NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.3279 8.1749 110.9401 61.4242 69.1580 173.2241 4 R 3.8695 7.9701 128.0164 56.7178 31.0066 175.3582 5 T 4.4639 7.9464 117.1748 60.8266 70.6896 172.2177 6 P 4.3650 0.0000 0.0000 62.3596 32.0137 175.9798 7 K 4.3517 8.3642 121.3161 55.1150 32.6867 176.4024 8 L 4.4831 8.4395 126.5163 54.7953 43.4323 175.9577 9 V 4.4533 8.7371 122.1527 61.0054 33.9485 174.0609 10 K 4.6899 8.5763 129.9110 54.9941 34.2734 174.2569 11 H 5.4156 9.0594 127.8127 54.3986 31.6765 173.2791 12 T 5.0384 8.8288 123.9873 61.8373 70.8692 173.1975 13 L 5.2096 9.0573 129.6722 53.4343 44.3810 174.8417 14 L 5.3758 9.1473 127.0374 53.3804 43.9525 175.7192 15 T 5.3760 9.1223 112.7211 59.9455 72.7438 172.6183 16 R 4.7884 8.3547 121.7619 54.6073 33.4920 174.0004 17 F 4.9446 8.6812 124.1181 55.9847 40.6367 175.8866 18 K 3.9891 8.9761 122.6411 56.8345 32.5310 177.9104 19 D 4.4256 8.9679 123.5293 57.5088 40.8908 177.7771 20 E 4.1965 8.0340 114.4392 57.4873 30.2208 176.7954 21 I 4.2074 7.5968 121.9580 61.1812 38.1164 176.2718 22 T 4.4321 8.8334 115.9426 60.5384 71.4636 176.0419 23 R 3.9032 8.5703 119.3975 60.0318 29.0777 178.7924 24 E 3.9480 8.0876 118.3962 59.1820 29.4801 179.1249 25 Q 3.9406 8.0097 118.1294 58.9841 28.6911 178.9710 26 I 3.6016 7.7300 120.7944 64.3673 37.0952 178.1627 27 D 4.3498 8.2004 119.7818 57.5425 40.6836 178.7517 28 N 4.3053 8.1337 116.8824 56.5312 38.5194 177.1938 29 Y 4.2843 8.1168 118.3098 61.1192 37.9201 178.6113 30 I 3.7318 8.2175 121.1635 64.3025 37.1210 178.1827 31 N 4.3307 8.2185 117.3995 56.5371 38.1693 177.2287 32 D 4.3412 7.9848 119.0941 57.2349 41.1448 178.0192 33 Y 2.9949 7.8136 120.1962 60.5785 38.8210 177.8219 34 T 3.3135 7.6848 116.6769 66.5396 68.5824 175.9528 35 N 4.2682 8.0313 118.6731 56.4564 38.8072 176.7356 36 L 3.9288 7.5112 120.5572 57.5281 41.3589 178.9228 37 L 3.8931 7.3697 119.4625 58.3371 42.0041 178.3395 38 D 4.4367 7.7479 116.4718 56.9554 41.2663 177.6445 39 L 4.5240 7.7223 117.5672 54.9809 42.5807 176.5402 40 I 4.4437 7.5516 119.8015 58.4416 37.7460 174.1723 41 P 4.3558 0.0000 0.0000 65.2118 31.4135 178.5444 42 S 4.3203 8.0918 111.4794 60.4808 63.3087 174.0381 43 M 3.7123 7.9531 122.0785 55.1961 32.4010 175.5552 44 K 4.4554 8.4712 125.6867 57.9532 33.9294 176.5904 45 S 4.6282 7.3562 111.9143 57.5226 66.3266 173.8307 46 F 5.2701 8.4481 122.6525 57.1637 41.9441 173.0806 47 N 5.0675 8.5835 122.7905 51.3719 43.0375 173.3305 48 W 5.2449 7.7747 116.5582 55.9052 31.6660 173.7452 49 G 3.7409 8.4739 106.7977 46.0861 0.0000 171.9469 50 T 5.1475 8.1351 108.9588 59.1141 71.8365 173.2185 51 D 4.3560 8.5482 122.5115 55.1851 41.0064 177.0550 52 L 4.0466 8.7930 125.8304 55.7244 42.0418 177.8434 53 G 3.8764 8.4982 106.5973 46.6469 0.0000 174.2121 54 M 4.3375 8.0637 117.6196 54.9431 32.9114 175.8635 55 E 4.5809 7.7171 117.7831 53.8232 32.2766 175.2644 56 S 4.0145 8.5402 113.5242 58.8665 62.6094 175.3962 57 A 4.0890 8.6718 129.7469 54.8065 18.5589 178.2001 58 E 4.3087 8.0617 112.6521 57.6575 30.4489 178.5059 59 L 4.1042 7.6625 119.4040 57.3400 41.9333 177.7196 60 N 4.5836 8.2504 114.7111 53.0156 37.8342 175.2987 61 R 3.6746 8.8236 117.2853 57.4123 28.2006 177.4971 62 G 3.8674 7.7084 105.9515 45.6169 0.0000 174.3343 63 Y 4.3541 7.7464 118.5372 58.1531 38.6181 175.4252 64 T 4.5688 9.1130 114.6312 62.5566 71.4001 174.2206 65 H 5.5387 8.4330 117.7629 53.6766 33.1201 172.3787 66 A 5.2018 8.7349 123.0645 50.1215 22.2458 175.0213 67 F 5.0079 9.3201 120.3229 55.6727 42.8187 173.8637 68 E 5.0572 9.2089 123.9697 54.6224 32.1678 175.1536 69 S 5.2101 9.0696 120.9642 56.9941 66.0993 173.1999 70 T 4.8179 8.2080 121.4066 61.8609 70.7494 173.7901 71 F 5.0399 9.1363 123.4741 55.8625 43.1875 175.5832 72 E 4.3600 8.9530 118.2467 57.3265 30.2899 176.6636 73 S 4.6935 7.4371 112.5610 