NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 H 4.5010 8.4449 120.3170 56.1056 30.1878 172.1807 18 F 4.8563 8.0233 127.6323 55.0270 41.4201 171.0792 19 E 4.6397 9.3459 122.6742 53.9788 32.2100 174.2180 20 P 4.5141 0.0000 0.0000 63.3137 32.3129 175.9747 21 V 4.5747 8.1350 110.4578 59.3962 32.3492 176.2125 22 V 4.3917 7.1434 120.8424 60.5997 32.8957 169.4942 23 P 4.2250 0.0000 0.0000 62.1586 31.6346 175.3756 24 L 3.8882 8.6058 124.7637 54.6629 41.9377 174.8838 25 P 4.4581 0.0000 0.0000 62.3910 32.0062 176.3403 26 D 4.5715 8.3264 120.8134 53.6430 41.5220 176.6104 27 K 4.1435 8.4167 121.4276 56.8519 32.6282 175.5287 28 I 4.5224 7.8025 119.9062 59.4038 40.6641 174.8477 29 E 4.2778 8.4663 122.0718 54.9113 28.8948 175.6491 30 V 3.9094 8.2419 121.4883 61.1694 31.8370 177.5067 31 K 4.0713 8.6567 128.1288 56.5015 31.1246 176.7007 32 T 3.2801 10.7500 117.7392 60.8738 66.2155 170.9216 33 G 4.1434 8.3073 106.6634 46.5949 0.0000 173.4516 34 E 3.9430 9.3382 121.6098 57.4595 28.5541 179.5562 35 E 3.5664 9.9250 125.8037 57.2243 34.5922 177.0026 36 D 4.6287 8.7747 122.0255 55.0882 38.9660 172.6527 37 E 5.4870 8.6960 119.0011 55.7886 33.7246 174.0868 38 E 4.7000 8.3944 117.0723 54.5761 33.0305 175.2092 39 E 4.4887 8.9164 122.1555 56.6717 27.8412 176.9849 40 F 4.2477 9.5232 126.0780 59.4673 40.1670 174.3475 41 F 4.6446 7.9960 118.9394 58.9185 43.6642 172.5800 42 C 5.0977 7.6516 121.3532 59.1820 33.1316 172.0727 43 N 5.2375 9.1656 124.7403 51.5482 42.6226 173.2342 44 R 4.9350 8.6909 120.1951 56.2019 31.2677 175.3257 45 A 4.5439 9.5272 122.9197 51.3965 23.4567 174.2033 46 K 4.7913 8.3470 118.4885 54.7152 34.8172 174.9439 47 L 5.1625 9.3127 129.8025 53.4743 44.7335 174.9257 48 F 5.3657 9.6877 123.4898 55.7114 43.0323 173.6610 49 R 5.3084 9.1023 123.3375 54.5619 32.5220 175.1649 50 F 3.6203 8.5981 127.9332 58.1930 39.8585 174.2573 51 D 4.3122 6.3106 120.8383 55.7868 41.5539 177.7788 52 V 3.9772 7.8083 121.1466 64.0290 31.3190 172.3078 53 E 4.1132 8.1664 118.4265 58.4049 30.7272 177.1996 54 S 4.4239 8.0459 107.1736 57.4610 62.9557 173.6173 55 K 4.6555 8.4101 126.8770 55.4380 34.5447 173.0169 56 E 4.2537 7.2349 117.3512 56.3213 31.2771 175.7609 57 W 4.3766 8.5540 121.4749 56.0628 30.5185 175.7597 58 K 4.7682 9.1735 123.3332 54.1604 35.0027 175.1892 59 E 3.5488 8.8425 125.2812 56.6235 29.3276 176.0772 60 R 4.2569 9.0903 129.0772 56.6290 31.3344 176.4167 61 G 3.9614 6.7777 107.5362 45.3159 0.0000 171.2627 62 I 5.2015 8.0123 119.1168 58.2019 41.2223 174.4389 63 G 4.4048 7.7680 115.3369 46.3385 0.0000 170.8685 64 N 5.4729 8.0956 120.7155 51.8773 40.8361 174.8061 65 V 4.2425 9.1784 119.0636 60.8871 32.5485 175.8573 66 K 5.3946 9.2720 124.7258 54.8845 36.1727 175.6256 67 I 4.7703 8.7884 121.8517 59.7749 39.7978 173.7631 68 L 5.3823 8.8918 126.8310 52.0894 44.2227 175.6338 69 R 4.9334 8.4819 119.8780 54.2806 32.1328 175.0096 70 H 4.5854 8.6013 122.5159 56.4711 30.6216 176.4191 71 K 4.0400 9.2573 125.2823 59.7233 32.1677 178.0853 72 T 3.9901 7.7482 114.4792 64.1534 68.2616 175.6409 73 S 3.9882 8.1058 121.6869 60.5079 63.4749 176.6637 74 G 4.2285 8.2562 106.1049 45.5074 0.0000 172.9466 75 K 4.3239 8.0139 120.3223 55.3018 33.1212 176.3669 76 I 4.6509 8.4233 127.5777 61.1237 38.6061 175.6109 77 R 5.0372 9.4603 122.9656 54.2266 33.5635 174.0427 78 L 4.7934 8.9621 121.3237 53.3925 43.6204 174.7656 79 L 4.8795 8.3714 128.6663 53.5056 43.9859 174.6743 80 M 5.3628 8.7325 125.7326 52.9881 35.6474 174.1960 81 R 5.1570 8.3718 123.0123 54.8129 34.7064 173.4060 82 R 5.0895 8.5940 122.1319 54.3886 32.1803 176.3794 83 E 4.2069 8.6182 121.9709 57.3316 30.3456 175.4815 84 Q 3.8909 8.9121 121.2131 56.4647 27.1091 175.4808 85 V 3.8106 7.5648 116.2919 61.3049 32.5090 174.2953 86 L 4.1831 7.8692 120.7997 53.8694 38.3284 172.8573 87 K 4.7036 7.8423 120.3568 54.3081 36.7287 175.8246 88 I 4.4117 8.4290 125.1258 61.8698 37.8936 176.1795 89 C 4.7971 8.4864 117.5885 58.1605 31.5630 