NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8140 8.3544 109.7190 44.8390 0.0000 174.0075 4 D 4.1447 8.6240 123.2996 54.0555 42.3804 175.8743 5 K 4.0179 9.4743 128.3773 59.2027 32.7912 178.4762 6 K 3.9807 8.5547 118.9253 58.5645 31.9684 179.3662 7 V 3.7047 8.0353 118.4827 66.0570 31.4334 177.9281 8 I 3.7051 7.6858 119.2363 64.4394 36.9878 178.4302 9 Q 3.9517 7.7995 118.9600 59.2438 28.5401 178.4853 10 H 4.1768 8.1282 117.1391 58.9994 28.7432 177.8309 11 L 4.0537 8.2060 120.7915 57.9765 41.4270 179.3876 12 N 4.5222 8.5511 116.2748 55.4032 38.3662 177.3402 13 K 3.9861 7.7346 120.9566 59.0248 32.5310 178.5279 14 I 3.6488 8.1067 120.4980 64.5644 37.0917 177.8695 15 L 4.0476 8.3966 121.4759 58.4395 41.8727 179.3923 16 G 3.5914 7.8723 105.1379 47.7757 0.0000 175.4815 17 N 4.3768 8.1717 118.8447 56.1729 38.5654 177.3746 18 E 3.9876 8.1159 119.9988 59.3669 29.0069 179.3806 19 L 4.0816 7.8428 119.0808 57.6075 41.5513 179.7346 20 I 3.6294 7.6354 119.2392 64.3504 37.0402 178.2998 21 A 3.3149 7.7805 121.5456 54.7448 18.0767 179.6300 22 I 3.5868 7.8801 118.6709 64.7717 37.2640 178.4805 23 N 4.3781 7.7024 116.2289 56.2755 38.3385 177.2999 24 Q 3.8873 8.2891 121.4105 59.4361 29.0660 178.0668 25 Y 4.6109 8.0771 117.8037 60.8036 38.0655 177.4945 26 F 3.9006 8.4365 121.7178 61.3850 39.4742 176.9878 27 L 4.0113 8.2045 119.7027 58.5054 41.8642 178.5697 28 H 3.8499 8.3010 116.2742 58.7280 28.6830 177.6008 29 S 4.3366 8.7637 115.2297 61.7200 62.2448 176.4514 30 R 3.9790 7.8948 120.1003 58.6134 29.8247 179.0073 31 M 3.4454 7.8020 118.9948 58.0274 31.9355 178.3981 32 W 4.6167 7.6399 118.9687 60.3064 29.2252 178.4237 33 N 4.4519 8.2247 115.9590 56.1077 37.7490 176.8601 34 D 4.3425 7.7306 118.7510 57.1918 41.4007 177.8364 35 W 4.8180 7.9112 115.9790 56.9234 28.9463 177.2110 36 G 3.9980 8.2364 108.1805 46.3563 0.0000 174.3078 37 L 4.7854 7.9233 122.2619 53.5245 38.5613 177.5619 38 K 4.0819 8.4911 121.2766 58.7505 32.5174 179.1675 39 R 3.8882 7.8935 119.5532 59.1591 30.0095 178.2773 40 L 3.8034 7.7862 118.4538 57.5807 41.5207 179.2090 41 G 4.0254 8.2058 105.5397 48.1864 0.0000 175.4948 42 A 4.0284 7.9285 123.2347 55.0307 18.4627 179.2400 43 H 3.9744 8.2653 116.8777 59.2650 29.8943 177.0968 44 E 4.0190 8.5622 121.3485 58.9459 29.5270 177.7445 45 Y 4.0669 8.0918 119.7981 61.3479 38.7542 178.1797 46 H 3.9462 8.4129 116.7926 58.7885 28.5782 177.6489 47 E 3.8313 8.0568 120.4938 59.2721 29.1828 179.4066 48 S 4.2891 8.0679 113.1853 61.4759 62.5245 176.1357 49 I 3.5587 7.5296 122.4988 64.5640 36.8340 177.9130 50 D 4.2820 8.1546 119.6454 57.6517 40.5885 178.8732 51 E 4.2868 7.7908 119.9320 58.5402 29.5076 179.0945 52 M 4.0465 8.0311 119.1320 58.1487 31.8923 178.9207 53 K 3.9681 7.9312 118.7680 59.6568 32.2392 178.9246 54 H 4.2051 8.1298 116.2888 58.9476 28.5847 177.4718 55 A 3.9773 8.1908 122.4324 55.3133 18.1891 179.1458 56 D 4.2504 8.2365 116.4081 57.5564 41.1942 178.6076 57 K 3.9893 8.2746 119.0098 59.4023 31.9584 179.4226 58 L 4.0273 7.9746 119.3159 57.8206 41.6456 179.4446 59 I 3.7225 8.0038 119.9525 64.5313 37.0301 178.3484 60 E 4.0299 8.4119 119.4479 59.3039 29.2655 179.4565 61 R 4.0540 7.9022 118.6429 59.4276 30.1677 178.5158 62 I 3.7615 7.9801 119.7238 64.4571 37.1542 178.4760 63 L 4.0067 7.9036 119.4020 57.6667 41.2289 179.2638 64 F 4.3325 8.0535 119.8842 60.8400 39.4190 176.2971 65 L 3.9105 7.7095 115.8948 54.3235 41.7531 176.9529 66 E 3.8025 7.8001 117.6265 56.7561 27.1811 174.9783 67 G 3.8738 7.8739 109.1179 44.5614 0.0000 173.2245 68 L 4.5763 8.0312 119.1756 51.9526 42.7428 175.0873 69 P 4.2965 0.0000 0.0000 62.5477 31.7085 175.6356 70 N 4.7062 9.7579 123.2759 52.4393 38.7461 174.0154 71 L 4.6985 8.3393 124.1227 54.5273 