NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4870 8.3049 120.3475 55.2419 33.8024 175.9615 2 L 4.1716 7.6715 116.4371 54.2605 44.5258 175.6618 3 M 2.5500 8.2279 114.4917 53.0903 32.6369 173.9470 4 P 4.4840 0.0000 0.0000 61.4611 31.3929 176.4055 5 R 3.8713 8.4182 120.3351 57.1068 29.7672 173.1098 6 R 3.8062 8.4186 125.4948 55.7039 31.0357 175.2193 7 M 4.1809 7.8764 118.9946 54.8725 34.9694 174.7773 8 K 3.7957 8.8851 127.7254 58.9127 32.6394 176.6696 9 Y 4.8030 7.3685 114.8415 56.0958 41.5404 174.8478 10 R 4.2434 8.6733 120.9454 56.0068 30.9702 173.1647 11 K 3.7559 8.7571 125.7800 56.0954 29.9191 175.1753 12 Q 4.6032 8.1185 120.4207 53.5681 31.4374 175.3037 13 Q 4.0982 8.5403 118.4121 56.3964 29.3335 178.6818 14 R 4.0582 8.6596 118.6032 57.2184 30.8621 178.8311 15 G 3.9112 7.3032 106.6642 46.1608 0.0000 172.3427 16 R 4.7597 8.2245 117.6033 55.4011 32.9629 175.1662 17 L 4.5472 8.3309 122.3291 54.5936 42.1390 177.1789 18 K 3.7928 8.7697 117.9013 56.9701 32.5576 177.5573 19 G 3.5261 7.6590 105.7102 44.0230 0.0000 175.0296 20 A 4.2802 8.4712 127.7130 52.3951 19.8506 176.9538 21 T 3.9343 8.5421 112.5994 63.9760 71.8215 171.7892 22 K 4.1035 8.1780 120.3100 53.6869 34.9077 172.1290 23 G 3.7045 8.9487 103.9846 44.3539 0.0000 173.1051 24 G 3.8396 8.6229 106.0885 48.3765 0.0000 176.0594 25 D 5.2672 8.6765 119.8124 54.4555 41.4241 174.2958 26 Y 4.7841 7.8695 111.7872 56.1316 40.2260 171.5855 27 V 4.4978 9.3307 126.1693 64.1127 32.3370 171.1927 28 A 4.3938 8.9345 125.0897 52.1469 20.8597 175.7041 29 F 4.1924 8.8808 113.8490 58.3830 41.8495 178.6279 30 G 4.2005 7.9549 114.7736 46.4486 0.0000 171.8105 31 D 4.5833 9.2754 118.2922 54.6699 42.6295 176.8993 32 Y 5.4755 7.3752 115.2129 55.4942 41.5267 175.0432 33 G 4.3239 8.8223 111.9418 44.9340 0.0000 171.0821 34 L 5.4003 8.4550 121.4753 53.2244 44.0253 175.9209 35 V 5.1884 9.3464 126.5500 60.0694 33.8786 175.0759 36 A 4.9382 8.3831 122.7007 50.9733 21.0291 177.3959 37 L 4.8416 8.5005 116.9419 54.2891 43.6515 176.6143 38 E 4.8870 7.9749 117.6922 53.7887 33.4945 173.4852 39 P 5.3550 0.0000 0.0000 62.7297 32.6888 174.8906 40 A 4.2917 8.1140 121.2263 51.7562 22.5889 174.7997 41 W 5.2937 8.8069 119.2146 55.5219 30.6444 176.2541 42 I 4.6029 8.7769 127.4536 60.0311 38.2581 176.1069 43 T 4.3726 9.5147 118.1005 61.0606 69.8122 175.2926 44 A 3.9362 8.6149 127.5333 55.6308 18.0960 179.7137 45 Q 4.2775 7.7513 111.1530 57.6348 28.8361 177.5358 46 Q 4.3474 8.4794 119.0142 57.9909 30.0524 177.7368 47 I 4.0403 7.7192 120.2419 64.2878 37.1179 177.8623 48 E 3.8834 8.5049 120.2367 59.0269 29.7299 178.2392 49 A 3.9380 7.6934 119.4886 55.7311 18.3849 179.1778 50 A 3.7086 8.4217 119.3522 54.6273 18.4234 179.4139 51 R 3.6675 8.3522 116.6359 60.1350 30.1297 178.3287 52 V 3.4695 8.4569 117.7110 65.7448 31.3595 177.7325 53 A 3.5096 8.0809 119.8749 56.2005 18.4417 178.1351 54 M 3.7811 8.0888 117.8739 56.5107 31.9429 178.1897 55 V 3.6019 7.8758 119.0066 65.2457 31.5048 178.8450 56 R 3.7594 8.3518 118.8970 59.3522 30.0806 177.2565 57 H 4.2726 7.4616 117.1243 58.1122 30.3396 175.7294 58 F 5.0480 6.9996 121.3889 54.0604 38.3658 172.9060 59 R 4.0766 8.4423 125.0934 56.8192 29.5737 176.9369 60 R 3.7879 8.2478 125.6952 56.8920 28.0840 176.3941 61 G 3.6595 9.0196 106.5744 44.5979 0.0000 173.1242 62 G 3.5417 8.0134 104.0254 48.1656 0.0000 173.8144 63 K 4.5888 6.1030 117.4346 54.7036 37.0005 175.1671 64 I 4.8556 7.8514 124.0722 59.8895 40.6076 174.7550 65 F 4.6515 8.9736 122.7977 57.8688 41.1317 176.2838 66 I 3.8299 9.3850 117.0193 61.3788 37.2119 175.1666 67 R 3.7661 8.0480 114.7768 55.8675 28.3027 175.7018 68 I 4.6086 7.1847 109.5299 59.0623 40.3543 174.7871 69 F 4.6102 8.2693 123.2040 56.4495 42.1245 171.6987 70 P 5.2556 0.0000 0.0000 62.6316 31.1347 175.5138 71 D 4.9180 8.8431 122.7864 52.4515 41.2485 175.4647 72 K 4.5038 7.9664 122.3051 54.6684 33.2152 173.8634 73 P 4.3292 0.0000 0.0000 62.8566 30.9944 175.2436 74 Y 4.5467 8.1247 125.2722 56.0194 40.9052 174.6149 75 T 4.8504 7.9314 116.7851 60.5008 71.6756 174.1907 76 K 4.5114 8.0422 123.1867 55.0783 35.6514 175.8468 77 K 4.5485 