NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3553 8.3044 118.7945 54.3876 32.1417 172.6955 2 V 3.6189 7.8463 121.4144 62.0177 31.7340 173.4402 3 K 4.6818 9.3051 128.6665 54.8639 35.1650 175.2448 4 L 5.2229 8.4748 123.5614 53.1722 45.3106 175.2850 5 M 4.6249 9.2462 123.8601 53.9846 34.7035 174.6473 6 I 4.8179 8.1996 126.4279 58.2729 37.9949 174.1520 7 I 3.9985 7.9760 126.6718 61.0478 38.6399 174.2256 8 E 4.9059 8.7877 125.8812 54.8954 31.0900 175.5219 9 G 4.2480 9.1362 110.9774 44.2345 0.0000 170.9324 10 E 5.1704 8.4132 120.4665 53.6931 32.8157 175.2045 11 V 3.8657 8.7909 127.7887 63.3743 32.4014 175.1606 12 V 4.9477 8.3936 120.6433 59.7243 35.3138 175.8298 13 S 4.6154 8.8669 118.9861 57.8514 64.2606 174.0773 14 G 4.2531 7.9725 109.6944 44.5836 0.0000 172.9596 15 L 4.1917 8.4135 121.1132 55.1807 41.6295 177.9764 16 G 3.9783 8.1981 106.9470 46.4467 0.0000 175.2615 17 E 4.2753 8.5933 121.3383 59.5178 29.3190 179.5881 18 G 3.6630 8.1484 104.6835 48.0961 0.0000 175.6755 19 R 4.0944 7.9708 119.9051 58.5934 30.5065 177.5922 20 Y 4.1715 7.6301 118.9173 60.7853 38.7401 177.8338 21 F 3.9644 7.9577 118.3453 60.5254 39.1528 177.3015 22 L 4.4103 8.2374 117.9853 55.8437 41.5719 177.9849 23 S 5.0182 7.4369 113.2953 60.0896 62.6756 174.8867 24 L 3.4049 7.3621 121.9321 53.3622 41.8431 175.5773 25 P 4.0422 0.0000 0.0000 65.0820 31.4018 176.3229 26 P 4.0385 0.0000 0.0000 66.1634 30.6138 177.9579 27 Y 3.6586 7.0300 116.2483 60.1863 37.7519 177.7995 28 K 3.8279 8.5631 121.5931 59.9394 31.9803 178.2128 29 E 3.9143 8.9658 119.2681 58.6853 29.5663 178.7012 30 I 3.6610 7.2136 118.5437 63.5643 37.8925 178.0017 31 F 4.4070 7.6950 118.9978 60.1376 38.7572 177.1983 32 K 4.2259 7.4687 120.3612 59.0900 31.6655 177.9072 33 K 3.7415 7.4766 117.8222 60.1831 32.0524 178.2095 34 I 3.8560 7.8657 119.6315 63.9302 36.5455 177.7979 35 L 4.4569 8.7489 118.6199 53.2201 42.3089 176.8577 36 G 3.9554 8.4671 107.4001 45.6098 0.0000 173.2614 37 F 4.7480 6.8515 108.1516 55.4594 40.6600 172.9406 38 E 4.4698 8.7724 123.2788 54.4383 29.2854 174.1709 39 P 4.8492 0.0000 0.0000 62.7178 32.0518 176.0447 40 Y 4.2147 9.1719 123.7251 57.8526 39.4517 176.6450 41 E 4.1058 7.3465 125.0895 54.3051 28.1248 176.2649 42 G 4.5779 7.0912 114.1466 45.2635 0.0000 169.1230 43 T 4.7835 7.8396 109.1179 59.5215 71.9815 173.5487 44 L 4.3502 9.1406 127.2256 54.2519 43.2131 175.0767 45 N 5.0842 8.6678 125.1076 52.6779 40.0980 174.2275 46 L 5.1584 9.1681 124.1113 52.6445 45.4687 175.5631 47 K 4.4522 8.9604 125.8441 55.7102 32.9882 176.0307 48 L 4.9211 8.9664 128.5210 53.4755 42.9891 176.8726 49 D 4.4733 8.7496 119.8797 54.8067 39.9756 176.1233 50 R 4.7076 7.6408 114.2200 53.6866 32.3675 174.4318 51 E 4.4221 8.4866 117.1705 56.0530 30.4540 176.1412 52 F 4.8886 8.8702 125.8351 56.8145 41.1321 174.5208 53 D 4.6338 7.6773 124.5693 52.5144 42.4240 175.1840 54 I 4.0305 8.2821 126.0950 62.7026 38.5175 176.8552 55 N 4.7751 8.1943 116.2802 55.3157 38.5741 175.0504 56 K 4.3325 7.7945 116.9340 56.5856 32.9421 175.9575 57 F 5.1276 7.6607 116.2256 56.8486 43.2374 175.4422 58 K 4.4327 8.3916 125.0440 55.5486 29.8014 175.2286 59 Y 4.8942 7.7102 121.8845 55.1744 41.2876 176.1490 60 I 4.4441 9.1714 121.3659 59.3964 38.7871 175.2534 61 E 4.9069 9.0513 126.7398 56.6447 30.0055 176.2135 62 T 4.9338 8.7010 112.2389 59.6670 72.9363 172.7934 63 E 4.3593 8.7113 120.2244 55.9647 31.4974 175.4361 64 D 4.9699 8.3943 120.3457 53.7965 43.7782 174.7932 65 F 4.9342 8.0860 113.6983 57.0886 41.6951 172.6086 66 E 4.9466 9.1797 115.8852 54.4152 32.0234 174.7058 67 F 4.8969 9.1818 124.0850 57.8787 42.8501 174.4047 68 N 3.5347 8.8617 123.6651 54.3772 36.6612 173.4159 69 G 3.4898 7.5718 109.3055 46.1830 0.0000 173.5563 70 K 3.7444 7.8476 125.8467 55.7701 30.7312 174.5262 71 R 4.6528 7.7800 118.7510 55.8702 31.8003 176.9748 72 F 4.3967 8.2069 122.7370 55.9140 43.3403 174.3107 73 F 5.5442 7.7110 124.5606 56.7826 41.3180 174.8856 74 G 4.5686 8.8563 108.5837 44.6420 0.0000 172.7280 75 V 4.5040 8.3447 115.1501 