NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8465 8.3544 109.7372 43.7322 0.0000 173.9254 2 S 4.1411 7.9976 119.9394 57.1142 63.7732 170.1496 3 V 3.2665 8.8372 118.4813 61.4568 29.3007 171.3789 4 A 4.6635 7.5012 123.8735 52.7360 26.3000 175.8659 5 P 4.3564 0.0000 0.0000 63.6335 30.4690 176.3005 6 V 4.3801 8.1496 118.6900 62.3205 31.9603 171.0641 7 E 3.7180 8.4159 126.0448 57.8862 26.8655 174.7390 8 T 4.6391 7.4777 112.8693 59.9195 68.8883 175.3291 9 L 4.0494 7.5952 122.0204 55.1669 42.7014 176.8684 10 E 4.3342 8.7037 125.1324 55.6723 30.4907 177.5136 11 V 4.4629 7.8510 122.0059 60.1202 32.5997 174.3039 12 E 4.3609 7.8695 119.5784 55.8463 31.2129 178.5303 13 K 4.7040 8.4112 120.1322 56.0948 31.1845 177.6639 14 W 5.2345 7.7001 116.9012 57.1840 31.4522 176.2742 15 F 4.7257 6.6418 128.0688 56.1546 37.1398 174.2869 16 F 4.5456 8.3040 122.4858 55.4705 41.3786 176.1642 17 R 4.0798 7.4902 121.4268 56.5515 32.7142 177.2979 18 T 4.8134 8.0911 111.5997 61.6771 65.8264 174.8063 19 I 3.9772 7.3584 124.4728 59.8246 39.5762 175.6564 20 S 4.3708 8.3094 117.7368 57.8098 64.3399 174.6709 21 R 3.9082 8.4803 124.4754 59.4959 29.9611 178.7228 22 K 4.1237 8.0021 117.7104 59.4169 32.4998 178.5303 23 D 4.2985 7.9078 120.2732 57.3842 41.0817 177.8515 24 A 4.0067 8.1073 121.0949 55.5987 18.2440 179.5840 25 E 3.9545 8.1484 116.5854 59.4570 29.3151 179.7388 26 R 3.9520 7.8635 115.2978 59.1749 29.6751 178.8935 27 Q 4.0877 8.0766 118.7501 58.8077 28.6446 178.3848 28 L 3.9661 7.6469 118.3633 57.9307 41.6867 178.6844 29 L 4.1325 8.1313 115.5755 55.6530 41.7069 177.3989 30 A 4.1485 7.7348 123.8573 51.3624 18.7188 176.8298 31 P 4.5273 0.0000 0.0000 64.6234 31.7563 177.6028 32 M 4.1486 8.0271 119.0410 57.9238 32.1941 176.2437 33 N 4.9353 7.5952 114.3136 51.8773 40.9576 174.1203 34 K 4.2970 7.8853 116.9060 55.8547 34.9516 173.9170 35 A 4.6072 8.2091 122.3475 55.1950 18.0366 175.8422 36 G 3.6617 9.1234 116.6184 46.4606 0.0000 173.7383 37 S 5.0829 8.0458 117.0284 58.0024 64.0832 173.8860 38 F 5.7826 8.7243 120.4109 54.9916 44.1692 173.5977 39 L 4.7053 8.4773 118.5952 54.0866 45.2395 175.3449 40 I 4.8867 9.2502 126.6706 59.4571 39.0281 174.7312 41 R 5.7271 9.0404 126.3916 54.3911 31.8772 175.2697 42 E 4.4825 8.4515 118.1957 55.2649 31.1567 175.8156 43 S 4.3436 8.3350 118.1339 57.0366 63.2635 174.8903 44 E 4.2630 8.4084 130.4053 56.0289 29.1348 177.3562 45 S 4.4756 7.7936 111.5107 59.7498 66.9712 173.9374 46 N 4.9448 7.5523 117.3149 50.3391 38.8520 176.1062 47 K 4.3226 8.5748 122.9896 54.9606 31.9596 178.2556 48 G 5.1169 7.4198 121.3119 47.6749 0.0000 172.3031 49 A 4.9629 7.0973 122.3441 50.9718 21.7407 175.9401 50 F 5.2748 8.8249 116.2800 56.7182 44.2383 173.6615 51 S 4.9742 9.4617 114.0998 57.9069 68.0493 173.5922 52 L 5.1868 8.5953 122.9395 54.1587 45.5672 174.6198 53 S 5.7288 9.0375 122.5866 56.3151 65.5434 173.4799 54 V 4.6777 7.7795 121.8841 59.7324 35.7098 173.7416 55 K 4.5932 8.6267 127.0705 56.2221 33.5009 174.7058 56 D 5.1606 9.1463 127.5212 52.5937 43.7511 174.8226 57 I 4.6603 8.3681 126.1409 60.0122 38.4564 174.7261 58 T 4.6788 8.0375 121.3496 60.0266 70.5745 174.4525 59 T 3.9743 8.4675 118.2112 64.0363 67.6642 174.3506 60 Q 4.4569 7.3791 120.9228 55.9031 28.3854 176.8262 61 G 4.0471 8.0810 101.3261 45.4688 0.0000 172.5025 62 E 4.5447 8.3030 119.9222 55.4114 30.7156 176.0741 63 V 4.5024 8.6043 118.8285 60.0755 35.5537 172.7196 64 V 4.9542 7.9334 120.1520 61.3447 34.2786 175.1986 65 K 4.6852 8.3192 116.5300 55.4170 37.1025 175.6078 66 H 4.8957 8.1564 117.7407 54.8398 31.9820 172.5507 67 Y 4.6468 8.7455 122.4760 55.5620 40.7156 175.4766 68 K 4.4901 8.8045 124.8544 56.5110 34.3012 175.8393 69 I 4.4862 8.2648 119.0378 59.7898 39.3460 175.8092 70 R 4.9914 8.3802 126.3003 54.6508 32.9664 175.5708 71 S 5.2962 8.3326 113.8039 55.7609 64.8917 173.3639 72 L 4.7400 8.2889 125.1791 52.9870 43.0089 177.9789 73 D 4.5094 8.8715 122.2483 55.8650 39.6442 176.4258 74 N 5.0630 7.4890 118.3095 51.5745 37.4064 175.7284 75 G 3.9568 8.5796 102.5162 46.7788 0.0000 175.4296 76 G 3.8909 8.2339 108.3601 44.6439 0.0000 173.6836 77 Y 5.8824 6.8263 112.9767 55.4120 43.3531 174.1637 