NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4456 8.3049 118.1935 54.6928 32.6106 174.5012 2 L 4.1327 8.0995 119.0541 52.8191 42.3690 176.0915 3 T 4.1241 8.5538 112.3172 63.4336 70.6309 174.4856 4 D 4.5475 7.6111 120.1036 50.9245 42.8028 173.3106 5 P 4.2245 0.0000 0.0000 65.2003 31.4788 178.3916 6 I 3.6289 7.7274 118.2698 64.0446 37.1247 178.0483 7 A 4.0614 9.9866 122.1147 54.7847 18.0979 179.1001 8 D 4.2152 8.0861 116.8531 57.6351 41.2788 178.2841 9 M 3.8955 7.9328 118.4799 58.8035 32.3100 177.9320 10 L 3.8522 8.1644 119.4705 58.2451 41.3956 179.8999 11 T 3.8679 7.9061 115.2427 66.4174 68.5413 176.9688 12 R 3.9593 8.1328 120.3341 59.6283 30.1049 179.1419 13 I 3.6273 7.7993 119.0805 64.2969 36.9344 178.2907 14 R 3.7739 7.6464 118.1833 59.6607 30.0795 177.9421 15 N 4.3443 9.2395 116.7454 56.1123 38.5208 176.8697 16 A 3.9828 8.3437 122.5995 55.9011 18.5850 179.9120 17 T 3.9769 8.0229 107.6675 64.8060 68.5990 176.6927 18 R 3.9325 7.8577 119.6523 57.5843 30.0462 177.4979 19 V 4.4287 7.1384 110.5262 60.4841 32.4906 174.6841 20 Y 3.4232 6.9031 114.3727 56.8992 35.8752 171.5340 21 K 4.0838 7.9657 117.4757 56.7661 33.2714 177.4490 22 E 4.2593 8.8199 120.5244 58.8465 29.9415 176.1532 23 S 5.0805 7.2858 109.5601 57.1107 66.5005 171.8631 24 T 4.3786 7.9343 110.0798 61.7574 70.2934 172.3624 25 D 5.2973 8.7517 127.9683 53.0945 43.1237 176.2346 26 V 4.6209 8.0683 114.8901 58.7294 36.0468 173.3677 27 P 3.3538 0.0000 0.0000 62.8622 31.7683 175.6307 28 A 4.6341 8.0440 125.0445 51.2021 20.3466 177.0338 29 S 4.5912 8.1941 113.0138 55.9058 66.1709 175.5757 30 R 3.9176 8.9071 122.5087 59.6236 29.9909 178.8517 31 F 4.4868 8.3440 119.6851 61.5147 39.2701 177.0448 32 K 3.5826 8.3591 118.2185 59.3966 31.8535 178.8100 33 E 3.5171 8.1602 119.4717 59.2204 29.1460 178.3408 34 E 3.9738 8.6457 119.6350 59.5147 29.6068 178.9915 35 I 3.5729 7.4335 119.3508 64.0292 37.0088 178.2769 36 L 3.8471 7.6270 119.9364 57.7885 41.3081 179.4549 37 R 4.1298 7.8252 117.9415 59.6960 29.9873 179.1149 38 I 3.7672 7.3612 118.8061 64.3190 37.0853 178.3093 39 L 4.1828 8.0668 119.6646 58.1678 41.3970 179.2847 40 A 4.0547 9.0820 121.7628 54.9746 18.1776 179.2414 41 R 3.7113 8.3156 116.7753 59.8001 30.2747 177.8727 42 E 4.1758 8.3273 115.0330 55.8404 30.0664 176.3510 43 G 3.6698 8.7074 107.9216 46.8585 0.0000 174.8006 44 F 4.7424 8.2761 118.8675 57.4927 40.3713 176.1641 45 I 4.7199 7.4610 111.4397 58.6765 40.4276 175.2332 46 K 4.1049 9.3146 119.4959 56.9957 32.5170 176.6622 47 G 4.0718 7.3282 104.6626 43.8985 0.0000 171.1402 48 Y 5.6388 7.7317 117.5754 56.3174 41.3732 173.7947 49 E 4.6051 8.9367 115.0908 55.0646 33.1462 175.0603 50 R 4.5224 8.6501 121.7045 56.8241 31.1183 176.0884 51 V 4.5364 8.3804 114.1850 60.5232 37.1621 173.6546 52 D 5.4674 8.5258 121.5284 52.3328 42.0534 175.1901 53 V 3.5652 8.1670 122.2293 63.1554 33.6306 176.1766 54 D 4.3773 9.1201 128.5538 55.4355 40.2667 174.1718 55 G 4.1625 9.3517 102.6886 44.6197 0.0000 172.4127 56 K 4.7199 8.0317 119.9935 53.2452 34.9606 173.6571 57 P 4.6991 0.0000 0.0000 63.8679 32.5434 174.7871 58 Y 5.1613 8.9464 122.5108 56.7714 41.6311 174.5433 59 L 5.0368 8.5497 118.6061 53.8394 44.9763 175.1117 60 R 4.2211 8.6874 123.2900 56.6632 30.9668 175.8566 61 V 4.1335 8.5378 124.6315 60.8749 33.3328 173.6706 62 Y 4.2630 8.4734 125.9934 57.9140 38.5152 176.2905 63 L 4.5262 8.3166 124.6666 54.4350 42.9673 176.5084 64 K 4.6087 7.5881 119.8586 55.4892 35.3843 174.2466 65 Y 4.8865 8.5055 122.3094 56.5780 43.2257 174.5361 66 G 4.1170 8.6630 109.2478 44.6304 0.0000 171.5548 67 P 4.7024 0.0000 0.0000 61.6022 33.3701 175.6313 68 R 4.1079 8.5699 121.3701 57.3201 30.7958 174.6103 69 R 4.8123 8.5108 120.0657 54.5382 34.3664 174.9816 70 Q 4.3166 8.6838 118.4513 56.0500 30.3113 178.1698 71 G 3.8638 8.4171 108.3803 44.3851 0.0000 171.6218 72 P 4.2217 0.0000 0.0000 63.6721 31.8765 174.7611 73 D 4.2827 8.5379 122.3744 54.2187 38.4693 171.5254 74 P 4.5145 0.0000 0.0000 63.3280 32.2175 177.2854 75 R 