NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4641 8.1233 123.6127 52.1322 20.8695 178.9184 3 L 3.7336 8.0516 115.2502 55.7849 41.2357 177.6679 4 K 4.0827 8.0277 118.5761 59.8519 33.4440 178.6067 5 R 3.8146 7.8379 119.9383 59.1299 29.5399 178.0782 6 I 3.3084 7.9372 119.7815 64.4835 37.1794 177.8684 7 N 4.4765 7.8529 116.1796 55.7488 38.6129 176.8652 8 K 3.8974 8.3331 121.8796 59.8412 32.2631 178.5902 9 E 3.9742 8.0404 118.2911 59.1558 29.3403 178.7613 10 L 4.2008 7.8342 119.8462 58.2134 42.2016 179.0043 11 S 4.0963 8.0042 112.5046 61.7274 62.1766 176.0123 12 D 4.4850 7.7641 120.4590 56.4928 40.4265 178.6728 13 L 4.0862 8.2885 121.6525 58.1066 41.9956 178.4740 14 A 4.0420 8.5121 119.6968 55.2326 18.4838 179.1245 15 R 4.2504 7.4349 115.0729 58.8861 30.9344 177.0552 16 D 4.5332 7.4066 115.3671 53.1325 43.3061 173.1313 17 P 4.6289 0.0000 0.0000 60.2263 32.8245 175.1612 18 P 4.2033 0.0000 0.0000 63.3095 31.7132 177.4679 19 A 4.1456 8.6601 126.1765 55.0023 18.7120 178.4248 20 Q 4.1417 8.0740 116.0639 59.1136 29.3466 176.0131 21 C 4.7401 7.4038 108.7156 57.1692 32.6870 173.9463 22 S 4.7061 8.6479 116.7324 58.0694 63.7992 172.2675 23 A 4.7865 7.6063 124.4249 51.3406 21.5794 175.8710 24 G 3.6336 7.6600 107.7346 44.3441 0.0000 171.5206 25 P 4.2283 0.0000 0.0000 61.3116 32.0759 176.0828 26 V 3.7308 8.2040 120.4675 63.2027 32.4567 177.4590 27 G 3.8283 8.4496 115.5113 45.9996 0.0000 172.6110 28 D 4.3397 8.5256 116.3218 55.0284 41.3575 176.8002 29 D 4.6346 7.4633 117.9637 55.5457 39.7990 176.2677 30 M 4.4840 8.2663 125.7725 53.5351 30.6551 174.3745 31 F 5.0450 8.2959 120.7554 57.9889 48.1100 173.2393 32 H 5.2086 8.6818 116.8072 54.2028 30.4294 174.4599 33 W 5.0246 9.1998 122.8563 55.1111 32.6534 174.3348 34 Q 5.2174 8.3994 119.2098 55.6824 32.4678 172.6774 35 A 4.7506 8.5592 119.8911 51.9443 23.2481 174.8009 36 T 4.5596 8.3065 112.2155 60.9986 70.8979 173.1862 37 I 4.7267 8.3023 125.7070 59.9518 41.7163 173.8619 38 M 4.7067 8.6829 125.6692 53.1572 34.8140 174.9224 39 G 4.0391 8.1366 111.3672 46.3185 0.0000 172.5239 40 P 4.2784 0.0000 0.0000 63.5330 32.0600 175.6322 41 N 4.3957 9.1625 113.5011 54.1225 35.6003 173.7143 42 D 4.8651 7.9712 116.4788 55.8890 47.3800 177.0261 43 S 4.6709 7.9453 114.5212 56.8384 64.1367 172.5566 44 P 4.8606 0.0000 0.0000 61.9177 28.4221 175.0138 45 Y 4.8053 7.7586 119.1904 58.7809 41.0815 173.6906 46 Q 4.2020 7.3412 121.0569 57.9142 29.0897 178.1916 47 G 3.9119 9.0808 110.1694 45.2345 0.0000 173.1694 48 G 3.7935 8.2913 108.8658 45.0273 0.0000 173.6724 49 V 4.0877 7.9705 120.2845 60.3002 32.7516 175.8904 50 F 5.0130 8.5809 123.8316 55.6796 41.8643 174.5600 51 F 5.2817 8.4500 119.6916 55.5500 42.9578 173.9576 52 L 4.8144 8.5235 122.7001 54.4805 43.2707 176.0973 53 T 4.7720 8.1266 117.5200 62.5985 70.9024 173.5033 54 I 4.8553 8.5366 123.1817 60.1225 41.1905 175.6292 55 H 4.7380 8.2734 119.7330 54.6356 32.1739 173.0076 56 F 4.5442 8.7335 123.4739 56.1223 39.5888 174.6230 57 P 4.5497 0.0000 0.0000 62.7590 32.0107 176.9694 58 T 4.3398 8.3322 108.3364 62.8338 69.0530 174.6589 59 D 4.0462 7.6774 121.0582 53.9734 41.5117 174.6289 60 Y 4.2526 6.8986 116.6886 57.2257 38.0088 169.0379 61 P 4.5732 0.0000 0.0000 65.8123 31.6713 177.5796 62 F 4.1229 9.0521 115.9655 59.5703 39.0786 175.2821 63 K 4.6120 8.2328 119.8016 53.3874 33.7846 174.2434 64 P 3.3012 0.0000 0.0000 62.2745 31.4453 174.3397 65 P 4.4016 0.0000 0.0000 62.3097 32.1429 175.9509 66 K 4.3708 8.1211 120.3932 55.8620 33.6341 176.0862 67 V 4.5947 8.2018 122.4789 61.3305 33.5817 