NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3078 8.2649 123.5801 51.4701 19.6848 176.4142 2 I 3.8429 7.9533 121.2462 59.8836 38.2520 173.6802 3 S 4.9950 9.2642 120.6879 57.3353 67.4979 172.7174 4 C 4.7754 8.6785 117.5523 55.0763 42.6411 174.7945 5 G 3.8830 8.2554 109.9953 44.0696 0.0000 173.1189 6 S 4.1635 8.7263 113.4738 57.8912 62.5106 172.6706 7 P 3.9403 0.0000 0.0000 61.5345 31.5739 174.2435 8 P 4.3226 0.0000 0.0000 61.9348 31.7480 174.5705 9 P 4.4500 0.0000 0.0000 62.6814 32.1029 175.5537 10 I 4.4504 7.9038 117.5538 58.9166 39.9716 174.2504 11 L 3.9943 8.5043 128.4503 56.0967 41.7654 176.6861 12 N 3.9346 8.9389 118.3723 53.8874 35.9963 173.5721 13 G 4.3411 7.5433 105.1261 44.9279 0.0000 172.2529 14 R 4.8523 8.9235 117.1737 54.3441 34.6809 174.8526 15 I 4.6522 7.8261 120.6293 58.9823 40.2272 175.8914 16 S 4.1113 8.4452 121.1450 58.2084 63.7297 173.8587 17 Y 4.4266 8.1476 119.2042 58.3801 38.2395 175.3601 18 Y 4.9863 7.6783 121.0129 55.2135 41.2796 174.8312 19 S 4.6322 8.6834 115.9367 57.6266 64.8372 173.1181 20 T 4.7127 8.1053 115.7062 59.5321 69.3081 172.1678 21 P 4.6301 0.0000 0.0000 62.4606 33.0487 176.2155 22 I 4.1696 8.3232 121.2684 60.8304 37.5391 175.4187 23 A 4.6344 8.4369 129.3517 50.7190 20.1899 176.7457 24 V 3.5754 7.4093 119.7787 64.7385 31.8638 176.8050 25 G 4.0322 9.3065 116.6664 45.2445 0.0000 173.9427 26 T 4.1234 7.9755 117.5163 63.6965 69.6510 173.4207 27 V 5.0187 8.5237 125.1461 61.2873 33.7462 174.5457 28 I 4.6317 8.9771 128.5719 59.4489 40.4128 174.4332 29 R 5.0426 8.8956 125.8999 54.9157 32.6432 173.9723 30 Y 5.1176 9.3531 124.4874 56.9385 40.1789 174.9866 31 S 4.7252 8.6423 115.0580 57.7258 66.8745 172.2765 32 C 5.3026 8.4896 117.1752 54.8569 41.8786 174.0708 33 S 4.2313 7.9883 117.4627 58.7520 63.2015 175.8025 34 G 3.6121 8.8963 108.8517 48.4568 0.0000 174.6203 35 T 4.4001 8.1205 108.5131 61.2561 69.1431 173.5345 36 F 5.4098 7.8399 119.2589 56.0934 42.7084 174.6663 37 R 4.6885 9.2856 119.0668 54.2476 33.5672 174.7381 38 L 4.5573 8.6439 125.8025 54.8616 43.2220 175.6839 39 I 3.9113 8.7883 127.9428 61.5269 39.1623 175.4447 40 G 3.0063 5.9597 112.7641 43.4035 0.0000 172.5944 41 E 4.0380 7.7496 118.8524 56.2142 30.0004 177.9230 42 K 4.1758 8.7171 122.2925 58.7938 34.1996 176.4948 43 S 5.3907 7.9582 116.2531 56.6454 65.0095 173.7069 44 L 4.9376 8.9749 123.9219 52.8593 44.8829 175.0030 45 L 5.3189 9.2975 124.2492 53.4497 45.0190 174.3426 46 C 4.2604 9.2692 127.2727 56.1091 42.9693 172.3763 47 I 4.8900 8.6835 126.3272 59.6751 41.7901 174.0414 48 T 4.7641 8.1277 116.5015 60.8310 69.0499 173.5863 49 K 4.2088 8.9877 128.3706 57.9367 32.8553 177.1996 50 D 4.6817 7.9443 114.9279 52.2807 39.7048 176.3832 51 K 3.8980 7.9369 116.9215 57.5110 30.3288 175.6472 52 V 4.1722 8.6413 117.3453 64.1305 33.1414 175.2737 53 D 4.9992 8.2661 116.9049 52.4762 43.3187 175.6591 54 G 4.2347 8.3412 107.3760 44.3638 0.0000 172.7433 55 T 4.7218 8.5972 116.0692 59.6854 70.9862 173.1811 56 W 4.6889 8.5707 125.9814 56.6257 30.1774 176.7395 57 D 4.6221 9.3493 122.6964 54.9050 39.4376 175.8505 58 K 4.5186 7.4938 117.6559 55.2606 35.5866 173.5435 59 P 4.3774 0.0000 0.0000 61.8883 31.8993 176.5703 60 A 3.4930 7.9757 123.3773 51.2934 18.7847 175.8775 61 P 4.4146 0.0000 0.0000 62.2112 33.2053 174.9009 62 K 4.6927 8.5221 117.9589 54.7591 36.3847 174.7799 63 C 5.4306 8.7041 118.6850 55.4821 38.0694 173.2289 64 E 5.0540 9.1750 123.9686 54.2786 31.8515 175.0587 65 Y 3.4353 8.9563 125.4722 57.4447 39.4500 175.6030 66 F 4.3500 8.4107 129.7874 58.5664 40.4536 174.1693 67 N 4.3145 8.5081 124.6011 50.9273 39.0839 174.6150 68 K 3.2815 7.0969 124.9951 58.7281 32.6953 177.8065 69 Y 4.2740 7.2613 116.2007 59.2796 