NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 38 G 4.2760 8.1600 109.1334 45.2706 0.0000 174.6368 39 L 3.7526 8.4133 125.2819 57.1780 42.0057 175.5943 40 E 4.1492 8.9033 119.1780 58.2530 30.2179 178.0331 41 Q 4.0273 7.9749 118.0456 59.3115 28.9453 177.8789 42 L 4.0443 7.7232 119.9350 57.9822 41.4557 179.3212 43 E 4.1145 8.1053 117.8994 59.3214 29.6613 178.5905 44 A 4.1732 7.4952 119.3148 55.1205 18.6221 178.8337 45 Q 4.4172 8.2842 113.4429 56.0921 29.0674 174.9277 46 T 4.5508 7.4157 109.7633 61.0272 72.0164 173.0016 47 N 4.6326 8.0918 116.5116 53.1213 38.3685 175.2893 48 F 5.3781 7.3144 117.2118 56.1926 41.0267 176.5000 49 T 4.5512 8.5771 114.5562 60.8981 71.1019 176.1215 50 K 3.9018 8.5132 121.0369 59.7107 31.7896 179.2407 51 R 3.8682 8.1299 118.2797 59.7938 29.8424 178.0781 52 E 3.9495 7.8532 116.6469 59.5434 29.5448 179.4255 53 L 4.0858 8.3065 119.2033 57.7977 41.6055 179.7966 54 Q 3.9922 8.1323 118.0961 58.9956 28.6770 178.7416 55 V 3.6160 7.4839 118.9913 65.9519 31.4884 177.9970 56 L 4.0508 8.0954 118.6172 58.0786 41.5333 178.7055 57 Y 3.7889 8.6845 119.7538 60.9589 38.4163 178.5631 58 R 4.0632 8.6417 118.0539 59.1800 30.4713 178.7494 59 G 3.7336 8.5421 106.0913 47.7605 0.0000 175.0826 60 F 3.6508 8.6605 123.6663 60.5386 39.2000 177.4303 61 K 3.9133 8.2939 118.3594 58.4940 31.6092 177.8199 62 N 4.4050 7.5075 115.1887 55.5631 39.1494 176.7928 63 E 4.0685 7.7558 119.0034 57.6235 29.7312 177.0540 64 C 4.4803 6.9474 113.4412 56.0471 32.3947 172.3033 65 P 4.3447 0.0000 0.0000 65.7527 31.4551 180.2344 66 S 3.7025 7.4015 111.5929 60.9116 63.7901 174.5165 67 G 4.2483 7.7824 105.7492 44.7719 0.0000 173.4367 68 V 4.4675 7.1367 111.1904 59.5000 34.1624 175.7282 69 V 4.1588 8.6150 126.9493 61.7730 32.7096 175.2179 70 N 5.4536 8.2509 126.7830 51.6817 39.9629 175.6538 71 E 4.1381 8.3966 117.8189 59.3222 29.5272 178.3932 72 D 4.5005 8.0241 118.9790 57.4797 41.0047 178.3583 73 T 3.8617 7.9923 109.8349 64.8822 68.3167 175.5289 74 F 4.1481 8.1618 124.9277 61.7198 39.5999 177.5441 75 K 4.3816 8.9595 123.5112 60.1386 31.1827 180.8158 76 Q 4.3423 8.4163 118.4297 58.4600 28.3910 178.1557 77 I 3.8313 8.2769 121.5842 63.4941 37.0863 176.5988 78 Y 4.3654 8.4441 116.6020 58.1627 38.3802 177.2161 79 A 4.1097 7.5118 120.6856 55.4349 18.4072 178.9876 80 Q 3.9449 8.5081 116.9851 61.0536 29.2925 179.5834 *81 F 3.3281 7.0158 114.4061 58.4571 38.3332 178.0139 82 F 5.0351 7.1649 118.2838 54.0534 43.3124 171.9337 83 P 4.2581 0.0000 0.0000 64.6327 30.6459 177.7982 84 H 4.8067 9.1057 113.2144 53.7462 28.1641 174.1601 85 G 4.3254 7.6010 108.7787 43.1530 0.0000 169.9857 86 D 4.7435 9.1202 118.4772 52.4529 42.3964 175.3547 87 A 4.6987 8.5622 127.9210 52.0563 19.1628 177.6942 88 S 4.1493 8.0917 115.7531 63.2397 62.1519 176.5220 89 T 4.1044 7.8787 111.6708 64.8798 68.6962 175.7480 90 Y 3.7939 8.0299 121.7204 60.0968 38.8878 177.2419 91 A 3.8115 8.2229 121.9809 55.7179 18.4172 179.0677 92 H 4.2938 7.8549 116.6103 59.2676 29.7445 177.1487 93 Y 3.8363 8.0262 116.8295 60.7271 37.9731 177.4663 94 L 3.8395 7.9282 121.7050 58.0421 42.0233 178.4552 95 F 3.7590 8.4049 121.1777 61.0474 39.0540 176.1168 96 N 4.9978 8.0548 114.4954 53.5093 37.7241 176.3950 97 A 3.9249 7.3968 125.2286 54.4344 19.0833 178.8682 98 F 4.7675 8.8383 122.4533 55.4945 37.4208 176.3925 99 D 5.0550 9.0281 125.7648 56.3191 38.2584 175.7923 100 T 3.9233 7.4440 117.6583 66.9829 68.5877 176.4821 101 T 3.9842 7.9730 116.9201 64.5675 68.8677 174.1195 102 Q 3.9123 7.7784 118.3150 56.9751 26.3810 173.6168 103 T 4.4977 8.0718 106.9468 61.8704 68.1300 174.3643 104 G 4.4582 8.8880 113.2892 44.8480 0.0000 174.0212 105 S 5.1536 7.6423 110.9141 56.4829 66.6562 173.5098 106 V 4.4268 8.5315 118.5859 60.5366 32.7596 176.8947 107 K 4.6738 8.7266 129.2843 54.2425 33.3505 