NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3443 8.2893 120.3449 55.7054 34.0736 175.6495 2 T 4.2481 7.6023 107.4025 59.3469 70.5931 172.6656 3 R 4.6081 10.0504 119.9943 54.2987 32.5009 176.3943 4 R 4.6527 8.6763 123.5136 55.9936 31.9008 176.0912 5 V 4.8748 9.0716 122.4111 61.0863 34.4660 174.1236 6 A 4.7780 9.2936 131.4435 51.7518 19.9683 175.8739 7 I 4.9364 9.1520 123.1796 59.4853 40.2410 175.1575 8 G 4.6279 9.4823 113.7505 44.7698 0.0000 171.3226 9 T 5.8612 8.3002 110.0476 59.7406 72.4375 172.4831 10 D 4.9772 8.1781 121.1110 52.0699 42.3837 175.9769 11 H 4.1097 8.9889 113.3972 58.7639 28.6143 175.7729 12 P 4.2301 0.0000 0.0000 64.7690 31.3649 176.9192 13 A 4.2432 7.5980 120.4355 52.9099 19.1530 178.7942 14 F 4.0854 8.2431 118.8333 61.0224 39.5068 177.0211 15 A 3.9289 8.2010 122.1101 54.2844 18.3859 177.7671 16 I 4.3413 7.4488 108.4120 60.6664 38.1380 177.3501 17 H 4.1261 7.9547 120.4453 59.0279 28.0402 177.3760 18 E 3.5555 7.2805 120.8594 58.9296 29.3124 178.4178 19 N 3.6078 7.7784 116.0593 56.2847 38.5374 177.0823 20 L 3.8517 7.4780 119.7007 57.7511 41.8474 179.5341 21 I 3.6241 7.5212 119.5926 64.3678 37.0150 178.0904 22 L 3.8889 7.7831 121.0654 58.5572 41.7664 178.6617 23 Y 4.3663 7.9914 116.8587 60.9704 37.4798 178.8699 24 V 3.5429 7.6354 118.5398 66.0338 32.0243 177.8827 25 K 4.1913 7.9729 117.7625 59.6832 31.6504 179.1959 26 E 4.0704 8.3133 117.8353 59.1544 29.4021 178.8597 27 A 4.1394 7.8387 120.2144 52.3632 18.8149 177.1230 28 G 4.6481 7.1288 107.2215 44.5743 0.0000 173.6575 29 D 4.4817 8.4065 122.1389 56.9624 41.0047 177.8644 30 E 3.9747 8.1530 115.7334 57.5056 29.9166 175.6172 31 F 5.0537 7.9688 119.6871 56.1250 40.4925 175.3937 32 V 4.4619 8.8865 125.4959 60.2785 33.0776 173.0662 33 P 4.8872 0.0000 0.0000 62.9128 32.4423 176.3138 34 V 4.3243 8.8980 123.3257 61.0838 33.5381 173.2067 35 Y 4.6687 8.6511 129.3933 57.2505 39.1759 174.4137 36 C 4.6651 8.7745 123.7040 59.4524 30.2347 174.6647 37 G 3.5036 5.5022 108.9913 43.1226 0.0000 172.0509 38 P 4.3353 0.0000 0.0000 62.5944 31.5905 177.2554 39 K 4.4019 8.5924 120.7309 58.4491 32.6026 176.4091 40 T 4.0902 6.9955 107.4093 59.5041 71.8239 173.7798 41 A 3.6945 7.8258 122.1418 52.1668 18.6309 177.6411 42 E 3.9279 7.0153 114.3210 56.0462 29.9361 177.2211 43 S 3.8721 8.4842 115.9730 58.7061 62.7875 173.5482 44 V 4.5971 7.9767 119.2623 59.7770 35.5889 174.0428 45 D 4.9496 8.4164 120.2477 52.7081 42.2876 177.1823 46 Y 4.3533 8.8268 123.5706 60.1352 37.7320 176.9370 47 P 4.2219 0.0000 0.0000 65.3309 31.3544 178.2241 48 D 4.2571 7.8550 117.7504 57.1971 40.6942 178.5549 49 F 4.2168 8.1979 117.1977 59.5211 39.3134 177.7193 50 A 4.0746 8.4576 121.0393 55.3078 18.1785 179.4788 51 S 3.9855 8.4751 111.8530 61.5193 62.1038 176.1103 52 R 3.8049 7.7632 121.2093 59.6307 29.7928 178.6616 53 V 3.6127 7.9650 117.4763 65.8184 31.5706 177.5674 54 A 4.0388 8.5139 120.9242 55.4964 18.1586 179.4719 55 E 3.9377 8.5847 117.2256 59.7904 29.5256 179.4099 56 M 4.0183 7.7510 118.3449 58.3859 32.0483 179.0455 57 V 3.7026 7.9429 117.9054 65.9945 31.5663 177.8224 58 A 4.0116 8.1179 119.4442 55.3261 18.3904 179.3193 59 R 4.0586 8.4723 113.6308 56.3643 30.2063 177.3325 60 K 4.1180 7.7903 117.0446 57.3029 30.0519 176.9862 61 E 4.1162 8.2990 121.2905 58.7085 29.4886 177.4811 62 V 4.5887 7.3117 109.3468 59.3766 35.6502 174.7009 63 E 4.1056 8.7031 122.2899 57.9999 30.1957 176.4192 64 F 5.5251 8.2217 116.1214 55.5907 43.7736 174.2817 65 G 4.5950 9.4438 107.8667 44.4744 0.0000 172.0201 66 V 4.9101 9.1591 122.3209 60.7094 34.5464 174.2044 67 L 5.3528 9.0425 127.5431 52.8862 45.0171 175.2339 68 A 5.1876 8.8446 