NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.2786 8.0976 119.7006 55.8268 31.3869 175.6119 4 P 4.3424 0.0000 0.0000 61.3471 32.0124 173.2809 5 E 4.3936 8.5519 118.6866 57.1461 31.0321 179.0002 6 S 4.0141 7.4738 117.1085 61.6618 62.7873 175.9010 7 E 3.9474 8.0629 121.6404 58.9816 29.3873 178.5796 8 L 4.0395 7.8402 118.8127 57.6572 41.6797 179.4333 9 I 3.5844 7.3519 120.8982 63.7921 37.1241 178.6518 10 R 4.0654 8.1436 119.1456 59.4129 29.5560 179.0088 11 Q 4.0924 8.6026 120.0286 59.1343 28.8604 178.2299 12 S 4.4136 8.7076 115.6581 61.0406 63.2884 176.2260 13 W 4.5934 9.2765 132.8078 60.0250 30.0791 178.1458 14 R 3.9438 8.1246 116.3627 59.0765 28.5058 179.0154 15 V 3.3910 6.9715 115.8926 64.6894 31.5058 178.1658 16 V 3.3736 6.7873 112.4713 62.2579 31.6572 178.2479 17 S 3.5601 7.4224 113.0153 60.2324 62.8426 176.2091 18 R 4.0992 7.0908 120.9341 57.8021 31.3887 176.8682 19 S 4.6694 7.7661 114.5643 55.2467 63.6667 172.6440 20 P 4.1866 0.0000 0.0000 65.6727 31.4530 178.5853 21 L 3.9037 7.7710 119.5967 57.8086 42.0219 178.4628 22 E 3.9031 8.0705 117.9983 59.9620 29.4785 179.0732 23 H 4.1983 8.1736 116.2267 58.7165 28.6809 178.2023 24 G 3.7829 8.8032 107.9413 47.9880 0.0000 175.9314 25 T 4.0103 8.3326 118.4793 66.4170 68.3357 176.8500 26 V 3.6009 7.5234 120.3023 65.8642 31.5083 177.6252 27 L 3.8411 7.8775 120.0115 58.4925 41.8525 179.1234 28 F 3.5333 8.5549 117.4640 59.9349 38.8209 177.6247 29 A 4.0597 8.5635 121.0582 55.2077 18.1435 179.5873 30 R 3.5393 8.1800 117.4826 59.3087 30.0017 178.3094 31 L 3.8903 7.6685 121.6898 57.7297 41.8057 179.0912 32 F 4.6483 7.9254 115.8448 60.2164 38.8923 177.3694 33 A 4.1584 7.8457 120.1860 55.0139 18.1900 179.2859 34 L 4.2817 7.8398 116.8978 56.3530 43.1710 177.2717 35 E 4.6481 8.5251 119.9431 53.5251 30.0223 173.5339 36 P 4.5068 0.0000 0.0000 64.4904 31.9251 178.2876 37 S 4.4401 8.0072 110.9425 59.4637 63.4604 175.4854 38 L 4.3253 8.3460 122.0680 56.9144 41.3543 178.3373 39 L 3.7864 7.8964 121.0855 57.8626 41.6991 176.8472 40 P 4.5107 0.0000 0.0000 64.0035 31.5085 177.9010 41 L 4.2487 7.8616 117.9436 56.1345 42.1844 177.2767 42 F 4.0970 7.8015 117.5886 56.1853 37.4455 174.0102 43 Q 4.4650 7.5150 122.3869 53.2425 29.1715 174.3529 44 Y 4.6728 7.6849 120.6189 57.0799 40.0550 176.2281 45 N 3.9816 9.3371 121.6366 55.2655 36.0084 174.2245 46 G 4.0776 8.2572 101.2089 46.3019 0.0000 173.6985 47 R 4.5842 7.6704 116.8236 53.8578 32.7311 174.8588 48 Q 4.4061 8.1152 121.2561 54.0190 30.9091 175.2415 49 F 4.6067 8.0146 123.4567 57.5790 39.7916 175.8985 50 S 4.3257 9.0700 122.0080 60.7184 63.3374 174.4899 51 S 4.7470 8.6932 113.4640 55.2926 66.1518 172.9168 52 P 3.8702 0.0000 0.0000 65.7690 31.5032 178.8282 53 E 3.9287 8.0346 115.9445 59.2727 29.4375 178.7116 54 D 4.2684 7.9134 120.3996 57.1282 40.7721 178.7352 55 S 2.0000 7.1497 114.6548 60.2228 62.4901 176.0563 56 L 4.2343 7.1384 120.6584 55.9628 41.5091 177.5013 57 S 4.5089 7.3269 112.1575 58.0069 63.7656 174.2269 58 S 4.6414 7.6909 117.4844 56.8033 63.5265 172.6471 59 P 4.2229 0.0000 0.0000 65.6899 31.1801 178.5364 60 E 3.7471 7.8745 117.0021 59.1756 29.2189 179.0398 61 F 4.1151 8.0785 120.7265 61.2211 39.5034 177.2934 62 L 3.8561 8.2991 118.9132 57.8055 41.2726 179.2335 63 D 4.3469 8.4917 119.3498 57.3774 40.6554 178.2562 64 H 4.1353 8.1199 118.9800 59.2719 29.8169 177.3026 65 I 3.5107 7.2707 121.6548 64.3826 36.8270 178.5841 66 R 3.9443 7.9229 118.7952 59.1895 29.8271 179.2496 67 K 4.0349 8.3702 118.6469 59.4341 31.9628 179.5560 68 V 3.7232 8.2187 118.9196 66.4650 31.5286 178.0912 69 M 4.3905 8.4620 118.5066 58.1646 31.7847 178.5576 70 L 4.1115 8.4505 121.3059 58.0903 42.1964 179.2268 71 V 3.6590 8.1773 118.3782 66.1179 31.4470 178.0520 72 I 3.6520 8.2258 119.9462 64.4466 36.8408 177.9147 73 D 4.2047 8.9094 119.0187 57.2091 40.9692 178.2155 74 A 3.9709 8.1224 121.2820 54.9081 18.1171 179.4877 75 A 3.8502 7.9218 118.8940 55.1442 18.7634 179.7425 76 V 3.3879 7.7435 117.0166 66.3796 31.3495 178.3018 77 T 3.9216 7.9614 114.5786 66.1583 68.5252 175.3096 78 N 5.1554 8.4019 118.8876 52.2904 39.5196 177.7223 79 V 3.6091 7.4365 123.3145 64.7596 31.6199 177.3965 80 E 4.1862 8.0365 119.0717 59.1274 30.4898 178.2813 81 D 