3.8868 7.4274 118.9474 56.2367 30.2488 174.9778 76 P 4.7029 0.0000 0.0000 62.0758 32.4946 175.5911 77 E 4.3634 8.8363 121.7806 56.5721 31.1664 175.1568 78 Q 4.9497 8.3565 121.2518 54.6818 30.2035 176.5039 79 V 3.8566 8.4758 121.9685 65.6022 31.9641 176.9226 80 I 4.3233 7.2891 121.7730 60.1783 35.6718 174.8176 81 H 4.3306 8.6332 121.8270 58.1608 29.4715 175.7278 82 H 4.3138 7.8372 118.4528 54.1114 33.1195 172.6846 83 I 4.6135 7.6532 125.6313 60.0047 40.1662 173.5024 84 R 4.5838 8.6882 130.0688 54.2656 33.4760 174.5231 85 R 4.1251 8.5959 124.7191 56.6597 30.4470 175.0990 86 I 4.2496 8.2957 123.1836 63.1148 38.3388 176.1212 87 S 4.3234 8.0386 117.6879 58.5761 63.2944 173.1704 88 K 4.6119 8.5339 122.8054 54.2785 36.2912 174.0224 89 P 4.4368 0.0000 0.0000 64.2929 31.7034 176.8970 90 G 4.0054 10.0622 110.5216 45.6347 0.0000 173.7246 91 R 4.4761 7.8808 114.3477 56.0981 32.2931 172.7485 92 R 4.2555 8.0365 120.4465 55.0332 31.5134 176.0613 93 V 4.2040 8.1754 121.7991 61.2386 33.8415 173.8162 94 Y 5.5457 8.5006 124.8144 56.4438 41.0914 175.4150 95 V 4.6051 9.3486 115.3395 59.6522 36.4642 175.2086 96 G 4.2961 9.0170 110.3173 44.9204 0.0000 175.1612 97 V 3.5992 8.6112 120.5297 64.7360 31.1662 178.6555 98 K 4.1350 8.0481 117.6475 58.0935 32.0207 177.1643 99 E 4.5393 8.5803 117.7196 55.7617 30.0706 176.2656 100 I 3.7960 7.4143 120.8736 60.6993 37.4975 174.6093 101 P 4.6115 0.0000 0.0000 62.1557 32.2072 176.7515 102 R 4.4226 7.9419 114.4146 53.8324 29.7017 173.3724 103 V 3.4379 8.2961 124.7562 65.0244 32.1781 175.3400 104 R 3.4465 9.0277 121.9128 59.7256 26.9377 177.0161 105 R 3.5821 8.4110 121.7572 57.0459 27.9618 177.3095 106 G 4.0568 8.0390 111.2124 45.6964 0.0000 175.6260 107 L 4.2698 8.5300 118.8913 55.9430 41.6196 176.1981 108 G 4.4986 7.5859 105.7605 43.6147 0.0000 171.1679 109 I 5.0994 9.0856 111.5568 59.0130 41.6948 174.1784 110 A 5.1164 8.9677 123.4482 50.2229 22.5246 175.3387 111 I 4.4515 8.8644 122.9003 59.8388 39.2933 175.5054 112 L 4.9705 8.6682 127.7042 53.5648 44.5540 175.8519 113 S 4.9171 8.9869 114.8565 57.0783 65.0165 172.9821 114 T 4.9602 8.4441 117.4896 59.5828 72.0339 174.7062 115 S 4.5471 8.6943 113.8508 59.0049 63.2616 174.4778 116 K 4.3776 8.0423 120.2356 56.2162 32.5450 177.1076 117 G 3.9244 7.8462 106.3575 44.5001 0.0000 173.3122 118 V 4.2918 8.0738 118.8199 63.0385 32.0378 175.0182 119 L 5.3159 9.0726 126.6756 52.2553 46.8798 175.6479 120 T 4.9168 8.4656 110.6544 60.4955 70.9950 175.4462 121 D 4.4956 8.8344 121.5194 55.4297 38.9496 178.0257 122 R 4.3053 7.7192 118.8945 58.5247 31.0528 177.9407 123 E 3.6179 8.2847 117.4891 59.5382 29.3632 179.4853 124 A 4.0198 8.3227 120.7634 55.2068 18.3984 179.6134 125 R 3.8644 7.3259 114.4890 59.4424 30.3482 178.3498 126 K 4.1025 8.9411 120.6128 59.4634 32.1212 178.4422 127 L 4.1784 7.9267 115.4608 54.4994 41.6278 177.1356 128 G 4.0320 7.9563 106.9446 46.7002 0.0000 173.7473 129 V 4.5815 7.9585 110.0285 59.2217 35.9603 175.2651 130 G 4.3335 9.0098 108.6680 46.0556 0.0000 173.2004 131 G 3.9967 7.3160 106.0833 46.4208 0.0000 171.6740 132 E 4.8081 8.3597 125.5810 55.4395 31.0571 176.6362 133 L 4.4881 8.7711 130.4130 55.0824 42.1018 177.3362 134 I 3.9225 8.8578 129.0696 63.7500 38.2802 175.8871 135 C 5.1864 7.2889 114.5353 57.8927 32.2796 172.1423 136 E 5.2086 8.3814 116.6568 54.6335 32.7610 175.1863 137 V 4.8360 9.1575 121.1021 61.0417 35.5711 174.9733 138 W 4.9854 8.7941 124.2312 57.0075 28.2397 174.4437 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.45 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 2 L 8.10 4.13 0.00 1.72 1.61 0.96 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.55 4.12 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 1.20 0.00 0.00 4 D 7.61 4.55 0.00 2.64 2.50 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 0.00 0.00 0.00 0.00 5 P 0.00 4.22 0.00 2.17 2.03 0.00 3.65 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 2.10 2.15 0.00 6 I 7.73 3.63 1.79 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 