42.7879 177.3687 72 Q 4.0280 8.8119 122.4564 57.9135 29.2788 175.4439 73 D 4.5805 8.1086 117.9266 52.8749 40.7011 175.2160 74 L 4.5592 8.2300 126.9011 52.7264 43.6512 177.3568 75 G 3.8123 8.3482 116.6135 45.0941 0.0000 171.1428 76 K 4.2084 8.3834 121.3515 55.1236 32.8250 177.1951 77 L 4.0676 8.3900 126.9982 54.3305 41.8534 176.9064 78 L 4.2673 8.3182 125.1177 53.8559 40.6069 176.0886 79 I 4.3856 8.0585 124.9397 59.1335 38.2920 176.6502 80 G 3.9738 8.6785 115.1747 45.0991 0.0000 172.1810 81 E 4.7550 8.7170 114.4650 55.3903 30.8393 175.4640 82 N 5.0958 7.7231 116.8057 50.6685 42.0711 174.8831 83 T 4.4179 8.6031 116.4259 67.1261 68.4649 176.6007 84 Q 4.0022 8.7221 121.6534 59.2820 29.1003 178.0615 85 E 4.0609 8.4280 119.1898 59.4852 29.4157 179.0426 86 M 3.9408 8.0624 118.9100 58.2436 31.8983 178.7598 87 L 4.1576 8.1367 119.0615 57.9931 41.8605 179.1209 88 Q 3.9723 7.9139 118.9986 59.7298 28.8971 178.4848 89 C 4.2779 8.3844 117.5156 62.9844 28.1615 175.9032 90 D 4.6719 7.9925 120.7594 57.1399 40.4131 178.5632 91 L 3.9775 8.2882 121.1816 58.2655 42.0020 178.6350 92 N 4.3402 8.6301 116.9007 56.3507 38.3812 177.1759 93 L 4.0193 8.1163 121.5837 58.2958 42.3190 178.9237 94 E 4.0585 8.4172 118.5778 59.3515 29.4839 179.3318 95 L 4.0590 8.1999 119.2520 57.5135 41.4916 179.3564 96 K 4.0792 7.9670 119.5663 59.0623 32.1501 178.7857 97 A 4.0285 8.3577 121.5668 55.5191 18.4104 179.7991 98 T 3.9204 7.9475 114.0796 66.2757 68.4189 177.0478 99 K 3.9772 7.6807 120.9903 59.6278 32.4360 178.7663 100 D 4.4331 7.9306 119.2006 57.0916 40.6709 178.7926 101 L 4.0051 7.9577 119.8174 57.8455 41.6918 179.7479 102 R 3.9464 7.8753 117.5100 59.3483 30.0369 178.9960 103 E 3.9826 8.2384 118.1728 59.2521 29.3576 179.3217 104 A 3.5784 7.8893 120.7071 54.8769 18.4047 179.7523 105 I 3.6504 7.8108 118.4498 64.4062 37.2741 178.7707 106 V 3.5608 7.7184 119.0391 66.2249 31.4650 177.6092 107 H 4.1314 8.0247 117.4774 59.5082 29.7635 177.0317 108 C 4.0579 8.2107 118.6147 62.6935 27.8857 175.7568 109 E 3.9091 8.3608 121.1034 59.2703 29.0230 178.6740 110 Q 3.9150 7.5766 118.1716 58.8338 29.1920 177.6389 111 V 3.8080 7.0311 109.8495 60.7887 31.6895 175.8939 112 H 2.9942 7.0818 113.9599 56.9536 27.0091 176.3978 113 D 4.5302 7.4324 120.3568 53.3017 37.6023 175.9365 114 Y 4.3484 7.3482 121.1192 60.8051 38.5587 178.2048 115 V 3.7231 7.9264 118.9438 65.9295 31.7724 178.1411 116 S 4.2274 8.4893 115.1248 61.1014 62.6433 176.3312 117 R 3.8987 7.9217 121.5035 59.6192 29.8011 178.0907 118 D 4.2953 7.8150 117.6973 57.1109 41.2481 177.5483 119 L 3.9321 7.7760 120.6041 58.4159 42.0598 178.9579 120 L 3.9587 7.9251 118.5052 57.7062 41.5954 179.3027 121 K 3.8639 8.5949 119.7665 59.8241 32.1596 178.4241 122 D 4.3705 8.1809 118.8788 57.4808 40.6654 178.8970 123 I 3.5289 7.8052 120.3342 64.1538 36.9933 178.2355 124 L 3.9576 8.4979 121.5845 58.0472 41.8510 178.6752 125 E 3.9300 8.3501 119.3467 59.3081 29.6259 178.7784 126 S 4.1229 8.0210 112.9691 61.5414 62.4980 176.0195 127 E 4.2232 8.6619 121.6383 59.3913 29.1459 179.2191 128 E 4.0712 8.6016 119.3149 59.2719 29.4821 179.0713 129 E 4.0421 8.4826 118.9338 59.7729 29.5572 178.9190 130 H 4.4571 8.4219 118.1652 59.0739 29.7946 177.5532 131 I 3.7335 7.9114 122.0358 64.3423 37.0417 177.4610 132 D 4.3661 8.2320 118.9433 57.7461 40.9118 178.0502 133 Y 4.0665 8.1984 119.6168 60.8096 38.9506 177.8134 134 L 3.7532 8.1507 119.8934 57.8547 41.6616 179.3976 135 E 4.0122 8.4183 118.4887 59.2994 29.4916 179.3461 136 T 3.8093 7.6658 115.5020 66.5016 68.4436 176.7496 137 Q 3.7171 7.7892 119.8854 58.7583 28.6013 178.5910 138 L 3.8306 7.5617 119.9364 57.9457 41.8639 180.0817 139 G 3.6042 8.1097 105.1614 47.5222 0.0000 175.6765 140 L 4.0627 