NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 S 4.4240 8.1933 115.2781 58.2052 65.5860 175.1722 -1 H 4.1798 7.7438 115.4555 55.8304 27.3752 176.5094 0 M 4.3037 9.7691 131.6169 58.4201 32.4298 176.0690 1 M 4.3443 8.0820 117.9949 55.3927 32.3476 176.9775 2 V 3.6548 7.5239 120.0473 62.0365 31.9078 176.9801 3 S 4.4264 8.4766 118.3677 57.6352 65.4212 174.7336 4 Q 3.9099 8.7094 123.8188 59.8796 28.5156 179.4379 5 E 3.9451 8.0566 118.5773 59.7148 29.6258 179.2330 6 T 3.8687 8.1486 116.0470 66.6292 68.4344 176.8914 7 V 3.5500 8.1418 120.2044 65.9466 31.5413 177.8952 8 A 3.9292 8.5426 120.8754 55.3918 18.1111 179.1119 9 H 4.0854 8.5121 117.0228 59.3508 29.8858 177.6673 10 V 3.4444 8.1820 120.5006 65.8370 31.2838 178.0216 11 K 3.6282 8.1385 118.4348 59.5006 31.6524 178.8536 12 D 4.2672 7.8328 117.8419 57.3860 41.0678 178.6138 13 L 4.0888 7.9013 119.4641 57.8767 41.4106 179.5387 14 I 2.8632 7.2676 118.9113 63.9858 37.0321 178.1333 15 G 3.7175 7.7487 103.4401 45.9092 0.0000 175.0012 16 Q 4.1445 7.8468 121.9966 57.4754 29.4514 175.8614 17 K 4.7709 7.1589 116.1641 54.1002 36.4647 175.6621 18 E 4.2425 8.9902 120.8695 59.2408 30.6241 177.0557 19 V 4.8472 8.4453 120.7032 61.0627 33.7890 174.1595 20 F 5.4298 9.7217 130.8520 56.4429 42.2667 174.0750 21 V 4.7681 8.2274 125.1512 60.9512 34.6431 174.0603 22 A 4.5406 9.1883 131.2115 51.4536 19.4822 176.0208 23 A 5.0950 9.3243 124.4513 50.3851 23.3069 174.7497 24 K 4.9166 8.7972 119.6261 55.2140 34.9724 177.2919 25 T 3.7780 9.5783 119.0157 64.9351 68.6833 175.0582 26 Y 4.1287 7.8585 117.6282 59.3846 38.5374 175.2416 27 C 4.4126 8.2506 121.7681 57.6013 32.4683 171.8474 28 P 4.1436 0.0000 0.0000 66.0857 30.8841 178.2217 29 Y 4.2786 7.2033 114.8401 61.0187 37.7130 178.4422 30 S 4.1571 8.0813 113.8047 61.2869 62.5667 176.0838 31 K 3.9588 8.2809 121.0827 59.3166 31.6897 179.1892 32 A 4.0025 8.3194 121.2083 55.5573 18.2587 179.8157 33 T 3.8530 8.2568 114.5596 66.7799 68.5048 176.9884 34 L 4.2482 8.4005 121.3020 57.7459 41.6228 179.2514 35 S 4.1399 8.3735 113.3635 61.8309 62.2596 176.3366 36 T 3.9834 8.2237 118.4692 66.7546 68.1602 176.6773 37 L 3.6986 8.0845 120.9247 57.4660 41.3628 179.1224 38 F 4.5129 8.1738 115.6856 58.6139 39.4296 177.4686 39 Q 4.3974 7.8687 116.7346 58.0389 29.2159 177.4735 40 E 3.8130 8.5124 119.8215 58.8195 29.9622 177.5295 41 L 4.4333 8.0589 115.5815 53.8071 42.2285 176.0433 42 N 4.4176 7.7230 114.6972 54.0229 36.6140 174.4929 43 V 3.4715 8.0218 118.6467 61.8822 31.9411 174.0694 44 P 4.4210 0.0000 0.0000 62.6912 31.9378 177.6528 45 K 3.9275 8.8383 122.0469 59.3461 32.1819 179.2009 46 S 4.2423 8.1006 112.0603 60.3002 63.1888 174.6929 47 K 4.6466 8.3900 120.2269 55.9365 33.0511 175.4246 48 A 5.3539 8.1664 121.2063 50.1956 22.6240 175.9601 49 L 4.6027 9.5950 122.8579 53.2661 44.8073 175.2951 50 V 4.4894 8.3505 126.4144 61.0951 33.5388 174.4855 51 L 4.4158 8.5365 129.1654 53.2808 43.4780 176.2560 52 E 4.3894 8.6600 125.0911 54.8053 28.7274 177.0679 53 L 4.0677 8.8975 126.0622 57.6052 42.0313 180.0296 54 D 4.4311 8.1387 116.8836 55.9009 39.4573 176.5309 55 E 4.2814 8.0596 118.3183 56.4811 30.1243 175.3086 56 M 4.6638 7.4901 118.5980 54.0130 33.8769 177.1587 57 S 4.1309 8.8262 118.3547 60.5360 63.6402 174.6603 58 N 4.9276 8.0786 117.1926 52.3683 37.6409 176.3445 59 G 4.2800 8.2104 110.4516 47.9669 0.0000 175.9137 60 S 4.1617 8.2393 117.2130 62.0260 62.3826 176.7269 61 E 3.9957 8.1496 120.3057 61.0824 29.4012 180.7908 62 I 3.9779 7.7994 120.2940 64.2978 37.0920 178.1861 63 Q 4.0250 8.3430 120.5945 59.4452 28.7660 178.1361 64 D 4.3756 8.4108 119.7798 57.3198 40.8541 178.6626 65 A 4.0073 8.3616 121.5851 55.3336 18.5256 179.7670 66 L 4.0223 8.2956 117.8552 57.7892 41.6696 179.3959 67 E 4.5062 8.5875 121.2125 58.7227 29.3580 178.4274 68 E 3.9764 8.1754 118.5473 59.3432 29.7611 178.5827 69 I 3.9046 7.7904 119.0971 63.6894 37.3106 177.0833 70 S 4.5696 8.2850 110.4326 57.1966 64.4577 174.9646 71 G 3.9780 8.6620 109.6669 45.1075 0.0000 173.6001 72 Q 4.0723 8.2814 