NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4486 8.3044 120.3488 54.8331 33.7656 174.3719 2 Q 4.4290 7.9742 118.2604 55.9935 35.3025 172.7398 3 H 4.6440 8.3553 114.9923 55.3758 30.9389 173.4978 4 L 3.9263 7.8374 120.6689 55.1364 42.4398 176.1360 5 D 4.7131 8.4215 125.5663 52.6070 42.0997 176.2960 6 I 3.5433 8.1448 127.8265 63.8432 38.0975 177.1164 7 A 3.9945 8.0631 121.2073 55.5165 18.2023 179.3754 8 E 3.9226 8.1282 116.7381 59.0431 29.4159 179.2919 9 L 3.8866 7.9127 120.5947 58.1014 42.1652 179.2161 10 V 3.7939 8.1287 118.5477 66.0786 31.5061 177.8299 11 R 3.8980 8.2824 118.7630 59.5532 29.6515 178.4515 12 S 4.0787 8.2310 112.6291 61.3297 62.4346 175.8759 13 A 4.2993 8.3663 123.7031 55.3532 18.0552 179.6632 14 L 3.9949 8.1862 117.4516 57.4978 41.6468 179.3836 15 E 3.8702 8.2369 119.5442 59.3535 29.4467 178.7515 16 V 3.5972 7.7261 117.0075 66.4534 31.5772 177.8190 17 S 4.3192 7.8632 112.9300 59.4806 62.6865 175.0133 18 G 3.8656 7.8727 109.5550 45.8737 0.0000 173.6252 19 C 4.1638 7.9702 116.8484 58.8660 28.8320 173.5416 20 D 4.4001 8.5188 122.4274 53.5723 40.4273 175.2056 21 P 4.4006 0.0000 0.0000 65.0675 31.5087 178.6513 22 S 4.1853 8.4757 113.7966 60.7473 62.9987 175.4684 23 L 4.0606 7.8002 120.2712 56.5684 41.5653 176.9893 24 I 4.0623 7.3393 120.5473 60.4157 37.3036 175.8358 25 G 3.8858 8.3468 120.8148 44.9407 0.0000 172.8841 26 G 3.7226 8.6385 113.1368 45.2641 0.0000 172.8667 27 I 4.5590 9.0840 119.1263 57.6632 40.1264 174.6079 28 D 4.9612 8.3565 132.9566 53.9106 37.1785 177.1248 29 S 4.3930 7.6706 116.9281 58.5170 63.2228 173.6697 30 H 4.2262 7.7213 116.0447 57.0211 26.0863 174.4298 31 S 4.8045 7.0701 116.0550 56.9984 65.2105 173.9353 32 T 4.2904 8.3255 117.7879 64.4224 68.8001 174.5571 33 I 4.1958 8.5813 127.4793 60.5836 38.8726 174.9565 34 V 4.6376 8.2648 125.7552 61.0462 34.1591 174.5234 35 L 4.5623 9.1270 128.7625 53.3068 42.7624 175.6508 36 D 4.9993 8.4963 124.0089 53.2298 41.7722 176.2580 37 L 4.9664 8.2427 120.3872 52.6382 45.8701 176.4471 38 F 4.2556 9.3491 123.2994 61.1994 39.1945 176.4940 39 A 4.6331 8.0837 118.1975 51.4493 19.9945 174.9942 40 L 4.9118 7.7077 116.6222 53.0356 45.4529 174.8391 41 P 4.3889 0.0000 0.0000 62.7965 31.5390 176.7842 42 S 4.4850 8.5166 117.1975 59.0658 64.2959 173.1244 43 I 4.5938 8.5375 124.5730 60.3971 38.7043 174.4685 44 C 4.7636 8.4225 125.0256 57.8184 30.6932 172.8496 45 I 5.0671 8.5307 123.4472 59.6571 40.1294 174.5705 46 S 5.0802 9.7092 120.7906 56.9910 66.5408 172.4483 47 V 4.7853 8.4923 124.8767 61.3355 32.8876 175.1323 48 K 4.3165 9.5617 128.8419 55.2405 33.8538 174.8525 49 D 4.3583 9.6320 125.0258 56.1802 37.7112 173.7819 50 D 4.4747 8.0141 114.7249 54.7648 39.3893 173.4093 51 D 4.8215 8.1170 120.0585 52.4290 42.8590 175.2496 52 V 4.7123 8.1358 123.6759 61.6110 33.1768 174.2767 53 W 5.3965 9.8520 128.2709 55.0712 32.1883 174.7471 54 I 5.1226 8.9317 124.9736 59.3556 39.5141 174.7831 55 W 5.8599 8.8364 122.5986 55.8177 32.3180 173.2082 56 A 4.9065 9.2889 120.9411 50.6353 22.3399 175.9109 57 Q 4.5877 8.9101 121.2490 56.0090 29.5612 176.0854 58 L 4.5121 8.9857 122.4310 54.2149 42.6425 176.1329 59 G 4.1638 8.4313 107.0375 43.4966 0.0000 175.3412 60 A 4.0774 8.7191 124.1103 54.7560 18.6023 178.4435 61 D 4.8581 7.9350 113.1439 54.2221 41.6091 178.2430 62 S 4.1494 8.0776 117.6911 61.9876 62.5270 176.5322 63 M 4.0588 7.9297 120.8721 57.9024 32.0558 178.4887 64 V 3.7266 7.6841 117.9858 66.1115 31.8850 178.1792 65 V 3.6277 8.0097 118.0724 65.7745 31.1651 177.4354 66 L 3.9714 8.2695 120.4896 58.4383 41.5264 178.9655 67 Q 4.0448 7.9082 117.1062 58.3878 28.6707 177.9307 68 Q 4.5619 8.1474 116.7736 55.7841 30.0998 176.4969 69 R 4.6023 7.3751 117.6335 55.5838 31.1631 177.4252 70 A 4.0745 8.1214 123.1156 55.2903 18.1632 179.8002 71 Y 4.1833 8.0161 117.6480 60.9859 39.0329 177.6111 72 E 3.6311 8.2039 119.7247 59.2154 