78 Y 5.3964 8.4391 119.6597 55.9296 41.0309 175.1088 79 I 4.3954 8.2655 112.0677 60.5779 39.7868 176.1025 80 S 4.9445 8.0505 116.8712 55.8033 64.8960 172.8973 81 P 4.3140 0.0000 0.0000 63.8190 31.1266 177.1321 82 R 4.2185 7.8679 114.4018 56.7743 29.4414 176.5953 83 I 4.1497 8.0344 113.9164 60.2416 39.8773 174.0622 84 T 4.8591 7.8307 121.4551 61.6237 71.3684 173.0188 85 F 4.9309 8.9515 121.4430 55.5139 43.3487 174.1200 86 P 4.4383 0.0000 0.0000 65.0679 31.9668 175.5392 87 T 4.9715 7.5377 110.7512 59.3697 72.0496 173.9250 88 L 3.9588 7.8987 122.1850 56.8139 41.5103 179.5648 89 Q 3.8030 8.0628 118.3107 59.1049 28.4376 178.1841 90 A 4.3130 7.7566 122.9083 53.2360 18.5567 179.2712 91 L 2.0000 7.0987 119.5298 57.6968 42.0045 179.2111 92 V 3.3674 7.3034 117.4007 65.5260 31.4394 177.6122 93 Q 3.8391 7.8014 117.9263 59.3822 28.3673 178.1962 94 H 3.9154 7.2990 120.1184 58.9899 29.9215 176.5880 95 Y 4.3075 7.3002 117.2468 59.7886 37.5184 177.2717 96 S 4.3239 7.5587 115.0209 59.3075 63.1707 175.0127 97 K 4.4354 7.6616 120.8252 57.6196 33.7093 175.3437 98 K 4.4627 7.7626 115.2751 56.2090 34.9884 175.2558 99 G 4.1957 8.2395 102.9154 44.5329 0.0000 172.0692 100 D 4.4950 8.4707 121.6311 57.0696 42.3055 176.7862 101 G 3.9909 8.4929 105.0142 46.7705 0.0000 173.6188 102 L 4.1860 7.1491 120.3008 53.0384 42.7738 177.4816 103 C 4.2509 8.5279 116.0960 60.0604 30.1040 173.7724 104 Q 4.3909 7.4655 120.4453 54.0670 31.6199 174.8841 105 K 4.3201 8.5314 122.4310 56.1688 33.6143 176.3594 106 L 4.0417 7.8826 120.0725 54.6947 41.4367 175.5634 107 T 4.4889 7.7783 111.1845 62.0845 70.8178 173.5781 108 L 4.7278 7.3559 118.6277 51.2925 46.4804 174.1486 109 P 4.6577 0.0000 0.0000 62.3221 32.2865 175.4281 110 C 4.4663 8.4586 120.7574 59.3701 31.9637 173.5190 111 V 3.8899 8.6446 117.7041 60.7061 31.7986 176.1272 112 N 4.4286 8.3972 121.0819 54.0620 39.5025 172.5594 113 L 3.4530 8.4078 126.0557 54.7280 39.4000 174.0091 114 A 4.1842 8.2387 124.9699 51.9400 18.3258 177.5863 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 G 8.35 3.85 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 0.00 0.00 0.00 2 S 8.00 4.14 0.00 3.86 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 3 V 8.84 3.27 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 0.80 0.00 0.00 0.93 0.00 0.00 4 A 7.50 4.66 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 5 P 0.00 4.36 0.00 2.06 2.07 0.00 3.74 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 6 V 8.15 4.38 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 0.64 0.00 0.00 0.93 0.00 0.00 7 E 8.42 3.72 0.00 2.12 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 2.22 2.28 0.00 8 T 7.48 4.64 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 1.26 0.00 0.00 9 L 7.60 4.05 0.00 1.63 1.65 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.70 4.33 0.00 1.96 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 2.30 2.38 0.00 11 V 7.85 4.46 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 0.75 0.00 0.00 0.93 0.00 0.00 12 E 7.87 4.36 0.00 2.08 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 2.46 2.40 0.00 13 K 8.41 4.70 0.00 1.88 1.73 0.00 1.16 0.00 0.00 1.95 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.48 7.81 14 W 7.70 5.23 0.00 3.24 3.20 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 15 F 6.64 4.73 0.00 1.51 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 0.00 0.00 0.00 0.00 16 F 8.30 4.55 0.00 2.69 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 17 R 7.49 4.08 0.00 1.45 1.63 0.00 2.89 0.00 0.00 3.11 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.29 0.00 18 T 8.09 4.81 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 1.17 0.00 0.00 19 I 7.36 3.98 2.09 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.02 1.08 0.00 0.00 20 S 8.31 4.37 0.00 3.94 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 21 R 8.48 3.91 0.00 1.95 1.92 0.00 3.27 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.82 0.00 22 K 8.00 4.12 0.00 1.99 2.07 0.00 1.58 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.48 7.81 23 D 7.91 4.30 0.00 3.03 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 