125.4232 50.3957 22.0233 175.0056 69 A 5.0823 8.0346 122.7323 50.8903 22.4745 175.6407 70 G 3.8487 9.1491 100.9878 49.2930 0.0000 176.0433 71 S 4.4609 8.2300 114.6724 56.7057 65.0993 176.0765 72 G 4.0255 8.0695 108.7959 45.7418 0.0000 175.3893 73 I 3.7138 7.5580 120.7787 64.4287 37.1043 178.4391 74 G 3.1317 7.6200 105.9353 47.8318 0.0000 175.0840 75 M 4.1740 7.8124 120.9418 58.5114 31.6708 178.9495 76 S 4.2061 8.0856 113.9853 61.1478 63.0414 176.6801 77 I 3.7343 7.7624 122.5522 64.1353 37.3592 177.7797 78 A 4.1832 8.5708 121.6953 55.3763 18.4304 179.5579 79 A 4.0196 8.1974 119.1654 55.3898 18.2497 179.3551 80 N 4.5220 7.7899 113.0127 55.3955 38.7330 177.1240 81 K 4.2404 7.8358 118.8188 56.8077 32.6256 176.8024 82 V 4.0590 7.2574 120.5207 60.6325 32.1711 173.5031 83 P 4.6897 0.0000 0.0000 64.1005 31.6932 176.7467 84 G 3.9530 9.8419 111.7210 45.0477 0.0000 173.6421 85 V 4.2083 7.1851 119.1492 61.8440 32.6084 175.6927 86 R 4.6901 9.6843 125.5985 54.3522 32.2446 173.1116 87 A 5.1798 9.6347 125.6932 50.0866 20.8701 175.6999 88 A 4.6011 9.1382 125.7009 49.9937 21.3133 175.4766 89 L 4.5752 8.6252 125.6880 55.5211 42.4812 175.7672 90 C 5.1043 8.8617 124.7753 58.2030 30.6939 173.8984 91 H 4.8550 8.2710 115.5436 54.8101 29.4367 172.3228 92 D 4.4543 7.1677 118.6735 52.1384 41.8008 175.5260 93 H 4.0650 8.7694 117.4558 59.5800 29.6139 176.4045 94 Y 3.9653 8.1876 121.0426 61.0388 38.7490 177.9814 95 T 3.7785 8.4691 110.4287 64.7210 68.7539 176.0775 96 A 4.0228 7.8137 122.9458 54.8483 18.3480 179.5295 97 A 3.8354 7.9137 119.2461 55.7034 18.5129 179.9150 98 M 3.8525 8.0082 117.6518 58.0728 31.8356 179.0698 99 S 4.2513 8.1946 114.8420 61.3831 63.1025 176.9823 100 R 3.8177 7.5204 120.6817 58.9667 29.8682 178.9443 101 I 3.7649 8.0093 119.7995 64.5926 36.9259 177.8273 102 H 4.2095 8.5614 115.1706 56.6155 29.4561 175.7861 103 N 4.7060 8.0380 114.3230 52.2230 39.8087 173.6797 104 D 4.1927 8.1191 116.6995 54.3533 39.6504 173.5479 105 A 4.2748 8.1562 120.9677 52.7939 19.2236 177.7162 106 N 5.3517 9.2164 117.9486 52.8187 39.7743 174.2437 107 I 5.2366 7.9567 121.0667 59.5646 41.1679 174.3381 108 V 4.1403 8.0072 126.6596 60.1793 33.3053 174.6350 109 C 5.3531 9.0785 122.0084 58.1290 31.3150 173.4054 110 V 4.6859 8.7698 114.8302 59.6700 36.5150 174.3989 111 G 4.3254 8.3056 109.3831 43.6449 0.0000 174.2651 112 E 4.0404 9.7111 128.7282 59.0067 29.8580 178.0005 113 R 4.2552 8.2447 116.7453 57.2551 30.6559 177.0338 114 T 4.3880 7.7557 106.6758 61.9882 70.5246 174.7507 115 T 4.5673 7.8596 118.3471 60.7486 71.0057 174.8699 116 G 3.7643 8.4790 112.7548 44.6147 0.0000 174.6559 117 V 3.6887 8.4881 116.1566 64.6855 31.7166 178.9101 118 E 4.0383 8.0609 117.4596 58.9645 29.3392 179.2829 119 V 3.6048 7.6368 118.1625 65.6337 31.6205 177.9310 120 I 3.5992 7.8275 119.7672 64.2011 36.9756 177.9848 121 R 2.8791 7.9223 119.7783 59.2787 29.5772 178.0275 122 E 3.8376 7.7526 118.3214 59.1922 29.5195 178.6951 123 I 3.6332 8.1986 120.0560 64.5188 37.2383 178.4496 124 I 3.6114 7.9249 120.7522 64.3759 36.9242 178.6210 125 I 3.5577 7.6629 120.4664 64.6718 36.9766 178.6190 126 T 3.7866 8.0153 116.6857 66.4697 68.0320 176.3016 127 F 3.9256 8.1218 121.5438 61.4836 39.4827 176.9566 128 L 3.3791 7.5354 116.9296 57.4085 41.3349 179.0469 129 Q 4.3483 7.8182 116.8106 56.9831 28.9690 176.4395 130 T 4.1715 7.2498 117.7458 62.0078 68.9717 172.9889 131 P 4.5756 0.0000 0.0000 61.8505 32.4353 175.8398 132 F 5.1175 8.8145 121.7558 57.6763 39.9421 175.7185 133 S 3.8997 7.8397 122.7633 59.3460 62.9621 175.8168 134 G 3.4841 5.3800 106.6511 45.4301 0.0000 173.9508 135 E 3.9879 7.2253 119.8725 55.6356 