173.7750 68 A 5.1971 8.4297 126.5236 49.6347 22.6800 174.5742 69 F 4.6921 8.6329 120.3607 56.6837 40.8119 175.7026 70 T 3.9917 8.0039 122.0808 64.6632 67.5123 174.8287 71 T 4.2193 6.7028 114.7779 62.6206 69.3222 175.4107 72 R 4.2823 8.2353 124.6967 55.3723 28.8792 174.7020 73 I 4.6343 8.3938 122.4036 59.4707 39.6936 175.6698 74 Y 4.2041 8.8010 132.7918 57.0501 38.3308 174.5966 75 H 5.0856 7.8528 119.9890 53.2881 32.1827 173.1822 76 P 4.5723 0.0000 0.0000 61.0395 27.9139 174.8302 77 N 4.3262 6.9992 118.9049 54.1395 42.8787 173.3667 78 I 5.2107 7.5341 117.4212 58.8326 40.7112 175.8704 79 N 4.6831 8.4816 125.1728 53.3579 40.0994 173.9410 80 S 4.4950 8.7510 109.2622 61.1803 63.7689 175.2789 81 N 4.5588 8.1203 115.2143 53.0514 37.2598 174.7786 82 G 3.7841 7.9907 107.1794 46.8720 0.0000 174.0510 83 S 4.4540 8.1652 116.7482 58.0780 62.1206 173.0781 84 I 4.4696 7.9863 126.9500 59.9729 38.1920 175.5420 85 C 4.3514 7.9316 120.2152 57.7273 30.3389 173.4312 86 L 4.6340 8.2668 123.7843 52.6180 44.4481 177.1748 87 D 4.3897 9.0026 124.6625 56.9782 41.5006 178.2376 88 I 3.9493 8.1575 119.9473 64.5882 37.2977 177.7619 89 L 3.6816 7.6968 118.3195 57.8409 41.9150 178.5900 90 R 4.2096 7.7953 116.7466 55.7852 31.0278 176.6799 91 S 4.1369 8.7607 111.7855 62.4291 62.3764 176.2456 92 Q 4.4105 7.9450 117.9988 55.9017 28.0595 175.7904 93 W 4.6115 7.9610 129.2342 54.9458 30.6157 175.2365 94 S 4.2438 7.6704 123.0118 56.7110 62.8690 173.9716 95 P 3.5995 0.0000 0.0000 64.5812 31.6402 176.5617 96 A 4.4939 7.5277 120.4761 50.2468 19.1677 175.1111 97 L 4.4068 6.9215 121.3346 53.3242 43.1921 178.3526 98 T 4.1196 8.0012 117.6087 62.3519 67.4546 175.1549 99 I 3.0731 8.4679 128.3620 63.9267 37.4918 176.9248 100 S 4.2221 8.2674 115.0437 61.5758 62.5041 176.6228 101 K 4.0596 8.9345 123.2721 59.4521 32.2698 179.3069 102 V 3.6578 7.5433 120.6451 65.2376 31.6033 177.7169 103 L 4.0273 8.0629 118.0473 58.1480 41.4268 179.4678 104 L 4.0332 7.6309 117.3206 57.9162 41.5723 179.5712 105 S 4.1360 8.1132 115.0585 61.9860 62.4963 177.0251 106 I 3.8333 7.6611 122.0102 64.1725 36.6536 178.0912 107 C 4.1888 7.9456 119.7306 62.5213 31.3475 175.8445 108 S 4.1872 8.4876 116.0308 60.7932 62.3652 176.0783 109 L 3.9064 7.3433 123.2561 58.3034 41.8969 178.7052 110 L 4.0320 7.2249 116.0467 57.5977 41.6588 178.3655 111 C 4.5227 7.5955 113.6655 59.4067 29.4888 173.6665 112 D 4.6082 7.1045 115.7825 53.3412 43.0879 173.1446 113 P 4.6832 0.0000 0.0000 62.6324 33.1738 177.5430 114 N 4.9099 8.0240 115.0111 50.4736 39.5176 171.2120 115 P 4.1998 0.0000 0.0000 62.9764 32.8730 174.5694 116 D 4.7063 8.7362 121.2826 54.5608 43.0241 175.4116 117 D 4.8805 8.5998 116.1028 52.8083 42.8425 172.9576 118 P 4.5393 0.0000 0.0000 62.3539 33.1080 177.0228 119 L 4.3833 8.2285 117.4236 55.3254 41.6811 178.9344 120 V 5.0929 7.7276 110.3532 58.8593 33.3060 173.9080 121 P 4.3266 0.0000 0.0000 65.3156 31.0999 178.5503 122 E 3.9912 8.0488 117.7055 59.5591 29.6526 178.9308 123 I 3.8588 7.6452 119.8656 63.2550 37.1184 178.0934 124 A 3.9502 7.5939 122.0048 55.1870 18.1398 179.6665 125 R 3.9213 7.7330 115.9818 59.5633 29.7029 179.1765 126 I 3.7543 7.4169 118.5385 64.9115 36.9788 177.9578 127 Y 4.0544 8.0974 118.7786 60.5625 38.5624 176.6719 128 K 3.5944 8.4479 120.5225 59.1429 32.1672 177.2134 129 T 4.2799 7.6458 112.6363 62.9487 70.4554 175.2250 130 D 4.7021 7.4614 120.3036 53.7648 39.6306 176.6607 131 R 3.9850 7.7210 122.9063 59.0323 30.4985 178.0131 132 D 4.4425 8.1595 117.4428 57.5666 41.0488 178.9380 133 K 4.1109 7.9635 117.7762 