38.4153 176.1985 70 S 4.4872 7.5567 115.7461 58.8661 63.5746 174.1285 71 S 4.8508 8.3166 115.7886 57.6286 65.4315 174.1348 72 C 5.1393 8.8451 120.9591 54.3626 42.1886 172.2294 73 P 4.6973 0.0000 0.0000 61.9515 31.8806 175.7452 74 E 3.9663 8.9469 120.3688 56.0942 29.7845 174.4992 75 P 4.3675 0.0000 0.0000 61.9317 32.2100 175.3607 76 I 4.4037 8.1020 123.2750 59.1972 39.8860 175.2478 77 V 3.9581 7.9244 124.0595 59.6421 32.2912 172.5974 78 P 4.3054 0.0000 0.0000 64.3189 31.4188 177.2066 79 G 3.0655 9.1337 108.8732 45.0524 0.0000 172.3040 80 G 4.5127 7.9150 105.7872 45.1867 0.0000 170.9100 81 Y 5.1224 8.4239 116.5591 55.5331 41.8830 174.1921 82 K 4.1554 8.6415 120.1076 55.9463 32.5131 177.2546 83 I 4.3408 8.4142 117.4024 60.5866 38.8994 175.5657 84 R 4.3504 7.4024 120.7448 56.2998 32.8609 172.8756 85 G 4.2494 9.9863 114.6296 46.1329 0.0000 172.5021 86 S 4.7561 8.0354 115.7703 56.6094 66.2129 173.6928 87 T 2.8120 7.9067 117.2174 62.6521 68.5787 172.6492 88 P 4.1762 0.0000 0.0000 62.9462 32.7719 175.6306 89 Y 4.8511 8.3367 119.6064 57.2505 39.1350 175.1023 90 R 4.9419 9.5038 124.1996 53.8385 33.8528 175.4628 91 H 4.4417 8.7705 119.8334 58.4468 29.8115 175.1989 92 G 4.1203 9.2176 116.5285 45.2348 0.0000 173.2862 93 D 4.7098 8.3080 120.1366 54.4725 42.0142 175.3867 94 S 4.9283 8.5424 115.0402 56.4141 65.6727 173.1570 95 V 4.4309 8.5479 124.0838 61.2372 34.9887 174.1553 96 T 4.8048 8.3131 123.4113 61.7923 71.2393 173.5564 97 F 4.8802 9.0838 124.8745 55.9819 41.5312 174.8736 98 A 4.6276 8.3619 120.8493 50.6286 22.7539 174.6380 99 C 4.8978 8.5338 116.7342 55.5061 36.3328 174.0038 100 K 4.5812 8.8731 122.3764 56.2350 33.2983 176.6512 101 T 4.0988 8.4773 117.9327 65.6291 68.8606 174.4021 102 N 4.4256 9.1562 120.5845 53.5989 35.9367 173.3712 103 F 5.3581 8.1381 115.6034 55.5963 42.6361 174.5791 104 S 4.8869 9.4000 116.3481 56.7638 66.0897 172.9011 105 M 4.9194 8.6165 121.3673 55.1381 33.7094 174.9425 106 N 4.8341 9.2522 120.9564 52.9985 42.6429 174.7449 107 G 4.0891 9.0270 109.4564 44.1870 0.0000 171.9907 108 N 4.6135 8.2656 116.2140 52.8542 39.1955 176.0025 109 K 4.2934 8.7311 121.5400 58.7353 34.0387 176.5076 110 S 5.3237 8.1286 116.4241 56.5902 65.8884 173.7214 111 V 4.9402 8.4720 121.9923 59.8983 35.2682 174.1603 112 W 5.2646 9.2530 120.6509 55.0315 32.8840 175.3439 113 C 3.9371 9.3291 124.9848 55.9466 44.8405 173.2951 114 Q 4.8224 8.7590 126.0980 54.6507 29.5530 177.1126 115 A 3.6941 9.0390 123.6059 55.2684 18.3716 178.4765 116 N 4.6065 8.0426 111.0134 52.9405 37.2972 175.0124 117 N 4.1734 8.1910 113.3942 54.5390 36.7838 173.7492 118 M 4.7466 7.7457 117.3815 52.8536 35.2191 175.4164 119 W 4.3900 8.9104 120.9196 58.1266 29.8947 176.3913 120 G 3.7204 9.8009 109.7645 45.3505 0.0000 172.7082 121 P 4.3854 0.0000 0.0000 64.7703 31.6223 176.6334 122 T 4.4767 7.6265 107.7618 59.4909 70.8490 173.7968 123 R 4.2667 8.1299 121.6535 55.2670 30.8687 175.8013 124 L 3.9435 8.2113 121.8647 54.1135 42.0204 175.4637 125 P 4.7459 0.0000 0.0000 63.0686 32.4576 175.0176 126 T 4.6921 8.8483 109.2023 60.0114 72.4318 172.2081 127 C 5.6097 8.7676 119.7873 55.2535 41.3557 173.7333 128 V 4.8708 8.8837 123.8427 59.1839 34.4730 176.2380 129 S 4.6581 8.4150 115.2702 58.2533 62.5605 174.1135 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 A 8.26 4.31 1.25 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 2 I 7.95 3.84 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.91 0.84 0.00 0.00 3 S 9.26 4.99 0.00 3.89 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 4 C 8.68 4.78 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.26 3.88 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 0.00 0.00 0.00 6 S 8.73 4.16 