NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3663 8.2649 123.5819 51.6366 19.9186 177.0201 3 L 4.0102 8.6010 120.9978 56.8247 41.9602 174.3785 4 E 4.6648 7.9285 117.6855 52.8367 30.6753 172.4698 5 P 4.3978 0.0000 0.0000 62.4392 32.1986 177.2464 6 I 3.7400 8.8313 122.4221 60.8543 38.5585 175.0409 7 D 4.4894 8.6288 126.0962 52.8862 41.5739 174.9285 8 Y 5.0763 7.4454 123.2753 56.7601 38.7222 176.4372 9 T 4.4367 7.9139 112.4164 63.9979 70.3182 176.6630 10 T 3.8680 8.2432 118.1796 66.1110 68.7787 174.3806 11 H 5.1354 7.8571 118.2045 55.0388 29.8869 176.2375 12 S 4.2997 8.3219 117.7611 61.4883 62.8281 175.5459 13 R 3.9909 7.9855 119.3868 59.2085 29.2762 178.5883 14 E 4.0356 8.1888 118.9445 59.1071 29.4815 179.2383 15 I 3.9094 7.9676 119.8788 64.6164 37.2450 178.2805 16 D 4.5755 8.6956 119.9633 57.1786 40.7485 178.6143 17 A 4.0105 8.1786 121.3316 55.4540 18.4506 179.6465 18 E 3.9496 8.0343 117.1352 59.4837 29.5219 178.9128 19 Y 4.1714 8.4435 119.9335 60.8187 38.8497 178.2661 20 L 3.6385 8.4825 120.1734 57.5921 41.7224 179.5379 21 K 4.0197 7.7645 119.3580 58.8737 32.0122 179.4062 22 I 3.5986 7.4454 119.4636 64.5989 36.9534 179.0432 23 V 3.6239 7.3537 111.8815 63.7677 31.4358 178.0848 24 R 4.2435 8.1698 116.3015 55.2763 30.5035 176.3172 25 G 3.9807 7.5236 106.8917 46.5569 0.0000 174.0274 26 S 4.4654 7.8465 111.0872 57.4872 63.5161 173.3495 27 D 4.5340 7.6114 121.4416 53.1779 41.9050 173.3880 28 P 4.2293 0.0000 0.0000 65.8939 31.4077 177.9295 29 D 4.3835 8.3562 116.0615 56.0776 40.8385 176.4789 30 T 4.3316 7.9549 116.1811 61.7444 68.8445 173.3352 31 T 4.7009 8.8576 115.3996 60.7628 70.5180 173.5240 32 W 5.3274 7.2700 118.5297 55.5813 31.8395 173.2688 33 L 5.1907 9.4788 122.3323 53.8964 45.8954 174.8541 34 I 5.4943 8.9491 124.5729 59.8004 41.0506 174.3455 35 I 5.1493 9.4242 121.4451 59.8292 40.2754 174.6951 36 S 4.9818 9.0667 118.0133 55.9933 66.3950 171.0807 37 P 4.3634 0.0000 0.0000 62.5598 32.1181 176.2895 38 N 4.6675 9.1068 121.4382 51.5852 39.6744 175.0092 39 A 3.9821 8.6423 119.8316 55.6953 18.3612 178.5208 40 K 4.4049 8.4370 113.4441 56.0556 32.0582 176.8662 41 K 3.8705 7.8333 116.2386 57.9074 30.2016 175.0566 42 E 4.8835 8.1858 116.5849 54.7566 32.4754 175.7544 43 Y 4.8576 9.1208 122.9904 57.9982 39.0279 174.6374 44 E 4.9187 9.0785 119.9188 54.3379 33.8779 172.4707 45 P 4.5979 0.0000 0.0000 63.3817 31.2854 175.6998 46 E 4.5983 9.4039 126.0783 57.7043 31.0764 175.8544 47 S 4.9099 7.8734 111.8539 57.4997 66.6618 172.8147 48 T 4.1190 7.0629 109.5868 59.7698 72.1948 172.6340 49 G 3.5192 5.4666 107.0383 46.4429 0.0000 173.3233 50 S 4.9481 8.9357 111.3669 57.0486 65.0064 174.4008 51 S 4.7190 8.3241 116.4836 57.0256 63.3289 173.8698 52 F 4.2763 9.0838 131.5747 61.6575 39.0175 176.2234 53 H 3.9613 8.3617 116.4345 59.4509 29.9255 176.4717 54 D 4.4415 8.0477 120.0208 57.1724 40.6764 178.1389 55 F 2.3000 7.7560 121.4686 60.9810 38.9098 177.3503 56 L 3.5963 7.1208 115.9624 56.5302 41.3372 178.4026 57 Q 4.3560 7.4684 116.3001 55.3554 29.2582 175.6089 58 L 4.2894 6.7145 119.1596 54.2299 41.9068 176.4484 59 F 3.9258 6.9958 117.7574 56.4757 39.5782 174.5095 60 D 4.6503 9.3902 125.1115 53.2017 41.5757 176.7642 61 E 4.6871 9.0522 123.8174 57.7700 29.9727 177.0392 62 T 4.5532 9.0949 109.9585 61.4176 69.4562 173.8813 63 K 4.7006 7.8531 120.5273 54.7197 36.1160 175.8616 64 V 4.0878 8.4014 122.5230 63.0294 32.2155 175.0101 65 Q 5.1439 9.4714 125.9363 54.7352 34.1538 173.3046 66 Y 5.4462 9.2111 116.4809 56.5677 42.1034 175.1962 67 G 5.1854 9.7779 110.3754 44.6416 0.0000 171.5604 68 L 5.4741 9.3615 123.0294 53.1408 45.5467 175.0593 69 A 5.0298 9.0907 126.9487 50.2612 22.9784 174.3806 70 R 4.8032 8.9635 122.7787 54.8797 31.3724 175.7092 71 V 4.3811 8.8678 125.7521 61.0940 35.8149 174.1649 72 S 5.0970 8.2674 119.2901 54.9140 63.2933 171.7989 73 P 4.2194 0.0000 0.0000 61.4611 31.8406 174.5812 74 P 4.1283 0.0000 0.0000 64.4113 31.2900 176.3902 75 G 3.7270 9.5710 