173.3737 90 A 4.7037 7.9415 117.1848 52.6147 21.2148 177.3921 91 N 4.8730 10.4643 117.5405 53.7017 43.8516 174.2351 92 H 4.4535 8.4140 113.7460 56.7367 29.8507 173.5646 93 Y 4.7958 8.4522 116.6670 56.8222 39.0574 175.7999 94 I 3.9851 8.3301 125.2766 61.5162 37.4812 175.5584 95 S 4.7445 8.4961 119.5860 55.6948 65.4289 172.6302 96 P 4.4180 0.0000 0.0000 64.0788 31.4110 177.5148 97 D 4.5325 7.8301 118.0301 56.6881 41.1714 177.2363 98 M 4.2528 7.6671 119.0163 55.0859 32.2435 175.6426 99 K 4.4822 8.6060 124.2276 54.3607 33.8786 176.2887 100 L 4.4006 8.4610 127.6885 54.8634 39.8517 176.8833 101 T 4.5010 8.4265 113.5349 60.0893 71.6343 175.9107 102 P 4.7660 0.0000 0.0000 62.4832 30.7953 177.7900 103 N 4.7393 10.3139 135.0000 54.8967 39.6970 172.6464 104 A 3.8236 9.0078 129.6888 52.9013 16.2292 178.6216 105 G 3.9061 8.4792 106.1567 47.2774 0.0000 175.3260 106 S 4.2417 7.9473 115.9909 58.6645 60.6026 174.0432 107 D 4.8991 8.3342 123.8915 53.4922 38.2837 177.9343 108 R 4.8674 8.1392 116.6037 56.2736 32.4547 174.9343 109 S 4.0054 7.2520 112.1534 57.1340 65.9963 173.1922 110 F 6.2020 9.0947 119.2529 54.8926 43.6864 173.8772 111 V 5.8203 9.2581 119.0305 59.1396 34.5410 174.6595 112 W 5.2792 8.4943 118.9607 55.6928 31.6552 172.6089 113 H 5.2462 8.9101 120.5282 55.2217 31.0567 173.9601 114 A 4.4207 8.2421 124.4899 50.2614 22.8126 176.2108 115 L 4.6359 8.1361 125.2714 53.8495 39.7848 175.5852 116 D 4.7290 8.0033 122.4632 54.4001 43.3785 175.9806 117 Y 5.3212 8.4134 119.8434 57.1928 40.0484 176.5482 118 A 3.8274 10.1803 124.0537 54.8378 18.3396 179.0853 119 D 4.5517 7.8880 112.1751 53.8104 41.1801 176.0978 120 E 2.5400 8.5630 118.0090 56.1346 27.0797 174.4149 121 L 4.7396 7.1929 117.4135 52.6777 45.6943 173.6884 122 P 4.9129 0.0000 0.0000 63.0373 31.8690 175.9428 123 K 4.6494 9.0440 124.1392 53.9339 35.6787 175.7270 124 P 4.8563 0.0000 0.0000 62.1985 29.8684 174.7936 125 E 4.5626 8.7194 127.6044 56.2009 32.2834 174.8990 126 Q 4.7538 8.4923 121.6090 54.8342 30.7742 174.9242 127 L 5.4693 8.7280 123.0080 53.0122 45.6759 175.1508 128 A 5.0675 8.5973 120.8741 50.6073 22.8531 175.1264 129 I 4.8974 9.2749 122.2538 59.0709 41.6551 174.0471 130 R 4.6844 8.7173 128.8539 54.4123 33.0948 173.9318 131 F 5.0738 9.6149 124.2907 55.4192 41.1025 175.5976 132 K 3.9520 9.2325 123.9387 59.4145 31.6424 176.8312 133 T 4.7856 8.0141 107.4345 58.6800 72.9494 172.8684 134 P 4.5262 0.0000 0.0000 65.1753 31.4939 177.9758 135 E 3.9405 8.2785 117.9451 59.5564 29.3969 179.1979 136 E 3.8530 8.1690 117.8523 59.0924 29.3868 179.3502 137 A 3.7363 7.6213 119.7776 55.0786 18.5786 179.1952 138 A 4.0867 8.9065 120.3447 55.5818 18.4405 179.6119 139 L 4.0077 8.3034 118.8276 58.2418 42.1518 178.8726 140 F 3.3784 8.3419 120.6014 61.0471 39.2054 176.5524 141 K 3.3769 8.8506 119.6022 60.4534 31.8464 177.3572 142 C 3.7007 8.8482 117.3653 62.5271 31.2383 175.5897 143 K 3.9541 8.4234 118.7121 59.7669 32.0364 178.5946 144 F 3.6159 7.6826 119.6857 61.4006 39.4141 176.8007 145 E 4.0506 8.1890 119.6030 58.7104 28.8016 178.9195 146 E 3.8168 9.0735 121.2586 58.2892 29.4302 177.9337 147 A 3.6888 7.2133 118.1701 52.8569 18.3841 178.1271 148 Q 4.1694 8.1584 116.9284 56.7797 30.0201 177.3924 149 S 4.3192 7.4786 114.1838 59.7148 62.5048 174.4527 150 I 4.0719 7.2001 128.3087 61.3277 37.2984 175.2399 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 17 H 8.44 4.50 0.00 2.96 3.24 0.00 5.87 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 F 8.02 4.86 0.00 3.18 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 19 E 9.35 4.64 0.00 1.89 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 2.19 2.36 0.00 20 P 0.00 4.51 0.00 2.10 2.02 0.00 3.70 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 2.06 2.17 0.00 21 V 8.14 4.57 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.92 0.00 0.00 22 V 7.14 4.39 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 0.67 0.00 0.00 0.93 0.00 0.00 23 P 0.00 