7.7141 121.3166 57.4240 41.7070 179.4673 141 I 3.5189 7.2470 119.9377 64.5114 36.8228 178.3514 142 Q 3.9898 7.4735 117.1442 58.7857 28.5315 178.8455 143 K 4.2029 7.6455 118.0498 58.3557 32.5966 178.7506 144 V 4.2334 8.2621 109.4915 59.6995 32.9297 176.0934 145 G 4.0483 7.7430 107.8637 45.9084 0.0000 174.0349 146 L 3.9695 8.7574 124.7556 58.4131 42.0051 179.5625 147 E 4.0537 8.1696 116.5629 59.2541 29.4488 178.7103 148 N 4.2446 8.1605 117.0474 56.3452 38.5902 176.1595 149 Y 4.1175 7.9143 119.7366 61.0274 39.0317 178.2959 150 L 3.9747 8.0868 119.4338 57.6569 41.8688 178.8605 151 Q 3.8866 7.8699 119.5644 59.6865 28.7560 179.2242 152 S 4.3118 7.9852 113.2888 60.3623 63.0321 174.5454 153 H 4.6946 7.9764 118.6357 55.5940 30.1480 175.5755 154 M 4.1811 8.0607 121.5081 57.5634 31.9646 176.2276 155 H 5.1928 7.6575 113.4913 53.9607 31.1840 174.5000 156 E 4.1687 8.6312 120.6840 56.7370 29.4446 176.5832 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 G 8.35 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 0.00 0.00 0.00 4 D 8.62 4.14 0.00 2.86 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 5 K 9.47 4.02 0.00 1.84 1.77 0.00 1.74 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.50 7.81 6 K 8.55 3.98 0.00 1.89 1.53 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.25 1.33 7.81 7 V 8.04 3.70 2.24 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 1.21 0.00 0.00 0.99 0.00 0.00 8 I 7.69 3.71 1.99 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 1.51 0.51 0.90 0.00 0.00 9 Q 7.80 3.95 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 10 H 8.13 4.18 0.00 3.37 3.32 0.00 5.62 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 11 L 8.21 4.05 0.00 1.85 1.74 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.55 4.52 0.00 2.85 2.86 0.00 0.00 6.66 7.78 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 13 K 7.73 3.99 0.00 1.96 1.96 0.00 1.64 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.47 7.81 14 I 8.11 3.65 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.87 0.92 0.00 0.00 15 L 8.40 4.05 0.00 1.78 1.82 0.92 1.03 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 16 G 7.87 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.17 4.38 0.00 2.99 2.88 0.00 0.00 7.02 7.69 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 18 E 8.12 3.99 0.00 2.15 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 2.53 2.52 0.00 19 L 7.84 4.08 0.00 1.84 1.68 0.90 0.83 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 20 I 7.64 3.63 1.95 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 1.41 0.69 0.89 0.00 0.00 21 A 7.78 3.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.88 3.59 1.97 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 1.50 0.98 0.88 0.00 0.00 23 N 7.70 4.38 0.00 2.79 2.83 0.00 0.00 6.74 7.60 0.00 0.00 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 Q 8.29 3.89 0.00 2.03 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 25 Y 8.08 4.61 0.00 3.11 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 26 F 8.44 3.90 0.00 3.33 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 27 L 8.20 4.01 0.00 1.89 1.83 0.88 0.87 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 28 H 8.30 3.85 0.00 3.49 2.88 0.00 5.70 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.76 4.34 0.00 3.98 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 30 R 7.89 3.98 0.00 1.88 1.88 0.00 2.98 0.00 0.00 2.61 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 31 M 7.80 3.45 0.00 0.91 1.65 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.17 0.00 32 W 7.64 4.62 0.00 3.69 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 33 N 8.22 4.45 0.00 2.77 2.85 0.00 0.00 6.64 