174.0569 108 F 3.0654 9.0557 122.4415 62.0521 38.9700 177.4061 109 E 3.9519 8.3738 116.3326 59.5667 29.1207 178.6503 110 D 4.4080 7.9624 119.5229 57.2595 41.0874 178.2261 111 F 4.2282 8.3108 120.4868 61.8723 39.1128 177.5038 112 V 3.6273 7.6839 111.5169 64.2105 31.2765 178.6749 113 T 3.8186 7.9468 115.3958 66.5761 68.2758 176.0165 114 A 3.8218 8.1057 122.7138 55.5835 18.2637 179.8153 115 L 3.7016 7.5730 116.8171 57.7914 41.7176 179.6108 116 S 3.4621 8.5834 113.7529 61.0847 62.1357 176.4591 117 I 3.5802 7.7864 122.7009 64.4392 36.7698 178.4531 118 L 3.7903 7.5729 118.5292 57.0752 41.4246 178.7684 119 L 4.4904 7.9912 117.3140 55.2649 42.4759 177.5394 120 R 4.4589 7.7174 113.9781 55.6771 32.5508 175.7652 121 G 3.7591 7.7185 106.2354 45.1217 0.0000 173.5529 122 T 3.9745 8.1275 113.0218 61.4665 69.2590 174.6568 123 V 3.5361 8.4027 125.3360 66.6451 31.4165 177.4904 124 H 3.9363 7.8308 117.1185 59.6811 29.6147 176.8267 125 E 4.1186 8.2427 121.8561 60.0154 29.5113 180.0198 126 K 4.0863 8.5178 124.1876 59.7542 31.7065 181.0801 127 L 4.3654 8.6576 120.6867 57.7360 41.5964 179.5702 128 R 3.9790 8.7174 119.0560 59.0724 29.5896 178.3383 129 W 3.9112 8.4222 128.3285 60.7576 30.7215 178.1739 130 T 3.8689 8.0666 115.3021 66.4079 67.7936 176.4322 131 F 3.7312 8.4919 122.7338 61.4426 39.2002 177.0404 132 N 4.1561 8.0026 114.6028 55.7124 38.2413 176.9741 133 L 3.7052 6.6214 121.0061 58.1267 42.2069 178.2794 134 Y 4.5421 7.2382 115.5580 60.2658 39.0199 177.3819 135 D 4.4393 7.7522 121.1693 53.2583 38.4620 176.3047 136 I 3.4358 8.0367 124.6730 63.9598 37.5107 177.2357 137 N 4.5679 8.1945 113.9283 51.8590 37.2341 175.3885 138 K 3.8843 7.5229 115.0438 57.9241 29.2650 174.2777 139 D 4.6250 9.0245 113.6554 52.6642 41.6287 177.2676 140 G 4.2599 9.6767 107.5808 46.3212 0.0000 172.9512 141 Y 4.8203 8.6659 116.3678 56.0073 41.3634 174.8849 142 I 5.2986 9.0581 125.3287 58.9953 39.2591 174.5651 143 N 5.5422 9.0692 126.6234 51.4187 40.3939 176.3707 144 K 3.8993 8.6465 125.1921 60.3072 31.4012 179.5096 145 E 4.0904 8.1313 119.8466 59.2841 29.3632 179.0910 146 E 4.8528 8.5883 117.5511 57.3210 30.2392 177.9836 147 M 3.7897 7.9349 119.4475 58.5526 32.3163 177.5621 148 M 3.8860 7.9824 118.9630 58.5358 32.2611 178.1252 149 D 4.3642 7.5360 118.3661 57.6405 41.0011 179.1927 150 I 3.4914 7.3966 119.4633 64.3586 37.0675 178.6914 151 V 3.3278 7.6008 118.8440 65.8082 31.2827 177.9207 152 K 3.6964 8.1040 118.3735 59.6619 31.6763 179.1259 153 A 4.0563 8.0323 122.3258 54.4838 18.1130 179.8128 154 I 3.5427 7.9990 118.7128 64.5343 37.3015 177.9228 155 Y 4.1045 8.3497 117.9668 61.3681 37.6456 178.7177 156 D 4.3790 8.5790 120.0418 57.4490 40.7910 178.4960 157 M 4.1870 7.6072 122.2290 59.0821 32.0696 178.7461 158 M 3.6619 7.9297 118.9978 57.5052 31.7122 179.0818 159 G 4.0247 7.9716 104.8202 45.3392 0.0000 173.8403 160 A 3.8269 7.0746 121.6296 51.7382 19.0234 176.8122 161 Y 4.7029 7.9270 120.1645 59.0658 38.6478 176.3516 162 T 4.7474 8.4738 114.5360 61.3641 69.1753 173.7936 163 Y 4.7662 7.5977 114.4779 57.5403 40.2079 172.5276 164 P 4.6197 0.0000 0.0000 62.9127 31.9387 177.4549 165 V 3.5212 8.3125 118.1725 65.1638 31.3922 176.9166 166 L 4.1792 7.7740 124.6879 53.7746 40.8659 179.8668 167 A 4.0782 8.8683 131.6256 54.8947 18.5321 179.6097 168 E 4.0266 8.3022 110.4572 58.4166 29.7301 180.0164 169 D 4.7366 7.7267 117.2515 56.2866 41.2617 177.6160 170 T 3.8654 8.0325 113.6589 60.6109 68.8384 178.7554 171 P 4.2435 0.0000 0.0000 64.4062 31.9490 179.1184 172 R 3.7763 8.0444 120.6431 60.3794 29.3159 184.8873 173 Q 4.3445 7.7396 111.5952 55.7613 27.7098 178.9354 174 H 4.7366 8.4180 120.0752 58.3664 31.5652 176.1044 175 V 3.6789 7.8759 119.9747 65.9464 31.2645 177.7248 176 D 4.4627 8.1204 118.2147 57.6537 40.5515 179.0615 177 V 3.6682 7.8018 