NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2339 8.4401 118.7924 56.0564 31.7731 176.1877 2 A 4.0398 7.7855 121.4107 51.3906 18.6366 171.8085 3 E 4.4522 8.4879 118.8656 57.3771 33.7610 175.9402 4 A 4.1798 7.7678 122.2035 53.1885 19.5789 176.6892 5 H 4.2866 7.2458 111.6409 56.1863 32.2581 173.3716 6 K 4.6564 8.6054 119.5431 56.9299 32.7817 177.5872 7 C 4.8267 8.1204 115.5924 57.4414 41.0872 174.8791 8 D 4.4788 8.1676 118.9758 56.5576 41.6793 177.8519 9 I 3.8007 7.5604 119.1110 64.5025 37.7700 177.5947 10 T 3.7769 7.8482 115.7496 67.0415 68.2831 176.1681 11 L 4.0224 7.8197 120.0772 57.9386 41.6873 179.4387 12 Q 3.9983 7.5520 119.6908 59.5232 29.1544 178.5199 13 E 4.0462 8.1610 119.1148 59.2231 29.1733 179.4308 14 I 3.7484 7.3661 119.0060 63.9262 37.3713 178.2462 15 I 3.6956 7.6331 121.0443 64.0335 37.0088 178.0620 16 K 3.8558 7.7466 120.0644 60.0896 32.0463 178.8092 17 T 4.0030 7.7750 115.6129 66.3332 67.9799 176.1196 18 L 3.9190 7.4686 121.5388 58.5615 42.5273 178.6958 19 N 4.4712 8.1489 115.5520 56.4292 38.3983 177.4637 20 S 4.2697 8.0802 116.1586 61.2752 62.7323 176.2485 21 L 4.4006 7.8274 120.3029 56.8648 41.3357 177.5695 22 T 4.4804 7.2784 115.0182 63.5378 68.5179 175.5388 23 E 4.0165 8.0479 125.1433 58.9466 30.3703 177.6659 24 Q 4.3107 7.8312 121.2315 54.8144 28.4002 176.1495 25 K 4.6119 7.2265 122.7645 53.9613 31.4464 174.0410 26 T 4.7214 7.2313 119.9949 64.7148 76.4400 175.5236 27 L 4.3173 7.9123 119.9904 56.6337 42.4627 178.6046 28 C 4.5886 8.1788 117.1152 58.2521 39.4042 173.7900 29 T 4.3585 7.4264 106.3037 61.4707 68.4501 175.9138 30 E 4.3386 7.9881 119.9179 58.0968 31.8795 177.1612 31 L 4.3894 7.9897 122.1438 54.8855 40.0930 179.2682 32 T 4.4135 8.1522 119.2785 63.4573 71.6093 172.2376 33 V 4.1171 7.6891 117.3509 61.2218 34.6401 172.1438 34 T 4.1412 8.4669 119.1838 63.8312 69.1674 174.1543 35 D 4.6213 8.4367 125.4837 52.8050 39.8949 176.6167 36 I 3.6443 7.5789 116.7434 62.3828 38.1026 177.3264 37 F 5.0446 7.4468 118.7845 57.6009 39.3870 176.4141 38 A 4.4760 7.7883 125.3465 53.7329 20.2096 179.0576 39 A 4.6335 7.4350 116.6286 50.9872 19.2937 176.3231 40 S 4.4372 7.7681 114.6796 55.8002 62.3524 175.1631 41 K 3.8541 8.0441 127.2764 59.0894 32.7772 177.2813 42 D 4.7026 7.2684 115.5072 54.1670 43.1226 174.5089 43 T 4.3067 7.5406 117.9889 63.1495 70.7944 174.7470 44 T 4.5594 7.9016 118.7923 61.9818 72.2245 175.5420 45 E 3.7423 8.3850 120.1331 59.2321 29.6162 179.1174 46 K 4.3423 7.9281 119.3116 59.5908 33.0764 178.6637 47 E 4.0721 8.0760 120.1320 59.2608 29.7641 178.6143 48 T 4.0217 7.8047 115.9391 66.1993 68.5139 176.9790 49 F 4.6548 7.7649 119.5694 60.8431 39.0173 176.9189 50 C 4.5869 8.3645 118.0609 59.6301 38.0343 175.3128 51 R 3.8104 8.0764 119.8349 59.6265 29.8249 178.4031 52 A 4.2179 8.2146 119.4684 54.5206 18.1565 179.2709 53 A 4.1724 7.8140 118.9616 55.2264 18.8053 179.7253 54 T 3.9605 7.9418 114.4953 66.7355 68.4576 177.1709 55 V 3.5725 7.5636 120.0455 66.1528 31.5300 178.1229 56 L 4.3069 8.1141 118.5094 57.5157 41.2808 179.3067 57 R 4.6281 7.8846 120.2711 59.3745 30.0055 178.6748 58 Q 4.0602 8.1777 117.0632 58.7743 28.0330 178.5908 59 F 4.4455 8.1787 122.3566 60.7602 39.2377 175.9754 60 Y 4.2429 7.8602 115.1326 57.7873 38.3918 177.3610 61 S 3.6436 6.9913 116.7393 61.1136 63.7538 175.3857 62 H 4.3854 7.7412 118.1903 58.5752 28.8971 177.5700 63 H 4.3514 7.6976 113.2527 58.2263 28.5323 177.2130 64 E 4.0920 8.0651 118.6070 57.9745 29.7296 177.4477 65 K 4.4765 7.4359 116.4356 55.9631 32.7875 175.6338 66 D 4.7988 7.6395 118.9611 53.5412 42.2099 176.6658 67 T 4.2262 8.2847 111.3600 63.9942 69.6719 177.1617 68 R 3.9321 8.1628 120.5490 59.1171 30.1512 177.9983 69 C 4.5216 8.0729 115.6077 57.9694 43.5610 173.5030 70 L 3.9933 6.8470 118.7177 54.6286 42.7015 179.7479 71 G 4.1406 7.9610 105.7356 44.1811 0.0000 176.3801 