0.00 3.93 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 7 P 0.00 3.94 0.00 1.71 0.90 0.00 3.66 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.22 0.00 8 P 0.00 4.32 0.00 2.15 2.07 0.00 3.22 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.86 0.00 9 P 0.00 4.45 0.00 2.20 2.12 0.00 3.71 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 10 I 7.90 4.45 2.13 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.44 0.95 0.00 0.00 11 L 8.50 3.99 0.00 1.64 1.55 0.92 1.08 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 12 N 8.94 3.93 0.00 2.34 1.48 0.00 0.00 6.76 8.34 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 13 G 7.54 4.34 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 0.00 14 R 8.92 4.85 0.00 1.58 1.60 0.00 2.96 0.00 0.00 3.02 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.48 0.00 15 I 7.83 4.65 1.67 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.25 0.60 0.00 0.00 16 S 8.45 4.11 0.00 3.83 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 17 Y 8.15 4.43 0.00 2.97 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 18 Y 7.68 4.99 0.00 3.08 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.68 4.63 0.00 4.05 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 8.11 4.71 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 1.24 0.00 0.00 21 P 0.00 4.63 0.00 2.13 2.06 0.00 3.84 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 2.00 2.01 0.00 22 I 8.32 4.17 2.06 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 1.36 0.78 0.84 0.00 0.00 23 A 8.44 4.63 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 24 V 7.41 3.58 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 0.76 0.00 0.00 0.89 0.00 0.00 25 G 9.31 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.98 4.12 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 1.41 0.00 0.00 27 V 8.52 5.02 2.16 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 0.89 0.00 0.00 1.01 0.00 0.00 28 I 8.98 4.63 1.59 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 1.05 0.18 0.48 0.00 0.00 29 R 8.90 5.04 0.00 1.83 1.70 0.00 3.07 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 30 Y 9.35 5.12 0.00 2.65 2.77 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 31 S 8.64 4.73 0.00 3.85 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 32 C 8.49 5.30 0.00 2.89 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 33 S 7.99 4.23 0.00 3.92 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 34 G 8.90 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.12 4.40 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 1.30 0.00 0.00 36 F 7.84 5.41 0.00 2.95 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 37 R 9.29 4.69 0.00 1.49 1.72 0.00 3.11 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 38 L 8.64 4.56 0.00 1.62 1.55 0.89 1.01 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 39 I 8.79 3.91 1.77 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.29 0.93 0.00 0.00 40 G 5.96 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 0.00 0.00 0.00 41 E 7.75 4.04 0.00 1.93 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 2.62 2.37 0.00 42 K 8.72 4.18 0.00 2.05 2.08 0.00 1.51 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.55 1.52 7.81 43 S 7.96 5.39 0.00 3.83 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 44 L 8.97 4.94 0.00 1.57 1.76 0.72 0.39 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 45 L 9.30 5.32 0.00 1.85 1.65 0.95 1.29 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 46 C 9.27 4.26 0.00 1.81 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.68 4.89 1.83 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 1.09 0.77 