111.0248 64.2409 31.7043 177.9484 178 F 4.3304 8.0578 120.5324 61.4681 39.2486 177.1965 179 F 3.9337 9.2053 120.0848 61.2793 38.6570 178.3612 180 Q 4.3471 8.5768 120.9268 59.4281 27.8348 179.3377 181 K 4.8618 7.4239 118.1446 54.9390 33.2573 181.4911 182 M 4.7588 7.7232 117.0874 56.9167 34.9068 175.3969 183 D 4.4457 7.9891 122.2300 53.5015 39.8696 176.2722 184 K 3.9264 8.5352 127.3356 59.4086 32.5206 178.0907 185 N 4.4448 8.1281 115.3142 54.3438 37.6263 175.6093 186 K 4.3617 7.6747 116.4152 56.7235 30.4465 176.3068 187 D 4.6087 8.3114 115.7694 52.8523 39.7566 176.7025 188 G 3.8741 8.8403 107.3467 46.1456 0.0000 173.2921 189 I 4.9592 8.1979 119.1974 58.9712 41.0307 174.6987 190 V 4.8446 9.1243 129.5602 59.6650 33.3880 175.7240 191 T 4.6020 8.4137 115.7413 59.9206 71.3326 175.6019 192 L 2.5965 8.1168 122.3643 58.1294 41.9058 178.5624 193 D 4.1175 7.7860 118.1969 57.1530 40.6104 178.2319 194 E 3.8806 7.7857 119.1601 59.2405 29.5208 178.7392 195 F 4.2524 8.6609 121.1529 61.1709 39.5852 177.0093 196 L 3.7871 8.4751 119.2221 57.9544 41.1237 179.3808 197 E 3.9225 8.1804 118.2856 59.4448 29.4665 179.5271 198 S 4.3514 7.7085 114.1485 60.9214 62.4049 175.9008 199 C 4.0801 7.5781 119.4323 62.3725 27.7459 175.9502 200 Q 3.9880 7.6210 118.5884 58.9508 28.4099 178.4686 201 E 4.3093 7.9194 118.9406 57.6670 29.5636 175.8803 202 D 4.8738 7.9501 121.2680 53.5473 40.9003 176.6524 203 D 4.4486 8.6341 130.3518 57.8062 39.5707 175.2329 204 N 5.0725 8.1132 116.7673 55.7959 39.8358 177.8547 205 I 4.2879 8.4999 119.1379 62.5813 35.9671 178.5281 206 M 4.7675 7.7435 120.3953 57.3402 34.4432 178.0873 207 R 3.9391 7.8851 120.8186 60.1553 29.9988 179.0864 208 S 4.3096 8.5568 118.5855 62.6689 62.2894 177.2794 209 L 5.0369 7.5901 120.0927 54.4272 42.9552 176.9755 210 Q 4.6939 8.1985 119.9022 57.5622 36.9800 175.4173 211 L 4.1767 7.5166 119.3853 54.8890 40.8315 179.2222 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 38 G 8.16 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 0.00 0.00 0.00 0.00 39 L 8.41 3.75 0.00 1.77 1.63 0.94 0.54 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 40 E 8.90 4.15 0.00 2.08 1.92 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 2.38 2.40 0.00 41 Q 7.97 4.03 0.00 2.38 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.61 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 42 L 7.72 4.04 0.00 1.90 1.88 1.21 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.11 4.11 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 44 A 7.50 4.17 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 45 Q 8.28 4.42 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.61 0.00 0.00 0.00 0.00 0.00 2.56 2.37 0.00 46 T 7.42 4.55 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 1.21 0.00 0.00 47 N 8.09 4.63 0.00 2.27 2.67 0.00 0.00 6.94 6.74 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 48 F 7.31 5.38 0.00 3.06 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 49 T 8.58 4.55 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 50 K 8.51 3.90 0.00 1.87 1.93 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.49 1.70 7.81 51 R 8.13 3.87 0.00 1.89 1.97 0.00 3.20 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 52 E 7.85 3.95 0.00 2.40 1.79 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 2.33 2.39 0.00 53 L 8.31 4.09 0.00 1.99 1.87 1.17 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 8.13 3.99 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 55 V 7.48 3.62 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 1.09 0.00 0.00 0.98 0.00 0.00 56 L 8.10 4.05 0.00 2.02 1.95 0.09 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 8.68 3.79 0.00 2.82 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 58 R 8.64 4.06 0.00 1.93 1.98 0.00 3.24 