NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 E 4.3643 8.2876 120.2262 56.2404 31.8474 177.6651 10 K 3.9053 7.8715 118.5333 58.5794 32.7853 177.4648 11 K 3.9881 8.7894 121.8249 59.0504 32.4478 180.1426 12 R 3.9137 7.8905 118.3296 59.3057 30.0786 178.9606 13 I 3.7563 7.6436 112.1427 63.7057 37.3598 178.1103 14 A 3.8957 7.7213 122.9182 54.8178 18.0769 179.4549 15 K 4.0448 8.1763 117.3826 59.8172 32.0794 179.3643 16 E 4.0216 7.9751 117.6367 59.1898 29.6272 179.0500 17 R 3.8045 8.7807 120.8289 59.2079 30.3555 178.1739 18 I 3.6400 8.5563 119.5827 64.4571 38.0647 177.6002 19 D 4.6692 8.0186 119.2623 57.1805 40.4830 178.8597 20 I 3.7788 7.5585 120.9240 64.2600 37.0448 178.3170 21 L 3.7817 7.7597 120.1723 58.5941 39.9875 178.8500 22 F 4.5275 8.0990 121.3357 61.4458 39.3215 177.4144 23 S 3.5928 7.8233 113.1052 60.8226 62.7747 176.1205 24 L 3.8753 8.0378 123.9654 58.0765 41.9340 178.4969 25 A 4.0862 9.1726 121.7228 55.5297 17.9183 179.5730 26 E 4.2250 7.9373 115.9414 59.8032 29.8001 179.2940 27 R 4.1272 8.1697 118.7446 59.0476 29.8607 178.9161 28 V 4.0034 8.8001 112.6423 64.3100 31.6918 178.1200 29 F 4.6991 8.5901 121.1789 60.6659 39.3487 175.1665 30 P 4.4361 0.0000 0.0000 66.1210 31.0773 176.9379 31 Y 4.7872 7.4159 115.3519 56.9711 39.9791 175.8623 32 S 4.1753 12.0000 113.2611 55.7106 64.4492 173.0087 33 P 3.9615 0.0000 0.0000 65.9554 31.0893 177.6068 34 E 3.8016 7.8781 117.2287 59.3214 29.6848 178.1851 35 L 3.6112 7.7409 118.1091 57.9414 41.5931 179.1643 36 A 3.4795 7.0944 117.3866 55.2345 18.0101 179.8950 37 K 3.8300 7.4188 115.6712 59.2118 32.3780 179.4154 38 R 3.9290 8.1617 119.9390 59.7239 29.8633 178.1604 39 Y 4.3069 7.5145 116.7952 61.0900 37.7639 178.5662 40 V 3.4816 7.7698 119.4801 66.2951 31.3024 177.7493 41 E 3.9604 8.0828 118.5748 59.2570 29.5734 178.8141 42 L 3.9869 7.8331 118.3353 57.7512 41.8017 179.2528 43 A 4.0185 9.7535 120.5476 54.7464 18.2943 179.6510 44 L 3.8695 8.1423 118.3946 57.9450 41.6726 179.6898 45 L 3.9787 7.6719 119.6741 58.8388 40.4498 179.1477 46 V 3.4974 7.6865 119.0709 65.7913 31.2804 177.8011 47 Q 3.8970 8.1763 119.2221 59.1151 28.9851 178.1121 48 Q 3.9821 7.9152 118.2230 59.2272 28.8865 178.0901 49 K 3.8178 8.7062 120.7892 58.4770 32.1580 177.9805 50 A 4.2135 7.6715 118.2534 51.6424 19.5972 176.7571 51 K 3.8825 7.5378 114.8440 57.2037 30.0291 175.0223 52 V 4.4920 8.2441 123.1165 61.8226 32.6598 175.2711 53 K 4.1307 8.5580 118.0131 56.5221 32.6084 176.2177 54 I 4.2431 8.0456 123.5368 59.3382 38.2164 174.2719 55 P 4.6006 0.0000 0.0000 63.2023 31.6896 175.0965 56 R 4.4710 7.8175 116.6967 57.3692 32.4740 176.3036 57 K 3.8973 7.2785 118.0663 57.8664 33.4465 178.6170 58 W 4.2825 7.4971 118.9090 58.4132 29.1914 177.3826 59 K 4.3459 7.8725 116.8172 58.3803 32.2377 178.0059 60 R 4.1098 8.7484 117.5854 58.2688 29.7827 177.5039 61 R 5.1873 8.3925 112.8795 55.4399 32.2285 173.7316 62 Y 5.3745 8.0555 120.1265 55.3096 42.8923 173.5207 63 C 4.5101 6.4621 122.3918 57.4044 34.2530 174.1714 64 K 4.7351 8.9225 124.5706 56.8821 32.1875 177.4550 65 K 4.2713 7.8350 119.2332 57.7799 32.9079 176.9780 66 C 4.4745 7.2521 107.8951 56.4361 31.0952 170.1867 67 H 3.4877 8.4152 123.0592 54.7339 28.6923 173.9315 68 A 4.3375 6.6324 123.2823 52.2014 23.3080 174.1239 69 F 5.1008 9.0716 116.0969 56.2563 41.0020 175.1047 70 L 4.5489 10.1697 123.8404 52.6126 44.8610 176.1320 71 V 4.4431 7.9133 121.0907 60.2297 34.5202 172.9500 72 P 4.4214 0.0000 0.0000 64.6918 31.5916 175.1668 73 G 4.1186 9.2707 111.6028 45.3999 0.0000 173.3906 74 I 4.1102 7.3128 119.2558 61.1065 38.4291 175.1638 75 N 5.2196 8.2894 114.1362 53.0776 40.9594 173.5410 76 A 5.0507 7.8348 119.8269 50.6179 23.7228 175.8915 77 R 4.9091 8.3130 116.8931 54.7915 34.6770 175.0184 78 V 5.0904 8.4407 115.9741 59.7408 35.0588 174.9958 79 R 4.7930 9.3098 125.1823 54.4843 33.6227 173.4681 80 L 5.3662 8.5625 125.4826 53.0579 43.3899 175.9649 81 R 4.7417 8.4294 120.4584 54.6781 34.6752 175.4221 82 Q 4.5676 