NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.3335 8.3049 118.1959 54.9096 31.8079 177.3266 1 I 3.6761 8.4195 121.5385 61.1366 36.2743 173.3170 2 Q 5.0887 9.1655 125.0314 54.1082 32.9217 175.2858 3 R 4.7672 8.8197 119.5450 54.6413 34.4689 174.7547 4 T 4.8008 8.9303 118.3396 60.7070 68.2495 172.1485 5 P 4.8696 0.0000 0.0000 62.8852 32.4610 175.8834 6 K 4.5917 9.6387 122.9890 55.9137 34.1177 175.8360 7 I 5.2994 8.1733 122.2645 59.9429 41.1745 174.6984 8 Q 4.7689 9.3392 124.6674 54.1811 32.7571 174.1803 9 V 5.0626 8.5160 123.5713 61.4931 34.0144 173.8754 10 Y 5.3689 8.6018 124.6664 56.9344 41.6932 172.9115 11 S 5.1157 9.0945 114.1786 56.8712 64.9635 174.5168 12 R 4.1204 8.9403 122.4756 59.3763 30.1455 176.4013 13 H 5.1078 8.0352 113.0605 52.7138 31.7015 172.1149 14 P 4.3233 0.0000 0.0000 62.7579 31.5694 176.5315 15 A 4.1963 8.7848 126.2309 52.2967 19.1269 176.5529 16 E 4.6145 8.5421 121.5090 54.0927 32.6236 175.0809 17 N 4.6937 8.8497 121.8071 55.0513 38.9634 175.6589 18 G 3.9588 9.0985 111.8429 45.1223 0.0000 173.3297 19 K 4.4194 7.4768 119.1660 54.2958 33.6035 176.3685 20 S 4.1704 8.2855 118.2221 59.2762 63.3067 172.6863 21 N 4.8332 8.3553 122.3166 53.1882 42.8655 172.1300 22 F 5.1917 8.8543 116.1853 55.7162 42.8747 173.9511 23 L 4.0987 9.1528 126.2789 53.5216 43.3953 174.8596 24 N 5.4785 8.8753 123.5564 51.5416 42.2095 173.0868 25 C 5.2194 9.2280 121.6507 55.3017 46.6596 171.7933 26 Y 5.4716 9.3836 129.1550 56.3476 40.3410 174.5352 27 V 5.1320 8.7478 120.4652 59.7406 34.9073 174.9801 28 S 5.4629 8.6350 118.1492 58.3205 66.9432 174.6041 29 G 4.1285 8.8351 105.8363 47.1119 0.0000 173.2280 30 F 5.6788 7.4038 113.7513 54.9010 41.3200 173.8855 31 H 5.2702 8.5649 117.4162 54.7849 33.2129 171.7159 32 P 4.9769 0.0000 0.0000 62.2150 32.3601 176.2011 33 S 3.9500 8.5068 113.3088 60.5258 63.1827 174.3393 34 D 4.3770 7.9292 121.0974 54.3736 41.3471 174.6712 35 I 4.5687 7.8810 124.7219 59.8898 41.3836 172.9211 36 E 4.5336 8.8214 128.0016 54.3465 31.9979 174.6720 37 V 4.5831 7.9901 126.2974 61.0219 34.2695 174.2276 38 D 4.8798 8.7568 126.4332 52.4688 45.1785 174.3539 39 L 5.0015 8.4026 121.7836 53.2989 44.1049 175.3760 40 L 5.2420 9.1198 123.5002 52.8337 45.4709 175.7562 41 K 3.9285 8.7103 123.1982 54.4825 34.7749 175.7993 42 N 4.3784 9.9558 128.2740 54.4644 36.2870 176.1314 43 G 3.9349 8.4268 104.4898 45.5192 0.0000 173.5710 44 E 4.5965 7.4851 119.3051 53.8153 31.5587 175.4884 45 R 4.2481 8.4490 123.4204 56.4887 30.4899 175.8613 46 I 4.0765 8.7977 127.6346 60.5609 37.3882 175.4516 47 E 4.0341 8.7999 126.0617 59.5988 29.6429 178.9078 48 K 4.2610 7.6334 121.1076 54.9723 30.7318 174.6565 49 V 4.4549 7.7101 120.1048 60.9663 33.7055 174.4547 50 E 4.6624 8.3709 127.0384 55.1009 32.6213 174.1062 51 H 5.7144 7.9814 114.7739 54.1766 31.5688 173.1553 52 S 4.6236 8.4671 114.5673 57.4627 64.6570 173.2941 53 D 4.4760 8.4606 120.2959 53.5624 41.1522 176.4102 54 L 4.0248 8.4069 126.0172 55.9944 42.8475 175.7628 55 S 4.6592 8.1259 119.6038 57.3590 66.6708 171.7408 56 F 5.3250 7.4989 115.3665 55.7529 41.1286 173.9812 57 S 4.6996 9.1511 116.6484 56.6147 64.4626 175.2853 58 K 3.5695 8.5746 122.0849 59.6777 31.5724 176.7122 59 D 4.4348 7.7970 114.8582 52.8944 39.5660 176.9724 60 W 3.6402 8.0102 119.9017 56.5156 27.8207 174.5896 61 S 4.3458 8.0054 114.2406 58.1304 64.0286 174.0451 62 F 4.9395 8.4642 121.5729 57.2200 40.6614 174.1751 63 Y 5.4937 8.2142 117.1742 55.9995 41.4727 173.9507 64 L 5.1414 9.5148 121.2910 53.3067 47.2132 174.5408 65 L 5.3832 8.8319 123.8678 53.8250 44.4857 174.5239 66 Y 5.1996 9.2436 124.7526 56.6670 40.4998 174.4448 67 Y 