59.7430 32.0584 178.5150 134 Y 4.0747 7.8656 119.7886 61.2737 38.6029 178.2807 135 N 4.4256 8.6310 117.1315 56.0346 38.5867 177.4298 136 R 3.8277 8.1430 120.5215 59.6340 30.2033 178.7782 137 I 3.5167 7.3788 119.0850 64.0277 36.7857 178.1098 138 S 3.7317 7.7085 113.6824 61.4735 62.3228 176.2317 139 R 4.3543 7.8835 121.7482 58.1492 29.3205 178.5849 140 E 4.0352 8.2540 119.4920 58.8365 29.4461 178.1138 141 W 4.5600 9.0368 117.5337 58.1731 29.3487 178.4199 142 T 4.1925 7.7950 117.4596 66.9157 67.9411 176.8949 143 Q 4.0498 8.0246 118.7494 58.4483 28.8604 178.1063 144 K 3.7083 7.4036 119.4223 59.3288 32.2011 176.9575 145 Y 4.5083 7.4285 111.4169 58.7686 41.0398 176.7540 146 A 4.1099 8.5916 121.5602 55.3938 18.5990 177.0415 147 M 4.2074 8.0441 118.2086 55.5929 32.1029 176.3632 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 2 A 8.12 4.46 1.51 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 3 L 8.05 3.73 0.00 1.71 1.73 0.81 0.71 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 4 K 8.03 4.08 0.00 1.94 2.03 0.00 1.45 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.44 7.81 5 R 7.84 3.81 0.00 1.86 1.93 0.00 3.31 0.00 0.00 3.41 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 6 I 7.94 3.31 1.69 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.60 0.75 0.00 0.00 7 N 7.85 4.48 0.00 2.96 2.94 0.00 0.00 6.84 5.86 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 8 K 8.33 3.90 0.00 1.76 1.77 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.59 7.81 9 E 8.04 3.97 0.00 1.80 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 2.23 0.00 10 L 7.83 4.20 0.00 1.97 1.83 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.00 4.10 0.00 3.98 3.95 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 12 D 7.76 4.49 0.00 2.90 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 13 L 8.29 4.09 0.00 2.13 1.88 1.15 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.51 4.04 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 15 R 7.43 4.25 0.00 1.93 2.06 0.00 3.22 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 16 D 7.41 4.53 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 4.63 0.00 2.20 2.17 0.00 3.41 0.00 0.00 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 18 P 0.00 4.20 0.00 2.46 2.08 0.00 3.66 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 2.19 2.16 0.00 19 A 8.66 4.15 1.29 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 0.00 0.00 0.00 20 Q 8.07 4.14 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 21 C 7.40 4.74 0.00 3.13 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 22 S 8.65 4.71 0.00 3.95 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 23 A 7.61 4.79 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 24 G 7.66 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.23 0.00 1.91 1.09 0.00 2.83 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.38 0.00 26 V 8.20 3.73 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 0.87 0.00 0.00 0.92 0.00 0.00 27 G 8.45 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 0.00 0.00 0.00 28 D 8.53 4.34 0.00 2.64 2.71 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 29 D 7.46 4.63 0.00 3.07 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 30 M 8.27 4.48 0.00 1.85 1.72 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.70 0.00 31 F 8.30 5.05 0.00 3.18 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 32 H 8.68 5.21 0.00 3.31 3.41 0.00 5.75 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.20 5.02 0.00 3.51 