24 A 8.11 4.01 1.40 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 25 E 8.15 3.95 0.00 2.13 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 2.34 2.55 0.00 26 R 7.86 3.95 0.00 1.97 2.31 0.00 3.08 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.68 0.00 27 Q 8.08 4.09 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.16 0.00 0.00 0.00 0.00 0.00 2.36 2.63 0.00 28 L 7.65 3.97 0.00 1.64 1.73 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.13 4.13 0.00 1.66 1.71 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.73 4.15 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 31 P 0.00 4.53 0.00 2.19 2.19 0.00 3.77 0.00 0.00 3.66 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 32 M 8.03 4.15 0.00 2.03 2.16 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 2.60 2.56 0.00 33 N 7.60 4.94 0.00 2.79 2.76 0.00 0.00 6.86 9.05 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 34 K 7.89 4.30 0.00 2.07 1.91 0.00 1.25 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.44 7.81 35 A 8.21 4.61 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 36 G 9.12 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 37 S 8.05 5.08 0.00 3.99 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 38 F 8.72 5.78 0.00 2.87 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 39 L 8.48 4.71 0.00 1.53 1.59 0.62 0.42 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 40 I 9.25 4.89 2.33 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.77 1.21 0.00 0.00 41 R 9.04 5.73 0.00 2.23 2.15 0.00 3.17 0.00 0.00 3.35 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 42 E 8.45 4.48 0.00 1.16 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 2.24 2.13 0.00 43 S 8.33 4.34 0.00 3.94 4.01 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 44 E 8.41 4.26 0.00 2.08 1.96 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 2.25 2.27 0.00 45 S 7.79 4.48 0.00 3.92 3.92 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 46 N 7.55 4.94 0.00 2.84 2.83 0.00 0.00 6.95 6.80 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 47 K 8.57 4.32 0.00 1.89 1.93 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.39 7.81 48 G 7.42 5.12 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 0.00 49 A 7.10 4.96 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 50 F 8.82 5.27 0.00 3.06 3.15 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 51 S 9.46 4.97 0.00 3.77 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 52 L 8.60 5.19 0.00 1.80 1.72 1.29 1.44 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 53 S 9.04 5.73 0.00 3.75 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 54 V 7.78 4.68 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 1.11 0.00 0.00 -0.84 0.00 0.00 55 K 8.63 4.59 0.00 1.90 1.78 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.51 1.61 7.81 56 D 9.15 5.16 0.00 2.69 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 57 I 8.37 4.66 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.04 0.92 0.00 0.00 58 T 8.04 4.68 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 1.28 0.00 0.00 59 T 8.47 3.97 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 60 Q 7.38 4.46 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 5.32 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 61 G 8.08 4.05 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 0.00 0.00 0.00 62 E 8.30 4.54 0.00 1.94 1.86 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 2.27 2.32 0.00 63 V 8.60 4.50 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 0.77 0.00 0.00 0.98 0.00 0.00 64 V 7.93 4.95 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 1.14 0.00 0.00 0.92 0.00 0.00 65 K 8.32 4.69 0.00 1.79 1.44 0.00 1.66 0.00 0.00 1.89 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.39 7.81 66 H 8.16 4.90 0.00 2.76 3.09 0.00 5.84 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 8.75 4.65 0.00 2.85 2.82 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 68 K 8.80 4.49 0.00 1.89 1.99 0.00 1.27 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.50 1.52 7.81 69 I 8.26 4.49 2.14 