124.7538 56.6693 29.3694 177.1119 73 K 4.4267 8.6742 126.1087 55.0637 32.9790 173.3815 74 T 4.6229 7.5957 106.5224 60.7247 70.3828 175.0572 75 V 3.9376 8.1360 117.2005 60.5442 32.6722 174.4368 76 P 4.8224 0.0000 0.0000 62.8488 33.3452 174.5818 77 N 5.3162 9.2992 119.2837 52.0985 41.8254 172.9145 78 V 5.0689 8.9565 127.2911 61.4036 34.2271 173.9054 79 Y 5.2597 9.6773 125.2550 56.3442 41.7094 174.7845 80 I 4.9443 8.7527 123.2552 60.0574 41.0782 175.3803 81 N 4.0151 9.9133 126.6456 54.3317 36.3000 175.1714 82 G 3.9991 8.1671 104.2915 45.1749 0.0000 172.2963 83 K 4.2537 8.0933 122.4226 55.0424 32.8859 175.0562 84 H 3.8799 8.6649 126.4562 55.5003 28.9037 174.5874 85 I 3.7634 7.8998 129.2681 63.1864 38.3230 176.8542 86 G 4.2408 7.5251 105.1231 44.2060 0.0000 174.0020 87 G 4.2142 9.5586 116.0498 43.6505 0.0000 172.7553 88 N 4.5242 8.9430 117.4497 56.2756 38.8383 177.5782 89 S 4.1803 7.8617 115.1968 61.4179 63.1474 176.1343 90 D 4.2655 7.9008 122.0602 56.8911 40.6911 178.0335 91 L 3.8992 8.0954 121.1379 58.2785 41.9851 178.7261 92 E 3.9306 8.5258 118.7166 59.8907 29.4464 179.5059 93 T 3.8363 7.8553 115.4130 66.8095 68.4558 176.7032 94 L 4.0435 7.9565 120.7613 57.3514 41.4096 179.3470 95 K 3.9168 8.7121 122.5159 60.2169 31.9303 179.6815 96 K 4.0157 8.0083 122.4604 59.8771 31.7482 180.0513 97 N 4.5484 8.3871 117.3801 54.5456 38.3334 176.5237 98 G 4.0178 8.0712 107.8585 45.5833 0.0000 175.4801 99 K 4.0299 7.8071 118.9971 59.0571 32.0151 178.7074 100 L 3.9585 8.1911 121.0556 58.0273 42.0740 178.8480 101 A 4.0168 7.9547 120.1771 55.2485 18.1519 179.2629 102 E 3.9354 7.5740 115.2543 59.6415 29.6182 179.3065 103 I 3.8782 8.0251 119.0331 64.4483 37.5277 178.1697 104 L 4.2623 8.5494 119.2322 56.2659 41.0223 178.9234 105 K 3.9254 7.8453 120.4848 59.5161 32.0540 176.7114 106 P 4.6063 0.0000 0.0000 64.7449 30.9230 178.8695 107 V 4.4553 7.5448 117.9627 65.6610 31.6088 177.8577 108 F 4.2067 7.8388 114.4715 59.3866 38.5997 175.5175 109 Q 4.2326 7.8731 121.7913 56.0873 28.6744 175.5819 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 S 8.19 4.42 0.00 3.85 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 -1 H 7.74 4.18 0.00 3.48 2.41 0.00 5.95 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 M 9.77 4.30 0.00 2.02 2.14 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 2.62 2.58 0.00 1 M 8.08 4.34 0.00 2.02 2.30 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 2 V 7.52 3.65 2.17 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 0.79 0.00 0.00 1.01 0.00 0.00 3 S 8.48 4.43 0.00 4.23 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 4 Q 8.71 3.91 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 5 E 8.06 3.95 0.00 2.09 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 2.39 2.45 0.00 6 T 8.15 3.87 4.38 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 1.23 0.00 0.00 7 V 8.14 3.55 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 1.12 0.00 0.00 1.09 0.00 0.00 8 A 8.54 3.93 1.38 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 0.00 0.00 9 H 8.51 4.09 0.00 3.30 3.53 0.00 5.79 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 10 V 8.18 3.44 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 0.94 0.00 0.00 0.99 0.00 0.00 11 K 8.14 3.63 0.00 1.89 1.71 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.57 7.81 12 D 7.83 4.27 0.00 2.77 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 13 L 7.90 4.09 0.00 1.72 1.84 0.93 1.13 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 14 I 7.27 2.86 1.39 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.13 0.00 0.00 15 G 7.75 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 16 Q 7.85 4.14 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.63 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 17 K 7.16 4.77 0.00 1.86 1.77 0.00 1.97 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.37 1.49 7.81 18 E 8.99 4.24 0.00 2.06 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 2.57 2.33 0.00 19 V 8.45 4.85 2.28 