4.9371 7.4148 123.8990 54.5333 39.9764 177.7764 82 L 3.8353 9.5304 120.9986 56.5199 37.3816 174.7821 83 S 4.5826 7.8007 111.9030 58.9669 66.8037 176.9530 84 S 3.9540 8.4015 114.0499 61.1917 62.2089 174.8568 85 L 4.4746 7.7537 117.5667 55.0312 42.5181 177.8429 86 E 3.9192 7.8640 120.4202 59.7941 29.4423 178.7884 87 E 3.9834 8.1425 117.6636 59.4140 29.5833 178.5176 88 Y 4.0937 7.9075 120.4930 60.1704 38.9488 178.0272 89 L 3.8517 8.3791 120.2434 57.8010 41.5814 179.5005 90 T 3.9437 7.9670 116.0479 66.7449 67.9052 176.6708 91 S 3.9639 7.6656 115.5371 61.3740 62.8490 176.3085 92 L 3.9180 7.8967 124.4871 57.4008 41.6906 179.0761 93 G 3.3706 8.2831 106.1875 47.6985 0.0000 175.3898 94 R 3.6383 7.7498 123.4424 57.9514 30.0130 178.2057 95 K 3.7225 7.9627 119.3930 60.0648 32.0749 178.4318 96 H 4.1405 8.1803 116.3092 58.7193 28.5970 177.7242 97 R 3.9589 7.5479 120.7814 59.3613 29.4921 178.4714 98 A 3.9574 7.6249 119.5463 54.7649 18.4583 179.1126 99 V 3.9532 7.3033 108.1646 61.4410 31.9637 177.0198 100 G 4.0532 7.7684 107.5864 45.0563 0.0000 173.8863 101 V 3.9659 7.9649 120.2041 62.2609 32.3843 175.9711 102 R 4.4757 8.5796 126.1021 55.4423 31.1808 177.2228 103 L 3.1449 8.1787 123.4748 58.0705 41.7523 179.5684 104 S 4.1471 7.9117 113.5516 61.2913 62.9690 176.4191 105 S 4.1968 8.1199 118.6517 61.1213 62.4911 176.2411 106 F 4.0523 8.5117 120.5763 59.5322 38.4690 177.6438 107 S 4.2911 8.2284 114.8849 61.8934 62.7029 176.7019 108 T 4.3436 7.6997 120.3385 65.6618 68.2166 176.6379 109 V 3.4231 7.8231 120.4509 65.7537 31.4355 178.2724 110 G 2.8186 7.9572 105.3534 47.6908 0.0000 175.5583 111 E 4.0012 8.2948 121.3691 59.0595 29.2671 179.7111 112 S 4.0441 8.1002 115.7249 61.2938 62.7336 176.4395 113 L 3.7775 8.0742 123.5110 58.0759 41.7152 179.0833 114 L 3.7940 8.1419 119.3886 57.5010 41.4133 178.8160 115 Y 3.8894 8.1061 119.9977 60.9329 38.7502 177.8847 116 M 3.7086 8.2525 119.3793 58.5792 32.2887 178.1948 117 L 3.5919 7.6930 119.3999 57.1733 41.5517 179.0207 118 E 3.1885 7.2433 119.5589 59.0397 29.3274 179.1683 119 K 3.7554 7.4641 117.4729 59.2756 32.0448 179.2981 120 S 4.2008 7.7697 114.9530 60.9098 63.1233 175.8715 121 L 4.3441 8.4122 121.0865 53.7962 42.1340 178.0991 122 G 3.7466 8.7593 108.3075 45.6646 0.0000 175.6234 123 P 4.2490 0.0000 0.0000 65.4444 31.0404 177.0330 124 D 4.5364 8.0741 117.1874 55.6874 41.1010 176.9069 125 F 4.6668 8.0054 124.4586 56.7713 37.7246 175.1864 126 T 4.1284 7.3869 116.1220 60.4393 71.1436 173.4242 127 P 4.0939 0.0000 0.0000 65.4946 31.1968 178.9210 128 A 3.9329 7.8010 119.1891 55.4177 18.3888 179.6046 129 T 3.7919 7.8206 114.2623 66.5877 68.4071 176.6550 130 R 3.5664 7.5846 120.8023 59.8675 30.0844 178.6658 131 T 3.8647 8.1734 115.4452 66.4745 68.3785 176.5117 132 A 4.0587 8.1644 122.7111 55.0947 18.4587 179.7821 133 W 4.1823 8.4703 117.5279 60.0352 29.0301 178.9982 134 S 4.4454 8.6722 115.4454 61.6166 62.1735 176.9952 135 R 3.9260 8.2335 120.8343 59.1135 29.7594 178.8886 136 L 3.8501 8.2817 120.5230 58.3390 42.0884 178.3176 137 Y 4.1452 8.8334 120.0676 60.6358 38.6291 178.2184 138 G 3.6179 8.6019 106.7560 47.8367 0.0000 175.5653 139 A 3.9418 8.1542 123.2844 54.5340 18.2464 180.0306 140 V 3.4045 7.7827 117.2532 66.2168 31.5964 178.4901 141 V 3.2831 7.6370 118.3961 65.7235 31.0058 177.6648 142 Q 3.8369 7.9600 118.6140 59.1382 29.1479 177.9146 143 A 4.2578 8.1142 121.8426 55.5402 18.3648 179.5854 144 M 4.2523 8.3423 117.7098 58.2199 31.9746 179.0471 145 S 4.3528 8.2419 114.6807 61.2454 63.1646 176.6658 146 R 4.4265 7.4696 122.9463 58.3383 29.4099 178.7591 147 G 3.6243 8.6361 105.5622 46.1958 0.0000 174.5695 148 W 4.3634 7.8790 120.0787 57.1900 29.7457 177.3289 149 D 4.7645 7.5668 114.8249 54.0890 36.8763 174.5306 150 G 3.7818 7.4295 115.3804 46.1600 0.0000 171.5623 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 R 8.10 4.28 0.00 1.84 1.87 0.00 3.04 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 4 P 0.00 4.34 0.00 2.23 2.13 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.00 0.00 5 E 8.55 4.39 0.00 2.16 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 2.22 2.28 0.00 6 S 7.47 4.01 0.00 4.07 3.88 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 7 E 8.06 