56.2288 66.6044 175.8876 74 K 3.8038 8.4791 121.8852 59.5403 31.6670 179.6959 75 S 4.1788 8.1269 114.2285 61.3433 62.9982 176.5461 76 G 3.6757 8.3333 109.5784 47.5152 0.0000 175.3632 77 L 2.6645 7.5417 122.8084 57.3123 41.9324 178.8418 78 Q 3.8272 8.1456 119.7471 59.0504 28.7851 177.5459 79 E 3.8770 8.0778 119.4212 59.5489 29.8719 177.9109 80 Y 4.2416 7.8081 118.9962 60.9297 38.6786 178.2142 81 L 3.8574 7.9681 118.5344 57.3558 41.7583 178.2996 82 D 4.6535 7.8655 116.3390 53.3195 41.5925 176.8116 83 S 4.3498 7.3899 115.5930 57.4544 64.3230 175.1975 84 A 3.9286 8.6421 124.0440 55.2577 18.2376 179.9956 85 A 3.8949 7.8995 118.7214 55.2394 18.4753 179.3335 86 L 3.7934 7.7267 118.5315 58.2626 42.0891 178.8905 87 A 3.9281 7.8872 120.3720 55.3224 18.3211 179.5352 88 A 3.9742 8.2053 119.2219 54.9808 18.4014 179.7690 89 F 4.1154 8.1750 118.6713 61.5616 39.5521 177.2982 90 A 3.6727 8.2972 120.7791 54.7593 17.8248 178.8397 91 E 3.8646 7.8510 117.4688 59.7447 29.6971 179.1151 92 G 3.8275 7.1642 100.8500 46.7811 0.0000 175.4454 93 F 3.3915 7.5620 122.8029 60.7581 39.3619 177.4222 94 L 3.6394 7.6592 118.6212 57.2568 41.2107 177.6810 95 P 4.2897 0.0000 0.0000 64.8122 31.4825 177.7315 96 T 4.1197 7.6050 107.9779 61.5736 69.1487 173.8607 97 L 4.6995 6.9232 122.7393 53.3218 43.0836 176.4903 98 S 4.5036 8.5125 117.7875 59.5213 64.4043 174.4122 99 Q 4.6100 7.6757 118.7060 54.1269 33.0427 174.2693 100 R 5.1285 8.5801 122.4249 55.1270 33.3691 173.6802 101 L 4.8602 9.1669 128.0424 53.2394 45.4680 175.0540 102 V 5.0152 8.4981 125.0017 61.1778 34.5352 174.3237 103 I 4.7929 8.7855 126.7883 59.5822 41.7570 173.1562 104 D 5.6003 8.7526 128.2003 52.9513 44.0493 174.5172 105 Y 4.9339 8.1084 118.6844 55.7179 41.5677 174.0997 106 F 4.4892 8.5791 119.8008 57.9354 39.9070 175.8107 107 L 4.5099 8.6047 123.2376 53.7998 40.7150 176.6933 108 Y 4.5570 8.1479 119.8453 58.1521 37.9806 175.8114 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 3 T 8.17 4.33 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 1.21 0.00 0.00 4 R 7.97 3.87 0.00 1.92 1.92 0.00 3.16 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 5 T 7.95 4.46 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 6 P 0.00 4.37 0.00 2.23 2.10 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 7 K 8.36 4.35 0.00 1.66 1.67 0.00 1.92 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.04 1.54 7.81 8 L 8.44 4.48 0.00 1.66 1.56 0.91 0.83 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 9 V 8.74 4.45 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 0.64 0.00 0.00 0.46 0.00 0.00 10 K 8.58 4.69 0.00 1.51 0.74 0.00 1.46 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.03 0.92 7.81 11 H 9.06 5.42 0.00 3.27 3.43 0.00 5.66 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.83 5.04 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 1.29 0.00 0.00 13 L 9.06 5.21 0.00 1.96 1.93 1.15 0.99 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 14 L 9.15 5.38 0.00 1.00 1.24 0.59 0.40 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 15 T 9.12 5.38 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 1.46 0.00 0.00 16 R 8.35 4.79 0.00 1.80 1.56 0.00 3.18 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 17 F 8.68 4.94 0.00 3.00 2.93 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 18 K 8.98 3.99 0.00 1.71 1.95 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.76 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.38 7.81 19 D 8.97 4.43 0.00 2.67 2.76 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 20 E 8.03 4.20 0.00 2.08 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 0.00 2.29 2.28 0.00 21 I 7.60 4.21 2.03 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 1.51 1.06 0.96 0.00 0.00 22 T 8.83 4.43 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 