31.3471 176.9967 136 E 3.8963 8.7952 123.6993 59.7990 29.6318 179.7572 137 R 3.9430 7.8176 115.2285 59.6385 29.5063 178.3839 138 H 4.3798 7.8900 116.4632 58.4486 28.7584 177.6293 139 V 3.7013 7.9107 120.0484 66.1583 31.4407 177.8378 140 R 3.8980 8.0693 118.2712 59.7535 29.8483 178.6921 141 R 3.9842 8.1651 117.5986 59.2893 30.1197 178.9881 142 I 3.6959 8.2727 120.1085 64.4317 36.9873 178.0761 143 E 3.9731 8.5166 120.2989 59.2440 29.4449 179.0727 144 K 4.0060 8.1780 118.5103 59.1683 32.0057 179.5064 145 I 3.7015 7.6925 120.4923 64.3233 37.0443 178.2365 146 R 4.1516 8.3366 120.6564 58.8275 29.8769 178.3327 147 A 4.0009 8.3412 120.7831 55.1873 18.1407 179.5994 148 I 3.6796 7.5195 117.2285 64.5263 36.9635 177.9844 149 E 4.1350 8.2037 119.1252 59.5069 29.2770 179.3162 150 A 4.0329 8.1059 120.6572 55.2363 18.3537 179.6544 151 S 4.1638 7.9883 110.3381 60.6060 62.9660 175.0415 152 H 4.8390 7.6831 117.4329 55.4091 29.5850 173.5592 153 A 4.2179 8.1928 130.0236 52.3852 18.4659 177.5311 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 8.29 4.34 0.00 1.97 2.14 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 2 T 7.60 4.25 4.36 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 1.18 0.00 0.00 3 R 10.05 4.61 0.00 2.00 2.19 0.00 2.64 0.00 0.00 2.80 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.09 0.00 4 R 8.68 4.65 0.00 1.85 1.95 0.00 3.09 0.00 0.00 3.51 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 5 V 9.07 4.87 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 1.17 0.00 0.00 1.37 0.00 0.00 6 A 9.29 4.78 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 7 I 9.15 4.94 2.13 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.08 1.11 0.00 0.00 8 G 9.48 4.63 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 9 T 8.30 5.86 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 1.38 0.00 0.00 10 D 8.18 4.98 0.00 2.98 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 11 H 8.99 4.11 0.00 3.37 3.80 0.00 5.48 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.23 0.00 2.18 2.20 0.00 3.69 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.85 0.00 13 A 7.60 4.24 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 14 F 8.24 4.09 0.00 3.13 3.29 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 15 A 8.20 3.93 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 16 I 7.45 4.34 1.82 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 1.40 0.86 0.88 0.00 0.00 17 H 7.95 4.13 0.00 3.17 3.42 0.00 5.46 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 7.28 3.56 0.00 1.70 1.76 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 1.97 1.75 0.00 19 N 7.78 3.61 0.00 2.67 2.20 0.00 0.00 7.13 6.74 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 20 L 7.48 3.85 0.00 1.80 1.72 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.52 3.62 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 1.42 1.04 0.87 0.00 0.00 22 L 7.78 3.89 0.00 1.62 1.55 0.91 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 23 Y 7.99 4.37 0.00 2.92 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 24 V 7.64 3.54 2.29 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 0.97 0.00 0.00 0.99 0.00 0.00 25 K 7.97 4.19 0.00 2.08 1.90 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.66 7.81 26 E 8.31 4.07 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 27 A 7.84 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.13 4.