NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2160 8.4445 119.1125 54.0874 28.6989 174.8223 4 L 3.9004 8.4266 123.7941 53.3462 41.2456 173.6477 5 T 4.0548 8.8805 120.0274 60.5067 68.9306 174.1376 6 E 3.8507 8.9810 126.9567 59.9525 28.8497 178.9249 7 E 3.9665 8.2563 120.3067 58.8697 29.3871 178.2089 8 Q 3.9927 7.9051 115.9896 57.3740 29.1321 176.8436 9 I 3.9141 8.5650 120.4615 64.1256 38.1422 177.3233 10 A 4.0061 8.0270 120.9341 55.6570 17.8256 179.4798 11 E 4.0812 8.0194 116.5107 59.6537 29.6903 179.1079 12 F 4.8000 8.8457 116.8603 59.1480 38.9938 177.2673 13 K 4.4572 7.9947 118.0968 58.6491 32.7368 178.2442 14 E 4.3345 8.6008 117.3044 58.5603 29.1205 178.2475 15 A 4.6988 7.8903 120.3877 53.5912 20.0663 178.3464 16 F 3.6279 8.0882 119.1380 61.6835 39.3600 177.6775 17 S 4.0589 9.0297 114.8927 61.4364 62.5917 176.1679 18 L 4.0629 7.4031 121.3400 57.1642 41.7156 177.4399 19 F 4.4950 7.4089 114.4905 57.3383 39.6071 175.8548 20 D 4.4075 8.0650 124.3659 51.8164 39.4276 176.2327 21 K 3.7256 8.1575 124.7529 59.0876 33.1773 177.6128 22 D 4.5372 8.5592 118.3181 58.8884 38.8209 178.6142 23 G 3.8362 7.4376 101.0919 47.7266 0.0000 175.6818 24 D 4.3205 8.2651 120.2723 53.1607 39.5656 175.7020 25 G 4.1082 7.2830 108.4784 45.0339 0.0000 172.6274 26 T 5.3746 8.1787 109.8464 59.7047 72.6071 173.0175 27 I 4.8298 8.6805 115.0191 59.1135 41.2622 175.3897 28 T 4.5953 9.8730 115.6837 61.5605 69.7188 175.6179 29 T 3.8079 8.3707 117.6486 66.6931 68.3917 176.6704 30 K 3.7949 8.0526 119.6655 59.7739 32.1359 178.6624 31 E 3.8481 7.9545 118.3342 59.5547 29.4285 179.0685 32 L 3.8828 8.0568 120.4667 58.2405 42.0003 179.2879 33 G 3.5557 7.9033 105.3433 48.2315 0.0000 175.8652 34 T 3.7314 7.6946 118.4660 66.0824 68.1895 176.9888 35 V 2.8056 7.6690 119.6013 66.2622 31.6814 177.6268 36 M 4.0596 7.8827 118.5527 57.8881 31.8488 178.4783 37 R 4.7281 8.4020 119.4458 59.0798 30.2268 179.1904 38 S 4.1821 7.5136 112.3798 61.3095 62.9315 175.8023 39 L 4.3356 7.9561 120.0101 54.0259 42.7797 175.8492 40 G 3.5744 8.7576 108.6874 44.0539 0.0000 172.6845 41 Q 4.5447 7.3858 121.6153 56.7849 32.7897 173.6703 42 N 5.1206 8.4144 114.7579 50.8406 38.1219 172.2631 43 P 4.2567 0.0000 0.0000 63.6467 32.2775 177.2880 44 T 3.9396 8.1726 110.0437 61.9788 68.9462 174.9451 45 E 4.0248 8.8426 121.1788 57.9961 29.3509 177.5145 46 A 4.5622 8.4312 121.3902 52.5121 21.4649 177.9676 47 E 4.0879 9.6270 116.1695 58.0743 29.9050 178.0722 48 L 4.1729 7.8333 118.9427 57.2084 42.5256 177.5383 49 Q 4.4189 7.6784 116.0287 57.1090 29.0107 177.3948 50 D 4.3410 7.4657 119.0011 57.6210 41.0460 178.2717 51 M 4.2160 7.9327 118.6281 58.3575 31.9957 178.5751 52 I 3.8385 7.6586 118.3128 64.0559 38.1892 177.1162 53 N 4.3797 8.7944 117.1674 55.7225 38.8309 175.5297 54 E 4.2286 7.6577 117.5613 57.3476 30.8336 176.2265 55 V 4.5552 7.7172 111.2787 61.3274 32.1235 178.0242 56 D 4.7007 7.7523 120.9959 53.9652 38.9655 177.0093 57 A 4.7411 7.8440 120.4735 51.5387 20.6521 175.5052 58 D 5.1587 7.7109 119.9831 53.8745 44.1020 177.7642 59 G 3.7538 8.6814 107.2563 46.8490 0.0000 172.4590 60 N 4.4490 8.2028 119.6974 50.7812 35.2409 172.3955 61 G 3.3803 7.3193 112.2656 44.8009 0.0000 170.6249 62 T 5.4440 7.6637 109.6822 59.2165 71.9438 172.9751 63 I 4.7898 8.2165 116.6250 59.4016 41.1737 175.2300 64 D 5.1181 8.4317 124.5556 52.7998 41.7128 175.3193 65 F 3.1042 8.9029 115.5595 60.3155 39.2325 175.8868 66 P 4.5417 0.0000 0.0000 65.2918 31.3684 177.3087 67 E 4.3196 9.3368 117.3934 57.6456 30.4845 178.1492 68 F 4.3780 8.6117 121.3289 60.5636 39.4067 177.1797 69 L 4.0487 8.0192 118.4431 58.5806 42.0500 177.9630 70 T 4.1164 7.8608 115.4042 65.3144 66.9668 177.0538 71 M 3.6476 8.0471 120.7680 58.9172 33.6152 177.2574 72 M 4.4747 7.4801 119.9368 53.6576 29.7328 174.2736 73 A 4.6627 7.1136 123.9878 52.8206 25.4447 179.2107 74 R 4.0891 7.4404 113.9827 58.4378 30.4898 177.7628 75 K 4.3306 7.9273 116.4103 56.5798 33.5910 176.0027 76 M 4.5221 9.0695 117.2752 55.5829 33.7794 176.8477 77 K 4.1123 8.0359 116.4331 57.6680 31.5894 175.2907 78 D 4.6813 7.3061 113.6102 55.5423 43.7406 175.2552 79 T 3.9260 7.7023 113.5865 63.3421 67.7581 174.2024 80 D 4.8203 8.3242 127.1628 53.3301 