4.22 0.00 2.20 2.11 0.00 3.79 0.00 0.00 3.58 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 24 L 8.61 3.89 0.00 1.61 1.68 0.93 1.01 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 25 P 0.00 4.46 0.00 2.09 1.97 0.00 3.73 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 2.03 2.19 0.00 26 D 8.33 4.57 0.00 2.65 2.60 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 27 K 8.42 4.14 0.00 1.75 1.77 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.47 7.81 28 I 7.80 4.52 1.88 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 1.31 0.89 0.92 0.00 0.00 29 E 8.47 4.28 0.00 1.93 1.89 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 2.25 2.33 0.00 30 V 8.24 3.91 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 0.73 0.00 0.00 0.94 0.00 0.00 31 K 8.66 4.07 0.00 1.70 1.39 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.51 7.81 32 T 10.75 3.28 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 1.31 0.00 0.00 33 G 8.31 4.14 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 0.00 34 E 9.34 3.94 0.00 1.96 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.41 0.00 35 E 9.93 3.57 0.00 2.19 2.35 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 2.32 2.30 0.00 36 D 8.77 4.63 0.00 2.80 2.79 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 37 E 8.70 5.49 0.00 1.96 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 0.00 2.35 2.18 0.00 38 E 8.39 4.70 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 39 E 8.92 4.49 0.00 2.00 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 0.00 2.48 2.36 0.00 40 F 9.52 4.25 0.00 3.17 3.12 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 0.00 0.00 0.00 41 F 8.00 4.64 0.00 3.28 2.84 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 42 C 7.65 5.10 0.00 3.08 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 N 9.17 5.24 0.00 2.48 2.91 0.00 0.00 6.67 7.24 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 44 R 8.69 4.94 0.00 1.94 2.23 0.00 3.23 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 45 A 9.53 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.35 4.79 0.00 1.80 1.68 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.92 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.71 1.25 7.81 47 L 9.31 5.16 0.00 1.60 1.39 1.14 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 48 F 9.69 5.37 0.00 2.55 2.85 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 49 R 9.10 5.31 0.00 1.91 1.83 0.00 3.26 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 50 F 8.60 3.62 0.00 1.74 2.46 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 0.00 0.00 0.00 0.00 51 D 6.31 4.31 0.00 2.49 2.28 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 52 V 7.81 3.98 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 0.79 0.00 0.00 1.03 0.00 0.00 53 E 8.17 4.11 0.00 1.91 2.41 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 2.27 2.36 0.00 54 S 8.05 4.42 0.00 3.89 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.41 4.66 0.00 1.74 1.80 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.41 7.81 56 E 7.23 4.25 0.00 2.05 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 2.11 2.15 0.00 57 W 8.55 4.38 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 58 K 9.17 4.77 0.00 1.81 1.68 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.27 7.81 59 E 8.84 3.55 0.00 1.83 1.75 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 2.05 1.80 0.00 60 R 9.09 4.26 0.00 1.78 1.93 0.00 3.43 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 61 G 6.78 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 62 I 8.01 5.20 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.31 0.87 0.00 0.00 63 G 7.77 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 0.00 0.00 0.00 0.00 64 N 8.10 5.47 0.00 2.72 2.85 0.00 0.00 6.87 7.68 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 65 V 9.18 4.24 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 