NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1318 8.2644 123.5821 50.6387 20.6528 176.0273 2 M 2.8126 8.6535 118.0793 54.6785 32.5803 171.6366 3 A 3.9856 9.6476 130.0272 52.6491 19.2427 177.7636 4 R 4.6217 8.2717 118.2974 55.2710 31.6597 175.9790 5 M 3.7804 8.3417 116.3491 55.8691 31.8000 178.1784 6 S 3.6298 8.9084 113.1593 57.8291 63.3530 171.2334 7 P 4.4483 0.0000 0.0000 64.7312 30.6476 177.8192 8 A 4.0243 7.4738 121.1912 55.6020 18.0767 179.2997 9 D 4.2821 7.9952 116.8861 57.4899 40.8820 178.8630 10 K 3.9183 8.0608 120.0504 59.5297 32.0863 179.1129 11 R 3.9393 7.8101 117.9969 59.1361 30.2232 178.8817 12 K 4.4185 8.1155 119.7578 58.9257 31.8928 179.3650 13 L 4.0116 8.1443 119.5523 57.7904 41.5230 179.5832 14 L 4.0258 8.0787 119.0477 57.6639 41.3954 179.0483 15 D 4.4157 8.4667 119.4315 57.6440 40.7869 178.8376 16 E 4.0128 8.1345 118.5194 59.3574 29.3094 179.3541 17 L 4.1367 7.7027 118.8616 57.8049 41.5386 179.7504 18 R 4.1453 8.1668 118.0257 59.4931 29.8197 179.3628 19 S 4.1682 7.7769 113.1138 61.5463 63.1604 176.5204 20 I 3.9393 8.4797 122.7887 64.5863 36.9362 177.6244 21 Y 4.0762 9.1548 121.4974 61.0588 38.4832 178.0205 22 R 4.0471 8.5102 119.7120 60.2832 30.0183 178.4808 23 T 4.0464 8.1190 115.2402 66.3350 68.1700 176.8646 24 I 3.6812 8.0860 122.2861 64.5554 37.0020 178.4358 25 V 3.1424 7.8874 117.1582 66.0916 31.1709 177.6515 26 L 4.2231 7.6186 117.8026 57.1672 41.9152 178.2900 27 E 4.5457 8.4821 116.3167 56.1074 29.7366 177.3198 28 Y 3.9655 8.8485 122.2962 60.5093 38.9045 176.8293 29 F 4.3428 8.1990 115.2064 57.0277 39.0610 175.3824 30 N 4.6385 7.6559 120.0389 53.3452 37.3625 174.1501 31 T 4.4916 8.1020 105.6499 62.5328 70.5445 175.2394 32 D 4.4917 7.8832 116.6653 54.9247 44.5997 175.2226 33 A 4.1223 8.7651 123.7721 52.3252 19.0017 179.4795 34 K 4.3385 8.2548 121.6387 56.1640 29.3582 178.1743 35 V 3.6200 7.4215 123.1735 66.3874 32.1421 176.1404 36 N 4.2903 8.2083 116.5859 57.0619 38.7181 176.5105 37 E 4.0618 8.1301 119.1315 59.2682 29.7105 179.4825 38 R 3.9399 7.6359 117.4249 59.4618 30.1357 179.1697 39 I 3.7022 9.5656 119.3801 64.1498 36.9170 177.8831 40 D 4.4340 8.5294 119.3210 57.5065 41.0985 177.9913 41 E 4.1018 8.1791 120.9664 58.6502 29.5098 178.6151 42 F 3.8584 8.1689 120.2334 61.3390 39.4003 177.3378 43 V 3.7199 8.7801 118.9012 65.9856 31.2775 178.2812 44 S 4.2144 8.9172 116.0728 61.6241 62.4477 176.7045 45 K 3.9480 8.5229 121.2121 59.3084 31.7588 179.0731 46 A 3.9923 8.0820 121.3944 55.3437 18.0645 179.5748 47 F 4.6612 7.9160 117.4302 61.5230 39.7830 176.8315 48 F 3.5932 9.0819 121.1064 60.7043 38.9157 175.7994 49 A 4.6136 9.1384 119.3296 52.5106 20.5412 177.1431 50 D 4.2617 7.3411 116.5626 56.7856 39.9996 173.5551 51 I 4.3695 7.9038 120.8514 60.0927 39.4119 176.2291 52 S 4.7204 8.2392 118.1497 56.7496 64.0027 174.8228 53 V 3.7010 8.5843 124.9477 66.4882 31.0363 178.4314 54 S 4.2083 8.2112 113.2254 61.6743 62.5245 176.4169 55 Q 4.1866 8.2399 121.5788 58.9568 28.4832 179.0114 56 V 3.8529 7.8262 119.0996 65.9166 31.4812 178.0227 57 L 4.1369 7.9379 118.4249 57.8773 41.4877 179.2595 58 E 4.0088 8.3327 118.4551 59.5897 29.5080 179.4330 59 I 3.8624 8.1450 119.9901 64.4465 36.3181 178.0278 60 H 3.9675 8.8345 119.5824 59.2445 29.7869 177.1720 61 V 3.8348 8.0242 120.2491 66.2511 31.2050 177.6049 62 E 3.9043 8.5736 119.1138 59.1013 29.4566 178.5803 63 L 3.7281 8.1922 120.6684 58.4733 42.1236 178.8311 64 M 4.3794 9.3275 118.8350 58.3536 31.9041 178.2978 65 D 4.3041 8.3524 118.7454 57.6319 41.4287 178.4108 66 T 3.7770 7.9093 116.3564 66.7396 68.3693 176.7003 67 F 4.3565 8.4471 120.0845 60.3791 38.8323 177.5859 68 S 4.1170 8.4330 113.3257 61.5697 62.0637 176.5627 69 K 4.0410 8.0178 120.7236 59.1514 31.6027 179.1683 70 Q 3.9662 7.9838 120.0127 59.3050 29.0010 178.1101 71 L 3.9824 8.3561 120.3298 57.9765 41.4548 