NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8425 8.1633 120.2509 55.1294 34.5641 173.6284 2 W 5.2354 9.5623 119.6788 54.6327 33.1169 173.0359 3 L 5.3614 10.1812 126.0412 53.3227 44.7061 175.2712 4 T 4.9855 9.3927 120.1938 61.7175 72.4224 172.9388 5 K 4.7179 8.7130 125.3748 54.9247 34.2779 175.1274 6 L 4.9653 8.8158 125.8411 52.8774 44.5835 175.8907 7 V 4.6329 8.4881 124.3500 60.8690 32.4082 174.6274 8 L 4.1607 8.3989 128.1617 54.7297 42.5599 176.6863 9 N 4.6674 8.4748 122.2186 51.4256 39.6738 173.7576 10 P 4.3915 0.0000 0.0000 63.8184 31.4948 177.5486 11 A 4.0673 8.1301 121.7483 53.9782 18.8762 178.2489 12 S 4.4608 8.0697 111.9059 57.2840 63.5864 174.6135 13 R 3.8776 8.6508 129.0377 59.5414 29.9958 178.2219 14 A 4.0551 8.0696 119.8570 55.1103 18.4389 179.2682 15 A 3.6968 8.0954 119.3019 55.3426 18.4644 180.1391 16 R 3.8417 8.0228 116.6081 59.1854 29.9488 179.2702 17 R 3.9252 8.1601 118.6008 59.6426 29.9014 178.4036 18 D 4.4186 8.0429 117.4592 57.3677 40.8931 178.5236 19 L 4.1279 8.0585 118.4456 57.0950 41.6661 178.5084 20 A 4.7362 7.6423 118.2728 51.7494 19.7240 176.5860 21 N 4.8466 7.9004 115.4475 50.2205 40.4892 172.5549 22 P 4.7134 0.0000 0.0000 66.0289 31.5432 177.7095 23 Y 4.2906 8.2448 118.2439 60.9440 38.7128 178.1969 24 E 3.8715 8.4694 119.0229 59.3973 29.6155 178.7331 25 M 3.8974 8.1723 118.3325 58.8705 32.2244 177.7254 26 H 4.0831 8.6025 118.5973 59.1845 29.8118 177.1543 27 R 3.7551 7.4041 119.1109 59.6851 30.0585 178.4007 28 T 3.8995 7.8579 115.4148 66.6681 68.4652 176.8216 29 L 4.2151 8.0157 121.0583 57.8917 41.5926 179.7050 30 S 4.1143 8.1851 115.1263 61.3381 62.4196 176.8210 31 K 3.9058 7.5667 120.3520 59.1640 31.9477 178.6952 32 A 4.1466 7.6661 121.6353 53.1987 18.1925 178.4338 33 V 4.4985 7.5287 112.0810 59.4952 33.5180 177.9257 34 S 4.0582 8.3935 116.8955 61.8209 62.7345 175.2799 35 R 3.8330 7.8592 121.8679 58.7650 29.8342 178.0738 36 A 3.9845 7.8642 120.1318 55.2187 18.4086 179.4779 37 L 3.9370 8.0223 117.5029 57.8014 41.4379 179.3283 38 E 3.9892 8.0915 118.5048 58.9909 29.6432 177.7692 39 E 4.4803 8.1294 115.8838 55.3808 29.6224 176.5223 40 G 3.9877 7.6106 106.0030 46.9101 0.0000 174.7428 41 R 4.6041 8.2285 115.8545 55.2478 30.4563 175.5899 42 E 4.7679 7.8672 117.1933 54.6673 32.7326 175.5802 43 R 4.5787 8.1506 123.3614 54.8737 31.2843 172.2958 44 L 4.6153 8.4420 125.8593 54.3410 42.9768 175.4140 45 L 5.2157 9.0544 126.3060 53.0022 45.7412 175.6230 46 W 5.6858 8.1527 117.4847 55.9868 32.1597 173.1162 47 R 4.5710 9.1353 120.2695 54.9159 33.3337 173.4991 48 L 4.7666 8.8693 129.0334 54.2835 42.2726 176.1417 49 E 4.2486 8.9436 126.8175 55.4586 30.3594 175.6840 50 P 4.1621 0.0000 0.0000 62.9666 31.9172 176.4132 51 A 4.1193 8.4852 125.7849 51.9225 19.1735 177.5268 52 R 4.4321 8.2800 118.7457 54.6966 30.6918 177.0468 53 G 3.7866 8.0454 117.8498 47.5251 0.0000 172.6927 54 L 4.5728 8.4985 124.0069 53.9236 42.1190 176.1653 55 E 4.1304 7.6630 118.4010 55.2965 29.9446 175.1410 56 P 4.2184 0.0000 0.0000 62.6132 32.0353 174.8514 57 P 4.4448 0.0000 0.0000 62.6025 32.8318 175.1851 58 V 4.8102 8.3327 122.5672 61.0900 34.2507 174.1805 59 V 4.7953 8.9390 127.8750 61.0511 34.2493 173.6939 60 L 4.8853 8.7938 130.6743 53.9321 43.7989 175.1302 61 V 5.1313 9.1438 126.4784 61.1597 34.6548 173.6981 62 Q 5.5162 9.6204 129.3567 54.6599 31.7938 174.2399 63 T 5.1923 9.1680 115.3604 60.2099 72.3318 174.8329 64 