29.6066 178.7605 73 I 3.5491 7.7719 119.8175 64.2536 37.1439 178.3280 74 L 3.9905 8.2329 120.2152 58.0657 41.3294 179.4169 75 M 3.8978 7.9484 118.6867 58.6327 31.6284 178.8620 76 T 3.6975 7.3648 114.3888 66.6754 68.8785 176.1398 77 I 3.9591 7.9318 121.7568 65.0045 37.0315 178.3982 78 M 4.2234 8.2055 117.7805 57.5082 31.8071 178.1842 79 E 4.1046 7.7446 117.2796 56.8863 29.9616 177.7866 80 G 3.8119 9.0158 104.6657 45.5001 0.0000 172.6436 81 C 4.1986 8.3663 118.7111 58.1654 33.1862 174.3894 82 H 4.3154 8.6677 125.5256 57.8197 28.7091 176.2837 83 F 3.7894 7.0976 112.6139 55.8719 38.6200 174.7715 84 A 4.9517 6.8959 124.9122 50.3223 20.5152 176.8535 85 R 4.2031 8.5457 121.5165 57.7454 30.4558 177.9111 86 G 3.8199 8.9397 110.3284 44.8019 0.0000 173.9288 87 G 3.9720 8.8809 107.5576 45.5623 0.0000 172.9533 88 Q 4.5318 7.4924 118.4393 53.9503 31.9971 174.2107 89 L 4.3038 8.1276 124.7066 54.9370 42.6294 176.1357 90 L 4.9251 9.0329 120.8721 52.9918 45.4995 175.3515 91 L 5.1256 8.5409 120.5418 53.3525 44.3011 176.2554 92 G 4.2228 8.7847 111.0473 45.1398 0.0000 170.3843 93 E 5.1885 8.5068 119.8762 54.8413 32.7864 175.1592 94 Q 4.5094 9.0113 124.7633 55.5802 32.6763 174.9576 95 N 4.1836 9.8821 118.7812 54.4876 36.2934 174.9662 96 G 4.0914 8.4000 101.1074 45.4370 0.0000 173.3405 97 E 4.8059 7.9754 118.5949 53.5710 33.3333 175.3776 98 L 4.5304 8.7195 125.7567 55.7800 43.6005 175.7001 99 T 5.1898 9.1643 122.2268 61.7221 71.9426 172.5591 100 L 4.8872 8.9845 128.4981 53.6493 44.1374 175.3176 101 K 5.6271 9.2209 124.3743 54.8050 37.0170 174.9888 102 A 4.9791 9.8299 125.9055 50.0537 21.9707 175.1452 103 L 3.5049 8.2484 125.6683 53.7621 42.6612 175.8557 104 V 4.3282 8.2308 127.9478 62.7977 32.2704 175.4521 105 H 4.3698 9.5562 128.5661 55.3409 30.5586 174.3832 106 P 4.3050 0.0000 0.0000 65.6610 31.4312 178.0972 107 D 4.2961 8.6536 117.0274 57.0469 40.4631 177.2025 108 F 4.7015 8.7338 116.6025 57.2477 38.9290 176.6344 109 L 4.8250 8.0149 119.0132 54.4587 42.4490 177.7401 110 S 4.2813 8.1374 114.7043 60.8777 63.6184 173.7722 111 D 4.7037 7.5827 119.1487 51.2407 42.9442 176.2052 112 G 3.7726 8.4810 106.9944 47.2735 0.0000 175.7593 113 E 4.0199 8.2514 120.4183 59.2497 29.5171 179.3695 114 K 4.0865 8.5529 118.5748 59.5817 32.0707 179.3086 115 F 4.6059 8.5192 122.3163 60.6935 39.1897 177.0368 116 S 3.9466 8.5756 113.4270 61.5823 62.1393 176.2614 117 T 3.8038 7.9040 117.7845 66.5486 68.1475 176.4236 118 A 2.5800 7.5336 122.1674 54.5932 18.2537 179.7493 119 L 3.6351 7.4264 117.7119 57.9103 41.6487 179.5763 120 N 4.4554 8.3219 116.8327 55.9845 38.4492 177.8113 121 G 3.7129 8.0247 107.3109 47.7347 0.0000 175.4613 122 F 4.3644 8.3315 123.6069 61.1773 39.4443 176.2162 123 Y 4.1026 8.4328 119.3316 61.0359 38.5921 177.9181 124 N 4.2808 8.3763 116.9702 56.8652 38.7159 177.0834 125 Y 4.2459 7.8914 117.8173 60.7432 37.8712 178.0443 126 L 3.8209 8.2077 121.8000 58.1553 42.1219 178.7929 127 E 3.8161 7.9098 118.2873 59.4527 29.3722 179.6744 128 V 3.4994 7.6237 117.7217 66.0642 31.4307 178.0923 129 F 3.9819 8.6472 116.6972 60.5201 38.9564 177.5012 130 S 4.3242 8.3726 114.0207 61.6523 62.7977 176.8319 131 R 3.9477 8.1015 121.6991 59.0203 29.5880 179.1727 132 S 4.3198 8.1898 114.0686 60.5862 62.7190 175.6372 133 L 4.6185 7.1346 119.6839 54.5437 41.8330 176.1033 134 M 4.1975 7.7614 124.5975 55.8506 32.1905 175.8651 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 1.97 2.12 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.59 0.00 2 Q 7.97 4.43 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.00 0.00 0.00 0.00 0.00 0.00 2.23 2.47 0.00 3 H 8.36 4.64 0.00 3.13 3.25 0.00 5.78 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 7.84 3.93 0.00 1.60 1.54 0.84 1.09 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 5 D 8.42 4.71 0.00 2.71 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 