NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5495 8.3649 120.1902 54.1535 43.0514 175.5952 3 I 3.8423 7.6345 118.9618 60.2742 37.6686 173.9815 4 K 4.6668 9.2029 125.5419 54.4337 35.7394 175.4059 5 E 4.3728 8.5357 122.1875 55.5769 30.4960 176.5227 6 L 4.4544 8.2662 122.3869 55.0258 42.8595 176.3636 7 H 4.4677 9.3224 123.7739 55.9744 30.7386 174.2218 8 V 4.5272 8.5231 127.0855 61.8861 32.3929 174.9474 9 K 4.5874 9.4397 128.3915 54.9090 34.6853 175.3193 10 T 4.8894 8.4416 121.5229 62.1485 69.7140 174.2918 11 V 4.5768 8.3581 119.2106 59.3271 36.2868 174.8775 12 K 4.6462 8.7788 120.3665 53.9833 35.0993 176.1733 13 R 4.4513 8.7820 120.9842 58.6863 29.8844 176.6242 14 G 4.0630 9.7075 113.8881 45.2230 0.0000 173.3538 15 E 4.1541 8.1096 119.0971 56.5439 30.7724 175.6119 16 N 5.3209 8.5352 118.9350 51.8749 40.6900 174.6772 17 V 4.4591 8.7487 122.0320 61.3405 35.3927 174.1761 18 T 4.8853 8.3754 122.0872 61.9475 71.6132 172.9725 19 M 4.5925 8.9318 125.8502 53.5297 34.5216 174.8119 20 E 5.2118 8.9740 123.1710 55.7473 31.5327 176.2213 21 C 5.0044 9.6514 122.5357 55.4424 47.6474 172.4544 22 S 5.3154 8.6879 120.2990 57.4739 63.2501 173.9534 23 M 4.2380 9.2536 125.9720 56.8729 32.4589 178.6221 24 S 4.0620 7.9929 113.8945 61.3533 62.7442 175.7703 25 K 4.3319 7.7719 117.0611 55.1561 32.1541 176.8041 26 V 3.8193 7.5062 120.5226 62.9704 31.9557 175.9210 27 K 4.0375 8.6614 127.4477 58.2252 32.6781 176.7553 28 D 4.5813 8.6717 120.8677 51.9132 42.9458 176.0160 29 K 3.5868 8.3526 127.3849 59.2400 32.1463 179.2887 30 D 4.6352 7.9285 117.3445 56.5401 41.0008 177.1343 31 K 4.3624 7.9937 117.7594 55.8894 32.4508 174.8786 32 L 4.9986 7.5238 122.7435 53.7306 43.4982 175.2615 33 A 5.3850 8.9503 126.3127 50.8168 23.3111 174.8289 34 W 5.3906 9.5540 119.8358 55.9543 31.4857 175.2509 35 Y 5.1262 9.7316 120.8511 56.2457 41.0432 174.4270 36 R 3.8697 8.8456 124.3286 54.1444 32.6200 174.3593 37 Q 4.5280 8.2713 128.1533 53.9296 31.0771 174.7780 38 S 4.1653 8.2470 122.8049 57.9893 64.4042 174.2780 39 F 4.5856 8.3116 121.7610 59.2547 38.9981 175.8881 40 G 3.9753 9.2251 112.7288 45.7063 0.0000 172.6561 41 K 4.6966 7.7431 117.6526 53.6024 35.4482 176.1322 42 V 3.8190 8.1228 119.9935 62.1197 32.0404 174.2440 43 P 4.6930 0.0000 0.0000 62.9635 32.1190 175.6555 44 Q 4.9309 8.9508 119.1458 53.9687 33.2697 174.1454 45 Y 4.0146 9.2237 123.8902 58.7011 39.0344 174.3937 46 F 4.7788 9.2297 127.9086 59.2212 41.9385 175.2515 47 V 4.6929 7.4878 116.6470 60.2083 34.2742 172.7656 48 R 5.4324 9.0912 119.8320 54.1640 32.9058 174.3380 49 Y 4.9498 8.8407 121.9216 58.6639 39.8544 175.1739 50 Y 4.7260 7.7223 126.3403 56.0983 42.6811 173.8374 51 S 4.0490 8.3430 121.9506 59.1621 62.3365 172.9999 52 S 4.3980 7.7077 119.2117 57.6943 65.1049 175.0468 53 N 4.4325 8.9152 117.5860 56.7949 38.3395 176.9838 54 S 4.1164 7.8972 111.1457 60.1742 63.3880 175.4399 55 G 4.3965 10.1121 108.5271 44.5114 0.0000 171.6062 56 Y 5.5010 6.8426 114.1348 55.7699 41.4198 174.1082 57 K 4.5662 9.2493 121.6814 54.7543 35.3486 175.6295 58 F 4.4534 9.2190 126.0525 57.0341 39.8968 175.3355 59 A 4.0844 8.6558 124.1492 51.3203 19.5761 176.8328 60 E 3.8939 8.7391 120.1292 58.0474 29.8939 177.9076 61 G 3.7718 8.8650 112.7878 45.7131 0.0000 173.3846 62 F 5.2530 7.8481 118.1833 57.2504 39.6073 175.7478 63 K 4.3190 8.1217 116.8503 56.2706 32.3233 176.8565 64 D 4.0834 7.8039 120.1958 54.3133 41.1322 177.4848 65 S 4.1338 8.3216 120.8439 60.6268 63.3675 175.4669 66 R 3.9665 8.1695 120.8759 58.3279 30.7169 176.3445 67 F 5.4413 7.2858 118.0694 56.3795 40.5081 175.3813 68 S 4.7253 8.7215 116.2579 57.9186 66.8563 172.3839 69 M 4.9330 7.7244 117.7184 53.8410 36.1917 175.5042 70 T 4.5429 8.8539 118.2134 62.1232 70.7477 173.5177 71 V 5.1951 8.5172 126.8537 61.3199 32.5696 174.4590 72 N 4.9134 8.9171 125.1691 52.6252 39.2649 174.4932 73 D 4.5918 8.8979 116.1113 57.0830 41.5521 176.7789 74 Q 4.5665 8.0389 115.4536 56.1014 31.4009 175.8518 75 K 5.0807 9.0072 118.1654 54.0333 35.0975 176.1520 76 F 