8.7811 126.8433 56.2831 32.6813 174.0738 78 P 4.7275 0.0000 0.0000 63.0714 31.7802 175.8054 79 L 3.8063 8.0911 113.5433 56.6916 39.1195 175.1784 80 E 4.7743 7.7108 122.7755 56.5782 31.1160 177.1197 81 V 4.0473 8.6930 126.4062 63.3933 32.8276 177.0558 82 R 4.7349 8.3392 108.4628 56.1989 31.1878 176.3002 83 M 4.5910 7.8964 121.4364 51.9585 32.7368 176.0600 84 G 3.9978 8.3338 107.0722 44.1687 0.0000 171.1261 85 K 3.7621 8.4662 120.6775 56.1732 32.6136 176.8691 86 G 3.8011 8.7395 114.3257 45.9648 0.0000 174.0600 87 K 4.1931 8.8566 121.4818 57.7726 33.0155 179.0603 88 G 3.9934 7.6954 110.4819 47.5868 0.0000 174.6587 89 N 4.1572 8.7295 119.8128 55.2953 39.1861 176.0203 90 V 3.6362 8.4167 117.3470 66.4979 31.0231 178.5292 91 E 3.5016 6.3994 118.6748 55.3290 32.9975 179.1348 92 G 4.3196 6.4320 108.0013 45.5172 0.0000 174.4475 93 Y 4.9149 8.1161 120.2784 56.5368 42.6701 172.8971 94 V 4.9826 8.8761 113.9787 59.5646 36.5930 174.2872 95 A 4.9948 8.7221 123.9363 49.8857 21.3222 176.1603 96 V 4.0930 8.4815 123.3885 63.0864 32.7224 175.4830 97 V 4.4932 9.0944 126.8847 61.1488 33.4628 173.9949 98 K 4.9290 8.0283 126.5484 54.9157 35.3650 173.5173 99 P 4.1129 0.0000 0.0000 61.7598 32.1207 175.9963 100 G 3.8437 9.4881 111.2520 45.3397 0.0000 172.0409 101 R 4.6030 7.2831 118.8466 54.5624 31.5435 175.6990 102 V 3.8173 8.5972 127.0505 63.2775 31.2282 174.8200 103 M 3.9969 8.7889 128.1372 55.4064 34.3423 175.4134 104 F 4.2257 9.7704 120.2065 54.3049 38.7571 171.2205 105 E 4.3113 8.9096 126.6725 56.2503 31.5042 173.8879 106 V 5.0315 8.4215 117.0961 60.3390 36.1419 173.4897 107 A 4.5931 8.7893 121.7901 52.9877 22.7689 175.5955 108 G 3.8993 8.8515 104.2973 45.7389 0.0000 172.4447 109 V 4.3373 7.0133 115.5594 61.2343 34.7793 171.4196 110 T 4.4349 7.8244 112.2907 60.5254 70.9409 175.6475 111 E 2.6832 8.8499 122.5940 59.2077 28.6675 179.2802 112 E 3.9429 8.0259 118.4882 59.1390 29.8392 178.4238 113 Q 4.1941 7.5058 120.4025 58.2140 29.1736 177.6488 114 A 4.0833 8.6426 123.0856 55.5993 18.4774 179.4527 115 M 3.7649 7.7862 116.9490 58.3554 31.8823 178.8104 116 E 3.8795 7.6247 115.9865 58.9093 29.9243 178.3071 117 A 3.6381 7.5378 120.3738 55.0813 18.2899 179.5982 118 L 3.8202 8.6827 117.7791 57.8730 41.5704 179.3218 119 R 3.8524 7.7107 117.6000 59.8020 30.2741 177.7147 120 I 3.8474 8.0707 119.3077 64.6016 37.0938 178.0037 121 A 3.9299 7.8403 121.2894 55.2473 17.9278 179.7779 122 G 3.6404 8.3959 103.5304 47.4123 0.0000 175.1467 123 H 4.4289 7.9817 117.5350 57.9402 28.8916 176.5446 124 K 4.1927 8.0172 119.4995 57.8964 32.6685 177.2870 125 L 4.4090 7.3605 119.0074 53.5347 42.1828 175.9532 126 P 4.7241 0.0000 0.0000 62.6912 31.0200 175.5290 127 I 4.6883 7.6118 112.1430 60.6565 40.9744 173.3971 128 K 4.6495 9.1028 119.8102 55.6325 33.8689 176.5414 129 T 5.3845 8.1922 113.5548 60.1935 72.3248 172.5169 130 K 4.6411 8.6192 120.6635 55.6222 35.8830 175.1019 131 I 5.0210 8.4507 127.4214 60.1078 39.3595 175.1093 132 V 4.7237 9.0057 117.8714 59.0376 36.5946 178.0280 133 R 4.7348 8.7632 124.1351 56.2521 28.0546 178.9321 134 R 4.2975 8.7242 113.8543 55.1387 32.0817 173.3291 135 D 3.7365 7.5854 113.1436 55.8273 40.9102 172.8964 136 A 4.5231 7.8362 121.8873 52.5362 19.9643 177.2270 137 Y 4.2590 7.5885 112.8960 60.3055 38.8226 176.2637 138 D 4.4254 8.3094 121.2079 58.3913 40.1702 175.9121 139 E 3.6838 6.5701 116.8020 55.3415 32.0258 174.7187 140 A 4.1643 7.7166 123.3056 50.4031 21.6112 175.8078 141 Q 3.4646 8.1654 121.3284 55.4937 30.0965 174.4430 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 4.49 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 2 L 7.67 4.17 0.00 1.53 1.14 0.47 0.61 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 3 M 8.23 2.55 0.00 2.13 1.73 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.60 0.00 4 P 0.00 4.48 0.00 2.01 2.10 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.29 0.00 5 R 8.42 3.87 0.00 1.90 1.94 0.00 3.16 0.00 0.00 3.14 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 6 R 8.42 3.81 0.00 1.91 1.92 0.00 3.30 0.00 0.00 3.12 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.61 