42.8630 177.3282 81 S 4.4482 8.0032 116.8021 60.9724 62.7930 174.8955 82 E 3.9370 8.3666 122.3187 60.0371 29.4028 177.7771 83 E 3.9730 8.3779 118.4184 58.7773 29.6474 178.0971 84 E 3.9556 8.1402 117.5936 60.0435 29.8479 179.7263 85 I 4.0117 7.7446 118.7416 64.4937 37.1347 178.1645 86 R 4.3849 8.6185 119.4545 58.5579 29.6623 178.3518 87 E 4.0452 8.5236 118.2839 59.1577 29.9017 178.1295 88 A 4.3428 8.3068 120.4357 55.6017 18.3977 178.7709 89 F 3.7201 8.5751 118.2270 61.9975 39.2434 177.4969 90 R 4.0079 8.0775 116.0431 59.1611 29.9248 179.1003 91 V 3.6560 7.8656 117.8281 66.0462 31.7134 177.7980 92 F 4.0538 8.0762 115.5850 59.8465 40.2405 176.5021 93 D 4.5161 7.3010 117.2679 53.7983 36.7941 175.5726 94 K 4.0071 7.8064 123.6272 59.6267 32.9440 178.7386 95 D 4.3860 7.9324 116.9819 56.2724 39.3319 177.3879 96 G 4.2391 7.8886 108.4903 45.6296 0.0000 173.5509 97 N 4.7124 8.7109 115.6649 51.7139 37.5600 176.3186 98 G 4.1135 8.4879 105.7136 46.4977 0.0000 173.2589 99 Y 5.0524 7.7866 116.0397 56.1162 42.0663 175.4277 100 I 4.4805 9.6176 125.1222 59.7562 38.7385 175.3214 101 S 4.7094 10.2687 123.8764 57.4047 64.4657 175.5121 102 A 4.1632 8.8405 123.0786 55.2690 18.0108 179.7853 103 A 3.9484 8.0554 119.2295 55.6436 18.5137 179.5873 104 E 3.9981 7.9903 114.2176 59.0101 29.6818 178.7209 105 L 4.0836 8.3421 122.0417 58.2874 42.0583 179.0095 106 R 3.8767 7.9234 117.8151 59.9126 29.9489 177.7565 107 H 4.1054 8.0971 116.6359 59.0609 29.7888 176.1988 108 V 3.8726 7.7770 118.9891 64.7422 32.0376 177.6310 109 M 4.1851 8.2486 118.5917 57.8767 31.5191 178.1135 110 T 4.7638 7.7593 109.9962 62.7813 69.8359 176.2562 111 N 4.5728 7.8327 119.7897 55.4225 38.4260 176.3238 112 L 4.1711 7.5658 117.7302 54.9679 41.3802 177.8049 113 G 3.8564 8.0912 107.1591 45.1171 0.0000 173.3882 114 E 4.3072 7.9234 121.3294 54.2821 30.0861 175.2132 115 K 4.3343 8.6049 126.8796 55.9719 31.8268 176.2603 116 L 4.6605 8.1563 124.0043 52.9125 43.8896 176.3749 117 T 4.1497 8.2480 116.9139 61.3517 67.6659 174.9608 118 D 4.4420 8.8413 128.6132 56.6751 41.2601 177.4681 119 E 4.3495 8.4789 118.5717 59.3464 30.2034 177.5881 120 E 4.3103 7.8068 116.2229 57.4084 29.5282 179.0307 121 V 3.6890 7.5520 119.1456 65.9419 31.8166 177.1482 122 D 4.4585 8.2256 116.8594 58.1956 40.8410 178.0327 123 Q 3.9879 7.8826 118.8583 59.4956 28.9040 177.7004 124 M 3.8772 8.5395 118.3230 58.9691 31.8000 179.3382 125 I 3.6129 8.0234 119.0739 64.5166 37.6210 178.1114 126 R 3.7838 8.0636 119.8498 59.3959 29.9033 178.0807 127 E 4.0725 8.1309 117.7074 58.2791 29.6718 177.8396 128 A 4.3635 7.2974 119.3112 53.2663 19.5451 177.2165 129 D 4.6626 7.5017 117.1781 54.3472 41.7612 175.8718 130 I 4.2504 10.0368 127.9946 61.8242 38.4553 176.2093 131 D 4.7415 8.3934 117.2478 52.6602 39.4294 177.2281 132 G 4.0446 8.4502 109.4395 46.0622 0.0000 174.7408 133 D 4.3326 8.0350 116.2760 53.8601 38.9557 177.6753 134 G 4.0464 8.8348 107.6954 46.1545 0.0000 173.1358 135 Q 4.8032 7.7425 114.9585 54.3522 32.1426 174.8053 136 V 4.9295 8.4875 112.0993 59.6295 34.8848 175.0227 137 N 5.2605 8.4052 121.2374 50.9732 40.4135 174.9164 138 Y 3.4266 7.9764 119.2866 61.4386 38.3614 177.4518 139 E 3.5760 8.2672 117.8307 60.3120 29.5400 179.1845 140 E 4.0230 9.4124 117.9025 59.1218 29.8821 179.0932 141 F 4.3891 8.4704 122.7775 61.1910 38.9306 177.2067 142 V 3.2564 8.1163 118.3531 66.1640 31.2002 177.4493 143 Q 3.8766 7.7489 117.4023 59.0009 28.2992 178.4593 144 M 3.7833 7.9086 119.2510 58.7463 32.5721 177.9137 145 M 3.8615 7.7935 116.7291 56.9278 32.0189 176.9396 146 T 3.7523 5.7900 107.7707 64.6783 69.5410 174.1035 147 A 3.8237 7.4709 128.2045 51.5772 18.0686 177.2449 148 K 4.1006 8.4436 121.4809 57.4499 32.3040 176.6607 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 3 Q 8.44 4.22 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 4 L 8.43 3.90 0.00 1.73 1.54 0.92 0.60 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 5 T 8.88 4.05 4.19 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 1.25 0.00 0.00 6 E 8.98 3.85 0.00 2.19 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 0.00 2.35 2.38 0.00 7 E 8.26 3.97 0.00 2.03 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 2.39 