NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.4241 8.3193 115.2966 57.9691 62.3983 172.6924 8 P 4.4440 0.0000 0.0000 61.5841 32.6389 173.2242 9 L 5.0268 7.2228 122.9493 53.4101 44.6885 176.5372 10 S 4.8816 8.9302 119.9151 56.8847 67.1103 172.1998 11 T 4.8513 8.1656 113.7548 61.1101 71.3525 172.3226 12 H 4.9022 8.4145 121.9626 55.3735 33.0796 171.8837 13 V 4.5980 9.0454 127.3041 61.2424 33.5127 174.2382 14 L 5.0245 8.5940 128.3058 52.8859 44.6600 175.5398 15 N 5.2589 8.9826 124.4451 53.0007 38.3731 175.1409 16 I 4.1578 8.8671 119.1382 62.0602 37.9487 177.3383 17 A 4.2736 8.5719 125.7424 54.4906 18.5209 177.9626 18 Q 4.5507 8.1738 111.7935 55.0213 30.4344 176.1069 19 G 3.9412 8.4757 105.8015 46.3427 0.0000 173.6948 20 V 4.7374 7.4429 110.7389 57.9765 36.3281 173.3250 21 P 4.5691 0.0000 0.0000 63.5606 31.8253 176.8027 22 G 3.7610 9.7439 110.9128 45.1544 0.0000 172.1909 23 A 4.5796 8.5574 128.4361 51.4405 20.0163 176.4122 24 N 4.2343 8.4564 116.7632 54.5221 36.8579 173.8864 25 M 4.5336 8.3210 118.8187 54.7278 33.9130 175.3686 26 T 4.4966 8.5846 123.0756 63.8041 70.0726 173.3282 27 I 4.8256 8.6935 126.1886 59.3612 41.3684 174.4672 28 V 4.5798 8.4449 126.0319 60.9058 34.4910 173.8213 29 L 4.9127 8.8852 130.7572 54.5270 43.5801 175.0229 30 H 5.5159 9.3915 122.7748 54.0669 33.0454 172.6196 31 R 4.8003 8.6636 119.4846 54.4377 33.6954 173.6671 32 L 3.7955 7.8142 127.9589 53.9042 42.8042 175.5132 33 D 4.4781 8.4128 127.6779 52.7427 41.3873 174.4073 34 P 4.1210 0.0000 0.0000 63.9179 31.2396 174.6751 35 V 3.5793 7.7950 123.0651 62.1354 30.5936 172.0493 36 S 4.3404 7.3352 116.5051 57.0792 64.0817 173.7786 37 S 4.3260 8.3791 114.6820 58.4421 63.0096 173.3451 38 A 4.4077 7.5721 123.8779 51.4045 19.6470 177.2295 39 W 4.8711 8.7495 123.0913 56.3885 30.5511 175.8099 40 N 5.2473 8.8836 119.6970 51.2407 43.0229 174.1668 41 I 3.9628 8.4802 122.0960 61.8560 37.9637 175.6564 42 L 4.5518 9.0289 125.1569 56.5124 43.0380 177.0132 43 T 4.7398 7.5781 112.0230 60.8395 70.8969 171.9417 44 T 4.9354 8.5627 118.1916 60.1305 71.3973 173.3598 45 G 4.2639 9.3468 110.9188 45.2829 0.0000 170.7707 46 I 5.3520 8.0163 118.8936 59.5452 41.3305 175.8525 47 T 4.3704 8.8704 117.1272 61.8608 70.3236 174.6771 48 N 5.1077 8.8223 121.7853 51.8469 39.7944 175.0864 49 D 4.3086 8.6880 116.7236 57.6465 40.8873 176.7971 50 D 4.6225 8.2919 116.2221 53.7667 41.2162 176.3698 51 G 4.0233 8.4058 104.9781 46.1321 0.0000 173.8441 52 R 5.0236 8.0151 118.3377 54.4977 32.4986 175.2178 53 C 4.7197 8.0336 119.1403 56.8750 31.8100 171.7626 54 P 4.3614 0.0000 0.0000 63.1802 31.8903 177.2334 55 G 3.8942 8.7148 106.1133 46.1439 0.0000 174.6073 56 L 4.0923 7.9971 120.9882 57.2356 41.7329 177.3814 57 I 4.6054 7.1215 114.9448 59.5751 40.9390 173.8165 58 T 4.3665 8.2030 115.3320 60.5107 70.2756 175.2472 59 K 4.1019 8.7447 124.1898 60.0485 31.9013 178.8856 60 E 4.0644 8.2571 117.3905 58.8789 29.5142 177.6836 61 N 4.9580 7.9279 113.9224 52.6941 40.1288 175.4026 62 F 4.9087 7.8292 122.4868 57.5896 37.9477 174.4420 63 I 4.3285 7.9089 118.6447 57.7211 39.9542 176.3018 64 A 4.0419 8.4115 124.2626 51.4515 18.8951 178.2232 65 G 3.7266 7.6057 108.3928 45.7696 0.0000 170.2862 66 V 4.7387 7.2800 118.8736 61.4176 33.5032 175.2536 67 Y 5.2026 8.7608 124.9606 56.1089 42.0104 174.5475 68 K 4.9260 8.8664 121.6386 55.2804 36.0175 174.5872 69 M 4.9228 9.2585 127.3537 53.6864 34.3310 174.6677 70 R 4.8936 8.7727 125.1863 54.6531 32.5693 174.5404 71 F 4.9799 9.4122 125.6548 55.8204 41.3965 175.9711 72 E 4.9690 8.9372 126.2896 55.5070 26.4704 177.3825 73 T 4.1393 8.0169 114.1257 64.5768 69.5108 176.8688 74 G 3.8686 8.3100 108.7810 47.7469 0.0000 175.8412 75 K 4.0777 8.1733 120.8263 58.9121 31.6021 178.6789 76 Y 4.0225 8.1519 119.9977 60.6418 38.6758 178.4187 77 W 4.0480 8.6540 120.1107 59.5867 29.2046 177.8623 78 D 4.4646 8.6195 118.1966 57.6619 40.4178 178.4985 79 A 4.0669 7.9341 119.4027 54.4452 18.3762 178.5284 80 L 4.2942 7.0901 114.5126 54.4038 41.8714 177.6390 81 G 3.9875 8.0483 107.0975 