6 I 8.14 3.54 1.84 0.00 0.00 0.58 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 1.12 0.93 0.00 0.00 7 A 8.06 3.99 1.30 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 8 E 8.13 3.92 0.00 1.96 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 2.49 2.45 0.00 9 L 7.91 3.89 0.00 1.73 1.46 0.92 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.13 3.79 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.15 0.00 0.00 11 R 8.28 3.90 0.00 1.98 2.10 0.00 3.32 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 1.64 1.65 0.00 12 S 8.23 4.08 0.00 4.05 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 13 A 8.37 4.30 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 14 L 8.19 3.99 0.00 1.86 1.72 0.93 0.62 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 15 E 8.24 3.87 0.00 2.16 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 0.00 2.30 2.31 0.00 16 V 7.73 3.60 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 0.89 0.00 0.00 1.00 0.00 0.00 17 S 7.86 4.32 0.00 4.01 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 7.87 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 19 C 7.97 4.16 0.00 3.04 2.86 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 20 D 8.52 4.40 0.00 2.66 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 21 P 0.00 4.40 0.00 2.25 2.29 0.00 3.74 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 2.07 1.95 0.00 22 S 8.48 4.19 0.00 3.98 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 23 L 7.80 4.06 0.00 1.76 1.77 0.92 0.63 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 24 I 7.34 4.06 2.00 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 1.23 0.47 0.91 0.00 0.00 25 G 8.35 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 0.00 0.00 0.00 26 G 8.64 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 0.00 0.00 0.00 27 I 9.08 4.56 1.86 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 1.46 0.76 0.90 0.00 0.00 28 D 8.36 4.96 0.00 2.85 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 7.67 4.39 0.00 3.90 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 30 H 7.72 4.23 0.00 3.27 3.38 0.00 5.88 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 S 7.07 4.80 0.00 4.07 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 32 T 8.33 4.29 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 1.13 0.00 0.00 33 I 8.58 4.20 1.87 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 1.11 0.56 0.90 0.00 0.00 34 V 8.26 4.64 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 0.75 0.00 0.00 0.84 0.00 0.00 35 L 9.13 4.56 0.00 1.59 1.61 0.91 1.14 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 36 D 8.50 5.00 0.00 2.58 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 37 L 8.24 4.97 0.00 1.85 1.70 1.21 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 38 F 9.35 4.26 0.00 2.99 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 39 A 8.08 4.63 1.28 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 40 L 7.71 4.91 0.00 1.63 1.51 0.57 1.01 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 41 P 0.00 4.39 0.00 2.07 2.15 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 42 S 8.52 4.48 0.00 3.73 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 43 I 8.54 4.59 1.85 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.98 0.67 0.00 0.00 44 C 8.42 4.76 0.00 1.23 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 45 I 8.53 5.07 1.91 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 1.15 0.92 1.10 0.00 0.00 46 S 9.71 5.08 0.00 4.32 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 47 V 8.49 4.79 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 0.90 0.00 0.00 0.97 0.00 0.00 48 K 9.56 4.32 0.00 1.87 1.89 0.00 1.53 0.00 0.00 1.39 0.00 0.00 2.78 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.34 1.36 7.81 49 D 9.63 4.36 0.00 2.82 