0.81 0.00 0.00 1.31 0.00 0.00 66 K 9.27 5.39 0.00 1.90 1.82 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.50 7.81 67 I 8.79 4.77 2.02 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.91 0.71 0.00 0.00 68 L 8.89 5.38 0.00 1.87 1.63 0.99 0.73 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 69 R 8.48 4.93 0.00 2.01 2.18 0.00 3.11 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.79 0.00 70 H 8.60 4.59 0.00 3.39 3.43 0.00 5.59 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 K 9.26 4.04 0.00 1.83 1.91 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.56 7.81 72 T 7.75 3.99 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 1.16 0.00 0.00 73 S 8.11 3.99 0.00 3.91 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 74 G 8.26 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 75 K 8.01 4.32 0.00 1.92 1.85 0.00 1.43 0.00 0.00 0.92 0.00 0.00 2.64 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.31 1.36 7.81 76 I 8.42 4.65 1.78 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.98 0.77 0.00 0.00 77 R 9.46 5.04 0.00 1.67 1.59 0.00 2.57 0.00 0.00 2.79 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.48 0.00 78 L 8.96 4.79 0.00 1.73 1.61 1.03 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.37 4.88 0.00 1.83 1.54 0.97 0.74 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 80 M 8.73 5.36 0.00 2.19 1.94 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.31 0.00 81 R 8.37 5.16 0.00 1.89 1.71 0.00 3.23 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 82 R 8.59 5.09 0.00 1.80 1.79 0.00 3.16 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 83 E 8.62 4.21 0.00 1.99 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 2.57 2.28 0.00 84 Q 8.91 3.89 0.00 2.23 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.02 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 85 V 7.56 3.81 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.92 0.00 0.00 86 L 7.87 4.18 0.00 1.81 1.75 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.84 4.70 0.00 1.60 1.61 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.40 7.81 88 I 8.43 4.41 2.00 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 1.40 0.46 1.02 0.00 0.00 89 C 8.49 4.80 0.00 2.90 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 90 A 7.94 4.70 1.36 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 0.00 0.00 0.00 91 N 10.46 4.87 0.00 2.66 2.89 0.00 0.00 7.21 8.07 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 92 H 8.41 4.45 0.00 3.44 3.58 0.00 5.69 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 93 Y 8.45 4.80 0.00 2.92 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 94 I 8.33 3.99 1.64 0.00 0.00 0.57 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 0.47 0.06 0.00 0.00 95 S 8.50 4.74 0.00 3.83 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 96 P 0.00 4.42 0.00 2.05 2.03 0.00 3.69 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 97 D 7.83 4.53 0.00 2.73 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 98 M 7.67 4.25 0.00 2.34 2.25 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.64 0.00 99 K 8.61 4.48 0.00 1.72 1.77 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.46 7.81 100 L 8.46 4.40 0.00 1.45 1.24 -0.08 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 101 T 8.43 4.50 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 102 P 0.00 4.77 0.00 2.28 1.37 0.00 3.81 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 2.21 2.26 0.00 103 N 10.31 4.74 0.00 2.89 2.75 0.00 0.00 6.80 8.51 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 0.00 104 A 9.01 3.82 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 0.00 105 G 8.48 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 0.00 106 S 7.95 4.24 0.00 3.76 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.33 4.90 0.00 2.97 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 R 8.14 4.87 0.00 1.64 2.14 