7.77 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 34 D 7.73 4.34 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.91 4.82 0.00 3.73 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 36 G 8.24 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 4.79 0.00 2.14 1.63 1.27 0.87 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 38 K 8.49 4.08 0.00 2.05 1.86 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.48 7.81 39 R 7.89 3.89 0.00 1.96 1.81 0.00 2.99 0.00 0.00 2.88 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 40 L 7.79 3.80 0.00 1.25 0.17 0.34 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.21 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 0.00 0.00 0.00 42 A 7.93 4.03 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 43 H 8.27 3.97 0.00 3.34 3.26 0.00 5.78 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.56 4.02 0.00 2.51 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 0.00 2.80 2.68 0.00 45 Y 8.09 4.07 0.00 3.03 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 46 H 8.41 3.95 0.00 3.29 3.22 0.00 5.87 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 E 8.06 3.83 0.00 2.05 1.79 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 2.23 2.08 0.00 48 S 8.07 4.29 0.00 4.10 4.09 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 0.00 0.00 0.00 49 I 7.53 3.56 1.82 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.01 0.82 0.00 0.00 50 D 8.15 4.28 0.00 2.82 2.61 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 0.00 0.00 0.00 0.00 51 E 7.79 4.29 0.00 2.09 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 2.62 2.54 0.00 52 M 8.03 4.05 0.00 2.04 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 2.89 2.55 0.00 53 K 7.93 3.97 0.00 1.92 1.83 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.61 7.81 54 H 8.13 4.21 0.00 3.52 3.35 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.19 3.98 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 56 D 8.24 4.25 0.00 2.80 2.83 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 57 K 8.27 3.99 0.00 2.00 1.87 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.66 7.81 58 L 7.97 4.03 0.00 1.89 1.73 0.96 0.86 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 59 I 8.00 3.72 2.07 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 1.53 1.11 0.92 0.00 0.00 60 E 8.41 4.03 0.00 2.17 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 2.41 0.00 61 R 7.90 4.05 0.00 2.02 2.13 0.00 3.38 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 62 I 7.98 3.76 1.89 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 1.54 0.54 0.92 0.00 0.00 63 L 7.90 4.01 0.00 2.07 1.77 0.93 1.13 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 64 F 8.05 4.33 0.00 2.98 3.29 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 65 L 7.71 3.91 0.00 1.62 1.59 0.95 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.80 3.80 0.00 2.07 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 2.14 2.10 0.00 67 G 7.87 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 68 L 8.03 4.58 0.00 1.61 1.60 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.30 0.00 2.04 2.00 0.00 3.66 0.00 0.00 3.76 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 70 N 9.76 4.71 0.00 2.61 2.85 0.00 0.00 7.05 6.19 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 71 L 8.34 4.70 0.00 1.60 1.60 0.91 0.95 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 72 Q 8.81 4.03 0.00 1.94 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 73 D 8.11 4.58 0.00 2.69 2.61 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 0.00 0.00 0.00 0.00 74 L 8.23 4.56 0.00 1.53 1.53 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.35 