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.89 0.00 59 G 8.54 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 F 8.66 3.65 0.00 2.81 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 61 K 8.29 3.91 0.00 1.48 1.62 0.00 1.68 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.13 1.69 7.81 62 N 7.51 4.40 0.00 2.90 2.75 0.00 0.00 7.00 7.38 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 63 E 7.76 4.07 0.00 1.54 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.12 0.00 64 C 6.95 4.48 0.00 2.85 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 4.34 0.00 2.15 2.08 0.00 3.80 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 66 S 7.40 3.70 0.00 3.81 3.79 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 67 G 7.78 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 0.00 0.00 0.00 0.00 68 V 7.14 4.47 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 0.77 0.00 0.00 0.98 0.00 0.00 69 V 8.62 4.16 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 0.78 0.00 0.00 0.69 0.00 0.00 70 N 8.25 5.45 0.00 2.87 3.03 0.00 0.00 6.24 7.54 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 71 E 8.40 4.14 0.00 1.30 1.77 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 2.38 2.33 0.00 72 D 8.02 4.50 0.00 2.82 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.99 3.86 4.15 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 1.21 0.00 0.00 74 F 8.16 4.15 0.00 3.57 3.32 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 75 K 8.96 4.38 0.00 1.75 1.80 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.33 7.81 76 Q 8.42 4.34 0.00 2.32 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.79 0.00 0.00 0.00 0.00 0.00 2.65 2.62 0.00 77 I 8.28 3.83 2.03 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.61 0.67 0.00 0.00 78 Y 8.44 4.37 0.00 3.41 3.27 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 79 A 7.51 4.11 1.44 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 0.00 0.00 80 Q 8.51 3.94 0.00 1.90 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.61 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 *81 F 7.02 3.33 0.00 2.32 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 0.00 0.00 0.00 0.00 82 F 7.16 5.04 0.00 3.16 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 83 P 0.00 4.26 0.00 2.23 1.97 0.00 3.93 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 2.10 2.02 0.00 84 H 9.11 4.81 0.00 3.31 3.37 0.00 5.47 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 85 G 7.60 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 86 D 9.12 4.74 0.00 2.65 2.56 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 0.00 0.00 0.00 87 A 8.56 4.70 1.52 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 0.00 0.00 88 S 8.09 4.15 0.00 3.97 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 0.00 89 T 7.88 4.10 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 1.23 0.00 0.00 90 Y 8.03 3.79 0.00 3.14 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 91 A 8.22 3.81 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 0.00 0.00 0.00 0.00 0.00 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0.00 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 0.00 101 T 7.97 3.98 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 102 Q 7.78 3.91 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.42 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 103 T 8.07 4.50 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 104 G 8.89 4.46 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 0.00 105 S 7.64 5.15 0.00 3.99 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 0.00 106 V 8.53 4.43 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 0.23 0.00 0.00 0.94 0.00 0.00 107 K 8.73 4.67 0.00 1.41 1.67 0.00 1.84 0.00 0.00 1.57 0.00 