179.6273 72 K 3.7347 7.6597 116.8050 59.6641 32.0476 179.0149 73 L 4.1614 7.4354 118.2228 57.8433 41.6593 179.0992 74 E 4.1689 8.4117 118.1526 57.0934 29.3908 177.7448 75 G 3.9625 8.7353 106.7812 46.4766 0.0000 174.4752 76 R 3.8600 8.3653 119.3241 56.2999 28.4234 178.0798 77 S 4.4400 8.4318 112.4837 56.8861 65.9145 175.1516 78 E 4.0305 8.5626 126.7169 58.1084 28.9808 178.5322 79 D 4.3528 7.4193 119.4574 57.5744 41.1643 178.6533 80 I 4.1053 7.1554 119.3177 63.5542 38.0622 177.6178 81 L 2.4654 7.2703 120.5475 57.7128 41.3691 178.5915 82 L 3.9747 9.2464 120.4697 57.6120 41.7739 177.8300 83 D 4.4737 7.9087 117.4990 54.6549 39.8023 177.6176 84 Y 4.6526 8.0950 120.4693 59.7831 37.7874 177.7281 85 R 4.0156 7.6836 117.7808 59.6313 29.2091 178.6566 86 L 4.0290 7.8186 119.1981 57.7820 41.0972 179.5481 87 T 3.2085 7.9745 115.6106 66.3388 68.3621 176.2011 88 L 4.4912 7.6943 122.8089 57.7786 42.0921 178.8648 89 I 3.6972 7.6823 119.5768 64.5819 37.0426 178.2208 90 D 4.4035 8.6072 120.0359 57.1565 40.6225 179.0109 91 V 3.2315 8.1247 119.3438 65.9357 31.6115 178.2928 92 I 3.7832 7.7279 112.4850 63.7433 37.3215 177.9760 93 A 4.0007 8.0421 122.9300 55.1717 17.9250 179.2826 94 H 3.9413 8.0465 114.1528 58.9369 29.0870 177.6307 95 L 3.9544 7.7010 121.0710 59.0942 40.1644 178.9504 96 C 3.9726 7.8996 117.3875 62.6720 28.1837 175.9583 97 E 3.9867 8.0769 120.2748 59.4070 28.7143 179.3117 98 M 4.0272 7.7356 116.8996 58.4601 31.6165 177.9986 99 Y 4.2494 7.1856 117.3367 60.7452 37.9417 178.0830 100 R 3.9171 8.0069 119.6861 59.5876 29.9785 178.8103 101 R 4.0685 7.7399 116.0746 58.5031 30.0293 178.0041 102 S 4.8352 7.4925 113.5772 57.4750 62.9814 173.8522 103 I 4.1514 7.1219 124.4075 59.5876 37.2437 175.1885 104 P 4.4089 0.0000 0.0000 63.6173 30.3949 178.4050 105 R 3.4359 7.4626 110.1585 58.2809 27.2579 175.5849 106 E 4.3887 8.4216 122.5875 57.0461 31.2491 176.2215 107 V 3.7323 6.9980 121.9788 60.6949 31.8000 175.4000 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 A 8.26 4.13 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 2 M 8.65 2.81 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 3 A 9.65 3.99 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 4 R 8.27 4.62 0.00 1.75 1.89 0.00 3.24 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 5 M 8.34 3.78 0.00 2.04 1.84 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.59 0.00 6 S 8.91 3.63 0.00 4.03 3.81 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 7 P 0.00 4.45 0.00 2.26 2.30 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.03 0.00 8 A 7.47 4.02 1.42 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 0.00 0.00 9 D 8.00 4.28 0.00 2.73 2.74 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 10 K 8.06 3.92 0.00 1.81 1.90 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.64 7.81 11 R 7.81 3.94 0.00 2.06 1.97 0.00 3.36 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.67 0.00 12 K 8.12 4.42 0.00 1.98 1.86 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.56 7.81 13 L 8.14 4.01 0.00 1.84 1.70 0.95 0.87 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 14 L 8.08 4.03 0.00 1.86 1.74 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.47 4.42 0.00 2.88 2.74 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 16 E 8.13 4.01 0.00 2.22 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 2.33 2.53 0.00 17 L 7.70 4.14 0.00 1.90 1.74 0.72 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.17 4.15 0.00 2.10 2.01 0.00 3.14 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.01 0.00 19 S 7.78 4.17 0.00 4.01 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 20 I 8.48 3.94 2.25 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.00 1.08 0.00 0.00 21 Y 9.15 4.08 0.00 3.29 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 22 R 8.51 4.05 