2.40 0.00 8 Q 7.91 3.99 0.00 1.95 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.54 0.00 0.00 0.00 0.00 0.00 1.82 2.06 0.00 9 I 8.56 3.91 1.97 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.82 0.89 0.00 0.00 10 A 8.03 4.01 1.35 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 11 E 8.02 4.08 0.00 2.28 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.66 0.00 12 F 8.85 4.80 0.00 3.18 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.99 4.46 0.00 1.97 2.00 0.00 1.80 0.00 0.00 1.92 0.00 0.00 3.05 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.53 1.74 7.81 14 E 8.60 4.33 0.00 2.18 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 2.43 2.56 0.00 15 A 7.89 4.70 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 F 8.09 3.63 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 17 S 9.03 4.06 0.00 4.16 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 18 L 7.40 4.06 0.00 1.86 1.95 0.89 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.41 4.50 0.00 2.81 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 20 D 8.06 4.41 0.00 2.34 2.51 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 21 K 8.16 3.73 0.00 1.72 1.80 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.41 1.51 7.81 22 D 8.56 4.54 0.00 2.84 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 23 G 7.44 3.84 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 0.00 0.00 0.00 24 D 8.27 4.32 0.00 2.76 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 25 G 7.28 4.11 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 0.00 0.00 0.00 26 T 8.18 5.37 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 1.18 0.00 0.00 27 I 8.68 4.83 1.61 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.59 -0.11 0.00 0.00 28 T 9.87 4.60 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 29 T 8.37 3.81 4.22 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 1.20 0.00 0.00 30 K 8.05 3.79 0.00 1.80 1.86 0.00 1.55 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.60 7.81 31 E 7.95 3.85 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.28 0.00 32 L 8.06 3.88 0.00 1.78 1.87 1.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.90 3.56 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 0.00 34 T 7.69 3.73 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 35 V 7.67 2.81 1.86 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 0.54 0.00 0.00 0.54 0.00 0.00 36 M 7.88 4.06 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.78 0.00 37 R 8.40 4.73 0.00 1.75 1.95 0.00 3.07 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 38 S 7.51 4.18 0.00 3.97 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 39 L 7.96 4.34 0.00 1.75 1.64 0.61 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.76 3.57 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 0.00 0.00 0.00 41 Q 7.39 4.54 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.86 0.00 0.00 0.00 0.00 0.00 2.17 2.12 0.00 42 N 8.41 5.12 0.00 2.75 2.74 0.00 0.00 6.04 7.75 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 43 P 0.00 4.26 0.00 2.18 2.11 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 44 T 8.17 3.94 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 1.28 0.00 0.00 45 E 8.84 4.02 0.00 1.97 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 2.30 2.31 0.00 46 A 8.43 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 9.63 4.09 0.00 2.02 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 2.30 2.24 0.00 48 L 7.83 4.17 0.00 1.76 1.67 0.92 0.69 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 49 Q 7.68 4.42 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 50 D 7.47 4.34 0.00 2.75 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 51 M 7.93 4.22 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 52 I 7.66 3.84 1.91 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 1.54 1.66 1.07 0.00 0.00 53 N 8.79 4.38 0.00 2.73 2.87 0.00 0.00 7.24 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.66 4.23 0.00 2.33 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 2.32 2.39 0.00 55 V 7.72 4.56 2.32 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 0.82 0.00 0.00 1.02 0.00 0.00 56 D 7.75 4.70 0.00 2.75 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 57 A 7.84 4.74 1.23 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 58 D 7.71 5.16 0.00 2.71 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 59 G 8.68 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.20 4.45 0.00 2.84 2.90 0.00 0.00 6.96 8.31 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 61 G 7.32 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 T 7.66 5.44 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 1.21 0.00 0.00 63 I 8.22 4.79 2.