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.41 4.48 0.00 2.69 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 30 E 8.15 3.97 0.00 1.86 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 1.47 1.60 0.00 31 F 7.97 5.05 0.00 3.29 3.09 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 32 V 8.89 4.46 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 1.13 0.00 0.00 0.97 0.00 0.00 33 P 0.00 4.89 0.00 2.19 2.11 0.00 3.83 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 34 V 8.90 4.32 2.15 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 0.95 0.00 0.00 1.05 0.00 0.00 35 Y 8.65 4.67 0.00 3.04 2.98 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 0.00 0.00 0.00 36 C 8.77 4.67 0.00 2.87 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 5.50 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.34 0.00 1.95 1.79 0.00 3.57 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.26 0.00 39 K 8.59 4.40 0.00 1.79 1.95 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.51 7.81 40 T 7.00 4.09 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 1.17 0.00 0.00 41 A 7.83 3.69 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 42 E 7.02 3.93 0.00 2.16 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 2.15 2.17 0.00 43 S 8.48 3.87 0.00 3.74 3.73 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 44 V 7.98 4.60 2.39 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 0.99 0.00 0.00 0.98 0.00 0.00 45 D 8.42 4.95 0.00 2.82 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 46 Y 8.83 4.35 0.00 3.31 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.22 0.00 1.97 2.00 0.00 3.13 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.28 0.00 48 D 7.85 4.26 0.00 2.59 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.20 4.22 0.00 3.11 3.10 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 50 A 8.46 4.07 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.48 3.99 0.00 3.89 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 R 7.76 3.80 0.00 1.94 2.03 0.00 2.97 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 53 V 7.97 3.61 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 1.01 0.00 0.00 1.06 0.00 0.00 54 A 8.51 4.04 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 55 E 8.58 3.94 0.00 1.95 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 2.51 2.48 0.00 56 M 7.75 4.02 0.00 2.08 2.30 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.72 0.00 57 V 7.94 3.70 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 1.03 0.00 0.00 1.05 0.00 0.00 58 A 8.12 4.01 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 59 R 8.47 4.06 0.00 1.82 1.98 0.00 3.27 0.00 0.00 3.22 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 60 K 7.79 4.12 0.00 1.91 1.90 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.55 7.81 61 E 8.30 4.12 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 62 V 7.31 4.59 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 0.75 0.00 0.00 1.05 0.00 0.00 63 E 8.70 4.11 0.00 1.82 1.75 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 1.47 1.82 0.00 64 F 8.22 5.53 0.00 3.15 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 65 G 9.44 4.60 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 0.00 0.00 0.00 66 V 9.16 4.91 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 0.88 0.00 0.00 0.91 0.00 0.00 67 L 9.04 5.35 0.00 1.57 1.54 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.84 5.19 1.22 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 69 A 8.03 5.08 1.26 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 0.00 0.00 0.00 70 G 9.15 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.23 4.46 0.00 3.93 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 72 G 8.07 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 73 I 7.56 3.71 