113.5196 45.8670 0.0000 171.6849 76 S 4.5983 7.5893 112.2905 57.1908 66.1147 172.1199 77 D 4.5977 8.5412 115.9776 55.1151 40.9628 176.5119 78 V 3.6459 7.6663 119.2351 62.9095 31.9570 173.7865 79 E 5.0042 8.5124 123.9297 54.5364 31.8700 175.4466 80 K 4.6139 9.1155 123.1453 54.6342 36.1110 174.8883 81 I 4.9569 8.6573 122.7029 59.7805 39.6839 174.3681 82 I 5.2874 8.9398 127.3870 59.1343 41.0441 174.0109 83 I 5.3929 8.9639 122.1673 59.3226 40.8031 174.3106 84 I 5.1199 9.4351 125.1189 59.6734 40.7964 174.7079 85 G 3.2793 9.1882 115.1018 44.2869 0.0000 172.5069 86 W 4.6065 8.6770 135.0000 55.7832 31.9340 174.4721 87 C 4.2455 7.8633 129.2549 56.4047 31.6415 170.9911 88 P 4.3244 0.0000 0.0000 60.3880 32.3810 177.7124 89 D 4.2109 8.4076 120.1383 57.8796 40.7427 178.1181 90 S 4.2712 7.8122 111.4558 59.1741 63.1971 174.2182 91 A 4.6221 7.5596 123.2387 50.1351 19.0557 176.2749 92 P 4.2485 0.0000 0.0000 62.6944 32.7026 176.9604 93 L 3.8855 8.6983 124.5447 58.7105 41.7293 179.5634 94 K 4.0510 8.0076 116.2258 59.6151 32.4349 179.0222 95 T 4.1301 7.8958 109.7437 64.8957 68.7101 176.8326 96 R 3.9974 8.2166 120.6369 58.6675 29.8523 178.3911 97 A 4.2442 7.9272 119.1324 53.6922 18.7439 178.5339 98 S 4.6452 7.7652 112.1956 58.0341 63.5346 175.4504 99 F 4.2513 7.9120 124.8755 61.6650 39.0503 176.5784 100 A 3.7566 8.2888 119.1512 55.2036 18.1478 179.2902 101 A 3.8791 7.8824 118.3673 55.5932 18.5588 179.5783 102 N 4.2878 8.4422 115.2575 56.1138 38.4651 177.6279 103 F 4.2461 8.7255 122.6144 61.0929 39.4059 177.0153 104 A 3.6793 8.0150 120.2935 54.9733 18.1351 179.5274 105 A 3.8190 7.8235 119.1221 55.2492 18.4851 179.8814 106 V 2.8676 7.8117 116.9352 66.0436 31.2386 178.1439 107 A 3.9169 7.6643 119.2142 54.8793 18.1729 178.7522 108 N 4.5621 7.8864 113.8149 54.9324 39.1246 176.4374 109 N 4.7983 8.3840 115.5118 53.0783 40.3270 173.9676 110 L 3.9449 7.3353 118.4360 55.7756 44.9634 176.7579 111 F 4.6164 7.8964 119.8071 56.3609 38.0797 176.5680 112 K 4.1840 7.3910 119.9914 57.7069 32.9439 178.3303 113 G 3.9475 8.7405 109.9687 45.1565 0.0000 173.5163 114 Y 4.3745 7.5141 117.0541 57.3791 38.7126 175.0988 115 H 4.7793 9.4803 118.5105 56.1819 31.0928 175.3034 116 V 4.6679 8.0422 117.4936 60.9741 34.8931 173.8948 117 Q 5.1356 8.9960 128.0071 54.3694 31.5474 174.5463 118 V 4.7194 9.0540 124.9927 61.5613 35.4254 173.8676 119 T 5.1844 8.7482 122.6751 61.9534 70.7954 173.5314 120 A 4.6667 8.7274 126.4370 50.5306 22.6124 176.8178 121 R 3.6799 9.3028 115.3858 55.2128 31.6093 175.1928 122 D 4.5796 7.4670 116.2102 51.7148 42.4470 175.3816 123 E 3.9880 9.2242 118.0977 59.9542 29.3979 179.8019 124 D 4.4077 8.0765 117.1319 57.1380 40.8821 177.1173 125 D 4.6100 8.2724 117.1544 55.0503 41.3705 176.4020 126 L 4.7184 7.6526 119.9972 53.7097 42.3915 177.3593 127 D 4.3669 7.9852 118.4599 53.9287 42.4794 174.2032 128 E 3.9524 8.9356 127.9056 59.8784 29.5952 178.6316 129 N 4.4173 8.2340 115.5305 56.3097 38.6724 176.8306 130 E 3.9547 8.7092 120.0598 59.6352 29.6606 179.3025 131 L 4.1099 8.1248 118.5823 58.1833 41.7562 179.6952 132 L 4.1978 8.2564 118.5690 58.1940 41.2713 179.5516 133 M 4.1855 7.8464 117.8707 57.9913 32.2474 178.5771 134 K 4.1930 8.2141 118.9016 59.5438 32.0096 179.4707 135 I 3.8219 8.1738 119.5692 64.4225 37.0378 178.4138 136 S 4.2577 7.6922 114.9342 60.7455 63.6989 175.2721 137 N 4.7603 7.8242 120.6489 51.1324 35.9539 174.9957 138 A 4.1380 7.4200 126.7638 52.9806 19.1240 176.5906 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 A 8.26 4.37 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 3 L 8.60 4.01 0.00 1.75 1.76 0.93 0.55 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 4 E 7.93 4.66 0.00 1.96 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 2.26 2.39 0.00 5 P 0.00 4.40 0.00 2.11 2.03 0.00 3.77 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 6 I 8.83 3.74 1.82 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.40 0.75 0.00 0.00 7 D 8.63 4.49 0.00 