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 50 D 8.01 4.47 0.00 2.84 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 D 8.12 4.82 0.00 2.99 2.33 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 52 V 8.14 4.71 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 1.17 0.00 0.00 0.91 0.00 0.00 53 W 9.85 5.40 0.00 3.42 3.25 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 54 I 8.93 5.12 1.63 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 1.25 0.91 -0.19 0.00 0.00 55 W 8.84 5.86 0.00 3.60 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 56 A 9.29 4.91 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 57 Q 8.91 4.59 0.00 2.02 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 7.00 0.00 0.00 0.00 0.00 0.00 2.48 2.58 0.00 58 L 8.99 4.51 0.00 1.59 1.73 0.96 0.97 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 59 G 8.43 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 60 A 8.72 4.08 1.30 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 61 D 7.93 4.86 0.00 2.72 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 62 S 8.08 4.15 0.00 4.10 4.31 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 63 M 7.93 4.06 0.00 2.02 2.18 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 2.80 2.62 0.00 64 V 7.68 3.73 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 1.04 0.00 0.00 0.94 0.00 0.00 65 V 8.01 3.63 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 0.95 0.00 0.00 1.01 0.00 0.00 66 L 8.27 3.97 0.00 2.00 1.93 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 7.91 4.04 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.56 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 68 Q 8.15 4.56 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.13 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 69 R 7.38 4.60 0.00 2.01 1.89 0.00 3.19 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 70 A 8.12 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.02 4.18 0.00 3.01 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 72 E 8.20 3.63 0.00 2.01 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 2.23 2.26 0.00 73 I 7.77 3.55 2.04 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 1.68 0.84 1.10 0.00 0.00 74 L 8.23 3.99 0.00 1.94 1.72 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 75 M 7.95 3.90 0.00 1.78 1.94 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.07 0.00 76 T 7.36 3.70 3.76 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 0.71 0.00 0.00 77 I 7.93 3.96 2.07 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 1.98 0.94 0.92 0.00 0.00 78 M 8.21 4.22 0.00 1.94 2.09 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 2.80 2.54 0.00 79 E 7.74 4.10 0.00 2.07 2.18 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 2.67 2.39 0.00 80 G 9.02 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 0.00 0.00 0.00 81 C 8.37 4.20 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 8.67 4.32 0.00 3.27 3.44 0.00 5.73 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 7.10 3.79 0.00 2.31 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 0.00 0.00 0.00 84 A 6.90 4.95 1.04 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 85 R 8.55 4.20 0.00 1.72 1.83 0.00 3.08 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.48 0.00 86 G 8.94 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 0.00 0.00 0.00 87 G 8.88 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 88 Q 7.49 4.53 0.00 1.91 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.12 6.97 0.00 0.00 0.00 0.00 0.00 2.18 2.38 0.00 89 L 8.13 4.30 0.00 1.32 1.34 0.15 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 90 L 9.03 4.93 0.00 1.67 1.60 1.14 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.54 5.13 0.00 1.50 1.55 1.00 0.73 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 92 G 8.78 