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.99 1.06 0.00 0.00 70 R 8.38 4.99 0.00 1.26 1.88 0.00 3.16 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.37 0.00 71 S 8.33 5.30 0.00 3.68 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 72 L 8.29 4.74 0.00 1.60 1.64 1.18 1.27 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 73 D 8.87 4.51 0.00 2.78 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 74 N 7.49 5.06 0.00 2.81 2.85 0.00 0.00 6.71 6.86 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 75 G 8.58 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 G 8.23 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 0.00 0.00 0.00 77 Y 6.83 5.88 0.00 3.21 2.94 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 78 Y 8.44 5.40 0.00 3.31 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 79 I 8.27 4.40 1.97 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.28 1.07 0.00 0.00 80 S 8.05 4.94 0.00 4.04 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 81 P 0.00 4.31 0.00 1.99 1.92 0.00 3.80 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.25 0.00 82 R 7.87 4.22 0.00 1.92 2.06 0.00 3.26 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 83 I 8.03 4.15 1.75 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.01 0.88 0.00 0.00 84 T 7.83 4.86 4.07 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 1.33 0.00 0.00 85 F 8.95 4.93 0.00 3.17 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 86 P 0.00 4.44 0.00 2.30 2.35 0.00 3.91 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 87 T 7.54 4.97 4.33 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 1.25 0.00 0.00 88 L 7.90 3.96 0.00 1.44 1.82 0.76 -0.89 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 89 Q 8.06 3.80 0.00 2.35 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 90 A 7.76 4.31 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 91 L 7.10 2.00 0.00 1.58 1.63 1.17 0.95 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 92 V 7.30 3.37 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.28 0.00 0.00 93 Q 7.80 3.84 0.00 2.12 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.54 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 94 H 7.30 3.92 0.00 2.87 2.57 0.00 5.58 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 95 Y 7.30 4.31 0.00 2.91 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 96 S 7.56 4.32 0.00 3.74 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 97 K 7.66 4.44 0.00 1.68 1.74 0.00 1.50 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.37 7.81 98 K 7.76 4.46 0.00 1.80 1.74 0.00 1.43 0.00 0.00 1.59 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.37 7.81 99 G 8.24 4.20 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 0.00 100 D 8.47 4.49 0.00 2.73 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 0.00 101 G 8.49 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 0.00 0.00 0.00 102 L 7.15 4.19 0.00 1.68 1.25 0.75 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 103 C 8.53 4.25 0.00 3.11 3.11 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 0.00 0.00 0.00 104 Q 7.47 4.39 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 105 K 8.53 4.32 0.00 2.18 1.92 0.00 1.43 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.40 1.52 7.81 106 L 7.88 4.04 0.00 1.34 1.21 0.45 -0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 107 T 7.78 4.49 4.22 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 0.00 0.00 1.27 0.00 0.00 108 L 7.36 4.73 0.00 1.55 1.54 0.91 1.01 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 0.00 109 P 0.00 4.66 0.00 1.99 2.23 0.00 3.69 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 2.12 2.19 0.00 110 C 8.46 4.47 0.00 2.87 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 0.00 111 V 8.64 3.89 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 0.81 0.00 0.00 0.99 0.00 0.00 112 N 8.40 4.43 0.00 2.68 2.75 0.00 0.00 7.02 7.81 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 0.00 113 L 8.41 3.45 0.00 1.81 1.71 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 114 A 8.24 4.18 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