0.00 7 M 7.88 4.18 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 8 K 8.89 3.80 0.00 1.51 1.39 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.30 0.86 7.81 9 Y 7.37 4.80 0.00 2.96 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 10 R 8.67 4.24 0.00 1.97 1.99 0.00 3.20 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 11 K 8.76 3.76 0.00 1.95 1.91 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.41 7.81 12 Q 8.12 4.60 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.91 0.00 0.00 0.00 0.00 0.00 2.15 2.28 0.00 13 Q 8.54 4.10 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.95 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 14 R 8.66 4.06 0.00 1.95 2.40 0.00 3.43 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.70 0.00 15 G 7.30 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 0.00 0.00 0.00 16 R 8.22 4.76 0.00 1.78 1.80 0.00 3.25 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 17 L 8.33 4.55 0.00 1.69 1.70 0.75 1.08 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 18 K 8.77 3.79 0.00 1.76 1.81 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.49 7.81 19 G 7.66 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.47 4.28 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 21 T 8.54 3.93 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 1.21 0.00 0.00 22 K 8.18 4.10 0.00 1.81 1.99 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.37 1.45 7.81 23 G 8.95 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 0.00 0.00 0.00 24 G 8.62 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 0.00 0.00 0.00 25 D 8.68 5.27 0.00 2.67 2.53 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 0.00 0.00 0.00 0.00 26 Y 7.87 4.78 0.00 3.12 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 27 V 9.33 4.50 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 0.89 0.00 0.00 1.02 0.00 0.00 28 A 8.93 4.39 1.01 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 0.00 0.00 29 F 8.88 4.19 0.00 1.58 1.45 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 30 G 7.95 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 31 D 9.28 4.58 0.00 2.36 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 0.00 0.00 0.00 32 Y 7.38 5.48 0.00 2.98 2.91 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 33 G 8.82 4.32 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 0.00 34 L 8.45 5.40 0.00 1.98 2.08 1.05 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 35 V 9.35 5.19 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 0.97 0.00 0.00 0.96 0.00 0.00 36 A 8.38 4.94 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 37 L 8.50 4.84 0.00 1.68 1.66 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.97 4.89 0.00 1.79 1.78 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 2.21 2.30 0.00 39 P 0.00 5.35 0.00 2.09 2.07 0.00 3.41 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.81 0.00 40 A 8.11 4.29 1.24 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 0.00 0.00 41 W 8.81 5.29 0.00 3.27 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 42 I 8.78 4.60 1.91 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 1.34 0.84 1.01 0.00 0.00 43 T 9.51 4.37 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 1.23 0.00 0.00 44 A 8.61 3.94 1.31 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 0.00 0.00 45 Q 7.75 4.28 0.00 2.09 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 46 Q 8.48 4.35 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 47 I 7.72 4.04 2.04 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 1.61 0.83 1.09 0.00 0.00 48 E 8.50 3.88 0.00 2.21 1.93 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 2.30 2.35 0.00 49 A 7.69 3.94 1.39 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 0.00 0.00 0.00 50 A 8.42 3.71 0.93 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 0.00 0.00 51 R 8.35 3.67 0.00 2.03 2.27 0.00 3.13 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 52 V 8.46 3.47 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 0.90 0.00 0.00 0.97 0.00 0.00 53 A 8.08 3.51 