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 0.00 0.00 0.00 76 K 8.38 4.21 0.00 1.70 1.72 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.51 7.81 77 L 8.39 4.07 0.00 1.64 1.58 0.88 1.01 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 78 L 8.32 4.27 0.00 1.76 1.70 0.96 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 79 I 8.06 4.39 1.89 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 1.49 0.82 0.92 0.00 0.00 80 G 8.68 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 0.00 0.00 0.00 81 E 8.72 4.76 0.00 2.12 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 2.37 2.32 0.00 82 N 7.72 5.10 0.00 2.89 2.87 0.00 0.00 6.24 7.22 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 83 T 8.60 4.42 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 1.54 0.00 0.00 84 Q 8.72 4.00 0.00 2.12 2.18 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 2.34 2.36 0.00 85 E 8.43 4.06 0.00 2.09 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 2.42 2.42 0.00 86 M 8.06 3.94 0.00 1.56 2.33 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 1.92 0.00 87 L 8.14 4.16 0.00 1.77 1.74 0.88 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 7.91 3.97 0.00 2.17 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 89 C 8.38 4.28 0.00 3.35 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 90 D 7.99 4.67 0.00 2.95 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 91 L 8.29 3.98 0.00 1.76 1.89 0.93 0.92 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 92 N 8.63 4.34 0.00 2.93 2.89 0.00 0.00 6.71 6.47 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 93 L 8.12 4.02 0.00 1.97 1.96 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.42 4.06 0.00 2.22 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 2.65 2.48 0.00 95 L 8.20 4.06 0.00 1.88 1.74 0.94 0.69 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 96 K 7.97 4.08 0.00 1.85 2.08 0.00 1.54 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.51 7.81 97 A 8.36 4.03 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 98 T 7.95 3.92 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 1.27 0.00 0.00 99 K 7.68 3.98 0.00 2.14 1.80 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.49 7.81 100 D 7.93 4.43 0.00 2.69 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 0.00 101 L 7.96 4.01 0.00 2.03 1.72 0.92 1.04 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 0.00 102 R 7.88 3.95 0.00 2.04 1.98 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 103 E 8.24 3.98 0.00 2.03 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 2.34 0.00 104 A 7.89 3.58 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.81 3.65 1.87 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 1.42 0.67 0.93 0.00 0.00 106 V 7.72 3.56 2.24 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 1.00 0.00 0.00 0.97 0.00 0.00 107 H 8.02 4.13 0.00 3.31 3.40 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 0.00 108 C 8.21 4.06 0.00 3.14 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 0.00 109 E 8.36 3.91 0.00 2.11 2.16 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 2.36 2.41 0.00 110 Q 7.58 3.92 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 111 V 7.03 3.81 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 0.69 0.00 0.00 0.81 0.00 0.00 112 H 7.08 2.99 0.00 3.11 3.07 0.00 5.66 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.43 4.53 0.00 2.64 2.48 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 0.00 0.00 0.00 0.00 114 Y 7.35 4.35 0.00 3.09 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 0.00 115 V 7.93 3.72 2.16 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 1.10 0.00 0.00 1.00 0.00 0.00 