59.6531 35.1673 175.0988 76 K 4.6633 8.5635 121.5888 55.3769 33.1683 176.2052 77 V 4.6849 8.8165 126.2299 61.6015 34.0756 174.9760 78 L 4.8978 8.7543 128.8571 53.0376 44.8794 173.3647 79 P 5.0158 0.0000 0.0000 63.1139 32.6264 175.2944 80 I 4.6946 8.3287 114.0974 60.1295 41.7345 173.2042 81 K 4.9830 8.7451 121.0256 54.6405 35.4939 175.5998 82 I 4.5736 9.0908 124.6533 59.6431 40.0914 174.7242 83 L 4.8460 8.5481 127.9465 52.5099 43.0837 175.6927 84 I 4.0062 7.8680 126.0370 58.6976 38.6856 176.3756 85 G 3.7575 8.6476 119.6118 46.8525 0.0000 174.8001 86 N 4.4116 8.8199 122.0868 55.0996 38.8515 175.0888 87 K 4.4094 7.5528 117.9709 56.1188 33.3547 175.8853 88 K 4.9271 7.8375 120.5866 55.2778 31.7509 175.1552 89 I 4.1121 8.7446 125.1284 60.5803 38.9082 175.4329 90 D 4.7154 8.4883 124.9839 54.6519 42.0651 176.5232 91 G 4.2861 8.4230 105.6601 46.9121 0.0000 171.7168 92 A 4.9207 8.4117 119.6273 50.9569 23.4121 176.2132 93 I 4.4721 8.8055 121.9952 60.2503 38.6685 175.4710 94 V 4.3900 8.0266 121.6734 60.0025 32.7631 176.2752 95 V 4.2090 8.7779 127.6306 60.3734 32.5079 173.7016 96 P 4.6574 0.0000 0.0000 62.1246 31.8529 177.0234 97 K 4.1281 8.4325 120.4299 57.8846 32.5471 176.8875 98 K 4.4949 7.7212 118.8695 55.1932 34.8079 174.7420 99 T 4.5082 8.0657 119.1702 60.6255 70.4777 172.8587 100 Y 4.7157 8.2570 122.0270 58.7447 38.5004 175.5970 101 H 4.8203 7.4998 115.8098 53.9480 30.1711 175.3422 102 S 4.4110 8.4441 115.5246 58.2515 63.4473 175.3048 103 S 4.4100 8.5669 114.8684 60.3484 63.0799 175.4856 104 E 4.3514 7.9282 120.4879 57.6432 29.6354 175.7209 105 I 5.0155 7.3847 120.2943 59.2668 39.2459 175.1385 106 I 4.5730 8.5988 119.5682 58.9937 41.6374 174.0275 107 E 4.9445 8.4905 122.3459 54.8467 31.9455 174.8614 108 I 4.7934 8.7633 126.8272 59.9016 39.2475 175.1736 109 I 4.8653 8.4897 119.7963 59.5107 40.7486 174.0914 110 A 4.7821 8.0626 122.5701 51.1480 21.7411 175.5609 111 P 4.1423 0.0000 0.0000 63.7497 31.8890 175.8219 112 M 4.6239 7.5198 114.8732 52.4607 34.1402 175.5311 113 K 3.2438 7.9055 119.2278 55.4769 32.1901 177.0266 114 L 4.2795 8.2190 128.2162 57.6311 41.6268 179.7996 115 R 3.9633 7.7401 118.2226 59.0095 30.3244 178.6272 116 E 3.8717 7.8609 116.9115 59.5234 29.6534 178.9134 117 Q 3.7723 7.5431 118.0198 57.7693 28.7496 177.5294 118 F 4.6212 7.2179 114.1496 56.1743 39.9422 175.3411 119 N 4.1185 7.3804 117.0456 54.4196 37.2805 174.2333 120 L 4.5457 7.9463 117.7350 53.5834 43.1637 177.6199 121 K 4.4963 9.2607 123.4915 54.8745 34.5358 175.7237 122 D 4.4768 8.3126 119.9203 55.9893 41.2039 175.5461 123 G 4.1747 9.3386 111.7733 45.0619 0.0000 174.0026 124 D 4.4069 7.5539 118.9832 55.1313 41.9335 176.2846 125 V 4.7377 8.3341 122.6784 61.5298 33.0111 174.7257 126 I 4.6609 8.5509 120.1660 59.1142 41.4745 174.2431 127 K 5.1358 8.3555 121.2075 54.7316 34.7834 175.5673 128 I 4.9575 8.5949 115.1460 59.1391 41.2240 173.7202 129 L 4.9763 9.1904 128.2090 53.6525 43.9467 174.8508 130 I 4.5413 8.7655 128.1302 59.5919 38.9757 174.8451 131 K 4.6087 8.7749 128.7771 56.0149 33.4029 178.4247 132 G 3.9079 9.0864 115.5007 47.4886 0.0000 172.3243 133 D 4.5889 7.5481 119.1176 54.3140 44.2690 172.8572 134 K 4.4347 8.4251 113.1810 59.8875 34.4719 177.3250 135 D 4.4528 8.0022 117.8189 57.6586 41.1517 176.6910 136 E 4.1521 7.9514 121.3769 56.6811 29.5101 176.9143 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 M 8.30 4.36 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 2 V 7.85 3.62 2.09 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 0.94 0.00 0.00 0.94 0.00 0.00 3 K 9.31 4.68 0.00 2.00 1.73 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.75 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.45 1.02 7.81 4 L 8.47 5.22 0.00 1.49 1.55 0.93 0.89 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 5 M 9.25 4.62 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 6 I 8.20 4.82 1.88 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 1.36 1.42 0.89 0.00 0.00 7 I 7.98 4.00 1.83 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.79 