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 28 P 0.00 2.97 0.00 1.67 0.67 0.00 3.58 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.27 0.00 29 F 6.07 2.00 0.00 2.68 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 30 Q 7.38 4.54 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.68 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 31 N 7.63 5.12 0.00 2.90 2.79 0.00 0.00 7.08 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 32 E 8.49 4.28 0.00 1.62 1.12 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 0.00 1.94 2.15 0.00 33 Y 7.54 5.03 0.00 3.08 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 34 W 8.45 4.28 0.00 3.27 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 35 D 6.32 3.86 0.00 1.91 1.54 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 0.00 0.00 0.00 0.00 36 H 6.98 3.85 0.00 3.42 3.32 0.00 5.89 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.00 4.54 0.00 1.61 1.65 0.00 1.73 0.00 0.00 1.52 0.00 0.00 3.20 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 1.53 7.81 38 E 7.68 4.22 0.00 1.74 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 2.50 2.58 0.00 39 E 9.71 4.61 0.00 2.15 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 2.55 2.56 0.00 40 G 8.01 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 41 L 7.19 4.83 0.00 1.13 1.26 0.49 1.00 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 42 Y 8.70 4.92 0.00 3.07 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 43 V 8.34 4.26 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 0.06 0.00 0.00 0.90 0.00 0.00 44 D 9.21 4.72 0.00 2.76 2.63 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 0.00 0.00 0.00 0.00 45 I 8.26 3.64 1.99 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 1.21 1.30 0.99 0.00 0.00 46 V 8.68 4.08 2.30 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 1.01 0.00 0.00 1.01 0.00 0.00 47 S 7.58 4.07 0.00 4.03 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 0.00 48 G 8.36 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 49 K 7.69 4.25 0.00 1.91 1.63 0.00 1.56 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.63 1.57 7.81 50 P 0.00 4.36 0.00 1.30 1.33 0.00 3.52 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 0.54 1.49 0.00 51 L 8.91 4.18 0.00 1.61 0.82 0.87 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 52 F 7.63 4.86 0.00 2.15 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 0.00 0.00 0.00 53 T 8.34 5.10 4.40 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 1.11 0.00 0.00 54 S 8.68 4.60 0.00 4.23 4.45 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 55 K 8.27 4.17 0.00 1.74 1.91 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.33 1.34 7.81 56 D 8.17 4.71 0.00 3.07 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 57 K 7.92 3.91 0.00 1.88 1.90 0.00 1.52 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.11 0.55 7.81 58 F 7.63 5.01 0.00 3.13 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 59 D 8.63 4.47 0.00 2.74 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 60 S 7.60 4.78 0.00 3.40 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 61 Q 8.33 4.88 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 62 C 7.47 4.23 0.00 3.29 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 63 G 7.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 W 7.34 5.21 0.00 3.31 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 65 P 0.00 4.05 0.00 1.89 2.35 0.00 4.05 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.16 0.00 66 S 7.80 4.98 0.00 2.79 3.33 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 67 F 9.10 5.53 0.00 2.92 2.97 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 68 T 8.83 4.85 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 69 K 8.05 4.40 0.00 1.72 1.98 0.00 1.77 0.00 0.00 1.92 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.26 1.38 7.81 70 P 0.00 4.33 0.00 1.84 1.55 0.00 3.59 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 71 I 7.26 4.06 1.66 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.33 0.85 0.00 0.00 72 E 8.62 4.17 0.00 1.97 1.93 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 2.31 2.38 0.00 73 E 8.57 3.61 0.00 2.03 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 2.26 2.37 0.00 74 E 7.90 4.65 0.00 1.90 1.63 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 0.00 2.42 2.26 0.00 75 V 7.65 4.71 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 1.00 0.00 0.00 0.46 0.00 0.00 76 E 9.60 4.83 0.00 1.90 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 2.22 2.24 0.00 77 E 8.63 5.08 0.00 1.83 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 2.22 2.35 0.00 78 K 9.43 4.60 0.00 1.67 1.69 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.32 7.81 79 L 8.59 4.31 0.00 1.67 1.56 0.90 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 80 D 9.18 4.99 0.00 2.76 2.58 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 81 T 8.58 5.60 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 1.19 0.00 0.00 82 S 7.87 4.38 0.00 3.79 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 83 H 9.53 3.82 0.00 3.30 3.37 0.00 5.75 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 84 G 8.47 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 85 M 7.79 