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 34 Q 8.40 5.22 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.47 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 35 A 8.56 4.75 1.32 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 36 T 8.31 4.56 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 1.24 0.00 0.00 37 I 8.30 4.73 2.07 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.69 0.99 0.00 0.00 38 M 8.68 4.71 0.00 2.01 1.89 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 2.44 2.50 0.00 39 G 8.14 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 40 P 0.00 4.28 0.00 2.10 2.19 0.00 3.89 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.19 0.00 41 N 9.16 4.40 0.00 2.92 3.00 0.00 0.00 6.79 8.83 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 42 D 7.97 4.87 0.00 2.65 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 43 S 7.95 4.67 0.00 3.99 3.96 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 44 P 0.00 4.86 0.00 2.09 2.15 0.00 3.98 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 45 Y 7.76 4.81 0.00 3.26 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 46 Q 7.34 4.20 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 5.61 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 47 G 9.08 3.91 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 0.00 0.00 0.00 48 G 8.29 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.97 4.09 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 0.73 0.00 0.00 1.02 0.00 0.00 50 F 8.58 5.01 0.00 2.96 2.83 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 51 F 8.45 5.28 0.00 2.85 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 52 L 8.52 4.81 0.00 1.88 1.66 1.03 0.81 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 53 T 8.13 4.77 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 1.25 0.00 0.00 54 I 8.54 4.86 2.09 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.69 0.58 0.00 0.00 55 H 8.27 4.74 0.00 3.13 3.15 0.00 5.61 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.73 4.54 0.00 3.30 3.13 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 57 P 0.00 4.55 0.00 2.26 2.20 0.00 4.05 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 58 T 8.33 4.34 4.14 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 1.12 0.00 0.00 59 D 7.68 4.05 0.00 2.60 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 60 Y 6.90 4.25 0.00 3.50 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 61 P 0.00 4.57 0.00 2.24 2.51 0.00 4.06 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.43 0.00 62 F 9.05 4.12 0.00 3.35 3.40 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 63 K 8.23 4.61 0.00 1.93 1.72 0.00 1.90 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.44 7.81 64 P 0.00 3.30 0.00 1.79 1.63 0.00 3.58 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 1.89 1.85 0.00 65 P 0.00 4.40 0.00 1.71 1.71 0.00 2.43 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.86 0.00 66 K 8.12 4.37 0.00 1.77 1.76 0.00 1.56 0.00 0.00 1.54 0.00 0.00 2.71 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.31 7.81 67 V 8.20 4.59 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 0.92 0.00 0.00 0.86 0.00 0.00 68 A 8.43 5.20 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 69 F 8.63 4.69 0.00 3.07 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 T 8.00 3.99 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 71 T 6.70 4.22 4.41 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 1.45 0.00 0.00 72 R 8.24 4.28 0.00 1.50 