0.86 0.00 0.00 8 E 8.79 4.91 0.00 1.83 1.85 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 2.36 2.27 0.00 9 G 9.14 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 0.00 0.00 0.00 0.00 10 E 8.41 5.17 0.00 2.04 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 2.17 2.23 0.00 11 V 8.79 3.87 2.22 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 0.70 0.00 0.00 0.97 0.00 0.00 12 V 8.39 4.95 2.09 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 0.74 0.00 0.00 0.96 0.00 0.00 13 S 8.87 4.62 0.00 3.87 3.80 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 14 G 7.97 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 0.00 0.00 0.00 0.00 15 L 8.41 4.19 0.00 1.95 1.77 0.96 1.07 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 16 G 8.20 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 17 E 8.59 4.28 0.00 2.22 2.33 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 2.55 2.61 0.00 18 G 8.15 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 0.00 0.00 0.00 19 R 7.97 4.09 0.00 1.91 2.02 0.00 3.25 0.00 0.00 3.14 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 20 Y 7.63 4.17 0.00 3.10 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 21 F 7.96 3.96 0.00 3.18 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 22 L 8.24 4.41 0.00 1.68 1.74 0.95 0.86 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 23 S 7.44 5.02 0.00 4.04 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 24 L 7.36 3.40 0.00 1.37 0.85 -0.18 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.04 0.00 1.94 2.09 0.00 2.20 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 2.11 2.06 0.00 26 P 0.00 4.04 0.00 0.49 1.29 0.00 2.71 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.90 0.00 27 Y 7.03 3.66 0.00 2.97 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 28 K 8.56 3.83 0.00 1.74 1.80 0.00 1.54 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.50 7.81 29 E 8.97 3.91 0.00 1.77 1.85 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 2.23 2.31 0.00 30 I 7.21 3.66 1.67 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 1.42 1.10 0.42 0.00 0.00 31 F 7.69 4.41 0.00 3.02 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.47 4.23 0.00 1.90 1.92 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.33 7.81 33 K 7.48 3.74 0.00 1.84 1.92 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.48 7.81 34 I 7.87 3.86 1.93 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 1.55 0.80 0.95 0.00 0.00 35 L 8.75 4.46 0.00 1.03 1.07 0.46 1.22 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 36 G 8.47 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 37 F 6.85 4.75 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 38 E 8.77 4.47 0.00 2.10 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 2.40 2.35 0.00 39 P 0.00 4.85 0.00 2.15 2.05 0.00 3.82 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.93 0.00 40 Y 9.17 4.21 0.00 3.05 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 41 E 7.35 4.11 0.00 1.61 1.68 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 2.22 2.08 0.00 42 G 7.09 4.58 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 0.00 0.00 0.00 43 T 7.84 4.78 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 1.18 0.00 0.00 44 L 9.14 4.35 0.00 1.73 1.56 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 45 N 8.67 5.08 0.00 2.99 2.72 0.00 0.00 6.84 6.74 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 46 L 9.17 5.16 0.00 1.40 1.44 0.82 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.96 4.45 0.00 1.81 1.68 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.41 7.81 48 L 8.97 4.92 0.00 1.77 1.59 0.81 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 49 D 8.75 4.47 0.00 2.79 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 50 R 7.64 4.71 0.00 1.93 1.98 0.00 3.11 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 51 E 8.49 4.42 0.00 1.92 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 2.49 2.33 