1.09 -0.08 0.74 0.00 0.00 7 A 9.99 4.06 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 8 D 8.09 4.22 0.00 2.85 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 9 M 7.93 3.90 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 10 L 8.16 3.85 0.00 1.71 1.61 0.82 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.91 3.87 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 12 R 8.13 3.96 0.00 1.90 1.98 0.00 3.17 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 1.63 1.79 0.00 13 I 7.80 3.63 1.95 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.86 0.81 0.00 0.00 14 R 7.65 3.77 0.00 1.82 1.97 0.00 3.16 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 15 N 9.24 4.34 0.00 2.75 2.80 0.00 0.00 6.91 6.99 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 16 A 8.34 3.98 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 17 T 8.02 3.98 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 1.12 0.00 0.00 18 R 7.86 3.93 0.00 1.86 1.95 0.00 3.01 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 19 V 7.14 4.43 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 0.75 0.00 0.00 0.96 0.00 0.00 20 Y 6.90 3.42 0.00 2.96 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.97 4.08 0.00 1.95 2.00 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.47 7.81 22 E 8.82 4.26 0.00 2.13 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 2.51 2.56 0.00 23 S 7.29 5.08 0.00 3.35 3.36 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 24 T 7.93 4.38 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 25 D 8.75 5.30 0.00 2.57 2.68 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 26 V 8.07 4.62 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.83 0.00 0.00 27 P 0.00 3.35 0.00 1.70 1.61 0.00 3.53 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.80 0.00 28 A 8.04 4.63 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 29 S 8.19 4.59 0.00 3.99 3.89 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 30 R 8.91 3.92 0.00 1.92 2.09 0.00 3.17 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 1.76 1.73 0.00 31 F 8.34 4.49 0.00 3.02 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 32 K 8.36 3.58 0.00 1.86 1.66 0.00 1.69 0.00 0.00 1.45 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.26 1.30 7.81 33 E 8.16 3.52 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 2.37 2.18 0.00 34 E 8.65 3.97 0.00 2.39 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 0.00 2.41 2.48 0.00 35 I 7.43 3.57 1.76 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.31 0.78 0.00 0.00 36 L 7.63 3.85 0.00 1.10 1.21 0.36 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.83 4.13 0.00 2.08 2.09 0.00 3.24 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.00 0.00 38 I 7.36 3.77 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.55 0.99 0.00 0.00 39 L 8.07 4.18 0.00 1.94 1.79 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 40 A 9.08 4.05 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.32 3.71 0.00 1.88 2.24 0.00 3.29 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 42 E 8.33 4.18 0.00 1.86 1.71 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 2.63 2.58 0.00 43 G 8.71 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 0.00 0.00 0.00 44 F 8.28 4.74 0.00 3.26 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 45 I 7.46 4.72 2.11 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.86 0.94 0.00 0.00 46 K 9.31 4.10 0.00 1.96 1.94 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.56 7.81 47 G 7.33 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 0.00 0.00 0.00 48 Y 7.73 5.64 0.00 3.17 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.94 4.61 0.00 2.07 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 2.60 2.43 0.00 50 R 8.65 4.52 0.00 1.78 1.98 0.00 3.25 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.79 0.00 51 V 8.38 4.54 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 0.80 