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 0.00 0.00 0.00 0.00 93 E 8.51 5.19 0.00 1.94 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 2.26 2.38 0.00 94 Q 9.01 4.51 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 5.98 0.00 0.00 0.00 0.00 0.00 2.15 2.36 0.00 95 N 9.88 4.18 0.00 2.84 2.87 0.00 0.00 7.03 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.40 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 0.00 0.00 0.00 0.00 97 E 7.98 4.81 0.00 2.06 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 2.23 2.43 0.00 98 L 8.72 4.53 0.00 1.82 1.57 0.98 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 99 T 9.16 5.19 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 1.40 0.00 0.00 100 L 8.98 4.89 0.00 1.50 1.52 -0.19 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 101 K 9.22 5.63 0.00 1.97 2.07 0.00 1.19 0.00 0.00 1.33 0.00 0.00 2.77 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.43 7.81 102 A 9.83 4.98 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 0.00 103 L 8.25 3.50 0.00 0.34 1.12 -0.15 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.23 4.33 2.21 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 1.11 0.00 0.00 1.20 0.00 0.00 105 H 9.56 4.37 0.00 3.29 3.49 0.00 5.65 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 0.00 106 P 0.00 4.30 0.00 2.22 2.10 0.00 3.26 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 107 D 8.65 4.30 0.00 2.67 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 8.73 4.70 0.00 3.42 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 0.00 109 L 8.01 4.82 0.00 1.74 1.61 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 110 S 8.14 4.28 0.00 3.96 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 0.00 111 D 7.58 4.70 0.00 2.94 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.48 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.25 4.02 0.00 2.23 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 2.41 2.42 0.00 114 K 8.55 4.09 0.00 1.97 1.91 0.00 1.22 0.00 0.00 1.37 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.48 7.81 115 F 8.52 4.61 0.00 3.23 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.58 3.95 0.00 4.07 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 0.00 117 T 7.90 3.80 4.68 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 1.41 0.00 0.00 118 A 7.53 2.58 0.82 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 0.00 0.00 119 L 7.43 3.64 0.00 1.39 1.54 0.82 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 120 N 8.32 4.46 0.00 2.75 2.82 0.00 0.00 6.92 8.16 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 0.00 121 G 8.02 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 0.00 0.00 0.00 122 F 8.33 4.36 0.00 3.35 3.23 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 0.00 123 Y 8.43 4.10 0.00 3.28 3.21 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 0.00 124 N 8.38 4.28 0.00 2.83 2.59 0.00 0.00 7.12 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 0.00 125 Y 7.89 4.25 0.00 2.97 3.02 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 0.00 126 L 8.21 3.82 0.00 1.53 1.65 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 127 E 7.91 3.82 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.94 0.00 128 V 7.62 3.50 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 0.93 0.00 0.00 0.85 0.00 0.00 129 F 8.65 3.98 0.00 3.02 3.07 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 0.00 130 S 8.37 4.32 0.00 4.06 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 0.00 131 R 8.10 3.95 0.00 1.92 2.00 0.00 3.24 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 132 S 8.19 4.32 0.00 3.89 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 0.00 133 L 7.13 4.62 0.00 1.61 1.70 1.02 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 134 M 7.76 4.20 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00