0.00 2.71 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.25 7.81 108 F 9.06 3.07 0.00 2.23 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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4.12 0.00 2.25 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 2.44 2.40 0.00 126 K 8.52 4.09 0.00 1.72 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 127 L 8.66 4.37 0.00 1.86 1.76 0.74 0.73 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 0.00 128 R 8.72 3.98 0.00 1.99 2.01 0.00 3.15 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 129 W 8.42 3.91 0.00 3.62 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 0.00 130 T 8.07 3.87 4.55 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 0.86 0.00 0.00 131 F 8.49 3.73 0.00 3.28 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 0.00 132 N 8.00 4.16 0.00 2.37 2.51 0.00 0.00 7.04 7.41 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 0.00 133 L 6.62 3.71 0.00 0.95 1.45 0.74 0.95 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 0.00 134 Y 7.24 4.54 0.00 2.68 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 D 7.75 4.44 0.00 2.15 2.24 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 0.00 136 I 8.04 3.44 1.72 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.86 0.42 0.00 0.00 137 N 8.19 4.57 0.00 2.77 2.83 0.00 0.00 6.23 7.13 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 0.00 138 K 7.52 3.88 0.00 1.75 1.80 0.00 1.47 0.00 0.00 1.66 0.00 0.00 3.27 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.34 1.31 7.81 139 D 9.02 4.63 0.00 2.64 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 9.68 4.26 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 0.00 0.00 0.00 141 Y 8.67 4.82 0.00 3.01 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 150 I 7.40 3.49 1.79 0.00 0.00 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 1.67 0.92 0.98 0.00 0.00 151 V 7.60 3.33 1.76 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 0.50 0.00 0.00 0.64 0.00 0.00 152 K 8.10 3.70 0.00 1.96 1.78 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.35 7.81 153 A 8.03 4.06 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 0.00 154 I 8.00 3.54 1.91 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 1.19 0.45 0.83 0.00 0.00 155 Y 8.35 4.10 0.00 3.11 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 0.00 156 D 8.58 4.38 0.00 2.81 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 0.00 157 M 7.61 4.19 0.00 1.90 1.91 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.60 0.00 158 M 7.93 3.66 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.42 0.00 159 G 7.97 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 0.00 0.00 0.00 160 A 7.07 3.83 0.63 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 0.00 0.00 161 Y 7.93 4.70 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 0.00 162 T 8.47 4.75 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 163 Y 7.60 4.77 0.00 2.87 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 0.00 164 P 0.00 4.62 0.00 2.32 2.13 0.00 3.80 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.26 0.00 165 V 8.31 3.52 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 0.70 0.00 0.00 0.93 0.00 0.00 166 L 7.77 4.18 0.00 1.56 1.63 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 167 A 8.87 4.08 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 0.00 168 E 8.30 4.03 0.00 2.00 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 2.24 1.93 0.00 169 D 7.73 4.74 0.00 2.96 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 0.00 170 T 8.03 3.87 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 171 P 0.00 4.24 0.00 1.78 1.34 0.00 3.51 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.62 0.00 172 R 8.04 3.78 0.00 1.76 1.98 0.00 