72 A 4.6503 8.3993 117.8621 50.7817 18.6559 175.6995 73 T 4.6247 7.0939 118.3129 61.7913 72.9275 175.5659 74 A 4.4040 8.5601 126.5958 54.9960 19.2967 180.0791 75 Q 3.9130 8.0668 114.7904 58.7175 28.7194 178.0471 76 Q 4.0773 7.5129 119.2608 58.6423 29.3393 178.0094 77 F 4.3381 7.8854 121.7951 61.6864 39.3676 176.6194 78 H 3.9896 8.4107 115.9745 59.3182 29.7472 176.6179 79 R 3.9957 8.0239 120.1213 58.9806 29.9859 177.9693 80 H 4.0490 7.8800 118.1911 59.2909 29.8427 177.3555 81 K 3.8056 7.7307 119.5397 59.4094 31.6817 179.2204 82 Q 3.8825 7.5262 118.6024 58.8260 28.7693 178.2671 83 L 4.1232 7.8076 120.6066 57.7169 42.1788 178.8990 84 I 3.8170 7.5663 119.6065 64.0737 37.0097 178.1737 85 R 4.0418 7.8802 119.0637 58.9195 29.8854 178.7108 86 F 4.2434 8.2311 120.2813 60.8695 39.4419 177.2126 87 L 4.0152 8.0447 120.2388 58.0610 41.3701 179.0774 88 K 3.6047 7.8855 118.4733 59.5607 32.1434 179.1357 89 R 3.7627 7.6491 120.0172 59.3122 30.1305 178.2902 90 L 3.9953 7.6090 119.3962 57.4072 41.5612 178.2464 91 D 4.3687 7.7660 118.0253 57.5816 41.1710 178.0964 92 R 4.6174 7.5375 118.0651 58.0375 30.2707 177.7438 93 N 4.4637 7.8544 114.8808 54.7761 39.0618 176.0790 94 L 4.1041 7.6958 121.2186 57.7384 42.9479 177.8804 95 W 4.6849 8.0279 116.6402 58.6021 28.3330 178.2896 96 G 3.5551 7.7987 106.9104 46.5764 0.0000 174.6762 97 L 4.1279 7.4587 118.8568 56.9848 42.1814 178.0327 98 A 4.1180 7.5874 120.2968 53.4523 19.2378 178.3748 99 G 3.6788 9.3677 103.5589 44.9994 0.0000 175.5524 100 L 4.4645 7.7147 117.5848 53.7474 43.7907 176.0314 101 N 4.0853 8.9432 122.2783 56.2818 39.3782 175.4023 102 S 4.1821 7.8621 113.0918 59.5496 63.5724 176.5047 103 C 4.9331 8.2255 121.6838 55.2240 41.7817 172.0590 104 P 4.3834 0.0000 0.0000 63.0170 29.8679 177.5446 105 V 4.2308 7.7093 129.2533 61.2011 31.5225 177.1565 106 K 4.6992 7.5015 113.6958 56.1438 33.1639 178.9586 107 E 4.5655 7.4048 115.3057 53.5771 30.2130 173.9622 108 A 4.2684 7.3175 126.6804 52.0904 21.8480 177.1098 109 D 4.5342 7.9277 119.3419 54.4449 43.0771 175.3517 110 Q 4.5479 8.4723 120.0415 55.5320 28.2161 176.8372 111 S 4.6598 8.5571 120.9774 57.4016 66.0278 173.0663 112 T 4.8318 8.0990 108.3257 59.7449 71.0697 174.8656 113 L 4.0947 8.4811 125.2629 58.0427 42.1484 178.2173 114 E 4.1286 7.7668 118.8294 58.8151 29.5679 178.0050 115 N 4.3454 8.3882 117.7905 56.8036 39.1102 177.1025 116 F 4.5592 8.2952 122.0034 61.1770 39.5631 177.3369 117 L 3.6626 7.8492 118.5413 57.2649 41.3765 179.2063 118 E 3.8185 8.0652 119.4019 59.4175 29.7854 179.0715 119 R 4.3421 7.7169 118.4343 57.7524 29.7426 179.1052 120 L 3.7756 7.1278 118.8410 57.4709 41.9434 179.0024 121 K 3.9604 7.6311 118.1178 59.5304 32.1229 179.1050 122 T 3.7491 7.5828 109.6949 65.3565 68.4722 176.0985 123 I 3.5865 7.3637 122.7266 64.0988 36.8190 178.3246 124 M 4.1059 7.8704 119.3268 57.8879 31.4639 178.8654 125 R 3.9152 7.5776 117.2080 58.5516 30.5765 177.8495 126 E 4.2841 7.8922 116.9865 58.2490 30.2357 178.2193 127 K 4.2187 8.1256 119.6062 59.2299 32.1633 178.2001 128 Y 4.2197 8.0843 115.9821 59.5517 38.0988 175.9938 129 S 4.7551 7.5502 114.3622 57.6736 63.6295 175.3475 130 K 4.4200 7.6837 116.8558 57.9684 32.7472 176.3142 131 C 4.4242 8.3219 119.9064 57.8475 44.0716 174.0986 132 S 4.3014 7.6740 112.7354 58.5081 63.4711 174.1436 133 S 4.1614 8.1801 116.1178 59.3135 63.5362 174.7645 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 E 8.44 4.23 0.00 2.07 2.13 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 2.14 2.28 0.00 2 A 7.79 4.04 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 3 E 8.49 4.45 0.00 1.90 1.85 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 2.18 2.24 0.00 4 A 7.77 4.18 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 5 H 7.25 4.29 0.00 3.04 3.14 0.00 5.89 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 6 K 