3.95 0.00 2.06 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 2.38 2.47 0.00 8 L 7.84 4.04 0.00 1.82 1.73 0.93 0.85 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 9 I 7.35 3.58 1.69 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.42 0.13 0.00 0.00 10 R 8.14 4.07 0.00 1.88 2.05 0.00 3.36 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 11 Q 8.60 4.09 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 12 S 8.71 4.41 0.00 4.49 4.43 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 13 W 9.28 4.59 0.00 3.97 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.12 3.94 0.00 2.11 2.24 0.00 2.87 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.65 0.00 15 V 6.97 3.39 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 0.76 0.00 0.00 0.87 0.00 0.00 16 V 6.79 3.37 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.11 0.00 0.00 17 S 7.42 3.56 0.00 3.64 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 18 R 7.09 4.10 0.00 1.71 1.98 0.00 3.06 0.00 0.00 3.18 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 19 S 7.77 4.67 0.00 3.86 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 20 P 0.00 4.19 0.00 2.28 2.31 0.00 3.66 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 21 L 7.77 3.90 0.00 1.77 1.68 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.07 3.90 0.00 1.90 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 2.35 2.36 0.00 23 H 8.17 4.20 0.00 3.26 3.27 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.80 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 25 T 8.33 4.01 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 1.25 0.00 0.00 26 V 7.52 3.60 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.97 0.00 0.00 27 L 7.88 3.84 0.00 1.71 1.75 0.82 0.28 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 28 F 8.55 3.53 0.00 3.17 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 29 A 8.56 4.06 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 30 R 8.18 3.54 0.00 1.58 1.93 0.00 2.63 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.32 0.00 31 L 7.67 3.89 0.00 1.41 1.31 0.76 0.58 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 32 F 7.93 4.65 0.00 3.09 2.95 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 33 A 7.85 4.16 1.33 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 0.00 0.00 34 L 7.84 4.28 0.00 1.71 1.68 0.78 0.73 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 35 E 8.53 4.65 0.00 1.92 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 2.26 2.30 0.00 36 P 0.00 4.51 0.00 2.23 2.10 0.00 3.68 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 37 S 8.01 4.44 0.00 4.01 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 38 L 8.35 4.33 0.00 2.29 2.17 0.99 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.90 3.79 0.00 1.66 1.57 0.84 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.51 0.00 2.05 2.19 0.00 3.87 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.28 0.00 41 L 7.86 4.25 0.00 1.49 1.48 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.80 4.10 0.00 3.47 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 43 Q 7.52 4.47 0.00 1.80 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.11 0.00 44 Y 7.68 4.67 0.00 3.04 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 45 N 9.34 3.98 0.00 2.91 2.93 0.00 0.00 7.16 7.65 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 46 G 8.26 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 7.67 4.58 0.00 1.91 1.72 0.00 3.21 0.00 0.00 3.09 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 48 Q 8.12 4.41 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.94 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 49 F 8.01 4.61 0.00 2.99 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 9.07 4.33 0.00 4.05 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 51 S 8.69 4.75 0.00 3.95 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 3.87 0.00 2.20 2.23 0.00 3.53 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 53 E 8.03 3.93 0.00 2.09 2.16 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 2.29 2.30 0.00 54 D 7.91 4.27 0.00 2.72 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 55 S 7.15 2.00 0.00 