4.59 0.00 2.10 1.99 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 2.54 2.49 0.00 86 I 7.93 4.78 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.60 0.89 0.00 0.00 87 R 9.03 4.53 0.00 1.58 1.95 0.00 2.86 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 88 T 7.81 4.71 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 1.10 0.00 0.00 89 E 9.06 4.25 0.00 1.93 1.84 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 2.23 2.18 0.00 90 V 8.61 5.18 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 1.12 0.00 0.00 1.13 0.00 0.00 91 R 8.74 5.07 0.00 2.04 1.94 0.00 2.82 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 92 S 9.10 4.97 0.00 3.94 3.87 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 93 R 8.75 3.95 0.00 1.89 2.25 0.00 3.07 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 94 T 8.20 4.09 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 1.27 0.00 0.00 95 A 8.04 3.90 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 96 D 7.17 5.15 0.00 2.64 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 97 S 7.75 4.81 0.00 3.84 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 98 H 8.66 4.53 0.00 3.11 3.40 0.00 5.89 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 9.01 4.49 0.00 1.78 1.71 1.02 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 100 G 6.78 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 0.00 0.00 0.00 0.00 101 H 8.03 5.17 0.00 2.99 2.43 0.00 5.77 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 0.00 102 V 8.00 4.50 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 0.74 0.00 0.00 103 F 8.75 4.77 0.00 3.10 3.07 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 0.00 0.00 0.00 104 N 8.77 5.52 0.00 2.63 2.80 0.00 0.00 7.12 8.06 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 0.00 105 D 7.61 4.58 0.00 2.63 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 0.00 106 G 7.67 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 0.00 0.00 0.00 107 P 0.00 3.86 0.00 1.66 1.92 0.00 2.47 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.51 0.00 108 G 7.87 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 0.00 109 P 0.00 4.39 0.00 2.20 2.20 0.00 3.78 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 2.00 1.96 0.00 110 N 8.39 4.35 0.00 3.00 3.20 0.00 0.00 6.18 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 0.00 111 G 8.27 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 0.00 0.00 0.00 0.00 112 L 7.32 5.16 0.00 1.88 1.48 1.11 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 113 R 9.26 5.16 0.00 2.04 2.06 0.00 3.17 0.00 0.00 3.36 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.96 0.00 114 Y 9.87 4.54 0.00 3.24 3.04 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 0.00 0.00 0.00 115 C 9.40 4.78 0.00 3.12 3.02 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 0.00 116 I 8.13 4.99 1.79 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 -0.05 0.99 0.00 0.00 117 N 8.71 4.84 0.00 2.71 2.82 0.00 0.00 7.18 6.95 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 0.00 118 S 10.77 4.35 0.00 3.99 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 0.00 119 A 9.13 4.23 1.39 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 0.00 120 A 8.19 4.97 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 0.00 121 L 8.76 5.14 0.00 1.71 1.76 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 122 R 8.82 4.84 0.00 2.00 1.81 0.00 3.12 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 123 F 8.95 4.73 0.00 1.94 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 0.00 124 V 7.62 3.81 1.50 0.00 0.00 0.00 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 0.63 0.00 0.00 125 P 0.00 3.83 0.00 1.79 1.88 0.00 3.36 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 2.00 2.01 0.00 126 K 8.52 3.44 0.00 1.68 1.71 0.00 1.71 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.40 1.44 7.81 127 H 7.87 4.65 0.00 3.22 3.35 0.00 5.71 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 0.00 128 K 7.50 4.49 0.00 1.56 1.86 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.00 7.81 129 L 7.85 4.03 0.00 1.60 1.99 0.43 0.64 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 0.00 130 K 7.95 4.00 0.00 1.81 1.79 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.74 7.81 131 E 8.00 4.02 0.00 1.97 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 0.00 2.26 2.38 0.00 132 E 7.97 4.27 0.00 2.29 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 2.45 2.35 0.00 133 G 7.55 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 0.00 134 Y 7.89 4.78 0.00 3.11 3.08 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 0.00 135 E 8.03 4.23 0.00 2.01 1.93 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 2.39 2.31 0.00 136 S 8.06 4.46 0.00 3.76 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 0.00 137 Y 7.90 4.81 0.00 3.33 3.13 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 0.00 138 L 7.70 4.34 0.00 1.90 1.85 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 139 H 8.57 4.46 0.00 3.34 3.48 0.00 5.53 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.64 4.04 0.00 0.94 1.24 0.90 0.51 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 0.00 141 F 8.49 4.45 0.00 2.90 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