L 4.4050 10.3844 123.8807 56.6093 42.1543 177.5386 65 T 4.6975 7.8407 107.1121 59.0700 71.0456 173.6007 66 E 2.5400 8.1931 123.4733 54.8553 29.7045 174.7635 67 P 4.0562 0.0000 0.0000 62.1676 32.2942 175.6856 68 D 4.4325 7.8753 120.5339 52.4030 40.9652 176.5116 69 W 4.7518 8.1217 125.1542 57.2677 29.5258 178.4851 70 S 4.3703 7.8309 113.5867 60.2605 62.5700 175.7464 71 V 3.7676 7.5804 113.5182 62.9452 31.6762 176.3203 72 L 4.1326 7.5631 120.4109 53.8215 42.5451 176.7254 73 D 4.5274 8.2157 121.9593 53.8644 41.5216 175.9455 74 E 4.1821 8.5043 120.5203 57.6722 30.0639 177.7124 75 G 3.9702 8.8664 109.1453 45.9389 0.0000 173.9464 76 Y 4.0633 8.0796 121.0739 60.3437 39.0239 174.9725 77 A 4.7697 7.4618 116.9490 51.0144 22.4941 175.5089 78 Q 4.1586 8.8018 122.0105 55.1696 30.3107 174.8682 79 V 4.3159 8.1628 127.4468 61.7080 32.3311 175.1491 80 F 4.3110 8.7192 127.6697 55.7108 40.0427 174.0907 81 P 4.2443 0.0000 0.0000 62.5317 31.4810 174.3679 82 P 4.8486 0.0000 0.0000 63.0698 32.1090 175.8668 83 K 4.8272 9.2756 123.3319 53.8243 35.0463 174.1327 84 P 3.8189 0.0000 0.0000 62.3513 32.1976 176.0094 85 F 4.7365 8.9591 125.6102 57.0463 41.4036 174.1457 86 H 4.4687 8.3166 123.4079 52.4468 29.3836 170.9870 87 P 4.0345 0.0000 0.0000 62.3070 31.9184 177.2433 88 A 4.3417 8.3480 124.7126 51.0110 18.3614 176.2163 89 L 5.4932 8.3322 120.9557 53.1765 43.9188 176.7362 90 K 4.6490 8.2286 119.5946 54.0612 35.7626 173.9123 91 P 4.4731 0.0000 0.0000 64.4078 31.5627 177.2548 92 G 3.9260 8.9845 111.2666 45.2341 0.0000 173.4824 93 Q 4.0541 7.9042 122.6344 56.4736 29.9792 175.1069 94 R 5.0848 8.5386 125.5645 55.1156 31.6763 175.7918 95 L 4.9715 8.9247 122.6908 53.0966 46.6403 176.1009 96 R 4.8504 9.2668 121.3108 55.9528 31.9228 175.5110 97 F 5.5009 8.7808 115.7272 55.6243 42.1504 173.1913 98 R 4.9648 9.1123 119.3489 54.7900 33.9155 173.8135 99 L 4.9408 9.2432 127.9018 54.2225 46.0256 173.8066 100 R 5.0300 8.8501 127.1373 55.0587 31.8351 174.7473 101 A 5.0297 9.2496 127.4267 50.6456 23.8334 174.0077 102 N 4.9074 8.3582 117.4698 49.9867 39.5711 173.8560 103 P 2.0000 0.0000 0.0000 60.6578 28.8846 174.4980 104 A 4.3900 6.1185 121.2578 51.1408 22.5850 176.9342 105 K 4.2637 8.8085 120.1184 59.2275 32.3236 176.6132 106 R 4.7436 7.4716 113.9051 54.0077 34.1338 175.6599 107 L 4.0724 8.2028 119.2093 54.8918 40.2072 177.3175 *117 K 4.1401 7.9815 125.3110 56.3888 33.6276 176.7819 118 T 4.0233 7.7274 120.0635 65.0541 67.6465 173.1070 119 P 4.2983 0.0000 0.0000 65.4685 31.3850 178.4303 120 A 4.1503 7.9689 119.1502 54.9110 17.9570 179.3674 121 E 4.0459 8.8110 117.8269 59.3210 29.5111 179.6357 122 K 4.2091 8.6141 119.2774 59.5122 32.0712 179.6077 123 V 3.7684 7.9409 118.3389 65.8472 31.5831 177.8533 124 A 4.0032 8.3090 120.6775 54.9428 18.2417 179.3394 125 W 4.0607 8.6462 127.1507 60.4999 30.6977 177.8061 126 L 3.3688 8.1839 120.1817 58.0442 41.4084 178.5973 127 E 3.8155 8.2111 118.5830 59.6233 29.3406 179.7527 128 R 3.7961 7.6125 117.2611 59.2299 30.1089 179.3737 129 R 3.5835 7.3038 117.7676 59.0036 29.8798 179.1776 130 L 3.8892 7.7754 118.9358 57.8268 41.6319 179.4234 131 E 4.6914 8.0619 119.8482 59.1298 29.1770 179.3744 132 E 4.0965 8.2767 117.8578 58.7459 29.6333 178.6236 133 G 4.0493 7.3864 105.5138 43.8119 0.0000 174.9458 134 G 3.7810 8.1161 109.6661 44.8020 0.0000 172.8278 135 F 5.3333 8.2669 118.4646 55.6499 43.1558 174.3414 136 R 4.8032 8.6916 119.2236 