0.00 3.12 0.00 0.00 3.18 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.50 0.00 109 S 7.25 4.01 0.00 3.58 3.41 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 0.00 110 F 9.09 6.20 0.00 3.06 3.24 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 0.00 111 V 9.26 5.82 2.14 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 1.06 0.00 0.00 1.17 0.00 0.00 112 W 8.49 5.28 0.00 3.49 3.30 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 0.00 113 H 8.91 5.25 0.00 3.13 3.29 0.00 5.95 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 0.00 114 A 8.24 4.42 1.08 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 0.00 115 L 8.14 4.64 0.00 1.69 1.66 0.96 1.29 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 0.00 116 D 8.00 4.73 0.00 3.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Y 8.41 5.32 0.00 2.96 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 0.00 118 A 10.18 3.83 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 0.00 119 D 7.89 4.55 0.00 2.62 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 0.00 120 E 8.56 2.54 0.00 1.84 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 1.99 1.87 0.00 121 L 7.19 4.74 0.00 1.61 1.59 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.91 0.00 2.14 2.13 0.00 3.89 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 123 K 9.04 4.65 0.00 1.76 1.74 0.00 1.88 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.64 7.81 124 P 0.00 4.86 0.00 2.18 2.16 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 2.03 0.00 125 E 8.72 4.56 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 126 Q 8.49 4.75 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.72 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 127 L 8.73 5.47 0.00 0.27 0.68 0.68 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.60 5.07 0.19 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 0.00 0.00 129 I 9.27 4.90 2.09 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 0.34 0.47 0.73 0.00 0.00 130 R 8.72 4.68 0.00 1.59 1.62 0.00 3.04 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.35 0.00 131 F 9.61 5.07 0.00 3.14 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 0.00 132 K 9.23 3.95 0.00 1.75 2.18 0.00 1.62 0.00 0.00 1.78 0.00 0.00 3.16 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.55 7.81 133 T 8.01 4.79 4.39 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 1.25 0.00 0.00 134 P 0.00 4.53 0.00 2.32 2.36 0.00 3.90 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 1.92 0.00 135 E 8.28 3.94 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 136 E 8.17 3.85 0.00 2.19 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 137 A 7.62 3.74 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 138 A 8.91 4.09 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 0.00 139 L 8.30 4.01 0.00 1.82 1.96 1.04 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 140 F 8.34 3.38 0.00 2.87 3.22 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 0.00 141 K 8.85 3.38 0.00 1.54 2.00 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.15 7.81 142 C 8.85 3.70 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 8.42 3.95 0.00 1.98 2.06 0.00 2.50 0.00 0.00 2.12 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.73 2.14 7.81 144 F 7.68 3.62 0.00 1.74 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 0.00 145 E 8.19 4.05 0.00 2.05 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 2.40 2.26 0.00 146 E 9.07 3.82 0.00 2.03 2.19 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 2.73 2.35 0.00 147 A 7.21 3.69 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 Q 8.16 4.17 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.83 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 149 S 7.48 4.32 0.00 4.03 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 0.00 150 I 7.20 4.07 1.82 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.78 0.93 0.00 0.00