45.6010 0.0000 173.3397 82 E 4.7659 8.2803 117.5756 54.3992 33.0516 175.5314 83 T 4.3839 8.1752 115.4088 61.3273 68.6894 173.3178 84 C 4.3506 7.9589 123.5323 56.8490 34.4470 173.7691 85 F 4.0712 7.9905 128.0041 60.3324 39.0674 174.8391 86 Y 4.4988 7.3148 118.2493 55.2443 39.2314 173.6877 87 P 4.6507 0.0000 0.0000 65.7973 32.6408 175.4641 88 Y 5.3494 7.0515 115.3508 56.2539 41.3933 174.2901 89 V 4.2624 8.9378 119.1811 61.0994 34.5681 173.7155 90 E 5.2406 9.0031 127.0403 54.7058 31.8297 175.2192 91 I 4.5461 8.9372 125.8397 59.7060 39.4978 174.6244 92 V 4.9651 8.6169 127.5710 61.1300 33.2885 174.6644 93 F 5.1817 8.9481 121.7838 55.8889 41.8747 173.0627 94 T 4.9526 8.7218 116.7246 62.2285 70.1875 173.9493 95 I 4.2464 8.9055 128.5521 60.0637 38.2524 176.4457 96 T 4.1436 8.7292 116.8383 61.6895 70.7707 173.5664 97 N 4.6920 7.8766 121.0640 52.1824 37.9478 174.1827 98 T 4.3354 8.1635 116.8179 62.2923 67.6302 175.2650 99 S 4.4219 8.3441 114.4732 60.1477 63.5145 173.8520 100 Q 4.6009 7.5855 118.5067 54.3644 31.0326 173.9418 101 H 4.8549 8.2937 119.0995 55.4941 31.3383 173.7348 102 Y 4.6869 8.7455 123.0874 56.4825 40.8398 173.8618 103 H 5.0558 9.3689 125.3311 54.6654 31.8925 174.0896 104 V 4.0372 8.0375 119.6865 58.4691 31.3176 173.5449 105 P 4.5967 0.0000 0.0000 62.2069 33.1293 176.0741 106 L 4.4855 8.7555 121.7297 53.3195 45.0121 175.0591 107 L 4.8867 9.0590 128.0997 53.3973 43.1543 175.3780 108 L 5.3804 9.2480 127.1604 53.3224 45.1743 175.4414 109 S 5.6860 9.0422 119.9612 56.7077 65.9707 173.8902 110 R 3.0140 8.3514 116.9717 58.4631 29.7382 178.1215 111 F 4.7942 7.8071 114.9858 56.3540 40.1262 174.5986 112 S 4.9149 8.1817 113.1904 58.0627 65.0804 172.7843 113 Y 6.0365 8.0571 118.3138 56.9097 40.6657 173.5878 114 S 4.7839 8.5628 113.6942 57.6567 66.8748 172.3295 115 T 5.1019 8.3434 114.1138 61.2436 70.4235 172.0013 116 Y 4.8657 7.5982 121.8838 55.2129 40.9993 174.2124 117 R 4.1070 8.7553 121.9495 56.2470 30.9429 175.4885 118 G 4.4641 8.9404 113.5156 44.8523 0.0000 172.7029 119 S 4.4669 8.3383 113.2635 58.8573 61.9107 174.6497 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 7 S 8.32 4.42 0.00 3.84 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.44 0.00 1.80 2.19 0.00 3.42 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.91 0.00 9 L 7.22 5.03 0.00 1.13 1.35 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.93 4.88 0.00 3.94 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 11 T 8.17 4.85 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 12 H 8.41 4.90 0.00 3.29 3.07 0.00 5.72 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 9.05 4.60 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 0.57 0.00 0.00 0.99 0.00 0.00 14 L 8.59 5.02 0.00 1.52 1.49 0.77 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.98 5.26 0.00 2.80 2.95 0.00 0.00 6.52 7.42 0.00 0.00 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 8.87 4.16 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.83 0.95 0.00 0.00 17 A 8.57 4.27 1.64 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 0.00 0.00 18 Q 8.17 4.55 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.38 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 19 G 8.48 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.44 4.74 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 0.89 0.00 0.00 0.96 0.00 0.00 21 P 0.00 4.57 0.00 2.23 2.22 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 22 G 9.74 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 23 A 8.56 4.58 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 24 N 8.46 4.23 0.00 2.95 2.96 0.00 0.00 6.88 7.55 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 25 M 8.32 4.53 0.00 2.00 1.72 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.55 0.00 26 T 8.58 4.50 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 1.22 0.00 0.00 27 I 8.69 4.83 1.72 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.08 0.48 0.00 0.00 28 V 8.44 4.58 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 