54.8728 33.4843 173.9234 137 L 4.3742 8.5374 128.8733 55.1000 42.9832 176.5577 138 L 4.4088 9.0254 125.8425 54.7720 43.2296 175.7359 139 E 4.9340 8.9432 120.7664 54.7572 31.4244 176.2768 140 G 3.9988 8.9338 113.6516 43.3593 0.0000 173.6413 141 E 4.2141 8.4171 115.8953 57.9902 29.5813 177.2544 142 R 4.5146 7.6910 118.8410 55.8433 31.7908 175.8699 143 G 3.8016 7.9847 106.3276 43.4545 0.0000 171.2569 144 P 4.6467 0.0000 0.0000 63.4148 32.0671 177.1526 145 W 4.6088 9.3946 134.9153 55.7819 28.7796 174.6886 146 V 5.3009 7.5550 120.3587 60.3115 34.1776 173.8875 147 Q 4.6353 9.2240 120.0411 54.7192 32.4768 174.2539 148 I 4.1880 8.3470 122.3598 60.4182 36.8831 175.5281 149 L 4.2164 8.6050 128.8903 57.1129 42.4881 177.7840 150 Q 4.4635 7.6151 118.6978 54.6098 32.7952 173.0714 151 D 4.7265 8.5072 124.7124 53.2810 43.7680 173.5078 152 T 4.4406 8.2592 122.0539 61.2566 70.8874 171.7636 153 F 5.3059 8.6610 117.5280 55.9986 42.8737 174.6090 154 L 4.6438 9.2606 122.4462 53.4324 43.9855 175.6016 155 E 4.5079 8.6569 123.1927 54.5884 29.9860 175.5707 *170 Q 4.1545 8.4186 125.2282 55.8343 29.5332 174.7851 171 V 4.3600 8.3708 124.1315 60.9320 32.9380 174.9247 172 Q 3.8482 8.9128 129.5276 56.1599 30.3924 174.5320 173 A 4.8153 8.8165 127.9265 50.2116 22.0050 174.6595 174 V 4.3299 8.6880 123.1923 61.3306 34.2291 174.2799 175 L 4.7826 8.6812 131.1684 54.0391 43.0447 175.0018 176 F 5.4195 9.4502 126.2159 56.2603 41.5727 174.9220 177 E 4.3840 8.6255 122.5718 54.6601 33.0938 173.9871 178 G 4.3181 6.7172 112.9416 46.7927 0.0000 171.9556 179 R 5.3829 8.7081 120.8952 54.4904 34.5820 174.7833 180 L 5.5580 9.1588 122.4204 54.3994 44.9196 174.3721 181 E 5.2461 9.3658 115.7406 54.4813 33.3716 175.0287 182 V 4.0046 8.7223 122.1981 63.3565 32.2968 175.8072 183 V 3.8780 8.6071 128.2434 64.1726 32.6756 175.5243 184 D 4.6717 7.5122 123.6608 51.2710 42.7272 173.8795 185 P 4.0944 0.0000 0.0000 65.8689 31.3291 178.4365 186 E 3.8689 7.9397 116.3958 59.5798 29.5126 179.5482 187 R 3.8705 8.1492 117.8740 58.9191 30.0306 178.9805 188 A 3.5796 7.9805 122.4326 54.2302 18.2299 179.4298 189 L 3.8397 7.9777 118.7397 58.2728 42.0986 178.9455 190 A 4.0191 8.0016 120.6710 55.5734 18.0398 179.7490 191 T 3.8694 8.1043 114.1796 66.7674 68.3043 176.8859 192 L 4.1508 7.8795 119.9587 58.0288 41.7542 179.5539 193 R 4.1721 7.9467 117.0795 58.9389 30.0600 178.6310 194 R 4.1701 8.2473 118.3042 56.7405 30.4789 177.4581 195 G 4.0092 8.3001 102.9785 45.2226 0.0000 172.5877 196 V 4.1278 8.8964 118.9655 61.9884 33.0454 176.6737 197 G 4.5468 8.9532 112.9772 44.4787 0.0000 170.1532 198 P 4.5122 0.0000 0.0000 62.9216 32.4695 176.0897 199 G 3.8606 8.7228 103.2099 46.4470 0.0000 175.8633 200 K 4.5992 8.4430 119.3611 57.8602 32.1637 177.6709 201 A 4.1951 7.8382 119.9559 51.8119 18.9447 176.9277 202 L 4.7825 7.8614 115.3812 54.8948 42.7339 177.2284 203 G 2.0000 7.4770 105.2422 44.6270 0.0000 173.4551 204 L 4.6770 7.3869 118.0869 53.1312 44.9372 177.5545 205 G 4.3473 9.0545 109.3004 44.9327 0.0000 173.2369 206 L 4.3612 7.4907 120.8481 54.4544 41.3797 175.7824 207 L 4.3993 8.4151 129.7216 54.5236 42.6123 175.6699 208 S 4.8595 9.0185 123.7374 57.0557 64.8086 174.0976 209 V 5.1212 8.1403 116.5594 59.9329 35.3133 174.7157 210 A 4.6418 8.5427 121.5119 50.2482 23.1194 175.1258 211 P 4.3480 0.0000 0.0000 63.1114 31.3591 176.3439 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 8.16 4.84 