2.71 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 8 Y 7.45 5.08 0.00 2.91 2.86 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 9 T 7.91 4.44 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 1.21 0.00 0.00 10 T 8.24 3.87 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 1.09 0.00 0.00 11 H 7.86 5.14 0.00 3.47 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.32 4.30 0.00 4.13 4.39 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.99 3.99 0.00 2.11 2.27 0.00 3.00 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 14 E 8.19 4.04 0.00 2.29 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 2.43 2.50 0.00 15 I 7.97 3.91 2.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.05 1.10 0.00 0.00 16 D 8.70 4.58 0.00 2.81 2.86 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 17 A 8.18 4.01 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 0.00 0.00 0.00 0.00 0.00 18 E 8.03 3.95 0.00 2.05 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 2.57 2.49 0.00 19 Y 8.44 4.17 0.00 3.18 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 20 L 8.48 3.64 0.00 1.82 1.62 0.95 0.84 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 21 K 7.76 4.02 0.00 1.92 1.79 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.51 7.81 22 I 7.45 3.60 1.92 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.18 0.88 0.00 0.00 23 V 7.35 3.62 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 0.53 0.00 0.00 0.43 0.00 0.00 24 R 8.17 4.24 0.00 1.92 1.89 0.00 3.29 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 25 G 7.52 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 26 S 7.85 4.47 0.00 4.00 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 27 D 7.61 4.53 0.00 2.67 2.47 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 28 P 0.00 4.23 0.00 2.05 2.10 0.00 3.69 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 2.01 2.11 0.00 29 D 8.36 4.38 0.00 2.74 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 30 T 7.95 4.33 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 1.03 0.00 0.00 31 T 8.86 4.70 4.39 0.00 0.00 0.00 0.00 0.00 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 32 W 7.27 5.33 0.00 2.54 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 33 L 9.48 5.19 0.00 1.69 1.49 1.08 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.95 5.49 1.99 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.94 0.87 0.00 0.00 35 I 9.42 5.15 2.33 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 1.88 1.38 1.31 0.00 0.00 36 S 9.07 4.98 0.00 3.94 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 37 P 0.00 4.36 0.00 1.92 1.34 0.00 3.62 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.83 0.00 38 N 9.11 4.67 0.00 2.93 3.26 0.00 0.00 6.57 8.05 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 39 A 8.64 3.98 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 40 K 8.44 4.40 0.00 1.88 1.85 0.00 1.89 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.42 7.81 41 K 7.83 3.87 0.00 1.94 1.95 0.00 1.68 0.00 0.00 1.86 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.41 7.81 42 E 8.19 4.88 0.00 2.02 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 2.44 2.49 0.00 43 Y 9.12 4.86 0.00 3.15 3.10 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 0.00 44 E 9.08 4.92 0.00 2.02 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 2.21 2.30 0.00 45 P 0.00 4.60 0.00 2.01 2.12 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 46 E 9.40 4.60 0.00 1.99 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 2.26 2.25 0.00 47 S 7.87 4.91 0.00 4.10 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 48 T 7.06 4.12 3.79 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 1.08 0.00 0.00 49 G 5.47 3.52 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 0.00 0.00 0.00 50 S 8.94 4.95 0.00 3.98 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 51 S 8.32 4.72 0.00 4.05 