2.72 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 56 L 7.14 4.23 0.00 1.74 1.73 0.93 0.75 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 57 S 7.33 4.51 0.00 3.99 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 58 S 7.69 4.64 0.00 4.28 4.07 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 59 P 0.00 4.22 0.00 2.16 2.06 0.00 3.67 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 60 E 7.87 3.75 0.00 1.16 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 2.21 2.24 0.00 61 F 8.08 4.12 0.00 3.39 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 62 L 8.30 3.86 0.00 1.83 1.67 0.97 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.49 4.35 0.00 2.76 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 64 H 8.12 4.14 0.00 3.32 3.11 0.00 5.60 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 I 7.27 3.51 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 -0.23 0.94 0.00 0.00 66 R 7.92 3.94 0.00 2.01 1.99 0.00 3.12 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 67 K 8.37 4.03 0.00 1.91 1.94 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.78 7.81 68 V 8.22 3.72 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 1.04 0.00 0.00 69 M 8.46 4.39 0.00 2.29 2.35 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 3.01 0.00 70 L 8.45 4.11 0.00 1.84 1.89 0.95 0.74 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 71 V 8.18 3.66 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 1.28 0.00 0.00 1.22 0.00 0.00 72 I 8.23 3.65 1.91 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.82 0.46 0.00 0.00 73 D 8.91 4.20 0.00 3.28 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 74 A 8.12 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.92 3.85 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 76 V 7.74 3.39 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 1.02 0.00 0.00 0.20 0.00 0.00 77 T 7.96 3.92 4.38 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 1.21 0.00 0.00 78 N 8.40 5.16 0.00 2.83 2.77 0.00 0.00 6.36 8.01 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 79 V 7.44 3.61 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 0.60 0.00 0.00 0.73 0.00 0.00 80 E 8.04 4.19 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 2.26 2.24 0.00 81 D 7.41 4.94 0.00 2.89 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 82 L 9.53 3.84 0.00 1.68 1.99 0.90 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 83 S 7.80 4.58 0.00 3.80 3.80 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 84 S 8.40 3.95 0.00 3.81 3.88 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 85 L 7.75 4.47 0.00 1.78 1.78 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 86 E 7.86 3.92 0.00 1.90 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 2.31 2.42 0.00 87 E 8.14 3.98 0.00 2.05 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 2.41 2.32 0.00 88 Y 7.91 4.09 0.00 3.14 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 89 L 8.38 3.85 0.00 1.70 1.66 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 90 T 7.97 3.94 4.34 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 1.19 0.00 0.00 91 S 7.67 3.96 0.00 3.92 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 92 L 7.90 3.92 0.00 1.16 1.56 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.28 3.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.75 3.64 0.00 1.84 1.84 0.00 3.07 0.00 0.00 3.08 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 95 K 7.96 3.72 0.00 1.78 1.91 0.00 1.49 0.00 0.00 1.59 0.00 0.00 3.04 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.39 7.81 96 H 8.18 4.14 0.00 3.38 3.84 0.00 5.87 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 7.55 3.96 0.00 0.67 1.45 0.00 2.78 0.00 0.00 2.89 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.48 0.00 98 A 7.62 3.96 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 99 V 7.30 3.95 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 0.73 0.00 0.00 0.93 0.00 0.00 100 G 7.77 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 0.00 0.00 0.00 101 V 7.96 3.97 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 0.93 0.00 0.00 1.06 0.00 0.00 102 R 8.58 4.48 0.00 1.96 1.85 0.00 3.23 