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 54 M 8.09 3.78 0.00 2.05 1.84 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 55 V 7.88 3.60 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 0.77 0.00 0.00 0.92 0.00 0.00 56 R 8.35 3.76 0.00 1.82 1.90 0.00 3.32 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 57 H 7.46 4.27 0.00 3.13 2.98 0.00 5.77 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 58 F 7.00 5.05 0.00 3.18 3.23 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 59 R 8.44 4.08 0.00 1.84 2.03 0.00 3.45 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 60 R 8.25 3.79 0.00 2.08 1.99 0.00 3.35 0.00 0.00 3.26 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 61 G 9.02 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 62 G 8.01 3.54 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 0.00 0.00 0.00 63 K 6.10 4.59 0.00 1.71 1.42 0.00 1.52 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 1.09 7.81 64 I 7.85 4.86 1.86 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 1.54 0.89 1.02 0.00 0.00 65 F 8.97 4.65 0.00 3.24 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 66 I 9.39 3.83 2.01 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 0.76 1.09 0.00 0.00 67 R 8.05 3.77 0.00 2.06 2.05 0.00 3.38 0.00 0.00 3.50 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 68 I 7.18 4.61 1.82 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.53 0.81 0.00 0.00 69 F 8.27 4.61 0.00 3.02 2.91 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 70 P 0.00 5.26 0.00 2.08 1.99 0.00 2.32 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.55 0.00 71 D 8.84 4.92 0.00 2.77 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 72 K 7.97 4.50 0.00 1.72 1.70 0.00 1.38 0.00 0.00 0.83 0.00 0.00 2.13 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.03 1.34 7.81 73 P 0.00 4.33 0.00 1.91 2.05 0.00 3.66 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.34 0.00 74 Y 8.12 4.55 0.00 2.94 2.68 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 75 T 7.93 4.85 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 1.15 0.00 0.00 76 K 8.04 4.51 0.00 2.02 1.72 0.00 1.65 0.00 0.00 1.95 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.58 7.81 77 K 8.78 4.55 0.00 1.78 1.75 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.40 7.81 78 P 0.00 4.73 0.00 2.04 2.06 0.00 3.76 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 1.97 2.09 0.00 79 L 8.09 3.81 0.00 1.82 1.83 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.71 4.77 0.00 1.90 1.16 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 2.21 2.19 0.00 81 V 8.69 4.05 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 0.86 0.00 0.00 0.93 0.00 0.00 82 R 8.34 4.73 0.00 1.90 1.87 0.00 3.02 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.61 0.00 83 M 7.90 4.59 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 84 G 8.33 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 85 K 8.47 3.76 0.00 1.71 1.73 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.38 7.81 86 G 8.74 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 0.00 0.00 0.00 87 K 8.86 4.19 0.00 1.95 2.07 0.00 1.55 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.43 7.81 88 G 7.70 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 89 N 8.73 4.16 0.00 2.60 2.86 0.00 0.00 7.15 7.59 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 90 V 8.42 3.64 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 0.75 0.00 0.00 0.94 0.00 0.00 91 E 6.40 3.50 0.00 2.43 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 2.38 2.44 0.00 92 G 6.43 4.32 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 0.00 93 Y 8.12 4.91 0.00 2.85 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 94 V 8.88 4.98 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 0.82 0.00 0.00 0.65 0.00 0.00 95 A 8.72 4.99 1.23 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 0.00 0.00 96 V 8.48 4.09 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 0.84 0.00 0.00 0.98 0.00 0.00 97 V 9.09 4.49 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 