0.00 52 F 8.87 4.89 0.00 2.96 3.07 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 0.00 0.00 0.00 53 D 7.68 4.63 0.00 2.54 2.33 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 54 I 8.28 4.03 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.35 0.63 0.00 0.00 55 N 8.19 4.78 0.00 2.88 2.92 0.00 0.00 6.93 7.61 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 56 K 7.79 4.33 0.00 1.53 1.69 0.00 1.29 0.00 0.00 1.42 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 0.25 7.81 57 F 7.66 5.13 0.00 3.38 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 58 K 8.39 4.43 0.00 2.03 1.81 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.36 7.81 59 Y 7.71 4.89 0.00 3.19 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 60 I 9.17 4.44 1.98 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.82 0.97 0.00 0.00 61 E 9.05 4.91 0.00 2.13 2.03 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 2.46 2.63 0.00 62 T 8.70 4.93 4.32 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 63 E 8.71 4.36 0.00 2.06 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 2.31 2.32 0.00 64 D 8.39 4.97 0.00 2.78 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 65 F 8.09 4.93 0.00 3.06 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 66 E 9.18 4.95 0.00 2.31 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 2.16 1.83 0.00 67 F 9.18 4.90 0.00 3.33 3.47 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 68 N 8.86 3.53 0.00 1.83 2.52 0.00 0.00 7.15 7.98 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 69 G 7.57 3.49 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 0.00 0.00 0.00 70 K 7.85 3.74 0.00 1.91 1.73 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.35 7.81 71 R 7.78 4.65 0.00 1.64 1.54 0.00 3.21 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 72 F 8.21 4.40 0.00 1.51 2.55 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 0.00 0.00 0.00 0.00 73 F 7.71 5.54 0.00 3.00 2.92 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 0.00 0.00 0.00 0.00 74 G 8.86 4.57 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 0.00 0.00 0.00 75 V 8.34 4.50 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 0.62 0.00 0.00 1.13 0.00 0.00 76 K 8.56 4.66 0.00 1.53 1.31 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.62 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.22 1.23 7.81 77 V 8.82 4.68 2.21 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 0.91 0.00 0.00 1.14 0.00 0.00 78 L 8.75 4.90 0.00 1.86 1.49 1.08 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 5.02 0.00 2.15 2.07 0.00 3.86 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 80 I 8.33 4.69 1.93 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 1.09 0.44 0.86 0.00 0.00 81 K 8.75 4.98 0.00 1.69 1.67 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.37 7.81 82 I 9.09 4.57 1.72 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 1.13 0.73 0.80 0.00 0.00 83 L 8.55 4.85 0.00 1.51 1.53 0.88 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.87 4.01 1.19 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.61 0.73 0.00 0.00 85 G 8.65 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 86 N 8.82 4.41 0.00 2.67 2.85 0.00 0.00 6.84 6.68 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 87 K 7.55 4.41 0.00 1.80 1.72 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.70 7.81 88 K 7.84 4.93 0.00 1.66 1.62 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 1.42 7.81 89 I 8.74 4.11 1.74 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.69 0.84 0.00 0.00 90 D 8.49 4.72 0.00 2.39 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 91 G 8.42 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 0.00 0.00 0.00 0.00 92 A 8.41 4.92 1.14 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 0.00 0.00 93 I 8.81 4.47 1.79 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 0.98 0.43 0.81 0.00 0.00 94 V 8.03 4.39 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 0.17 0.00 