0.81 0.00 0.00 0.85 0.00 0.00 29 L 8.89 4.91 0.00 1.77 1.51 1.19 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 30 H 9.39 5.52 0.00 3.11 3.41 0.00 5.81 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.66 4.80 0.00 1.55 1.52 0.00 2.87 0.00 0.00 2.79 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.00 32 L 7.81 3.80 0.00 0.27 0.78 -0.13 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.41 4.48 0.00 2.58 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.12 0.00 2.12 1.92 0.00 3.70 0.00 0.00 3.65 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 35 V 7.79 3.58 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 0.68 0.00 0.00 0.89 0.00 0.00 36 S 7.34 4.34 0.00 3.93 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 37 S 8.38 4.33 0.00 3.96 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 A 7.57 4.41 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 39 W 8.75 4.87 0.00 3.13 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 40 N 8.88 5.25 0.00 2.59 2.66 0.00 0.00 6.81 7.95 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 41 I 8.48 3.96 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.48 0.84 0.00 0.00 42 L 9.03 4.55 0.00 1.69 1.75 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 T 7.58 4.74 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 44 T 8.56 4.94 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 1.15 0.00 0.00 45 G 9.35 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 0.00 0.00 0.00 0.00 46 I 8.02 5.35 1.87 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 1.39 0.63 0.92 0.00 0.00 47 T 8.87 4.37 4.15 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 1.28 0.00 0.00 48 N 8.82 5.11 0.00 2.95 3.03 0.00 0.00 6.98 8.11 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 49 D 8.69 4.31 0.00 2.69 2.79 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 50 D 8.29 4.62 0.00 2.63 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 51 G 8.41 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 52 R 8.02 5.02 0.00 1.86 1.81 0.00 3.01 0.00 0.00 3.03 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 53 C 8.03 4.72 0.00 2.84 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 54 P 0.00 4.36 0.00 2.20 2.02 0.00 3.86 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 55 G 8.71 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 8.00 4.09 0.00 1.72 1.72 0.91 0.73 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 57 I 7.12 4.61 1.90 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.77 0.67 0.00 0.00 58 T 8.20 4.37 4.27 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 1.23 0.00 0.00 59 K 8.74 4.10 0.00 1.92 1.90 0.00 1.82 0.00 0.00 1.94 0.00 0.00 3.11 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.57 1.68 7.81 60 E 8.26 4.06 0.00 2.02 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 2.40 0.00 61 N 7.93 4.96 0.00 2.77 2.90 0.00 0.00 7.16 6.38 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 62 F 7.83 4.91 0.00 3.07 3.16 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 63 I 7.91 4.33 1.84 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 1.29 0.79 0.93 0.00 0.00 64 A 8.41 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 65 G 7.61 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 0.00 0.00 0.00 66 V 7.28 4.74 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.86 0.00 0.00 67 Y 8.76 5.20 0.00 1.59 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.87 4.93 0.00 1.26 1.00 0.00 1.36 0.00 0.00 0.76 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.98 1.17 7.81 69 M 9.26 4.92 0.00 1.54 2.07 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.47 0.00 70 R 8.77 4.89 0.00 1.73 1.70 0.00 3.04 0.00 0.00 2.95 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 71 F 9.41 4.98 0.00 2.77 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 72 E 8.94 4.97 0.00 2.03 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 2.31 2.46 0.00 73 T 8.02 4.14 4.52 