5.4277 8.5734 120.5446 56.5695 41.9572 173.4596 68 T 5.0324 8.8256 114.1602 60.8108 71.4274 172.3588 69 E 4.2986 8.8184 127.9099 56.3787 30.5145 175.6423 70 F 4.7759 8.8913 119.2753 56.2552 41.7600 173.3234 71 T 4.5247 8.1316 117.5153 60.7732 69.6474 172.2491 72 P 4.5189 0.0000 0.0000 62.8943 32.7700 175.5247 73 T 5.0194 8.3929 110.1782 59.6586 72.1807 173.5020 74 E 4.1214 8.9528 122.0270 58.5037 29.6579 177.3437 75 K 4.5265 7.8738 114.8557 56.2316 33.9261 176.0585 76 D 4.5872 7.9117 119.5622 54.1102 41.4133 175.2286 77 E 4.7794 9.2002 123.6294 55.0927 31.5360 174.6653 78 Y 5.2561 8.8318 121.3733 56.6006 41.4813 174.4486 79 A 5.0986 8.6727 122.1293 51.3179 23.7630 174.1030 80 C 5.3049 9.3313 119.6921 54.7304 47.6000 172.5716 81 R 5.0806 9.0265 126.9383 54.5705 32.0583 174.4315 82 V 4.8834 9.0415 126.6862 61.0315 34.7794 173.6685 83 N 5.2551 8.9060 125.1669 52.2561 42.4128 172.4060 84 H 5.0635 8.4984 123.3393 54.8211 33.2703 174.4419 85 V 3.6695 8.1729 115.6150 64.3335 31.7749 177.7945 86 T 4.1403 7.9844 108.7080 62.6115 69.3373 173.7539 87 L 4.8566 7.6171 123.4210 53.0254 42.6189 176.6784 88 S 4.2995 8.7155 119.2375 59.8223 63.6802 174.1698 89 Q 4.6231 7.6335 120.5726 52.9305 31.3824 172.9172 90 P 4.5011 0.0000 0.0000 63.1204 32.4823 174.9877 91 C 4.6816 9.3243 123.7731 57.8356 33.5842 172.3174 92 I 4.8130 8.3963 127.1641 59.6345 38.7667 175.0622 93 V 4.4177 8.8541 127.7481 60.8995 33.7216 174.9395 94 K 4.7834 8.7456 127.4372 55.8638 33.1456 176.3825 95 W 4.6736 9.1778 134.6747 57.0277 31.7864 175.0363 96 D 4.4518 8.0764 125.8143 51.7175 43.0557 176.5904 97 R 3.4369 7.6892 122.9541 58.3577 29.4695 176.5186 98 D 4.8985 8.0214 117.2876 53.8993 41.5227 175.8215 99 M 4.3688 7.7257 122.5003 55.1349 33.1184 175.0671 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 0 M 8.30 4.33 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 1 I 8.42 3.68 1.82 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 0.13 0.90 0.00 0.00 2 Q 9.17 5.09 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.56 0.00 3 R 8.82 4.77 0.00 1.91 1.89 0.00 3.17 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 4 T 8.93 4.80 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 1.26 0.00 0.00 5 P 0.00 4.87 0.00 2.00 1.71 0.00 3.79 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.75 0.00 6 K 9.64 4.59 0.00 1.81 1.82 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.48 7.81 7 I 8.17 5.30 1.92 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 1.33 0.60 0.97 0.00 0.00 8 Q 9.34 4.77 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 9 V 8.52 5.06 2.34 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 0.93 0.00 0.00 1.12 0.00 0.00 10 Y 8.60 5.37 0.00 3.19 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 11 S 9.09 5.12 0.00 4.25 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 0.00 12 R 8.94 4.12 0.00 1.84 2.03 0.00 3.04 0.00 0.00 2.99 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.46 0.00 13 H 8.04 5.11 0.00 3.24 3.21 0.00 5.77 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.32 0.00 2.10 2.07 0.00 3.78 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 2.08 2.16 0.00 15 A 8.78 4.20 1.59 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 0.00 0.00 16 E 8.54 4.61 0.00 1.97 1.82 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 2.30 2.51 0.00 17 N 8.85 4.69 0.00 2.72 2.80 0.00 0.00 7.29 7.65 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 18 G 9.10 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 0.00 0.00 0.00 19 K 7.48 4.42 0.00 1.80 1.69 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.72 