0.00 1.94 2.18 0.00 3.01 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 23 T 8.12 4.05 4.51 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 1.28 0.00 0.00 24 I 8.09 3.68 2.05 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 1.66 0.82 0.77 0.00 0.00 25 V 7.89 3.14 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 -0.55 0.00 0.00 0.67 0.00 0.00 26 L 7.62 4.22 0.00 1.85 1.78 1.03 1.40 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 27 E 8.48 4.55 0.00 2.04 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 2.29 2.49 0.00 28 Y 8.85 3.97 0.00 2.68 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 29 F 8.20 4.34 0.00 3.15 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.66 4.64 0.00 2.85 2.95 0.00 0.00 7.23 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 31 T 8.10 4.49 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 1.23 0.00 0.00 32 D 7.88 4.49 0.00 2.64 2.65 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 33 A 8.77 4.12 1.29 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 0.00 0.00 34 K 8.25 4.34 0.00 2.04 1.99 0.00 1.41 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.56 7.81 35 V 7.42 3.62 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 1.02 0.00 0.00 0.98 0.00 0.00 36 N 8.21 4.29 0.00 2.79 2.81 0.00 0.00 7.25 7.66 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 37 E 8.13 4.06 0.00 2.06 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 2.40 2.40 0.00 38 R 7.64 3.94 0.00 1.92 2.00 0.00 3.33 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 39 I 9.57 3.70 2.02 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.03 0.85 0.00 0.00 40 D 8.53 4.43 0.00 2.88 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 41 E 8.18 4.10 0.00 2.16 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 2.31 2.20 0.00 42 F 8.17 3.86 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 43 V 8.78 3.72 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 0.94 0.00 0.00 1.05 0.00 0.00 44 S 8.92 4.21 0.00 3.81 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 45 K 8.52 3.95 0.00 1.59 1.75 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.60 7.81 46 A 8.08 3.99 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 47 F 7.92 4.66 0.00 3.02 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 48 F 9.08 3.59 0.00 3.16 3.05 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 0.00 49 A 9.14 4.61 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 50 D 7.34 4.26 0.00 2.63 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 51 I 7.90 4.37 2.01 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.96 0.95 0.00 0.00 52 S 8.24 4.72 0.00 3.87 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 53 V 8.58 3.70 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 1.09 0.00 0.00 1.03 0.00 0.00 54 S 8.21 4.21 0.00 4.12 4.16 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 55 Q 8.24 4.19 0.00 2.32 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 56 V 7.83 3.85 2.36 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 1.14 0.00 0.00 1.20 0.00 0.00 57 L 7.94 4.14 0.00 1.99 1.77 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.33 4.01 0.00 2.25 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 2.37 2.62 0.00 59 I 8.15 3.86 2.27 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.87 1.14 0.00 0.00 60 H 8.83 3.97 0.00 3.44 3.64 0.00 5.80 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 61 V 8.02 3.83 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 0.96 0.00 0.00 1.03 0.00 0.00 62 E 8.57 3.90 0.00 2.11 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 2.27 2.30 0.00 63 L 8.19 3.73 0.00 1.62 1.50 0.64 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 64 M 9.33 4.38 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.32 