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 0.97 0.00 0.00 0.90 0.00 0.00 20 F 9.72 5.43 0.00 3.15 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 21 V 8.23 4.77 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 0.94 0.00 0.00 1.06 0.00 0.00 22 A 9.19 4.54 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 23 A 9.32 5.10 1.19 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 0.00 0.00 0.00 24 K 8.80 4.92 0.00 1.87 1.68 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.68 7.81 25 T 9.58 3.78 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 1.23 0.00 0.00 26 Y 7.86 4.13 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 27 C 8.25 4.41 0.00 3.03 3.03 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 28 P 0.00 4.14 0.00 1.58 1.88 0.00 3.34 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 29 Y 7.20 4.28 0.00 3.08 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 30 S 8.08 4.16 0.00 3.95 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 0.00 31 K 8.28 3.96 0.00 1.97 1.84 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.57 7.81 32 A 8.32 4.00 1.48 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 33 T 8.26 3.85 4.49 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 1.24 0.00 0.00 34 L 8.40 4.25 0.00 1.76 1.90 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.37 4.14 0.00 3.93 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 0.00 36 T 8.22 3.98 4.38 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 1.22 0.00 0.00 37 L 8.08 3.70 0.00 0.85 0.58 0.81 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 38 F 8.17 4.51 0.00 3.13 3.14 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 39 Q 7.87 4.40 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 40 E 8.51 3.81 0.00 1.94 2.17 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 2.31 2.35 0.00 41 L 8.06 4.43 0.00 1.84 1.73 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 42 N 7.72 4.42 0.00 2.87 3.03 0.00 0.00 6.86 7.56 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 43 V 8.02 3.47 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.83 0.00 0.00 44 P 0.00 4.42 0.00 2.18 1.98 0.00 3.26 0.00 0.00 3.73 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 45 K 8.84 3.93 0.00 1.73 1.74 0.00 1.15 0.00 0.00 0.61 0.00 0.00 2.33 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.44 1.21 7.81 46 S 8.10 4.24 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.39 4.65 0.00 1.76 1.83 0.00 1.38 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.32 7.81 48 A 8.17 5.35 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.59 4.60 0.00 1.79 1.70 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.35 4.49 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 0.82 0.00 0.00 0.75 0.00 0.00 51 L 8.54 4.42 0.00 1.45 1.56 1.11 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.66 4.39 0.00 2.00 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 2.32 2.26 0.00 53 L 8.90 4.07 0.00 1.79 1.76 0.98 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.14 4.43 0.00 3.00 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 55 E 8.06 4.28 0.00 1.94 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 2.27 2.31 0.00 56 M 7.49 4.66 0.00 2.12 2.07 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 2.86 2.51 0.00 57 S 8.83 4.13 0.00 3.98 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 58 N 8.08 4.93 0.00 2.88 3.04 0.00 0.00 6.15 6.93 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 59 G 8.21 4.28 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 0.00 60 S 8.24 4.16 0.00 3.90 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.15 4.00 0.00 2.01 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 0.00 2.31 1.97 0.00 62 I 7.80 3.98 2.09 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 1.48 0.66 1.03 0.00 0.00 63 Q 8.34 4.02 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 64 D 8.41 4.38 0.00 2.91 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 65 A 