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 1.18 0.00 0.00 74 G 8.31 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.17 4.08 0.00 1.89 1.92 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.57 7.81 76 Y 8.15 4.02 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 W 8.65 4.05 0.00 3.59 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.62 4.46 0.00 2.88 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 79 A 7.93 4.07 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 80 L 7.09 4.29 0.00 1.78 1.67 0.05 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.05 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 0.00 0.00 0.00 82 E 8.28 4.77 0.00 2.19 1.83 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 2.33 2.54 0.00 83 T 8.18 4.38 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 1.18 0.00 0.00 84 C 7.96 4.35 0.00 2.99 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 85 F 7.99 4.07 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.31 4.50 0.00 2.98 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 87 P 0.00 4.65 0.00 2.25 2.32 0.00 3.50 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 88 Y 7.05 5.35 0.00 3.07 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 89 V 8.94 4.26 1.78 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 0.08 0.00 0.00 -0.08 0.00 0.00 90 E 9.00 5.24 0.00 1.91 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 0.00 2.20 2.52 0.00 91 I 8.94 4.55 2.17 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 1.22 0.92 1.08 0.00 0.00 92 V 8.62 4.97 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 1.09 0.00 0.00 0.89 0.00 0.00 93 F 8.95 5.18 0.00 3.10 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 94 T 8.72 4.95 4.31 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 1.23 0.00 0.00 95 I 8.91 4.25 1.77 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.64 0.31 0.00 0.00 96 T 8.73 4.14 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 1.22 0.00 0.00 97 N 7.88 4.69 0.00 2.82 2.94 0.00 0.00 6.89 7.22 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 98 T 8.16 4.34 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 1.20 0.00 0.00 99 S 8.34 4.42 0.00 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 0.00 100 Q 7.59 4.60 0.00 1.80 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 101 H 8.29 4.85 0.00 3.11 3.10 0.00 5.67 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 0.00 102 Y 8.75 4.69 0.00 2.79 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 0.00 103 H 9.37 5.06 0.00 3.16 3.05 0.00 5.54 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.04 4.04 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 0.08 0.00 0.00 0.94 0.00 0.00 105 P 0.00 4.60 0.00 1.86 1.87 0.00 3.34 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.04 0.00 106 L 8.76 4.49 0.00 0.56 0.87 0.46 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 107 L 9.06 4.89 0.00 1.68 1.64 0.99 0.32 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 0.00 108 L 9.25 5.38 0.00 1.62 1.50 1.12 0.65 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 0.00 109 S 9.04 5.69 0.00 3.97 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 0.00 110 R 8.35 3.01 0.00 1.53 1.00 0.00 2.77 0.00 0.00 2.84 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 111 F 7.81 4.79 0.00 2.92 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 S 8.18 4.91 0.00 4.02 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 0.00 113 Y 8.06 6.04 0.00 2.84 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 0.00 114 S 8.56 4.78 0.00 3.90 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.34 5.10 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 1.26 0.00 0.00 116 Y 7.60 4.87 0.00 3.07 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.76 4.11 0.00 1.93 1.99 0.00 3.34 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 118 G 8.94 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.34 4.47 0.00 3.72 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00