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.32 7.81 20 S 8.29 4.17 0.00 3.77 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.36 4.83 0.00 2.59 2.37 0.00 0.00 7.02 7.87 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 22 F 8.85 5.19 0.00 2.98 2.87 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 23 L 9.15 4.10 0.00 0.27 0.90 -0.17 -0.10 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 24 N 8.88 5.48 0.00 1.63 2.11 0.00 0.00 5.98 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 25 C 9.23 5.22 0.00 2.94 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 26 Y 9.38 5.47 0.00 3.36 3.19 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 27 V 8.75 5.13 1.96 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 0.67 0.00 0.00 1.16 0.00 0.00 28 S 8.64 5.46 0.00 3.88 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 29 G 8.84 4.13 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 30 F 7.40 5.68 0.00 3.00 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 31 H 8.56 5.27 0.00 3.31 3.24 0.00 5.86 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.98 0.00 2.17 2.18 0.00 3.91 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 2.02 2.01 0.00 33 S 8.51 3.95 0.00 3.33 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 34 D 7.93 4.38 0.00 2.64 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 35 I 7.88 4.57 1.65 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.61 0.83 0.00 0.00 36 E 8.82 4.53 0.00 1.99 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 37 V 7.99 4.58 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 0.42 0.00 0.00 0.43 0.00 0.00 38 D 8.76 4.88 0.00 2.52 2.42 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 0.00 0.00 0.00 0.00 39 L 8.40 5.00 0.00 1.56 1.52 0.87 0.53 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 40 L 9.12 5.24 0.00 1.69 1.51 0.89 0.35 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 41 K 8.71 3.93 0.00 1.79 1.61 0.00 1.91 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.13 0.89 7.81 42 N 9.96 4.38 0.00 2.79 2.83 0.00 0.00 7.07 7.47 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 43 G 8.43 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 0.00 0.00 0.00 44 E 7.49 4.60 0.00 2.17 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 2.21 2.18 0.00 45 R 8.45 4.25 0.00 1.75 1.84 0.00 3.21 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 46 I 8.80 4.08 1.93 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 1.36 0.80 0.93 0.00 0.00 47 E 8.80 4.03 0.00 1.96 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 2.32 2.35 0.00 48 K 7.63 4.26 0.00 1.75 1.77 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.42 7.81 49 V 7.71 4.45 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 0.95 0.00 0.00 1.00 0.00 0.00 50 E 8.37 4.66 0.00 1.16 1.43 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 2.11 2.09 0.00 51 H 7.98 5.71 0.00 2.26 2.08 0.00 5.13 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.47 4.62 0.00 3.98 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 0.00 53 D 8.46 4.48 0.00 2.69 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 54 L 8.41 4.02 0.00 1.60 1.58 0.70 0.61 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 55 S 8.13 4.66 0.00 3.63 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 56 F 7.50 5.32 0.00 2.80 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 57 S 9.15 4.70 0.00 4.07 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 58 K 8.57 3.57 0.00 1.59 1.76 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.29 7.81 59 D 7.80 4.43 0.00 2.82 