5.6337 9.0406 124.5046 56.9672 38.3106 173.6358 77 D 5.1776 8.8151 121.4564 53.0231 43.6242 176.7626 78 L 4.3753 8.3618 125.3644 53.4646 43.8390 174.7214 79 N 5.3684 8.9644 123.8292 51.4399 41.9615 173.5830 80 I 5.1271 8.5526 123.0325 59.6565 40.7032 174.2989 81 I 4.4873 8.6786 128.4874 59.7393 38.5256 175.9644 82 G 3.6735 8.8747 115.7211 46.2006 0.0000 173.4057 83 T 4.3521 8.2460 114.3938 62.4017 68.7863 172.9747 84 R 4.9422 9.0613 123.5878 54.1751 34.5784 176.1526 85 E 2.5400 8.3044 119.0882 59.1680 29.3869 179.2102 86 D 4.4143 7.6900 115.7017 55.1018 39.6830 176.5843 87 D 4.6210 8.1759 119.7226 55.3252 41.3300 177.1199 88 G 4.4726 7.9933 109.2340 45.3060 0.0000 174.8569 89 G 2.1952 6.9340 107.5347 44.2268 0.0000 170.9614 90 E 5.0197 7.5557 119.6396 54.5918 33.3302 174.9535 91 Y 4.6336 8.8773 120.3357 56.0769 41.7142 174.5328 92 F 5.5991 9.3494 122.5804 55.8760 42.9137 173.0992 93 C 4.8691 9.1522 123.9560 54.8233 46.2993 172.7134 94 G 4.4161 9.4764 112.7271 44.6216 0.0000 170.5635 95 E 5.2044 8.6673 122.4206 53.6932 32.2926 175.3775 96 V 4.0056 8.4038 128.1156 62.9511 32.0928 175.7381 97 E 4.4183 9.0794 125.8590 54.9981 31.7348 177.7355 98 G 3.8789 8.5051 119.3959 47.3239 0.0000 173.7827 99 N 4.5691 9.1992 122.7927 54.0962 39.2431 174.0766 100 T 4.6363 7.4738 106.7870 59.8727 72.2373 171.9107 101 I 4.5762 7.8685 121.3589 58.9527 40.2531 174.2679 102 K 4.2963 8.4191 130.1759 54.6745 33.9351 174.7430 103 F 5.0758 8.5497 126.9889 57.1075 39.3716 175.7395 104 T 4.6133 9.0094 113.9758 62.4818 70.6815 174.1909 105 S 4.7313 7.8054 115.2037 57.6862 66.8042 173.0135 106 G 4.7966 8.3950 104.7438 46.1534 0.0000 172.3620 107 T 5.2847 9.3302 117.6873 61.5772 72.9213 172.8918 108 R 4.8938 9.0941 126.5742 54.8309 32.3193 174.5869 109 L 4.9983 9.3410 129.7665 53.5765 43.5118 174.5753 110 Q 5.3505 9.1586 125.2342 54.2882 31.8215 176.0994 111 F 4.7523 8.9373 118.0962 56.9817 39.4344 175.5197 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 D 8.36 4.55 0.00 2.63 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 3 I 7.63 3.84 1.87 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 1.41 0.27 0.91 0.00 0.00 4 K 9.20 4.67 0.00 1.73 1.71 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.54 7.81 5 E 8.54 4.37 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 2.31 2.40 0.00 6 L 8.27 4.45 0.00 1.62 1.72 1.10 1.33 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 7 H 9.32 4.47 0.00 3.26 3.23 0.00 5.57 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.52 4.53 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 0.91 0.00 0.00 0.99 0.00 0.00 9 K 9.44 4.59 0.00 1.57 1.55 0.00 1.51 0.00 0.00 1.48 0.00 0.00 2.40 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.18 1.19 7.81 10 T 8.44 4.89 4.19 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 1.16 0.00 0.00 11 V 8.36 4.58 1.77 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 0.59 0.00 0.00 -0.12 0.00 0.00 12 K 8.78 4.65 0.00 1.92 1.71 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.30 7.81 13 R 8.78 4.45 0.00 1.87 1.94 0.00 3.23 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 14 G 9.71 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 0.00 0.00 0.00 15 E 8.11 4.15 0.00 2.03 1.84 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 2.31 2.36 0.00 16 N 8.54 5.32 0.00 2.56 2.69 0.00 0.00 6.64 7.68 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 17 V 8.75 4.46 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 0.85 0.00 0.00 0.81 0.00 0.00 18 T 8.38 4.89 4.18 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 1.16 0.00 0.00 19 M 8.93 4.59 0.00 1.53 1.11 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 20 E 8.97 5.21 0.00 2.00 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 2.34 2.36 0.00 21 C 9.65 5.00 0.00 2.99 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 22 S 8.69 5.32 0.00 3.97 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 23 M 9.25 4.24 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.75 