0.00 2.24 2.39 0.00 0.00 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.72 0.00 2 W 9.56 5.24 0.00 3.30 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 3 L 10.18 5.36 0.00 1.56 1.54 0.22 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.39 4.99 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 0.95 0.00 0.00 5 K 8.71 4.72 0.00 1.57 1.50 0.00 1.30 0.00 0.00 1.51 0.00 0.00 2.73 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.34 1.35 7.81 6 L 8.82 4.97 0.00 1.47 1.37 0.32 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.49 4.63 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 1.07 0.00 0.00 1.13 0.00 0.00 8 L 8.40 4.16 0.00 1.41 1.34 0.76 0.49 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 9 N 8.47 4.67 0.00 2.70 2.78 0.00 0.00 7.10 7.10 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 10 P 0.00 4.39 0.00 2.04 2.04 0.00 3.68 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 1.99 2.02 0.00 11 A 8.13 4.07 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.07 4.46 0.00 4.03 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 13 R 8.65 3.88 0.00 1.97 1.93 0.00 3.30 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 14 A 8.07 4.06 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 15 A 8.10 3.70 1.01 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 16 R 8.02 3.84 0.00 2.03 1.98 0.00 3.12 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 17 R 8.16 3.93 0.00 1.92 2.17 0.00 3.14 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 18 D 8.04 4.42 0.00 2.91 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 19 L 8.06 4.13 0.00 1.78 1.74 0.85 0.62 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 20 A 7.64 4.74 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 21 N 7.90 4.85 0.00 2.71 2.77 0.00 0.00 7.02 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.71 0.00 2.40 2.57 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 23 Y 8.24 4.29 0.00 3.06 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.47 3.87 0.00 2.26 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 2.59 2.40 0.00 25 M 8.17 3.90 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.81 0.00 26 H 8.60 4.08 0.00 3.92 3.56 0.00 5.84 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 R 7.40 3.76 0.00 1.55 1.97 0.00 3.21 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 28 T 7.86 3.90 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 0.82 0.00 0.00 29 L 8.02 4.22 0.00 1.54 1.81 0.12 1.10 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 30 S 8.19 4.11 0.00 3.96 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 31 K 7.57 3.91 0.00 1.67 1.78 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.65 7.81 32 A 7.67 4.15 0.23 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 33 V 7.53 4.50 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 0.65 0.00 0.00 0.88 0.00 0.00 34 S 8.39 4.06 0.00 3.99 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 35 R 7.86 3.83 0.00 1.85 1.90 0.00 3.14 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 36 A 7.86 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 37 L 8.02 3.94 0.00 1.87 1.74 0.91 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.09 3.99 0.00 2.07 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 2.32 2.35 0.00 39 E 8.13 4.48 0.00 1.98 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 