0.00 0.00 1.00 0.00 0.00 52 D 8.53 5.47 0.00 2.52 2.62 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 53 V 8.17 3.57 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.52 0.00 0.00 54 D 9.12 4.38 0.00 2.79 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 0.00 0.00 0.00 55 G 9.35 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 0.00 0.00 0.00 56 K 8.03 4.72 0.00 2.11 1.79 0.00 1.62 0.00 0.00 1.85 0.00 0.00 3.10 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.43 7.81 57 P 0.00 4.70 0.00 2.13 2.24 0.00 3.67 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 2.04 2.01 0.00 58 Y 8.95 5.16 0.00 2.93 2.94 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 59 L 8.55 5.04 0.00 1.57 1.64 0.77 1.31 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 60 R 8.69 4.22 0.00 1.58 1.25 0.00 3.19 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 61 V 8.54 4.13 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 0.97 0.00 0.00 1.00 0.00 0.00 62 Y 8.47 4.26 0.00 3.21 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 63 L 8.32 4.53 0.00 1.56 1.20 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.59 4.61 0.00 1.69 1.53 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.49 7.81 65 Y 8.51 4.89 0.00 3.05 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.66 4.12 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 0.00 0.00 0.00 67 P 0.00 4.70 0.00 2.14 2.20 0.00 3.78 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 2.07 1.98 0.00 68 R 8.57 4.11 0.00 1.80 1.89 0.00 3.13 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 69 R 8.51 4.81 0.00 1.66 1.80 0.00 3.23 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 70 Q 8.68 4.32 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.81 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 71 G 8.42 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 0.00 0.00 0.00 72 P 0.00 4.22 0.00 2.05 2.00 0.00 3.83 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 2.03 2.07 0.00 73 D 8.54 4.28 0.00 2.79 2.67 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 74 P 0.00 4.51 0.00 2.19 2.24 0.00 3.73 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 1.98 1.93 0.00 75 R 7.43 3.89 0.00 1.79 1.72 0.00 3.34 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.44 0.00 76 P 0.00 4.70 0.00 2.25 2.06 0.00 2.60 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.57 0.00 77 E 8.84 4.36 0.00 2.15 1.95 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 2.43 2.35 0.00 78 Q 8.36 4.95 0.00 1.85 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.25 0.00 79 V 8.48 3.86 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 1.02 0.00 0.00 1.01 0.00 0.00 80 I 7.29 4.32 1.75 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.70 0.66 0.00 0.00 81 H 8.63 4.33 0.00 3.11 3.44 0.00 5.84 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 82 H 7.84 4.31 0.00 1.40 1.31 0.00 5.60 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.65 4.61 1.59 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.65 0.75 0.00 0.00 84 R 8.69 4.58 0.00 1.67 1.70 0.00 3.16 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.50 0.00 85 R 8.60 4.13 0.00 1.68 1.80 0.00 3.48 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 86 I 8.30 4.25 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.56 0.89 0.00 0.00 87 S 8.04 4.32 0.00 3.99 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 88 K 8.53 4.61 0.00 1.79 1.59 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.56 7.81 89 P 0.00 4.44 0.00 2.03 1.99 0.00 3.64 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 2.02 2.09 0.00 90 G 10.06 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.88 4.48 0.00 1.68 1.71 0.00 3.20 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.61 0.00 92 R 8.04 4.26 0.00 1.35 1.48 0.00 3.37 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 93 V 8.18 4.20 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 0.94 0.00 0.00 0.89 