0.88 0.00 0.00 48 T 8.13 4.76 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 1.17 0.00 0.00 49 K 8.99 4.21 0.00 1.77 1.83 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.35 7.81 50 D 7.94 4.68 0.00 2.73 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 K 7.94 3.90 0.00 1.89 1.93 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.34 7.81 52 V 8.64 4.17 2.16 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 0.79 0.00 0.00 0.98 0.00 0.00 53 D 8.27 5.00 0.00 2.54 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 54 G 8.34 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 0.00 0.00 0.00 0.00 55 T 8.60 4.72 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 56 W 8.57 4.69 0.00 3.41 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 D 9.35 4.62 0.00 2.71 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 58 K 7.49 4.52 0.00 2.02 1.81 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.35 7.81 59 P 0.00 4.38 0.00 1.98 1.97 0.00 3.64 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 2.00 2.07 0.00 60 A 7.98 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.41 0.00 1.81 1.87 0.00 2.20 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 62 K 8.52 4.69 0.00 1.65 1.68 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.28 7.81 63 C 8.70 5.43 0.00 2.92 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 64 E 9.18 5.05 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 65 Y 8.96 3.44 0.00 2.65 2.77 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 66 F 8.41 4.35 0.00 2.75 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 8.51 4.31 0.00 2.50 2.36 0.00 0.00 6.96 5.97 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 68 K 7.10 3.28 0.00 1.45 1.23 0.00 0.84 0.00 0.00 1.16 0.00 0.00 2.79 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.51 0.21 7.81 69 Y 7.26 4.27 0.00 3.08 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 70 S 7.56 4.49 0.00 3.68 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 71 S 8.32 4.85 0.00 3.86 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 72 C 8.85 5.14 0.00 2.17 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 0.00 0.00 0.00 73 P 0.00 4.70 0.00 2.31 2.15 0.00 3.87 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 2.23 2.05 0.00 74 E 8.95 3.97 0.00 2.22 2.07 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 2.37 2.42 0.00 75 P 0.00 4.37 0.00 1.74 0.49 0.00 3.15 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.57 0.00 76 I 8.10 4.40 1.83 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.86 0.89 0.00 0.00 77 V 7.92 3.96 1.63 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 0.88 0.00 0.00 -0.47 0.00 0.00 78 P 0.00 4.31 0.00 2.16 2.00 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 79 G 9.13 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 0.00 0.00 0.00 80 G 7.91 4.51 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 0.00 81 Y 8.42 5.12 0.00 3.06 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 82 K 8.64 4.16 0.00 1.52 1.44 0.00 1.35 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.30 1.18 7.81 83 I 8.41 4.34 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.81 0.00 0.00 84 R 7.40 4.35 0.00 1.72 1.59 0.00 3.12 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 85 G 9.99 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 86 S 8.04 4.76 0.00 3.89 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 87 T 7.91 2.81 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 1.00 0.00 0.00 88 P 0.00 4.18 0.00 2.01 1.97 0.00 3.64 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.94 0.00 89 Y 8.34 4.85 0.00 3.39 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 