1.22 0.00 0.00 23 R 8.57 3.90 0.00 2.07 2.28 0.00 2.99 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 24 E 8.09 3.95 0.00 2.06 2.01 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 2.39 2.46 0.00 25 Q 8.01 3.94 0.00 2.31 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 26 I 7.73 3.60 1.79 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.38 0.55 0.00 0.00 27 D 8.20 4.35 0.00 2.83 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 28 N 8.13 4.31 0.00 2.78 2.63 0.00 0.00 7.07 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 29 Y 8.12 4.28 0.00 3.24 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 30 I 8.22 3.73 1.83 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.84 0.14 0.00 0.00 31 N 8.22 4.33 0.00 2.90 2.85 0.00 0.00 7.02 7.70 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 32 D 7.98 4.34 0.00 3.05 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 33 Y 7.81 2.99 0.00 2.56 2.52 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 34 T 7.68 3.31 4.38 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 1.34 0.00 0.00 35 N 8.03 4.27 0.00 2.88 2.90 0.00 0.00 7.20 6.65 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 36 L 7.51 3.93 0.00 1.66 1.72 0.71 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.37 3.89 0.00 1.62 1.75 0.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.75 4.44 0.00 2.70 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 39 L 7.72 4.52 0.00 1.64 1.70 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.55 4.44 2.15 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.73 1.18 0.00 0.00 41 P 0.00 4.36 0.00 2.07 2.14 0.00 3.73 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 42 S 8.09 4.32 0.00 4.18 4.28 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 43 M 7.95 3.71 0.00 1.92 2.02 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 1.79 2.18 0.00 44 K 8.47 4.46 0.00 1.56 1.75 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.46 7.81 45 S 7.36 4.63 0.00 3.80 3.84 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 0.00 0.00 0.00 0.00 46 F 8.45 5.27 0.00 2.89 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 47 N 8.58 5.07 0.00 2.43 2.39 0.00 0.00 6.07 7.06 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 48 W 7.77 5.24 0.00 3.22 2.76 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 49 G 8.47 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 0.00 0.00 0.00 50 T 8.14 5.15 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 1.28 0.00 0.00 51 D 8.55 4.36 0.00 2.76 2.71 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 52 L 8.79 4.05 0.00 1.66 1.69 0.88 0.94 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 53 G 8.50 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 0.00 0.00 0.00 54 M 8.06 4.34 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.53 0.00 55 E 7.72 4.58 0.00 1.95 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 2.23 2.22 0.00 56 S 8.54 4.01 0.00 3.85 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 57 A 8.67 4.09 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 58 E 8.06 4.31 0.00 2.22 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 0.00 2.34 2.39 0.00 59 L 7.66 4.10 0.00 1.82 1.79 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.25 4.58 0.00 3.17 3.11 0.00 0.00 6.35 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 61 R 8.82 3.67 0.00 2.25 2.14 0.00 3.42 0.00 0.00 3.44 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.81 0.00 62 G 7.71 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 63 Y 7.75 4.35 0.00 3.16 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 T 9.11 4.57 4.42 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 1.37 0.00 0.00 65 H 8.43 5.54 0.00 3.27 2.94 0.00 5.56 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 66 A 8.73 5.