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 52 F 9.08 4.28 0.00 3.20 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 53 H 8.36 3.96 0.00 3.39 3.35 0.00 5.79 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 54 D 8.05 4.44 0.00 3.16 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 55 F 7.76 2.30 0.00 1.51 2.49 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 0.00 56 L 7.12 3.60 0.00 1.43 1.40 0.60 0.24 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 57 Q 7.47 4.36 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.10 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 58 L 6.71 4.29 0.00 0.97 1.45 1.24 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 59 F 7.00 3.93 0.00 1.51 1.45 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 60 D 9.39 4.65 0.00 2.62 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 9.05 4.69 0.00 2.24 2.26 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 2.34 2.34 0.00 62 T 9.09 4.55 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 63 K 7.85 4.70 0.00 1.76 1.74 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.39 7.81 64 V 8.40 4.09 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 0.92 0.00 0.00 0.92 0.00 0.00 65 Q 9.47 5.14 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.54 0.00 0.00 0.00 0.00 0.00 2.43 2.70 0.00 66 Y 9.21 5.45 0.00 3.25 3.17 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 67 G 9.78 5.19 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 0.00 68 L 9.36 5.47 0.00 0.91 1.07 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 69 A 9.09 5.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.96 4.80 0.00 1.75 1.81 0.00 3.44 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 71 V 8.87 4.38 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 0.42 0.00 0.00 0.18 0.00 0.00 72 S 8.27 5.10 0.00 3.85 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.22 0.00 2.05 1.98 0.00 3.80 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 74 P 0.00 4.13 0.00 2.18 2.11 0.00 3.82 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 1.99 1.99 0.00 75 G 9.57 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 76 S 7.59 4.60 0.00 3.91 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 77 D 8.54 4.60 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 78 V 7.67 3.65 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 0.94 0.00 0.00 0.91 0.00 0.00 79 E 8.51 5.00 0.00 1.82 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 0.00 2.16 2.40 0.00 80 K 9.12 4.61 0.00 1.56 1.65 0.00 1.24 0.00 0.00 1.35 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.26 1.45 7.81 81 I 8.66 4.96 2.00 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 1.34 1.33 1.04 0.00 0.00 82 I 8.94 5.29 2.04 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.89 1.24 0.00 0.00 83 I 8.96 5.39 2.25 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.70 1.17 0.00 0.00 84 I 9.44 5.12 2.07 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.01 0.63 0.00 0.00 85 G 9.19 3.28 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 86 W 8.68 4.61 0.00 2.61 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 87 C 7.86 4.25 0.00 1.23 1.60 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 88 P 0.00 4.32 0.00 2.23 1.39 0.00 3.54 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.27 0.00 89 D 8.41 4.21 0.00 2.54 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 90 S 7.81 4.27 0.00 4.13 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 91 A 7.56 4.62 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 92 P 0.00 4.25 0.00 2.19 2.02 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.16 0.00 93 L 8.70 3.89 0.00 1.73 1.70 0.91 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.01 4.05 0.00 1.79 1.89 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.51 7.81 95 T 7.90 4.13 4.37 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 1.29 0.00 0.00 96 R 8.22 4.00 0.00 