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.46 0.98 0.00 0.00 64 D 8.43 5.12 0.00 2.85 2.81 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 65 F 8.90 3.10 0.00 2.86 2.75 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 66 P 0.00 4.54 0.00 2.17 2.17 0.00 4.20 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 67 E 9.34 4.32 0.00 2.06 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 2.33 2.70 0.00 68 F 8.61 4.38 0.00 3.07 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 69 L 8.02 4.05 0.00 1.69 1.69 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.86 4.12 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 1.20 0.00 0.00 71 M 8.05 3.65 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 72 M 7.48 4.47 0.00 2.37 2.05 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.77 0.00 73 A 7.11 4.66 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 74 R 7.44 4.09 0.00 1.80 2.01 0.00 3.30 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 75 K 7.93 4.33 0.00 1.69 1.80 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.39 7.81 76 M 9.07 4.52 0.00 2.10 2.05 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 2.49 2.44 0.00 77 K 8.04 4.11 0.00 1.72 1.79 0.00 1.64 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.48 7.81 78 D 7.31 4.68 0.00 2.66 2.51 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 79 T 7.70 3.93 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 1.26 0.00 0.00 80 D 8.32 4.82 0.00 2.66 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 81 S 8.00 4.45 0.00 4.14 4.13 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 E 8.37 3.94 0.00 2.02 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 2.40 2.51 0.00 83 E 8.38 3.97 0.00 2.14 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 2.39 2.48 0.00 84 E 8.14 3.96 0.00 2.27 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 0.00 2.45 2.54 0.00 85 I 7.74 4.01 2.12 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.21 0.87 0.00 0.00 86 R 8.62 4.38 0.00 1.69 2.13 0.00 2.94 0.00 0.00 2.93 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.33 0.00 87 E 8.52 4.05 0.00 2.12 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 2.39 2.64 0.00 88 A 8.31 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.58 3.72 0.00 3.78 3.56 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 90 R 8.08 4.01 0.00 2.04 2.07 0.00 3.25 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 91 V 7.87 3.66 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 0.37 0.00 0.00 0.89 0.00 0.00 92 F 8.08 4.05 0.00 2.59 2.93 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 93 D 7.30 4.52 0.00 1.90 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 0.00 0.00 0.00 0.00 94 K 7.81 4.01 0.00 1.96 1.87 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.62 1.39 7.81 95 D 7.93 4.39 0.00 2.74 2.81 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 96 G 7.89 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 0.00 0.00 0.00 0.00 97 N 8.71 4.71 0.00 3.07 3.17 0.00 0.00 6.92 6.95 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 98 G 8.49 4.11 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 0.00 0.00 0.00 99 Y 7.79 5.05 0.00 2.80 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 0.00 100 I 9.62 4.48 1.73 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.05 0.76 0.00 0.00 101 S 10.27 4.71 0.00 3.78 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 0.00 102 A 8.84 4.16 1.35 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 0.00 103 A 8.06 3.