8.61 4.66 0.00 1.81 1.79 0.00 1.50 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.24 1.39 7.81 7 C 8.12 4.83 0.00 2.89 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 8 D 8.17 4.48 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.56 3.80 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.64 0.90 0.00 0.00 10 T 7.85 3.78 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 1.12 0.00 0.00 11 L 7.82 4.02 0.00 1.61 1.72 0.61 -0.57 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 12 Q 7.55 4.00 0.00 2.31 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 13 E 8.16 4.05 0.00 2.09 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 2.31 2.39 0.00 14 I 7.37 3.75 1.97 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.38 0.94 0.00 0.00 15 I 7.63 3.70 1.93 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 -0.18 0.80 0.00 0.00 16 K 7.75 3.86 0.00 1.83 1.82 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.54 1.60 7.81 17 T 7.77 4.00 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 0.38 0.00 0.00 18 L 7.47 3.92 0.00 1.76 1.70 0.88 1.07 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 19 N 8.15 4.47 0.00 3.01 2.86 0.00 0.00 7.04 7.11 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 20 S 8.08 4.27 0.00 4.49 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 21 L 7.83 4.40 0.00 1.89 1.84 1.07 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.28 4.48 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 1.21 0.00 0.00 23 E 8.05 4.02 0.00 1.94 1.97 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 2.30 2.24 0.00 24 Q 7.83 4.31 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.67 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 25 K 7.23 4.61 0.00 1.87 1.74 0.00 1.70 0.00 0.00 0.61 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.41 7.81 26 T 7.23 4.72 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 1.23 0.00 0.00 27 L 7.91 4.32 0.00 1.64 1.76 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 28 C 8.18 4.59 0.00 3.05 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 29 T 7.43 4.36 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 30 E 7.99 4.34 0.00 2.10 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 2.46 2.42 0.00 31 L 7.99 4.39 0.00 1.72 1.08 1.06 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.15 4.41 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 1.22 0.00 0.00 33 V 7.69 4.12 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.26 0.00 0.00 34 T 8.47 4.14 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 35 D 8.44 4.62 0.00 2.76 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 36 I 7.58 3.64 1.54 0.00 0.00 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 0.49 -0.36 0.61 0.00 0.00 37 F 7.45 5.04 0.00 3.21 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 38 A 7.79 4.48 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 39 A 7.43 4.63 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 40 S 7.77 4.44 0.00 4.04 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 41 K 8.04 3.85 0.00 1.74 1.83 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.43 7.81 42 D 7.27 4.70 0.00 2.66 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 43 T 7.54 4.31 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 44 T 7.90 4.56 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 45 E 8.39 3.74 0.00 1.97 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 2.34 2.41 0.00 46 K 7.93 4.34 0.00 2.15 2.20 0.00 1.42 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.52 1.58 7.81 47 E 8.08 4.07 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 48 T 7.80 4.02 4.06 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 1.35 0.00 0.00 49 F 7.76 4.65 0.00 3.38 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 50 C 8.36 