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.69 0.00 103 L 8.18 3.14 0.00 0.56 1.17 0.63 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 104 S 7.91 4.15 0.00 4.07 4.07 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 0.00 105 S 8.12 4.20 0.00 4.00 3.88 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 0.00 106 F 8.51 4.05 0.00 3.22 3.26 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 0.00 107 S 8.23 4.29 0.00 4.11 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 0.00 108 T 7.70 4.34 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 109 V 7.82 3.42 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 0.92 0.00 0.00 0.68 0.00 0.00 110 G 7.96 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 0.00 0.00 0.00 111 E 8.29 4.00 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 112 S 8.10 4.04 0.00 3.71 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 0.00 113 L 8.07 3.78 0.00 1.46 1.47 0.69 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.14 3.79 0.00 1.84 1.78 1.02 0.85 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 0.00 115 Y 8.11 3.89 0.00 3.02 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 0.00 116 M 8.25 3.71 0.00 2.05 2.06 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 2.81 2.64 0.00 117 L 7.69 3.59 0.00 0.88 0.94 -0.56 0.67 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 0.00 118 E 7.24 3.19 0.00 1.67 1.69 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 2.17 2.42 0.00 119 K 7.46 3.76 0.00 1.28 1.56 0.00 1.46 0.00 0.00 1.35 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.51 0.63 7.81 120 S 7.77 4.20 0.00 3.67 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 0.00 121 L 8.41 4.34 0.00 1.80 1.86 1.16 0.83 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 0.00 122 G 8.76 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 0.00 123 P 0.00 4.25 0.00 2.21 2.22 0.00 3.87 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 124 D 8.07 4.54 0.00 2.92 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 8.01 4.67 0.00 2.88 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 0.00 126 T 7.39 4.13 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 1.26 0.00 0.00 127 P 0.00 4.09 0.00 2.14 2.11 0.00 3.56 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 128 A 7.80 3.93 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 0.00 129 T 7.82 3.79 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 1.49 0.00 0.00 130 R 7.58 3.57 0.00 1.29 1.91 0.00 3.20 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 131 T 8.17 3.86 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 1.21 0.00 0.00 132 A 8.16 4.06 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 0.00 133 W 8.47 4.18 0.00 3.81 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 0.00 134 S 8.67 4.45 0.00 4.09 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 0.00 135 R 8.23 3.93 0.00 2.04 1.96 0.00 3.12 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 136 L 8.28 3.85 0.00 1.48 1.51 0.79 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 8.83 4.15 0.00 3.34 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 0.00 138 G 8.60 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 8.15 3.94 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 0.00 140 V 7.78 3.40 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 1.00 0.00 0.00 0.96 0.00 0.00 141 V 7.64 3.28 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 0.82 0.00 0.00 0.37 0.00 0.00 142 Q 7.96 3.84 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 143 A 8.11 4.26 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 0.00 144 M 8.34 4.25 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.63 0.00 145 S 8.24 4.35 0.00 3.95 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 0.00 146 R 7.47 4.43 0.00 1.96 2.03 0.00 3.36 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.51 0.00 147 G 8.64 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 W 7.88 4.36 0.00 3.56 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 0.00 149 D 7.57 4.76 0.00 2.75 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.43 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