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 7.99 4.00 0.00 2.40 2.25 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 2.40 2.33 0.00 105 L 8.34 4.08 0.00 1.75 1.94 0.95 0.83 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 0.00 106 R 7.92 3.88 0.00 2.23 1.94 0.00 3.33 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 107 H 8.10 4.11 0.00 3.13 3.49 0.00 5.99 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.78 3.87 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 0.33 0.00 0.00 0.64 0.00 0.00 109 M 8.25 4.19 0.00 2.13 2.37 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 3.02 0.00 110 T 7.76 4.76 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 1.34 0.00 0.00 111 N 7.83 4.57 0.00 2.65 2.83 0.00 0.00 6.85 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.57 4.17 0.00 1.64 1.68 0.90 0.87 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 0.00 113 G 8.09 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 0.00 114 E 7.92 4.31 0.00 2.09 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 0.00 2.27 2.33 0.00 115 K 8.60 4.33 0.00 1.80 1.78 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.41 7.81 116 L 8.16 4.66 0.00 1.64 1.59 0.97 0.95 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 0.00 117 T 8.25 4.15 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 1.29 0.00 0.00 118 D 8.84 4.44 0.00 2.71 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 0.00 119 E 8.48 4.35 0.00 1.98 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 2.28 2.48 0.00 120 E 7.81 4.31 0.00 2.00 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 2.33 2.32 0.00 121 V 7.55 3.69 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 1.15 0.00 0.00 0.96 0.00 0.00 122 D 8.23 4.46 0.00 2.84 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 0.00 123 Q 7.88 3.99 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 124 M 8.54 3.88 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.63 0.00 125 I 8.02 3.61 2.03 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 1.42 1.12 0.95 0.00 0.00 126 R 8.06 3.78 0.00 2.26 1.95 0.00 3.10 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 127 E 8.13 4.07 0.00 2.03 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 0.00 2.33 2.33 0.00 128 A 7.30 4.36 1.35 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 0.00 129 D 7.50 4.66 0.00 2.85 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 0.00 130 I 10.04 4.25 1.88 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 1.36 0.90 0.91 0.00 0.00 131 D 8.39 4.74 0.00 2.79 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 0.00 132 G 8.45 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 133 D 8.03 4.33 0.00 2.77 2.89 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 0.00 134 G 8.83 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 0.00 135 Q 7.74 4.80 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.54 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 136 V 8.49 4.93 2.23 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 0.90 0.00 0.00 1.03 0.00 0.00 137 N 8.41 5.26 0.00 2.41 2.75 0.00 0.00 6.42 7.45 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 0.00 138 Y 7.98 3.43 0.00 2.02 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 0.00 139 E 8.27 3.58 0.00 2.33 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 0.00 2.38 2.40 0.00 140 E 9.41 4.02 0.00 2.33 2.22 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 2.53 2.45 0.00 141 F 8.47 4.39 0.00 3.25 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 8.12 3.26 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 0.80 0.00 0.00 -0.21 0.00 0.00 143 Q 7.75 3.88 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.41 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 144 M 7.91 3.78 0.00 2.09 2.13 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 2.65 2.71 0.00 145 M 7.79 3.86 0.00 1.82 1.49 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.35 0.00 146 T 5.79 3.75 4.19 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 1.16 0.00 0.00 147 A 7.47 3.82 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 0.00 148 K 8.44 4.10 0.00 1.81 1.67 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.41 7.81