NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3861 8.3049 120.3027 54.5669 34.2206 175.1198 2 K 4.3488 7.4109 116.9199 53.5857 36.3471 175.0639 3 F 4.1985 9.6190 123.0749 57.8202 40.0897 175.7654 4 E 4.8393 8.8933 123.6055 56.5306 30.3477 175.9435 5 T 4.6808 7.7530 115.1673 61.5442 71.8747 173.3791 6 I 4.2674 8.4343 127.0429 60.6490 37.6356 174.7417 7 N 5.0374 8.8481 122.6313 50.3554 40.7608 174.8220 8 Q 3.9943 8.6443 117.3261 59.3991 28.9845 177.7917 9 E 3.9321 8.0172 120.3318 58.9720 29.6968 178.7198 10 S 2.9793 7.3606 113.9074 60.7729 63.0797 176.3108 11 I 3.6729 7.6622 123.2118 64.1154 37.0226 177.9686 12 A 4.0539 7.8252 121.3934 55.3017 18.1691 179.6269 13 K 3.8753 7.8560 117.6702 59.4308 32.2300 178.6535 14 L 3.8865 8.0516 120.9005 58.5404 42.0007 178.8748 15 M 4.4699 8.5373 118.9093 58.4872 31.9190 178.4497 16 E 4.0429 8.2522 119.1367 59.3424 29.7788 178.9605 17 I 3.6616 7.8126 119.7784 64.2855 37.1806 178.2150 18 F 4.2713 8.3924 123.0893 61.1758 39.2713 176.8550 19 Y 3.7746 7.9169 115.7784 60.2999 37.4458 177.8446 20 E 3.7661 7.9638 120.5129 59.0572 29.4622 179.0086 21 K 3.8326 7.2889 117.4232 59.2211 32.3739 179.1188 22 V 3.3345 7.1926 118.5680 65.9344 31.0796 178.0387 23 R 3.5028 7.5289 117.1016 58.9220 29.8575 177.9438 24 K 4.0661 7.2714 116.0490 56.3880 32.9937 176.7669 25 D 4.4513 7.1687 120.3155 53.4292 41.7578 177.2496 26 K 4.0607 8.5320 124.9534 59.3296 33.2037 177.6695 27 D 4.4348 8.0296 118.0677 56.1917 41.8641 178.2021 28 L 4.2574 8.5517 119.6016 57.1461 41.5825 179.1927 29 G 3.8712 8.0059 105.8906 47.8679 0.0000 173.7590 30 P 4.3554 0.0000 0.0000 65.0165 31.2636 178.7873 31 I 3.7274 7.8430 118.1042 64.4455 37.0932 178.4082 32 F 3.8554 8.5650 118.5622 60.5594 38.8287 177.5307 33 N 4.9315 8.6605 117.5919 56.1159 38.1567 177.2749 34 N 4.3986 8.5058 116.8876 55.7669 38.6313 176.8349 35 A 4.2204 7.4860 121.7693 53.5554 19.2914 178.0193 36 I 3.9169 8.2164 108.3519 60.0871 38.7860 175.9433 37 G 3.9770 8.2226 107.6228 45.3615 0.0000 173.8369 38 T 4.7575 8.1378 107.1418 61.9966 69.8324 176.0450 39 S 4.4625 8.4500 118.9401 58.2591 65.1358 174.7525 40 D 4.4929 8.7364 123.7469 57.6370 40.6647 178.9950 41 E 4.0600 8.2132 117.7232 59.3880 29.6255 178.9319 42 E 4.0664 8.1463 119.3484 58.9938 29.4675 179.2558 43 W 4.0327 8.5128 119.1754 59.2805 29.0888 178.8308 44 K 4.0356 8.5985 118.9941 59.6043 31.5030 178.9424 45 E 3.9302 8.2961 119.4529 59.6238 29.3928 178.5932 46 H 4.1255 8.0493 116.2147 58.4522 28.7444 177.7611 47 K 3.9156 8.2671 120.2783 59.4221 31.8903 179.2422 48 A 4.0490 8.2906 121.0723 54.9506 18.3521 179.4882 49 K 3.9831 8.4029 118.5871 59.9469 32.1998 179.1259 50 I 3.9165 8.2926 120.5042 64.1690 37.0696 178.4390 51 G 3.9837 8.5622 106.8667 48.1012 0.0000 175.0823 52 N 4.4224 8.4799 119.5409 56.3010 39.0067 176.5229 53 F 3.6325 8.1007 121.9576 61.1417 39.2465 177.2341 54 W 4.1189 8.5972 118.5045 59.5890 28.8492 178.3650 55 A 4.1718 8.8381 121.4412 55.0159 17.8130 179.9726 56 G 3.6633 8.0762 104.1760 47.1172 0.0000 175.7164 57 M 3.9146 7.5565 119.8798 57.4457 32.2149 177.3377 58 L 4.5607 8.1718 117.6645 55.0645 42.9685 177.1049 59 L 4.6402 7.7423 115.2840 53.0080 43.6519 176.9828 60 G 3.8475 8.1661 106.1625 46.4648 0.0000 173.0657 61 E 4.4966 7.9111 118.6376 54.6663 32.3599 176.2721 62 G 4.6584 8.8690 108.6940 45.7134 0.0000 172.5536 63 D 4.9444 8.3161 115.9813 52.6262 39.6817 175.5987 64 Y 4.1879 8.3577 121.0808 59.2692 39.2467 174.9584 65 N 4.7589 7.7774 122.8271 52.4105 38.3975 174.5179 66 G 3.5140 5.7938 108.0826 45.8399 0.0000 174.3541 67 Q 4.5166 8.0138 117.8707 53.0013 28.7479 174.9103 68 P 