90 R 9.50 4.94 0.00 1.74 1.93 0.00 3.33 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 91 H 8.77 4.44 0.00 3.14 3.52 0.00 5.92 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 92 G 9.22 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 8.31 4.71 0.00 2.87 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 94 S 8.54 4.93 0.00 2.72 3.37 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 95 V 8.55 4.43 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 0.12 0.00 0.00 0.65 0.00 0.00 96 T 8.31 4.80 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 1.15 0.00 0.00 97 F 9.08 4.88 0.00 2.72 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 98 A 8.36 4.63 0.72 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 99 C 8.53 4.90 0.00 2.93 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.87 4.58 0.00 1.65 1.84 0.00 1.40 0.00 0.00 1.51 0.00 0.00 2.74 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.58 7.81 101 T 8.48 4.10 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 1.26 0.00 0.00 102 N 9.16 4.43 0.00 2.89 2.77 0.00 0.00 6.86 8.13 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 0.00 103 F 8.14 5.36 0.00 3.18 2.95 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 0.00 0.00 0.00 104 S 9.40 4.89 0.00 3.82 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 0.00 105 M 8.62 4.92 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.56 0.00 106 N 9.25 4.83 0.00 2.61 2.64 0.00 0.00 7.37 8.37 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 0.00 107 G 9.03 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 0.00 108 N 8.27 4.61 0.00 2.80 2.87 0.00 0.00 6.85 7.61 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 0.00 109 K 8.73 4.29 0.00 2.00 2.07 0.00 1.42 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.49 7.81 110 S 8.13 5.32 0.00 3.74 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 0.00 111 V 8.47 4.94 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 0.61 0.00 0.00 1.40 0.00 0.00 112 W 9.25 5.26 0.00 3.47 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 0.00 113 C 9.33 3.94 0.00 1.96 2.95 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 0.00 0.00 0.00 114 Q 8.76 4.82 0.00 2.41 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.53 0.00 0.00 0.00 0.00 0.00 2.43 2.62 0.00 115 A 9.04 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 N 8.04 4.61 0.00 2.83 2.90 0.00 0.00 6.07 8.04 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 0.00 117 N 8.19 4.17 0.00 2.85 3.06 0.00 0.00 6.66 7.17 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 0.00 118 M 7.75 4.75 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 119 W 8.91 4.39 0.00 3.33 3.20 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 0.00 120 G 9.80 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 0.00 121 P 0.00 4.39 0.00 2.19 2.16 0.00 4.08 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.89 0.00 122 T 7.63 4.48 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 1.28 0.00 0.00 123 R 8.13 4.27 0.00 1.81 1.87 0.00 3.24 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 124 L 8.21 3.94 0.00 1.50 1.23 0.69 0.74 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 0.00 125 P 0.00 4.75 0.00 1.96 2.14 0.00 3.23 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.86 0.00 126 T 8.85 4.69 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 1.15 0.00 0.00 127 C 8.77 5.61 0.00 2.95 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 0.00 128 V 8.88 4.87 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 0.88 0.00 0.00 0.92 0.00 0.00 129 S 8.42 4.66 0.00 3.68 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