1.39 0.00 2.34 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.00 0.00 73 I 8.39 4.63 1.94 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.12 0.69 0.00 0.00 74 Y 8.80 4.20 0.00 2.07 2.55 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 75 H 7.85 5.09 0.00 3.12 2.99 0.00 5.96 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.57 0.00 1.99 1.85 0.00 3.03 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.15 0.00 77 N 7.00 4.33 0.00 2.57 2.66 0.00 0.00 6.75 7.76 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 78 I 7.53 5.21 1.68 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.69 0.81 0.00 0.00 79 N 8.48 4.68 0.00 2.66 2.99 0.00 0.00 7.21 7.67 0.00 0.00 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 S 8.75 4.50 0.00 4.13 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 N 8.12 4.56 0.00 2.87 2.99 0.00 0.00 6.08 7.00 0.00 0.00 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 G 7.99 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 83 S 8.17 4.45 0.00 3.88 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 84 I 7.99 4.47 1.83 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.68 0.77 0.00 0.00 85 C 7.93 4.35 0.00 2.92 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 86 L 8.27 4.63 0.00 1.55 1.61 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 87 D 9.00 4.39 0.00 2.68 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.16 3.95 2.15 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 1.49 1.33 1.07 0.00 0.00 89 L 7.70 3.68 0.00 1.65 1.51 0.91 1.24 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 90 R 7.80 4.21 0.00 2.27 1.92 0.00 3.15 0.00 0.00 3.09 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.55 0.00 91 S 8.76 4.14 0.00 3.87 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 92 Q 7.94 4.41 0.00 2.53 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.60 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 93 W 7.96 4.61 0.00 3.63 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 94 S 7.67 4.24 0.00 3.59 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 95 P 0.00 3.60 0.00 1.24 0.49 0.00 3.38 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 96 A 7.53 4.49 1.07 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 97 L 6.92 4.41 0.00 1.41 1.21 0.56 -1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 98 T 8.00 4.12 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 1.23 0.00 0.00 99 I 8.47 3.07 1.99 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.42 0.95 0.00 0.00 100 S 8.27 4.22 0.00 4.12 4.18 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 0.00 101 K 8.93 4.06 0.00 1.93 2.09 0.00 1.26 0.00 0.00 1.47 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.42 7.81 102 V 7.54 3.66 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 1.33 0.00 0.00 1.01 0.00 0.00 103 L 8.06 4.03 0.00 1.97 1.78 1.11 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.63 4.03 0.00 1.93 1.73 1.02 0.89 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 0.00 105 S 8.11 4.14 0.00 4.00 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 0.00 106 I 7.66 3.83 2.05 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 1.37 1.29 0.85 0.00 0.00 107 C 7.95 4.19 0.00 3.05 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 0.00 108 S 8.49 4.19 0.00 4.06 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 0.00 109 L 7.34 3.91 0.00 1.76 1.81 0.88 0.88 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 0.00 110 L 7.22 4.03 0.00 1.59 1.63 0.71 