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 F 9.32 5.01 0.00 3.31 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 68 E 9.21 5.06 0.00 1.81 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 2.21 2.19 0.00 69 S 9.07 5.21 0.00 3.86 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 70 T 8.21 4.82 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 1.11 0.00 0.00 71 F 9.14 5.04 0.00 2.86 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 72 E 8.95 4.36 0.00 2.01 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 2.28 2.30 0.00 73 S 7.44 4.69 0.00 4.06 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 74 K 8.48 3.80 0.00 1.82 1.84 0.00 1.77 0.00 0.00 1.94 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.28 1.38 7.81 75 S 8.13 4.18 0.00 4.05 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 76 G 8.33 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 0.00 0.00 0.00 77 L 7.54 2.66 0.00 1.13 1.49 0.35 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.15 3.83 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.52 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 79 E 8.08 3.88 0.00 2.12 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 0.00 2.37 2.35 0.00 80 Y 7.81 4.24 0.00 3.13 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 81 L 7.97 3.86 0.00 1.74 1.67 0.88 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.87 4.65 0.00 2.60 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 83 S 7.39 4.35 0.00 3.97 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 84 A 8.64 3.93 1.32 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 0.00 0.00 0.00 85 A 7.90 3.89 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 86 L 7.73 3.79 0.00 1.28 1.54 0.83 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.89 3.93 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.21 3.97 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 89 F 8.17 4.12 0.00 2.98 3.14 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 90 A 8.30 3.67 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 91 E 7.85 3.86 0.00 2.05 2.17 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 2.32 2.33 0.00 92 G 7.16 3.83 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 0.00 93 F 7.56 3.39 0.00 1.67 2.13 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 94 L 7.66 3.64 0.00 1.65 1.56 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.29 0.00 1.91 2.04 0.00 3.48 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.05 0.00 96 T 7.60 4.12 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 1.06 0.00 0.00 97 L 6.92 4.70 0.00 1.42 1.53 0.54 -0.14 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 98 S 8.51 4.50 0.00 3.79 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 Q 7.68 4.61 0.00 1.70 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.87 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 100 R 8.58 5.13 0.00 1.73 1.76 0.00 3.22 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 101 L 9.17 4.86 0.00 1.49 1.01 0.73 0.44 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 0.00 102 V 8.50 5.02 2.15 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 0.95 0.00 0.00 1.02 0.00 0.00 103 I 8.79 4.79 1.91 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 1.42 1.59 1.01 0.00 0.00 104 D 8.75 5.60 0.00 2.59 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 0.00 105 Y 8.11 4.93 0.00 3.01 2.93 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 0.00 106 F 8.58 4.49 0.00 2.00 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 0.00 0.00 0.00 107 L 8.60 4.51 0.00 1.55 1.69 0.89 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 108 Y 8.15 4.56 0.00 3.05 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