0.00 0.00 94 Y 8.50 5.55 0.00 2.89 2.74 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 95 V 9.35 4.61 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 0.92 0.00 0.00 1.03 0.00 0.00 96 G 9.02 4.30 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 0.00 97 V 8.61 3.60 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 0.76 0.00 0.00 1.01 0.00 0.00 98 K 8.05 4.13 0.00 1.78 1.92 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 8.58 4.54 0.00 2.12 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 2.27 2.26 0.00 100 I 7.41 3.80 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.79 0.94 0.00 0.00 101 P 0.00 4.61 0.00 2.06 2.04 0.00 3.65 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 2.08 0.00 102 R 7.94 4.42 0.00 1.81 1.89 0.00 3.09 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 103 V 8.30 3.44 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 1.18 0.00 0.00 1.07 0.00 0.00 104 R 9.03 3.45 0.00 1.73 1.51 0.00 2.52 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.82 0.00 105 R 8.41 3.58 0.00 1.81 2.18 0.00 3.34 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 106 G 8.04 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 0.00 107 L 8.53 4.27 0.00 1.49 1.73 0.87 0.76 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 0.00 108 G 7.59 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 9.09 5.10 1.99 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.94 1.09 0.00 0.00 110 A 8.97 5.12 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 0.00 111 I 8.86 4.45 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.89 0.95 0.00 0.00 112 L 8.67 4.97 0.00 1.66 1.64 0.96 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.99 4.92 0.00 4.00 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 0.00 114 T 8.44 4.96 4.30 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 1.27 0.00 0.00 115 S 8.69 4.55 0.00 3.98 3.98 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 0.00 116 K 8.04 4.38 0.00 1.76 1.83 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.34 7.81 117 G 7.85 3.92 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 0.00 0.00 0.00 118 V 8.07 4.29 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 0.98 0.00 0.00 1.16 0.00 0.00 119 L 9.07 5.32 0.00 1.63 1.63 0.99 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.47 4.92 4.30 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 1.32 0.00 0.00 121 D 8.83 4.50 0.00 2.95 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 0.00 122 R 7.72 4.31 0.00 1.89 2.00 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 123 E 8.28 3.62 0.00 2.03 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 0.00 2.43 2.47 0.00 124 A 8.32 4.02 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 7.33 3.86 0.00 2.15 1.99 0.00 3.28 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 126 K 8.94 4.10 0.00 1.92 1.95 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.49 7.81 127 L 7.93 4.18 0.00 1.68 1.70 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 128 G 7.96 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 0.00 0.00 0.00 129 V 7.96 4.58 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 0.79 0.00 0.00 0.94 0.00 0.00 130 G 9.01 4.33 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 0.00 131 G 7.32 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.36 4.81 0.00 2.48 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 2.34 2.32 0.00 133 L 8.77 4.49 0.00 1.80 1.57 0.94 0.56 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 0.00 134 I 8.86 3.92 2.19 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.90 0.89 0.00 0.00 135 C 7.29 5.19 0.00 3.04 2.94 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 0.00 136 E 8.38 5.21 0.00 2.15 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 0.00 2.22 2.26 0.00 137 V 9.16 4.84 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.74 0.00 0.00 138 W 8.79 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