0.00 0.82 0.00 0.00 95 V 8.78 4.21 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 0.97 0.00 0.00 1.02 0.00 0.00 96 P 0.00 4.66 0.00 1.99 1.81 0.00 3.71 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 1.92 1.91 0.00 97 K 8.43 4.13 0.00 1.74 1.85 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.41 7.81 98 K 7.72 4.49 0.00 1.69 1.62 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.12 1.29 7.81 99 T 8.07 4.51 4.10 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 1.19 0.00 0.00 100 Y 8.26 4.72 0.00 3.05 2.92 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 0.00 0.00 0.00 0.00 101 H 7.50 4.82 0.00 3.28 3.36 0.00 5.58 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.44 4.41 0.00 4.19 4.10 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 0.00 103 S 8.57 4.41 0.00 4.09 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 0.00 104 E 7.93 4.35 0.00 2.21 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 2.50 0.00 105 I 7.38 5.02 1.80 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 1.28 0.87 0.81 0.00 0.00 106 I 8.60 4.57 1.57 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.75 0.55 0.00 0.00 107 E 8.49 4.94 0.00 2.03 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 2.49 2.29 0.00 108 I 8.76 4.79 1.80 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.07 0.85 0.00 0.00 109 I 8.49 4.87 1.75 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.68 0.70 0.00 0.00 110 A 8.06 4.78 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.14 0.00 2.08 1.86 0.00 3.03 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.24 0.00 112 M 7.52 4.62 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 113 K 7.91 3.24 0.00 1.09 1.56 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.16 0.58 7.81 114 L 8.22 4.28 0.00 1.71 1.76 0.89 1.03 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 0.00 115 R 7.74 3.96 0.00 1.78 1.93 0.00 3.12 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.66 0.00 116 E 7.86 3.87 0.00 2.12 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 0.00 2.41 2.26 0.00 117 Q 7.54 3.77 0.00 1.48 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.05 0.00 0.00 0.00 0.00 0.00 2.11 2.26 0.00 118 F 7.22 4.62 0.00 3.14 2.99 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 0.00 119 N 7.38 4.12 0.00 2.87 2.81 0.00 0.00 7.07 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 0.00 120 L 7.95 4.55 0.00 1.72 1.59 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 121 K 9.26 4.50 0.00 1.87 1.93 0.00 1.32 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.60 1.37 7.81 122 D 8.31 4.48 0.00 2.67 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 0.00 123 G 9.34 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 0.00 0.00 0.00 124 D 7.55 4.41 0.00 2.71 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 0.00 125 V 8.33 4.74 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 0.90 0.00 0.00 0.91 0.00 0.00 126 I 8.55 4.66 1.75 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 1.15 1.09 0.82 0.00 0.00 127 K 8.36 5.14 0.00 1.69 1.68 0.00 1.56 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.33 1.31 7.81 128 I 8.59 4.96 1.76 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.72 0.79 0.00 0.00 129 L 9.19 4.98 0.00 1.72 1.66 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 130 I 8.77 4.54 1.90 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.59 0.61 0.00 0.00 131 K 8.77 4.61 0.00 1.79 1.71 0.00 1.90 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 1.41 1.47 7.81 132 G 9.09 3.91 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 0.00 0.00 0.00 133 D 7.55 4.59 0.00 2.61 2.40 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 0.00 134 K 8.43 4.43 0.00 1.63 1.68 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.26 1.39 7.81 135 D 8.00 4.45 0.00 2.66 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 0.00 136 E 7.95 4.15 0.00 1.94 1.87 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 2.31 2.36 0.00