4.2197 0.0000 0.0000 65.3455 31.5773 177.5291 69 L 3.3420 7.9137 118.3276 57.9219 42.0503 178.3408 70 K 3.6981 8.0108 118.8793 59.8251 31.7434 178.1813 71 K 3.7530 7.4695 116.3274 60.0330 32.1058 178.5731 72 H 4.3060 7.6390 116.0342 58.4637 28.4981 177.8057 73 L 3.8833 7.8899 120.3595 57.3930 41.4957 178.4028 74 D 4.5507 7.8352 116.2873 53.9382 41.4403 176.9043 75 L 4.2079 6.7611 119.9439 53.4767 42.3534 175.2563 76 P 4.3664 0.0000 0.0000 61.9845 31.8831 174.7384 77 P 4.2172 0.0000 0.0000 63.2791 31.7395 175.8340 78 F 4.9315 7.7948 116.0774 54.2703 41.1198 172.5360 79 P 4.3940 0.0000 0.0000 62.1937 32.1812 176.9033 80 Q 3.8062 8.0785 120.3997 59.4546 28.5162 178.3523 81 E 4.0174 8.3518 119.7629 59.7776 29.3824 178.8171 82 F 4.6657 8.7420 117.2299 60.3340 38.7977 177.5744 83 F 4.3246 9.0274 118.3523 60.3950 38.5926 177.4196 84 E 4.1740 8.4830 118.1159 59.4750 29.2151 179.4081 85 I 3.7813 7.9914 119.2724 64.1493 37.2213 177.7574 86 W 4.3375 8.6105 129.2907 60.9523 30.4901 177.9700 87 L 4.4520 8.8894 118.9665 57.6442 41.0744 179.3111 88 K 3.9473 8.6115 119.9506 59.8349 32.1960 178.8590 89 L 4.0619 8.3004 119.2368 57.5960 41.4130 179.4586 90 F 3.2800 8.3648 120.8885 60.9728 39.2253 176.7609 91 E 3.7563 8.5726 119.3814 59.2695 29.2509 178.6124 92 E 3.9069 8.1088 118.5284 59.5885 29.4254 179.5567 93 S 4.0539 7.9090 115.0947 61.5177 62.7786 176.7756 94 L 3.9031 7.7125 121.8146 57.8197 41.0645 179.2966 95 N 4.3420 8.0224 115.5762 56.3827 38.4895 177.2366 96 I 3.8368 7.3836 120.4173 63.7290 37.4398 177.8568 97 V 3.9242 7.6244 118.1098 63.3374 31.7400 175.0859 98 Y 5.2034 7.6291 114.3697 55.7532 40.9805 174.6201 99 N 4.7737 8.5134 119.2852 51.6473 39.2040 175.7779 100 E 3.9066 8.7904 117.8819 59.4574 29.5104 178.2372 101 E 3.8652 8.0646 118.5858 59.7125 29.9119 178.6183 102 M 3.9372 8.0856 118.3089 57.9424 31.9407 178.4420 103 K 3.6375 8.0006 119.8686 59.8183 32.4172 178.5777 104 N 4.3918 8.0743 116.4567 55.9874 38.2577 177.4720 105 V 3.5328 7.5309 119.2864 66.2314 31.5515 178.2693 106 I 3.6160 7.5722 119.2400 64.0341 36.9275 178.0736 107 L 4.0999 8.1777 121.6123 58.5793 41.9279 179.0447 108 Q 4.2664 7.9905 117.4799 58.9375 28.6169 179.0453 109 R 3.9049 7.9689 119.4945 59.4685 30.2186 178.3058 110 A 4.2846 8.6575 120.9248 55.5110 18.3197 179.5976 111 Q 3.9854 8.8524 116.7445 59.3469 28.7688 178.7761 112 M 3.9919 8.0869 119.1700 58.7031 32.2373 178.3820 113 I 3.4088 7.8319 119.7240 64.0083 37.1183 178.1086 114 A 3.7678 8.3318 121.9704 55.2723 18.1508 179.6247 115 S 3.8961 8.1513 111.6887 61.6610 62.4840 175.7985 116 H 4.1234 8.2662 120.9747 59.2801 29.6318 177.1461 117 F 4.4410 8.0940 119.6166 60.7627 38.7197 177.6033 118 Q 3.8988 7.9875 117.7555 59.1841 28.3000 178.5146 119 N 4.3231 8.3714 117.6926 56.6971 38.3025 176.9853 120 M 4.1419 7.2993 117.1335 57.5690 32.5409 178.3343 121 L 3.7798 7.5404 118.3501 56.3490 42.3966 177.2318 122 Y 4.7758 7.6928 115.6470 56.1436 38.5447 175.9723 123 K 3.9897 7.9201 118.8423 56.4357 33.0636 175.2282 124 Y 4.2023 8.5775 124.5294 57.8921 38.7515 174.9231 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 4.39 0.00 1.95 2.12 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 2 K 7.41 4.35 0.00 1.71 1.63 0.00 1.73 0.00 0.00 1.96 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.47 7.81 3 F 9.62 4.20 0.00 2.94 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 4 E 8.89 4.84 0.00 1.99 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 2.25 2.42 0.00 5 T 7.75 4.68 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 1.27 0.00 0.00 6 I 8.43 4.27 1.86 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 