2.04 1.96 0.00 2.97 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.75 0.00 97 A 7.93 4.24 1.37 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 0.00 0.00 98 S 7.77 4.65 0.00 4.10 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 99 F 7.91 4.25 0.00 3.06 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 0.00 100 A 8.29 3.76 1.37 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 0.00 0.00 101 A 7.88 3.88 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 0.00 102 N 8.44 4.29 0.00 2.82 2.82 0.00 0.00 6.74 8.61 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 0.00 103 F 8.73 4.25 0.00 2.12 2.53 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 0.00 0.00 0.00 0.00 104 A 8.02 3.68 1.30 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 0.00 0.00 105 A 7.82 3.82 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.81 2.87 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 0.35 0.00 0.00 0.04 0.00 0.00 107 A 7.66 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 7.89 4.56 0.00 2.67 2.85 0.00 0.00 6.89 8.04 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 0.00 109 N 8.38 4.80 0.00 2.57 2.79 0.00 0.00 6.78 7.85 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 0.00 110 L 7.34 3.94 0.00 0.27 0.78 0.47 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 111 F 7.90 4.62 0.00 3.00 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 0.00 112 K 7.39 4.18 0.00 1.85 1.79 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.40 7.81 113 G 8.74 3.95 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 0.00 0.00 0.00 114 Y 7.51 4.37 0.00 3.29 3.10 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 0.00 115 H 9.48 4.78 0.00 3.04 3.43 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.04 4.67 2.24 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 1.19 0.00 0.00 1.09 0.00 0.00 117 Q 9.00 5.14 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.49 0.00 0.00 0.00 0.00 0.00 2.31 2.00 0.00 118 V 9.05 4.72 2.23 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 0.98 0.00 0.00 1.07 0.00 0.00 119 T 8.75 5.18 4.37 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 1.23 0.00 0.00 120 A 8.73 4.67 1.12 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 0.00 0.00 121 R 9.30 3.68 0.00 1.62 1.77 0.00 2.91 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.24 0.00 122 D 7.47 4.58 0.00 2.86 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 9.22 3.99 0.00 2.03 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 2.52 2.34 0.00 124 D 8.08 4.41 0.00 2.88 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 0.00 125 D 8.27 4.61 0.00 2.69 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 0.00 126 L 7.65 4.72 0.00 1.62 1.48 0.63 0.73 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 0.00 127 D 7.99 4.37 0.00 2.78 2.57 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 0.00 128 E 8.94 3.95 0.00 2.01 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 2.53 2.58 0.00 129 N 8.23 4.42 0.00 2.95 2.89 0.00 0.00 7.04 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 0.00 130 E 8.71 3.95 0.00 2.21 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 0.00 2.51 2.53 0.00 131 L 8.12 4.11 0.00 2.11 2.04 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 132 L 8.26 4.20 0.00 1.97 1.77 1.02 0.62 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 0.00 133 M 7.85 4.19 0.00 2.04 2.31 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.60 0.00 134 K 8.21 4.19 0.00 2.08 1.94 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.76 7.81 135 I 8.17 3.82 2.01 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.78 0.86 0.00 0.00 136 S 7.69 4.26 0.00 4.06 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 0.00 137 N 7.82 4.76 0.00 2.93 2.83 0.00 0.00 6.79 7.23 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 0.00 138 A 7.42 4.14 1.24 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