2.31 2.45 0.00 40 G 7.61 3.99 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 0.00 0.00 0.00 41 R 8.23 4.60 0.00 1.79 1.94 0.00 3.12 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 42 E 7.87 4.77 0.00 1.85 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 2.17 2.36 0.00 43 R 8.15 4.58 0.00 1.84 1.84 0.00 3.40 0.00 0.00 3.24 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 44 L 8.44 4.62 0.00 1.77 1.71 1.11 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 45 L 9.05 5.22 0.00 1.74 1.56 1.03 0.44 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 46 W 8.15 5.69 0.00 3.57 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 47 R 9.14 4.57 0.00 1.90 1.82 0.00 3.09 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 48 L 8.87 4.77 0.00 2.01 1.77 0.97 1.09 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 49 E 8.94 4.25 0.00 1.95 1.86 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 58 V 8.33 4.81 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 0.98 0.00 0.00 0.88 0.00 0.00 59 V 8.94 4.80 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 1.01 0.00 0.00 0.92 0.00 0.00 60 L 8.79 4.89 0.00 1.83 1.57 0.89 0.39 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 61 V 9.14 5.13 2.31 0.00 0.00 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 0.95 0.00 0.00 62 Q 9.62 5.52 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.45 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 63 T 9.17 5.19 4.59 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 1.31 0.00 0.00 64 L 10.38 4.41 0.00 1.65 1.86 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 65 T 7.84 4.70 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 1.25 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 2.29 2.32 0.00 75 G 8.87 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.08 4.06 0.00 3.11 3.06 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 77 A 7.46 4.77 1.13 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 0.00 0.00 78 Q 8.80 4.16 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 1.90 2.07 0.00 79 V 8.16 4.32 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 0.70 0.00 0.00 0.84 0.00 0.00 80 F 8.72 4.31 0.00 3.14 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 81 P 0.00 4.24 0.00 2.16 2.15 0.00 3.85 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 2.10 2.18 0.00 82 P 0.00 4.85 0.00 2.21 2.37 0.00 3.81 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 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91 P 0.00 4.47 0.00 2.03 2.01 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 92 G 8.98 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 93 Q 7.90 4.05 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 94 R 8.54 5.08 0.00 1.67 1.73 0.00 3.14 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.79 0.00 95 L 8.92 4.97 0.00 1.54 1.52 1.05 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 96 R 9.27 4.85 0.00 1.79 1.77 0.00 3.05 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 97 F 8.78 5.50 0.00 3.10 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 98 R 9.11 4.96 0.00 1.78 1.74 0.00 3.09 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 99 L 9.24 4.94 0.00 1.96 1.81 1.05 1.07 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0.00 0.00 0.00 0.00 125 W 8.65 4.06 0.00 3.48 3.47 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 