0.00 65 D 8.35 4.30 0.00 2.91 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 66 T 7.91 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 0.92 0.00 0.00 67 F 8.45 4.36 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 68 S 8.43 4.12 0.00 3.95 4.08 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.02 4.04 0.00 2.00 1.83 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.62 7.81 70 Q 7.98 3.97 0.00 2.31 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.00 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 71 L 8.36 3.98 0.00 1.66 1.70 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.66 3.73 0.00 1.90 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.75 7.81 73 L 7.44 4.16 0.00 1.76 1.73 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.41 4.17 0.00 2.02 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 2.48 2.50 0.00 75 G 8.74 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 76 R 8.37 3.86 0.00 1.78 1.67 0.00 3.23 0.00 0.00 3.12 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 77 S 8.43 4.44 0.00 3.74 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.56 4.03 0.00 1.99 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 2.35 2.36 0.00 79 D 7.42 4.35 0.00 2.51 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 7.16 4.11 1.63 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 2.14 0.71 0.00 0.00 81 L 7.27 2.47 0.00 1.50 1.56 1.02 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 82 L 9.25 3.97 0.00 1.74 1.73 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 83 D 7.91 4.47 0.00 3.11 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 84 Y 8.09 4.65 0.00 3.19 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 85 R 7.68 4.02 0.00 2.04 2.28 0.00 2.82 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.76 0.00 86 L 7.82 4.03 0.00 1.98 1.87 1.06 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.97 3.21 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 0.52 0.00 0.00 88 L 7.69 4.49 0.00 1.19 1.60 0.87 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.68 3.70 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 1.52 0.72 0.92 0.00 0.00 90 D 8.61 4.40 0.00 2.60 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 91 V 8.12 3.23 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 0.16 0.00 0.00 0.26 0.00 0.00 92 I 7.73 3.78 1.91 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 1.78 0.47 0.99 0.00 0.00 93 A 8.04 4.00 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 94 H 8.05 3.94 0.00 3.22 3.36 0.00 5.86 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 95 L 7.70 3.95 0.00 1.75 1.94 1.02 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 96 C 7.90 3.97 0.00 3.23 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 97 E 8.08 3.99 0.00 2.12 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 2.50 2.36 0.00 98 M 7.74 4.03 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.14 0.00 99 Y 7.19 4.25 0.00 3.08 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 0.00 100 R 8.01 3.92 0.00 1.91 2.07 0.00 3.09 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 101 R 7.74 4.07 0.00 2.00 1.98 0.00 3.18 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 102 S 7.49 4.84 0.00 3.99 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 0.00 103 I 7.12 4.15 1.98 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 1.47 0.84 0.93 0.00 0.00 104 P 0.00 4.41 0.00 2.18 2.11 0.00 3.91 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 105 R 7.46 3.44 0.00 1.87 1.96 0.00 3.23 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 106 E 8.42 4.39 0.00 1.90 1.94 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 2.20 2.26 0.00 107 V 7.00 3.73 2.08 0.00 0.00 0.00 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 0.93 0.00 0.00