1.10 0.38 0.90 0.00 0.00 7 N 8.85 5.04 0.00 2.85 2.93 0.00 0.00 6.18 6.81 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 8 Q 8.64 3.99 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.96 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 9 E 8.02 3.93 0.00 2.08 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 2.40 2.39 0.00 10 S 7.36 2.98 0.00 2.97 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 11 I 7.66 3.67 1.93 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.86 1.09 0.00 0.00 12 A 7.83 4.05 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 13 K 7.86 3.88 0.00 1.90 1.78 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.45 7.81 14 L 8.05 3.89 0.00 1.83 1.89 0.57 1.00 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 15 M 8.54 4.47 0.00 2.36 2.44 0.00 0.00 0.00 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.02 3.12 0.00 16 E 8.25 4.04 0.00 2.18 2.12 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 2.33 2.42 0.00 17 I 7.81 3.66 1.85 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 1.38 1.24 0.87 0.00 0.00 18 F 8.39 4.27 0.00 2.85 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 19 Y 7.92 3.77 0.00 3.45 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 20 E 7.96 3.77 0.00 2.07 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 0.00 2.20 2.23 0.00 21 K 7.29 3.83 0.00 1.69 1.68 0.00 1.75 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.46 7.81 22 V 7.19 3.33 1.73 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 0.11 0.00 0.00 -0.44 0.00 0.00 23 R 7.53 3.50 0.00 1.18 1.58 0.00 2.21 0.00 0.00 2.55 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 24 K 7.27 4.07 0.00 1.72 1.73 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.31 1.38 7.81 25 D 7.17 4.45 0.00 2.74 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.53 4.06 0.00 1.88 1.89 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.43 7.81 27 D 8.03 4.43 0.00 2.20 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 28 L 8.55 4.26 0.00 1.57 1.81 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.01 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 30 P 0.00 4.36 0.00 2.24 2.17 0.00 3.70 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 31 I 7.84 3.73 2.05 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.85 0.63 0.00 0.00 32 F 8.56 3.86 0.00 3.49 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 33 N 8.66 4.93 0.00 2.95 3.02 0.00 0.00 6.58 6.48 0.00 0.00 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 N 8.51 4.40 0.00 2.73 2.89 0.00 0.00 7.00 7.72 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 35 A 7.49 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 I 8.22 3.92 1.34 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.31 0.37 0.00 0.00 37 G 8.22 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 38 T 8.14 4.76 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 1.29 0.00 0.00 39 S 8.45 4.46 0.00 4.15 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 40 D 8.74 4.49 0.00 2.75 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 41 E 8.21 4.06 0.00 2.23 2.25 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 2.40 2.46 0.00 42 E 8.15 4.07 0.00 2.30 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 2.36 2.40 0.00 43 W 8.51 4.03 0.00 3.41 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 44 K 8.60 4.04 0.00 2.05 1.92 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.65 7.81 45 E 8.30 3.93 0.00 2.09 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 2.23 2.13 0.00 46 H 8.05 4.13 0.00 3.03 3.10 0.00 5.88 