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.60 4.52 0.00 3.03 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 7.10 4.61 0.00 2.52 2.61 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 0.00 113 P 0.00 4.68 0.00 2.13 2.07 0.00 3.81 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 114 N 8.02 4.91 0.00 2.63 2.73 0.00 0.00 6.92 8.02 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 0.00 115 P 0.00 4.20 0.00 2.07 2.09 0.00 3.66 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.10 0.00 116 D 8.74 4.71 0.00 2.52 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 0.00 0.00 0.00 0.00 117 D 8.60 4.88 0.00 2.62 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 P 0.00 4.54 0.00 2.14 2.26 0.00 3.72 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 119 L 8.23 4.38 0.00 1.61 1.69 0.88 0.77 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 0.00 120 V 7.73 5.09 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 1.17 0.00 0.00 0.82 0.00 0.00 121 P 0.00 4.33 0.00 2.25 2.29 0.00 3.67 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 122 E 8.05 3.99 0.00 2.22 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 0.00 2.33 2.36 0.00 123 I 7.65 3.86 1.64 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.34 0.59 0.00 0.00 124 A 7.59 3.95 1.32 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 0.00 125 R 7.73 3.92 0.00 1.88 2.01 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 126 I 7.42 3.75 2.21 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.35 1.14 0.00 0.00 127 Y 8.10 4.05 0.00 2.48 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.45 3.59 0.00 1.86 1.86 0.00 1.67 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.43 7.81 129 T 7.65 4.28 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 1.18 0.00 0.00 130 D 7.46 4.70 0.00 2.78 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 0.00 131 R 7.72 3.99 0.00 1.80 1.92 0.00 3.17 0.00 0.00 2.88 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.42 0.00 132 D 8.16 4.44 0.00 2.64 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 0.00 133 K 7.96 4.11 0.00 2.08 1.89 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.46 7.81 134 Y 7.87 4.07 0.00 3.24 3.35 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 0.00 135 N 8.63 4.43 0.00 3.11 2.88 0.00 0.00 6.75 7.33 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 0.00 136 R 8.14 3.83 0.00 1.83 1.95 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 137 I 7.38 3.52 1.22 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.14 -0.93 0.00 0.00 138 S 7.71 3.73 0.00 3.43 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.88 4.35 0.00 1.87 1.92 0.00 3.16 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 140 E 8.25 4.04 0.00 2.20 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 0.00 2.35 2.56 0.00 141 W 9.04 4.56 0.00 3.63 3.59 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 0.00 142 T 7.79 4.19 4.41 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 1.37 0.00 0.00 143 Q 8.02 4.05 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.94 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 144 K 7.40 3.71 0.00 1.92 1.80 0.00 1.56 0.00 0.00 1.36 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.69 1.21 7.81 145 Y 7.43 4.51 0.00 2.94 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 0.00 146 A 8.59 4.11 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 0.00 147 M 8.04 4.21 0.00 2.03 2.05 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 2.79 2.49 0.00