1.77 0.00 0.00 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 1.42 0.66 0.87 0.00 0.00 74 G 7.62 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 0.00 0.00 0.00 75 M 7.81 4.17 0.00 2.05 2.27 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.53 0.00 76 S 8.09 4.21 0.00 4.07 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 77 I 7.76 3.73 1.95 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 1.48 0.71 0.96 0.00 0.00 78 A 8.57 4.18 1.49 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 0.00 0.00 79 A 8.20 4.02 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.79 4.52 0.00 2.85 2.91 0.00 0.00 7.08 7.28 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 81 K 7.84 4.24 0.00 1.92 1.87 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.75 1.60 7.81 82 V 7.26 4.06 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 1.03 0.00 0.00 0.99 0.00 0.00 83 P 0.00 4.69 0.00 2.08 1.97 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 84 G 9.84 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 0.00 0.00 0.00 85 V 7.19 4.21 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.95 0.00 0.00 86 R 9.68 4.69 0.00 1.73 1.83 0.00 3.22 0.00 0.00 3.12 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 87 A 9.63 5.18 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 88 A 9.14 4.60 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 89 L 8.63 4.58 0.00 1.64 1.61 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 90 C 8.86 5.10 0.00 2.79 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 91 H 8.27 4.85 0.00 3.17 3.33 0.00 5.59 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 7.17 4.45 0.00 2.80 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 93 H 8.77 4.07 0.00 3.44 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.19 3.97 0.00 3.15 3.09 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 95 T 8.47 3.78 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 96 A 7.81 4.02 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 97 A 7.91 3.84 1.16 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 98 M 8.01 3.85 0.00 1.72 1.79 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 99 S 8.19 4.25 0.00 4.18 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 0.00 100 R 7.52 3.82 0.00 2.01 1.98 0.00 2.67 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.46 0.00 101 I 8.01 3.76 1.88 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.91 0.93 0.00 0.00 102 H 8.56 4.21 0.00 3.14 3.31 0.00 5.81 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.04 4.71 0.00 2.92 2.83 0.00 0.00 7.07 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.12 4.19 0.00 1.58 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 0.00 0.00 0.00 0.00 105 A 8.16 4.27 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.22 5.35 0.00 2.90 3.06 0.00 0.00 6.59 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 0.00 107 I 7.96 5.24 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.83 0.91 0.00 0.00 108 V 8.01 4.14 0.67 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 0.26 0.00 0.00 0.51 0.00 0.00 109 C 9.08 5.35 0.00 2.76 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 0.00 110 V 8.77 4.69 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 0.67 0.00 0.00 0.91 0.00 0.00 111 G 8.31 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 0.00 0.00 0.00 0.00 112 E 9.71 4.04 0.00 1.88 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 2.32 2.43 0.00 113 R 8.24 4.26 0.00 1.92 1.95 0.00 3.33 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 114 T 7.76 4.39 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 