0.96 0.00 0.00 0.98 0.00 0.00 98 K 8.03 4.93 0.00 1.75 1.70 0.00 1.77 0.00 0.00 2.21 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 P 0.00 4.11 0.00 2.07 1.92 0.00 3.70 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 2.03 2.25 0.00 100 G 9.49 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 0.00 0.00 0.00 101 R 7.28 4.60 0.00 2.03 1.80 0.00 3.21 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 102 V 8.60 3.82 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 0.99 0.00 0.00 1.05 0.00 0.00 103 M 8.79 4.00 0.00 1.10 1.38 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.28 0.00 104 F 9.77 4.23 0.00 3.34 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 0.00 105 E 8.91 4.31 0.00 2.33 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 2.55 2.49 0.00 106 V 8.42 5.03 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 nan 0.00 0.00 1.26 0.00 0.00 107 A 8.79 4.59 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.85 3.90 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 0.00 0.00 0.00 109 V 7.01 4.34 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 0.77 0.00 0.00 0.47 0.00 0.00 110 T 7.82 4.43 4.53 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 0.00 0.00 0.00 1.24 0.00 0.00 111 E 8.85 2.68 0.00 1.60 1.88 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 2.37 2.30 0.00 112 E 8.03 3.94 0.00 2.18 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 2.35 2.30 0.00 113 Q 7.51 4.19 0.00 2.34 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 114 A 8.64 4.08 1.14 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 0.00 0.00 115 M 7.79 3.76 0.00 2.04 2.12 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 2.58 2.37 0.00 116 E 7.62 3.88 0.00 2.11 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 2.45 2.26 0.00 117 A 7.54 3.64 1.20 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 0.00 118 L 8.68 3.82 0.00 1.69 1.77 1.12 1.02 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 0.00 119 R 7.71 3.85 0.00 1.94 2.16 0.00 3.32 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 120 I 8.07 3.85 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 1.64 0.96 0.84 0.00 0.00 121 A 7.84 3.93 1.06 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 0.00 122 G 8.40 3.64 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 0.00 0.00 0.00 123 H 7.98 4.43 0.00 3.47 3.35 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 8.02 4.19 0.00 1.78 1.84 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.60 7.81 125 L 7.36 4.41 0.00 1.95 1.67 1.28 1.10 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 0.00 126 P 0.00 4.72 0.00 2.18 2.15 0.00 3.79 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 127 I 7.61 4.69 1.89 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 1.34 0.67 1.00 0.00 0.00 128 K 9.10 4.65 0.00 1.72 1.75 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.62 7.81 129 T 8.19 5.38 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 1.29 0.00 0.00 130 K 8.62 4.64 0.00 1.88 1.67 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.46 7.81 131 I 8.45 5.02 1.93 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 1.40 0.77 1.06 0.00 0.00 132 V 9.01 4.72 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 0.75 0.00 0.00 1.05 0.00 0.00 133 R 8.76 4.73 0.00 1.93 0.99 0.00 3.24 0.00 0.00 3.20 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.76 0.00 134 R 8.72 4.30 0.00 1.67 1.71 0.00 3.42 0.00 0.00 3.11 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.52 0.00 135 D 7.59 3.74 0.00 3.09 2.89 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 0.00 136 A 7.84 4.52 1.03 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 0.00 137 Y 7.59 4.26 0.00 3.01 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 0.00 138 D 8.31 4.43 0.00 2.54 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 E 6.57 3.68 0.00 1.83 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 2.28 2.39 0.00 140 A 7.72 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Q 8.17 3.46 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00