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 W 8.01 3.64 0.00 3.22 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 61 S 8.01 4.35 0.00 3.84 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 62 F 8.46 4.94 0.00 1.59 2.50 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 63 Y 8.21 5.49 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 64 L 9.51 5.14 0.00 1.87 1.63 1.14 0.43 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 65 L 8.83 5.38 0.00 2.11 1.72 1.09 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.24 5.20 0.00 3.11 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 67 Y 8.57 5.43 0.00 2.97 2.96 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 68 T 8.83 5.03 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 1.13 0.00 0.00 69 E 8.82 4.30 0.00 1.75 1.74 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 2.10 1.95 0.00 70 F 8.89 4.78 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 71 T 8.13 4.52 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 1.11 0.00 0.00 72 P 0.00 4.52 0.00 2.19 1.80 0.00 3.30 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.43 0.00 73 T 8.39 5.02 4.30 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 1.26 0.00 0.00 74 E 8.95 4.12 0.00 1.98 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 2.32 2.36 0.00 75 K 7.87 4.53 0.00 1.79 1.83 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.45 7.81 76 D 7.91 4.59 0.00 2.83 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.20 4.78 0.00 1.86 1.88 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 2.30 2.44 0.00 78 Y 8.83 5.26 0.00 3.06 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 79 A 8.67 5.10 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 80 C 9.33 5.30 0.00 2.97 2.94 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 81 R 9.03 5.08 0.00 1.84 1.69 0.00 3.05 0.00 0.00 3.05 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 82 V 9.04 4.88 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 0.70 0.00 0.00 0.82 0.00 0.00 83 N 8.91 5.26 0.00 2.69 2.52 0.00 0.00 6.41 7.51 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 84 H 8.50 5.06 0.00 3.04 3.00 0.00 5.73 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 85 V 8.17 3.67 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 0.72 0.00 0.00 0.82 0.00 0.00 86 T 7.98 4.14 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 1.40 0.00 0.00 87 L 7.62 4.86 0.00 1.80 1.85 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.72 4.30 0.00 3.98 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 89 Q 7.63 4.62 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.99 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 90 P 0.00 4.50 0.00 1.95 1.94 0.00 3.68 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 91 C 9.32 4.68 0.00 2.93 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 92 I 8.40 4.81 1.88 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 1.22 1.01 0.92 0.00 0.00 93 V 8.85 4.42 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 1.14 0.00 0.00 0.96 0.00 0.00 94 K 8.75 4.78 0.00 1.74 1.81 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.49 1.48 7.81 95 W 9.18 4.67 0.00 3.29 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.08 4.45 0.00 2.54 2.30 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 97 R 7.69 3.44 0.00 1.87 1.47 0.00 3.00 0.00 0.00 3.13 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.48 0.00 98 D 8.02 4.90 0.00 2.59 2.60 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 99 M 7.73 4.37 0.00 2.00 1.83 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00