0.00 24 S 7.99 4.06 0.00 3.99 4.03 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 0.00 0.00 0.00 25 K 7.77 4.33 0.00 1.73 1.83 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.40 7.81 26 V 7.51 3.82 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 0.57 0.00 0.00 0.80 0.00 0.00 27 K 8.66 4.04 0.00 1.82 1.78 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.30 7.81 28 D 8.67 4.58 0.00 2.50 2.41 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 29 K 8.35 3.59 0.00 1.22 0.74 0.00 1.35 0.00 0.00 1.13 0.00 0.00 2.74 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.00 1.12 7.81 30 D 7.93 4.64 0.00 2.80 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 31 K 7.99 4.36 0.00 1.97 1.91 0.00 1.52 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.36 7.81 32 L 7.52 5.00 0.00 1.49 1.21 0.76 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.95 5.39 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 34 W 9.55 5.39 0.00 3.35 3.26 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 35 Y 9.73 5.13 0.00 3.15 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 36 R 8.85 3.87 0.00 0.67 0.83 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.50 0.00 37 Q 8.27 4.53 0.00 1.98 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.72 0.00 0.00 0.00 0.00 0.00 2.15 2.46 0.00 38 S 8.25 4.17 0.00 3.76 3.69 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 39 F 8.31 4.59 0.00 3.06 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 40 G 9.23 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 41 K 7.74 4.70 0.00 1.73 1.73 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.56 1.48 7.81 42 V 8.12 3.82 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 0.87 0.00 0.00 0.98 0.00 0.00 43 P 0.00 4.69 0.00 2.27 2.18 0.00 3.76 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 44 Q 8.95 4.93 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 45 Y 9.22 4.01 0.00 2.86 3.04 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 46 F 9.23 4.78 0.00 2.82 3.01 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 0.00 0.00 0.00 47 V 7.49 4.69 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 0.39 0.00 0.00 0.30 0.00 0.00 48 R 9.09 5.43 0.00 2.00 2.21 0.00 2.83 0.00 0.00 2.97 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.70 0.00 49 Y 8.84 4.95 0.00 2.68 3.03 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 0.00 0.00 0.00 50 Y 7.72 4.73 0.00 2.99 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 51 S 8.34 4.05 0.00 3.95 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 52 S 7.71 4.40 0.00 3.91 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 53 N 8.92 4.43 0.00 2.70 2.92 0.00 0.00 6.84 7.57 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 54 S 7.90 4.12 0.00 3.29 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 55 G 10.11 4.40 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 0.00 0.00 0.00 56 Y 6.84 5.50 0.00 3.03 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 57 K 9.25 4.57 0.00 1.30 1.46 0.00 0.90 0.00 0.00 1.09 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.23 1.20 7.81 58 F 9.22 4.45 0.00 2.98 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 59 A 8.66 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.74 3.89 0.00 1.95 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 2.25 2.31 0.00 61 G 8.86 3.77 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 0.00 0.00 0.00 62 F 7.85 5.25 0.00 3.03 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 63 K 8.12 4.32 0.00 1.69 1.76 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.34 7.81 64 D 7.80 4.08 0.00 2.21 1.54 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.32 4.13 0.00 3.91 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 66 R 8.17 3.97 0.00 1.36 2.02 0.00 3.25 0.00 0.00 3.07 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.52 0.00 67 F 7.29 5.44 0.00 1.91 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 