8.3437 120.7685 55.1852 31.3000 175.1609 83 K 3.9237 8.3452 113.6265 58.0308 29.2919 173.1890 84 R 3.5610 7.9416 122.2505 56.7059 27.4516 172.3580 85 M 3.0237 8.2378 122.1416 53.8235 28.8893 174.4590 86 P 4.9237 0.0000 0.0000 62.4606 33.1056 174.6754 87 H 5.1962 8.6354 118.6314 54.1349 33.1102 171.9911 88 I 4.7182 8.5446 122.9471 59.6665 40.2164 174.2015 89 V 4.9426 9.7199 129.6641 61.1715 33.5405 174.6514 90 V 5.2717 8.6510 127.0412 58.9717 34.3264 174.5210 91 K 5.3969 8.2416 122.4406 55.6267 36.1129 173.8266 92 C 4.6098 8.7003 127.0307 59.0455 32.3114 173.9469 93 L 4.3937 8.2171 125.3053 56.0193 41.9705 178.0975 94 E 4.2076 8.2303 118.4077 58.7030 30.3684 177.1597 95 C 4.6384 7.5200 114.7729 55.3678 28.8910 170.3240 96 G 4.4640 7.7145 113.7254 43.6191 0.0000 168.9827 97 H 4.8311 8.9226 125.4975 53.9450 33.2318 172.0253 98 I 4.6241 8.4527 126.1513 60.6941 38.1594 174.9391 99 M 5.0216 9.1378 125.8461 53.6047 36.5581 174.2793 100 R 5.1422 8.4143 119.3052 55.3619 34.2136 174.7381 101 Y 4.2653 9.3042 125.4417 55.8795 40.9093 172.2300 102 P 4.8514 0.0000 0.0000 62.9675 32.6844 174.7365 103 Y 4.5261 8.4057 120.9266 56.0303 40.8282 174.8118 104 I 4.6279 8.3130 126.8575 59.4247 40.4096 175.3783 105 K 4.2354 8.8195 124.9381 56.5218 32.0832 175.7161 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 9 E 8.29 4.36 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 2.30 2.37 0.00 10 K 7.87 3.91 0.00 2.02 2.06 0.00 1.52 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.50 7.81 11 K 8.79 3.99 0.00 1.84 1.84 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.52 7.81 12 R 7.89 3.91 0.00 2.15 1.96 0.00 3.23 0.00 0.00 3.50 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 13 I 7.64 3.76 1.86 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 1.75 0.99 0.91 0.00 0.00 14 A 7.72 3.90 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 15 K 8.18 4.04 0.00 1.99 1.90 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.71 1.61 7.81 16 E 7.98 4.02 0.00 2.11 2.21 0.00 0.00 0.00 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 2.45 0.00 17 R 8.78 3.80 0.00 1.85 1.94 0.00 3.08 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 18 I 8.56 3.64 1.91 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.89 0.96 0.00 0.00 19 D 8.02 4.67 0.00 2.87 2.84 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 20 I 7.56 3.78 1.99 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 1.95 0.88 0.86 0.00 0.00 21 L 7.76 3.78 0.00 1.59 1.82 0.97 1.30 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 22 F 8.10 4.53 0.00 3.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.82 3.59 0.00 4.00 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 24 L 8.04 3.88 0.00 1.86 1.80 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 25 A 9.17 4.09 0.97 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 26 E 7.94 4.23 0.00 1.96 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 2.28 2.52 0.00 27 R 8.17 4.13 0.00 2.10 1.98 0.00 3.08 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 28 V 8.80 4.00 2.21 0.00 0.00 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 1.15 0.00 0.00 29 F 8.59 4.70 0.00 3.36 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.44 0.00 2.39 2.37 0.00 4.03 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.25 0.00 31 Y 7.42 4.79 0.00 2.98 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 32 S 12.00 4.18 0.00 3.80 3.68 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 33 P 0.00 3.96 0.00 2.02 1.94 0.00 3.33 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.59 0.00 34 E 7.88 3.80 0.00 1.94 1.82 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 2.27 2.33 0.00 35 L 7.74 3.61 0.00 1.63 1.33 1.