1.19 0.00 0.00 115 T 7.86 4.57 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 116 G 8.48 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 0.00 0.00 0.00 0.00 117 V 8.49 3.69 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 0.86 0.00 0.00 0.98 0.00 0.00 118 E 8.06 4.04 0.00 1.92 1.92 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 2.37 2.27 0.00 119 V 7.64 3.60 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 1.08 0.00 0.00 0.90 0.00 0.00 120 I 7.83 3.60 2.03 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 1.39 0.64 0.99 0.00 0.00 121 R 7.92 2.88 0.00 0.67 1.61 0.00 2.84 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.76 0.00 122 E 7.75 3.84 0.00 2.14 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 2.33 2.34 0.00 123 I 8.20 3.63 1.95 0.00 0.00 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 1.66 0.64 0.82 0.00 0.00 124 I 7.92 3.61 1.87 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 1.45 0.95 0.90 0.00 0.00 125 I 7.66 3.56 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.56 0.86 0.00 0.00 126 T 8.02 3.79 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 1.03 0.00 0.00 127 F 8.12 3.93 0.00 2.97 3.10 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 0.00 128 L 7.54 3.38 0.00 0.95 0.13 0.53 0.23 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 0.00 129 Q 7.82 4.35 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 130 T 7.25 4.17 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 1.21 0.00 0.00 131 P 0.00 4.58 0.00 2.20 2.08 0.00 3.76 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 1.98 1.95 0.00 132 F 8.81 5.12 0.00 3.01 3.04 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 0.00 133 S 7.84 3.90 0.00 3.82 3.90 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 0.00 0.00 0.00 134 G 5.38 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.23 3.99 0.00 1.81 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 2.23 2.18 0.00 136 E 8.80 3.90 0.00 2.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 137 R 7.82 3.94 0.00 2.05 2.13 0.00 2.99 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.54 0.00 138 H 7.89 4.38 0.00 3.45 3.85 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 7.91 3.70 2.29 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 1.14 0.00 0.00 1.18 0.00 0.00 140 R 8.07 3.90 0.00 1.95 2.10 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 141 R 8.17 3.98 0.00 2.10 2.00 0.00 3.38 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 142 I 8.27 3.70 1.91 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 1.31 0.96 0.83 0.00 0.00 143 E 8.52 3.97 0.00 2.15 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 0.00 2.32 2.41 0.00 144 K 8.18 4.01 0.00 2.05 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.72 7.81 145 I 7.69 3.70 2.04 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 0.81 0.92 0.00 0.00 146 R 8.34 4.15 0.00 1.88 2.10 0.00 3.14 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.51 0.00 147 A 8.34 4.00 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 0.00 148 I 7.52 3.68 2.07 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 1.55 0.75 0.97 0.00 0.00 149 E 8.20 4.14 0.00 2.28 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 150 A 8.11 4.03 1.37 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 0.00 0.00 151 S 7.99 4.16 0.00 3.95 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 0.00 152 H 7.68 4.84 0.00 3.13 3.33 0.00 5.84 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 8.19 4.22 1.26 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 0.00 0.00 0.00