0.00 0.00 0.00 0.00 68 S 8.72 4.73 0.00 3.93 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 69 M 7.72 4.93 0.00 1.44 0.88 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.96 0.00 70 T 8.85 4.54 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 1.26 0.00 0.00 71 V 8.52 5.20 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 1.30 0.00 0.00 1.30 0.00 0.00 72 N 8.92 4.91 0.00 3.02 2.97 0.00 0.00 6.59 7.43 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 73 D 8.90 4.59 0.00 2.71 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 74 Q 8.04 4.57 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 75 K 9.01 5.08 0.00 1.85 1.79 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.42 7.81 76 F 9.04 5.63 0.00 2.94 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 77 D 8.82 5.18 0.00 2.66 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.36 4.38 0.00 0.27 0.23 0.68 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.96 5.37 0.00 2.57 2.59 0.00 0.00 6.36 7.11 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 80 I 8.55 5.13 1.81 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.85 1.07 0.00 0.00 81 I 8.68 4.49 1.84 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 1.14 0.80 0.93 0.00 0.00 82 G 8.87 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.25 4.35 4.36 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 0.00 0.00 0.00 1.44 0.00 0.00 84 R 9.06 4.94 0.00 1.83 1.78 0.00 3.16 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 85 E 8.30 2.54 0.00 1.77 1.70 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 2.21 1.72 0.00 86 D 7.69 4.41 0.00 2.79 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 87 D 8.18 4.62 0.00 3.00 2.90 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 88 G 7.99 4.47 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 0.00 89 G 6.93 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.56 5.02 0.00 1.54 1.52 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 2.28 2.29 0.00 91 Y 8.88 4.63 0.00 2.65 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 92 F 9.35 5.60 0.00 2.75 2.32 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 93 C 9.15 4.87 0.00 1.23 2.41 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 94 G 9.48 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 0.00 0.00 0.00 0.00 95 E 8.67 5.20 0.00 1.88 1.65 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 2.07 2.08 0.00 96 V 8.40 4.01 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 0.76 0.00 0.00 0.88 0.00 0.00 97 E 9.08 4.42 0.00 2.02 1.95 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 2.06 2.15 0.00 98 G 8.51 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 99 N 9.20 4.57 0.00 2.69 2.85 0.00 0.00 6.53 7.54 0.00 0.00 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 T 7.47 4.64 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 1.16 0.00 0.00 101 I 7.87 4.58 1.56 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.76 0.34 0.00 0.00 102 K 8.42 4.30 0.00 1.86 1.50 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.26 1.31 7.81 103 F 8.55 5.08 0.00 2.90 2.85 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 0.00 0.00 0.00 104 T 9.01 4.61 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 1.17 0.00 0.00 105 S 7.81 4.73 0.00 3.99 4.03 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 0.00 0.00 0.00 106 G 8.40 4.80 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 0.00 0.00 0.00 107 T 9.33 5.28 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 1.18 0.00 0.00 108 R 9.09 4.89 0.00 1.99 1.88 0.00 3.20 0.00 0.00 3.31 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.83 0.00 109 L 9.34 5.00 0.00 1.70 1.63 0.73 0.36 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 0.00 110 Q 9.16 5.35 0.00 2.18 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.52 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 111 F 8.94 4.75 0.00 3.09 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