0.00 126 L 8.18 3.37 0.00 1.18 1.58 0.48 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.21 3.82 0.00 2.17 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 2.30 2.54 0.00 128 R 7.61 3.80 0.00 1.85 1.77 0.00 3.21 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 129 R 7.30 3.58 0.00 1.23 1.47 0.00 2.79 0.00 0.00 2.79 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 130 L 7.78 3.89 0.00 1.62 1.60 0.39 0.75 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 0.00 131 E 8.06 4.69 0.00 1.93 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 2.29 2.26 0.00 132 E 8.28 4.10 0.00 2.00 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 2.39 0.00 133 G 7.39 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 0.00 134 G 8.12 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 0.00 135 F 8.27 5.33 0.00 2.89 2.73 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 0.00 136 R 8.69 4.80 0.00 1.85 1.72 0.00 3.32 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 137 L 8.54 4.37 0.00 1.65 1.60 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 138 L 9.03 4.41 0.00 1.78 1.68 0.54 0.81 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 0.00 139 E 8.94 4.93 0.00 2.02 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 2.28 2.34 0.00 140 G 8.93 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 0.00 141 E 8.42 4.21 0.00 2.05 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 2.14 2.23 0.00 142 R 7.69 4.51 0.00 1.63 1.84 0.00 3.12 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 143 G 7.98 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 0.00 0.00 0.00 144 P 0.00 4.65 0.00 2.12 2.11 0.00 3.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 145 W 9.39 4.61 0.00 3.62 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 0.00 146 V 7.55 5.30 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 0.86 0.00 0.00 1.31 0.00 0.00 147 Q 9.22 4.64 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 148 I 8.35 4.19 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.64 0.73 0.00 0.00 149 L 8.61 4.22 0.00 1.47 1.67 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 7.62 4.46 0.00 2.01 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.85 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 151 D 8.51 4.73 0.00 2.52 2.38 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 0.00 152 T 8.26 4.44 4.17 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 1.18 0.00 0.00 153 F 8.66 5.31 0.00 2.89 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 0.00 154 L 9.26 4.64 0.00 1.60 1.62 0.92 0.94 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 0.00 155 E 8.66 4.51 0.00 1.95 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 2.22 2.31 0.00 *170 Q 8.42 4.15 0.00 1.80 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.52 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 171 V 8.37 4.36 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 0.91 0.00 0.00 0.96 0.00 0.00 172 Q 8.91 3.85 0.00 2.11 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.62 0.00 0.00 0.00 0.00 0.00 2.06 1.64 0.00 173 A 8.82 4.82 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 0.00 174 V 8.69 4.33 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.68 0.00 0.00 175 L 8.68 4.78 0.00 1.66 1.50 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 176 F 9.45 5.42 0.00 