4.59 0.00 3.31 3.26 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 51 R 8.08 3.81 0.00 2.14 1.92 0.00 3.11 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 52 A 8.21 4.22 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 0.00 0.00 0.00 0.00 0.00 53 A 7.81 4.17 1.55 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 0.00 0.00 54 T 7.94 3.96 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 1.17 0.00 0.00 55 V 7.56 3.57 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 0.90 0.00 0.00 0.84 0.00 0.00 56 L 8.11 4.31 0.00 2.17 1.88 1.20 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.88 4.63 0.00 2.15 2.15 0.00 3.15 0.00 0.00 3.29 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.75 0.00 58 Q 8.18 4.06 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.63 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 59 F 8.18 4.45 0.00 3.07 3.30 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 60 Y 7.86 4.24 0.00 3.12 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 61 S 6.99 3.64 0.00 3.63 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 62 H 7.74 4.39 0.00 3.35 3.40 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 7.70 4.35 0.00 3.42 3.58 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.07 4.09 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.29 0.00 65 K 7.44 4.48 0.00 1.68 1.77 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.35 7.81 66 D 7.64 4.80 0.00 2.70 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 67 T 8.28 4.23 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 1.22 0.00 0.00 68 R 8.16 3.93 0.00 1.83 2.07 0.00 3.20 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 69 C 8.07 4.52 0.00 3.07 3.30 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 70 L 6.85 3.99 0.00 1.82 1.68 0.97 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 71 G 7.96 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 0.00 0.00 0.00 0.00 72 A 8.40 4.65 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 73 T 7.09 4.62 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 1.24 0.00 0.00 74 A 8.56 4.40 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 75 Q 8.07 3.91 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 76 Q 7.51 4.08 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.00 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 77 F 7.89 4.34 0.00 3.15 3.26 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 78 H 8.41 3.99 0.00 3.25 3.36 0.00 5.80 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 R 8.02 4.00 0.00 2.14 1.88 0.00 3.12 0.00 0.00 3.07 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 80 H 7.88 4.05 0.00 3.45 3.08 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 K 7.73 3.81 0.00 1.45 1.67 0.00 1.16 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.31 7.81 82 Q 7.53 3.88 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.45 0.00 83 L 7.81 4.12 0.00 1.75 1.64 1.05 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.57 3.82 1.97 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.13 1.02 0.00 0.00 85 R 7.88 4.04 0.00 1.84 2.04 0.00 3.11 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 86 F 8.23 4.24 0.00 3.21 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 87 L 8.04 4.02 0.00 1.99 1.90 1.17 0.02 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 88 K 7.89 3.60 0.00 1.50 1.53 0.00 1.19 0.00 0.00 1.43 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.54 7.81 89 R 7.65 3.76 0.00 1.75 2.03 0.00 2.95 0.00 0.00 2.78 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.50 0.00 90 L 7.61 4.00 0.00 1.68 1.77 0.92 1.67 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 91 D 7.77 4.37 0.00 2.69 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 92 R 7.54 4.62 0.00 2.07 2.01 0.00 3.47 0.00 0.00 3.48 