116 S 8.49 4.23 0.00 3.95 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 0.00 117 R 7.92 3.90 0.00 1.97 2.27 0.00 3.25 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 118 D 7.82 4.30 0.00 2.97 2.67 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 0.00 119 L 7.78 3.93 0.00 1.96 1.84 0.95 0.52 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 0.00 120 L 7.93 3.96 0.00 1.92 1.71 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.59 3.86 0.00 1.95 2.06 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.37 7.81 122 D 8.18 4.37 0.00 2.95 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 0.00 123 I 7.81 3.53 1.96 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 1.13 0.78 0.82 0.00 0.00 124 L 8.50 3.96 0.00 1.77 1.85 0.94 0.84 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 0.00 125 E 8.35 3.93 0.00 2.10 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 2.33 2.34 0.00 126 S 8.02 4.12 0.00 4.04 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 0.00 127 E 8.66 4.22 0.00 2.04 2.27 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 2.59 2.53 0.00 128 E 8.60 4.07 0.00 2.24 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 2.36 2.47 0.00 129 E 8.48 4.04 0.00 2.22 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 2.37 2.36 0.00 130 H 8.42 4.46 0.00 3.28 3.48 0.00 5.60 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 7.91 3.73 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.57 0.93 0.00 0.00 132 D 8.23 4.37 0.00 2.84 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 0.00 133 Y 8.20 4.07 0.00 3.18 3.18 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 0.00 134 L 8.15 3.75 0.00 2.09 1.67 1.05 0.65 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 0.00 135 E 8.42 4.01 0.00 1.98 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 2.30 2.51 0.00 136 T 7.67 3.81 4.27 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 1.19 0.00 0.00 137 Q 7.79 3.72 0.00 1.83 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 1.38 1.84 0.00 138 L 7.56 3.83 0.00 1.77 1.62 0.82 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.11 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.71 4.06 0.00 1.72 1.80 1.02 0.63 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 0.00 141 I 7.25 3.52 1.80 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.33 0.81 0.00 0.00 142 Q 7.47 3.99 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00 143 K 7.65 4.20 0.00 1.75 1.85 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.64 7.81 144 V 8.26 4.23 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 0.78 0.00 0.00 1.11 0.00 0.00 145 G 7.74 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 0.00 146 L 8.76 3.97 0.00 1.76 1.71 0.97 0.90 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 0.00 147 E 8.17 4.05 0.00 2.20 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 2.36 2.34 0.00 148 N 8.16 4.24 0.00 3.13 2.93 0.00 0.00 6.74 7.48 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 0.00 149 Y 7.91 4.12 0.00 3.00 3.24 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 0.00 150 L 8.09 3.97 0.00 1.76 1.71 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 7.87 3.89 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 152 S 7.99 4.31 0.00 3.88 3.70 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 0.00 153 H 7.98 4.69 0.00 2.98 3.02 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 8.06 4.18 0.00 1.90 1.99 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.44 0.00 155 H 7.66 5.19 0.00 3.08 3.14 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.63 4.17 0.00 1.94 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 2.28 2.29 0.00