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.27 3.92 0.00 2.10 2.01 0.00 1.85 0.00 0.00 2.00 0.00 0.00 3.17 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.75 1.72 7.81 48 A 8.29 4.05 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 49 K 8.40 3.98 0.00 1.91 1.98 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.66 1.71 7.81 50 I 8.29 3.92 2.18 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 1.74 0.81 1.43 0.00 0.00 51 G 8.56 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 52 N 8.48 4.42 0.00 3.17 3.21 0.00 0.00 6.88 7.30 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 53 F 8.10 3.63 0.00 1.69 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 54 W 8.60 4.12 0.00 3.70 3.22 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 0.00 55 A 8.84 4.17 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 56 G 8.08 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 57 M 7.56 3.91 0.00 1.86 1.38 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 58 L 8.17 4.56 0.00 1.76 1.72 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.74 4.64 0.00 1.77 1.80 0.96 0.90 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 60 G 8.17 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 61 E 7.91 4.50 0.00 2.05 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 2.36 0.00 62 G 8.87 4.66 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 63 D 8.32 4.94 0.00 2.76 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 64 Y 8.36 4.19 0.00 2.96 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 65 N 7.78 4.76 0.00 2.66 2.69 0.00 0.00 6.22 7.00 0.00 0.00 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 G 5.79 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 8.01 4.52 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.83 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 68 P 0.00 4.22 0.00 2.34 2.09 0.00 3.74 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 69 L 7.91 3.34 0.00 1.81 1.65 0.72 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.01 3.70 0.00 1.84 1.76 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.71 7.81 71 K 7.47 3.75 0.00 1.82 1.65 0.00 1.67 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.63 1.57 7.81 72 H 7.64 4.31 0.00 2.81 3.24 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.89 3.88 0.00 1.62 1.62 0.82 0.88 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 74 D 7.84 4.55 0.00 2.62 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 6.76 4.21 0.00 1.84 1.73 0.88 1.15 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 76 P 0.00 4.37 0.00 2.12 2.04 0.00 3.74 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 2.06 2.13 0.00 77 P 0.00 4.22 0.00 2.04 1.98 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 2.02 2.06 0.00 78 F 7.79 4.93 0.00 2.82 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 79 P 0.00 4.39 0.00 2.07 2.07 0.00 2.53 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.62 0.00 80 Q 8.08 3.81 0.00 0.93 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.03 0.00 81 E 8.35 4.02 0.00 2.20 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 0.00 2.57 2.84 0.00 82 F 8.74 4.67 0.00 3.46 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 83 F 9.03 4.32 0.00 3.55 3.27 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 84 E 8.48 4.17 0.00 2.46 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 2.47 2.52 0.00 85 I 7.99 3.78 2.09 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.91 0.90 0.00 0.00 86 W 8.61 4.34 0.00 3.62 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 87 L 8.89 4.45 0.00 