8.36 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 66 L 8.30 4.02 0.00 1.96 1.87 1.17 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.59 4.51 0.00 2.12 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 2.34 2.36 0.00 68 E 8.18 3.98 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 69 I 7.79 3.90 2.01 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 1.52 0.62 0.91 0.00 0.00 70 S 8.29 4.57 0.00 3.93 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 71 G 8.66 3.98 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 0.00 0.00 0.00 72 Q 8.28 4.07 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.58 0.00 0.00 0.00 0.00 0.00 2.60 2.34 0.00 73 K 8.67 4.43 0.00 1.81 1.69 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.29 0.98 7.81 74 T 7.60 4.62 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 1.24 0.00 0.00 75 V 8.14 3.94 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 0.81 0.00 0.00 1.01 0.00 0.00 76 P 0.00 4.82 0.00 2.16 2.23 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 77 N 9.30 5.32 0.00 3.00 2.92 0.00 0.00 7.01 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 78 V 8.96 5.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.96 0.00 0.00 79 Y 9.68 5.26 0.00 3.08 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 80 I 8.75 4.94 1.91 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 1.27 0.89 0.94 0.00 0.00 81 N 9.91 4.02 0.00 2.83 2.85 0.00 0.00 7.17 8.51 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 82 G 8.17 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.09 4.25 0.00 1.80 1.87 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.36 7.81 84 H 8.66 3.88 0.00 2.96 3.12 0.00 5.80 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 85 I 7.90 3.76 1.87 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 1.33 0.89 0.84 0.00 0.00 86 G 7.53 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 0.00 0.00 0.00 0.00 87 G 9.56 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 0.00 0.00 0.00 88 N 8.94 4.52 0.00 2.99 2.84 0.00 0.00 7.44 7.63 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 89 S 7.86 4.18 0.00 4.00 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 90 D 7.90 4.27 0.00 2.81 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 91 L 8.10 3.90 0.00 1.71 1.84 0.89 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.53 3.93 0.00 2.20 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 2.50 2.52 0.00 93 T 7.86 3.84 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 1.19 0.00 0.00 94 L 7.96 4.04 0.00 1.85 1.78 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.71 3.92 0.00 1.91 1.88 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.42 1.45 7.81 96 K 8.01 4.02 0.00 1.89 1.71 0.00 1.89 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.35 7.81 97 N 8.39 4.55 0.00 2.73 2.97 0.00 0.00 7.24 7.53 0.00 0.00 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 G 8.07 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.81 4.03 0.00 1.85 1.86 0.00 1.56 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.55 7.81 100 L 8.19 3.96 0.00 1.75 1.71 0.91 1.36 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 0.00 101 A 7.95 4.02 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 0.00 102 E 7.57 3.94 0.00 2.15 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 2.35 2.53 0.00 103 I 8.03 3.88 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.56 0.93 0.00 0.00 104 L 8.55 4.26 0.00 1.85 2.08 1.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 105 K 7.85 3.93 0.00 2.01 1.98 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.54 7.81 106 P 0.00 4.61 0.00 2.22 2.12 0.00 4.06 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 107 V 7.54 4.46 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 0.64 0.00 0.00 0.91 0.00 0.00 108 F 7.84 4.21 0.00 3.08 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 0.00 109 Q 7.87 4.23 0.00 2.39 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00