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 93 N 7.85 4.46 0.00 2.82 2.75 0.00 0.00 6.99 8.94 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 94 L 7.70 4.10 0.00 1.96 1.84 0.90 1.41 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 95 W 8.03 4.68 0.00 3.97 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 96 G 7.80 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 7.46 4.13 0.00 1.40 1.59 0.77 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 98 A 7.59 4.12 1.58 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 0.00 0.00 99 G 9.37 3.68 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 0.00 0.00 0.00 100 L 7.71 4.46 0.00 1.76 1.75 0.99 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.94 4.09 0.00 2.77 2.91 0.00 0.00 7.26 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 0.00 102 S 7.86 4.18 0.00 3.92 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 0.00 103 C 8.23 4.93 0.00 2.97 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 P 0.00 4.38 0.00 2.02 2.02 0.00 3.66 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 2.02 2.07 0.00 105 V 7.71 4.23 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 0.77 0.00 0.00 0.81 0.00 0.00 106 K 7.50 4.70 0.00 1.66 1.74 0.00 1.49 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.29 1.39 7.81 107 E 7.40 4.57 0.00 1.98 1.87 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 2.12 2.26 0.00 108 A 7.32 4.27 1.13 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 0.00 109 D 7.93 4.53 0.00 2.59 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 8.47 4.55 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.94 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 111 S 8.56 4.66 0.00 4.07 4.07 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 0.00 112 T 8.10 4.83 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 1.22 0.00 0.00 113 L 8.48 4.09 0.00 1.62 1.69 0.94 0.89 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 0.00 114 E 7.77 4.13 0.00 2.08 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 2.41 2.38 0.00 115 N 8.39 4.35 0.00 2.80 2.93 0.00 0.00 7.07 7.58 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 0.00 116 F 8.30 4.56 0.00 3.21 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 0.00 117 L 7.85 3.66 0.00 1.98 1.64 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 118 E 8.07 3.82 0.00 2.08 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 2.28 2.34 0.00 119 R 7.72 4.34 0.00 1.97 1.47 0.00 3.46 0.00 0.00 3.63 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 120 L 7.13 3.78 0.00 1.37 1.52 0.44 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 121 K 7.63 3.96 0.00 1.86 1.76 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.50 7.81 122 T 7.58 3.75 4.10 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 1.13 0.00 0.00 123 I 7.36 3.59 1.84 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.53 0.92 0.00 0.00 124 M 7.87 4.11 0.00 1.17 1.91 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.83 0.00 125 R 7.58 3.92 0.00 1.81 1.93 0.00 3.10 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 126 E 7.89 4.28 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 127 K 8.13 4.22 0.00 2.02 2.09 0.00 1.52 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.57 7.81 128 Y 8.08 4.22 0.00 3.06 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 0.00 129 S 7.55 4.76 0.00 4.13 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 0.00 130 K 7.68 4.42 0.00 1.69 1.76 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.47 7.81 131 C 8.32 4.42 0.00 2.88 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 0.00 132 S 7.67 4.30 0.00 3.95 3.74 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 0.00 133 S 8.18 4.16 0.00 3.85 3.74 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