3.25 0.00 0.00 3.37 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.21 0.00 173 Q 7.74 4.34 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.17 0.00 174 H 8.42 4.74 0.00 3.26 3.18 0.00 5.75 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 0.00 175 V 7.88 3.68 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 1.16 0.00 0.00 0.85 0.00 0.00 176 D 8.12 4.46 0.00 2.76 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 0.00 177 V 7.80 3.67 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 0.81 0.00 0.00 1.03 0.00 0.00 178 F 8.06 4.33 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 0.00 179 F 9.21 3.93 0.00 3.33 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 0.00 180 Q 8.58 4.35 0.00 2.14 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 7.26 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 181 K 7.42 4.86 0.00 1.66 1.64 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.27 1.20 7.81 182 M 7.72 4.76 0.00 1.09 1.40 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 2.31 2.21 0.00 183 D 7.99 4.45 0.00 2.96 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 0.00 184 K 8.54 3.93 0.00 1.84 1.80 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.36 7.81 185 N 8.13 4.44 0.00 2.88 2.94 0.00 0.00 6.37 7.13 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 0.00 186 K 7.67 4.36 0.00 1.85 2.34 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.37 7.81 187 D 8.31 4.61 0.00 2.82 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 0.00 188 G 8.84 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 0.00 0.00 0.00 189 I 8.20 4.96 2.03 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 1.13 0.00 0.00 190 V 9.12 4.84 1.82 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 0.90 0.00 0.00 0.87 0.00 0.00 191 T 8.41 4.60 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 0.68 0.00 0.00 192 L 8.12 2.60 0.00 0.75 1.29 0.35 0.97 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 0.00 193 D 7.79 4.12 0.00 2.67 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 0.00 194 E 7.79 3.88 0.00 2.01 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 0.00 2.49 2.28 0.00 195 F 8.66 4.25 0.00 3.25 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 0.00 196 L 8.48 3.79 0.00 1.71 1.56 0.76 0.74 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 0.00 197 E 8.18 3.92 0.00 2.22 1.94 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 2.28 2.31 0.00 198 S 7.71 4.35 0.00 4.08 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 0.00 199 C 7.58 4.08 0.00 2.65 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 0.00 200 Q 7.62 3.99 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.01 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 201 E 7.92 4.31 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 202 D 7.95 4.87 0.00 2.68 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 0.00 203 D 8.63 4.45 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 N 8.11 5.07 0.00 2.66 2.86 0.00 0.00 6.95 7.27 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 0.00 205 I 8.50 4.29 1.87 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 1.52 0.62 0.91 0.00 0.00 206 M 7.74 4.77 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.61 0.00 207 R 7.89 3.94 0.00 1.85 1.92 0.00 3.13 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 208 S 8.56 4.31 0.00 3.65 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 0.00 209 L 7.59 5.04 0.00 1.63 1.68 0.94 0.67 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 0.00 210 Q 8.20 4.69 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 211 L 7.52 4.18 0.00 1.70 1.47 0.92 0.87 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 * Residues marked with a * may have inaccurate shift predictions.