2.10 1.95 1.16 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.61 3.95 0.00 2.16 2.03 0.00 1.69 0.00 0.00 1.89 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.70 7.81 89 L 8.30 4.06 0.00 2.09 1.80 0.79 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 90 F 8.36 3.28 0.00 1.91 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 91 E 8.57 3.76 0.00 2.08 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 0.00 2.28 2.32 0.00 92 E 8.11 3.91 0.00 2.23 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 2.31 2.45 0.00 93 S 7.91 4.05 0.00 3.69 3.81 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 94 L 7.71 3.90 0.00 1.61 1.55 0.60 0.29 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 95 N 8.02 4.34 0.00 2.81 2.85 0.00 0.00 7.10 6.97 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 96 I 7.38 3.84 1.97 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 1.37 0.58 0.87 0.00 0.00 97 V 7.62 3.92 1.80 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 0.32 0.00 0.00 0.90 0.00 0.00 98 Y 7.63 5.20 0.00 2.99 2.79 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 0.00 99 N 8.51 4.77 0.00 2.92 3.00 0.00 0.00 7.02 7.65 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 0.00 100 E 8.79 3.91 0.00 2.10 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 2.38 2.43 0.00 101 E 8.06 3.87 0.00 2.07 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 0.00 2.36 2.39 0.00 102 M 8.09 3.94 0.00 1.67 2.18 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.85 0.00 103 K 8.00 3.64 0.00 1.90 1.97 0.00 1.60 0.00 0.00 1.60 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.72 7.81 104 N 8.07 4.39 0.00 2.92 2.83 0.00 0.00 6.69 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 0.00 105 V 7.53 3.53 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 0.99 0.00 0.00 0.91 0.00 0.00 106 I 7.57 3.62 1.47 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.29 0.35 0.00 0.00 107 L 8.18 4.10 0.00 1.76 1.72 1.09 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 108 Q 7.99 4.27 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 109 R 7.97 3.90 0.00 1.99 2.34 0.00 3.16 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 110 A 8.66 4.28 1.71 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 0.00 0.00 111 Q 8.85 3.99 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 112 M 8.09 3.99 0.00 2.17 2.06 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 2.58 2.70 0.00 113 I 7.83 3.41 1.75 0.00 0.00 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 1.33 0.46 0.06 0.00 0.00 114 A 8.33 3.77 1.38 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 0.00 0.00 0.00 115 S 8.15 3.90 0.00 3.94 3.97 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 0.00 116 H 8.27 4.12 0.00 3.23 3.33 0.00 5.84 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 0.00 117 F 8.09 4.44 0.00 3.06 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 0.00 118 Q 7.99 3.90 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.71 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 119 N 8.37 4.32 0.00 2.84 2.88 0.00 0.00 7.06 7.25 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 0.00 120 M 7.30 4.14 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.68 0.00 121 L 7.54 3.78 0.00 0.83 0.18 0.91 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 122 Y 7.69 4.78 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 0.00 123 K 7.92 3.99 0.00 1.67 1.73 0.00 1.56 0.00 0.00 2.28 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.42 7.81 124 Y 8.58 4.20 0.00 2.95 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