3.25 3.06 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 0.00 177 E 8.63 4.38 0.00 1.91 1.62 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 2.03 2.20 0.00 178 G 6.72 4.32 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 0.00 179 R 8.71 5.38 0.00 0.94 1.35 0.00 2.67 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.24 0.00 180 L 9.16 5.56 0.00 1.74 1.52 0.85 -0.41 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 0.00 181 E 9.37 5.25 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 2.36 2.24 0.00 182 V 8.72 4.00 2.27 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 0.80 0.00 0.00 1.03 0.00 0.00 183 V 8.61 3.88 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 0.72 0.00 0.00 0.90 0.00 0.00 184 D 7.51 4.67 0.00 2.64 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 0.00 0.00 0.00 185 P 0.00 4.09 0.00 2.11 2.18 0.00 3.57 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 2.05 2.11 0.00 186 E 7.94 3.87 0.00 1.91 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 2.34 2.30 0.00 187 R 8.15 3.87 0.00 1.72 1.86 0.00 3.07 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 0.00 188 A 7.98 3.58 0.51 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 0.00 0.00 189 L 7.98 3.84 0.00 1.77 1.77 0.82 1.20 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 0.00 190 A 8.00 4.02 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 T 8.10 3.87 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 192 L 7.88 4.15 0.00 1.92 1.94 1.12 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 193 R 7.95 4.17 0.00 2.01 2.05 0.00 3.19 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 194 R 8.25 4.17 0.00 1.92 2.02 0.00 3.25 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 195 G 8.30 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 0.00 196 V 8.90 4.13 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 0.84 0.00 0.00 0.90 0.00 0.00 197 G 8.95 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 0.00 0.00 0.00 0.00 198 P 0.00 4.51 0.00 2.22 2.15 0.00 4.16 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 199 G 8.72 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 0.00 200 K 8.44 4.60 0.00 1.78 1.91 0.00 1.83 0.00 0.00 2.50 0.00 0.00 2.81 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.47 1.54 7.81 201 A 7.84 4.20 1.21 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 0.00 0.00 202 L 7.86 4.78 0.00 1.66 1.62 0.95 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 203 G 7.48 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 0.00 0.00 0.00 0.00 0.00 0.00 204 L 7.39 4.68 0.00 1.64 1.49 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 205 G 9.05 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 0.00 0.00 0.00 0.00 206 L 7.49 4.36 0.00 1.63 1.65 1.03 1.02 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 0.00 207 L 8.42 4.40 0.00 1.66 1.59 0.76 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 208 S 9.02 4.86 0.00 3.82 3.72 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 0.00 209 V 8.14 5.12 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 0.58 0.00 0.00 1.11 0.00 0.00 210 A 8.54 4.64 1.19 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 0.00 211 P 0.00 4.35 0.00 2.19 2.06 0.00 3.82 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 1.99 1.98 0.00 * Residues marked with a * may have inaccurate shift predictions.