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.09 3.48 1.36 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 0.00 0.00 0.00 37 K 7.42 3.83 0.00 1.94 1.83 0.00 1.93 0.00 0.00 1.90 0.00 0.00 3.42 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.53 7.81 38 R 8.16 3.93 0.00 1.70 1.70 0.00 3.51 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 39 Y 7.51 4.31 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 40 V 7.77 3.48 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 1.29 0.00 0.00 0.45 0.00 0.00 41 E 8.08 3.96 0.00 2.13 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 2.33 2.38 0.00 42 L 7.83 3.99 0.00 1.93 1.71 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 43 A 9.75 4.02 1.30 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 0.00 0.00 0.00 44 L 8.14 3.87 0.00 1.85 1.72 0.88 0.45 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 45 L 7.67 3.98 0.00 1.86 1.93 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 46 V 7.69 3.50 2.22 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 1.05 0.00 0.00 0.94 0.00 0.00 47 Q 8.18 3.90 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.28 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 48 Q 7.92 3.98 0.00 2.36 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.55 0.00 0.00 0.00 0.00 0.00 2.62 2.39 0.00 49 K 8.71 3.82 0.00 1.85 1.92 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.55 7.81 50 A 7.67 4.21 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 51 K 7.54 3.88 0.00 1.93 1.85 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.60 1.50 7.81 52 V 8.24 4.49 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 0.79 0.00 0.00 1.02 0.00 0.00 53 K 8.56 4.13 0.00 1.86 1.77 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.48 7.81 54 I 8.05 4.24 1.85 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 1.46 0.76 0.91 0.00 0.00 55 P 0.00 4.60 0.00 2.24 2.21 0.00 3.74 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 56 R 7.82 4.47 0.00 1.67 1.84 0.00 2.72 0.00 0.00 3.06 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.09 0.00 57 K 7.28 3.90 0.00 1.70 1.76 0.00 1.32 0.00 0.00 1.45 0.00 0.00 2.37 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.49 0.93 7.81 58 W 7.50 4.28 0.00 3.51 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 59 K 7.87 4.35 0.00 1.89 2.01 0.00 1.26 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.22 1.44 7.81 60 R 8.75 4.11 0.00 1.75 2.06 0.00 2.99 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 61 R 8.39 5.19 0.00 1.79 1.97 0.00 3.32 0.00 0.00 2.75 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.05 0.00 62 Y 8.06 5.37 0.00 3.16 3.02 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 0.00 0.00 0.00 63 C 6.46 4.51 0.00 2.83 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.92 4.74 0.00 1.88 1.95 0.00 1.96 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.75 1.77 7.81 65 K 7.83 4.27 0.00 1.68 1.67 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.20 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.23 7.81 66 C 7.25 4.47 0.00 2.95 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 67 H 8.42 3.49 0.00 3.33 3.48 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 6.63 4.34 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 69 F 9.07 5.10 0.00 2.77 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 70 L 10.17 4.55 0.00 1.44 1.64 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.91 4.44 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 1.06 0.00 0.00 0.61 0.00 0.00 72 P 0.00 4.42 0.00 2.08 2.03 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 73 G 9.27 4.12 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 74 I 7.31 4.11 2.21 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.74 1.02 0.00 0.00 75 N 8.29 5.22 0.00 2.89 2.89 0.00 0.00 6.84 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.83 5.05 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 R 8.31 4.91 0.00 1.56 1.79 0.00 3.09 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 78 V 8.44 5.09 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 0.68 0.00 0.00 0.95 0.00 0.00 79 R 9.31 4.79 0.00 1.83 1.73 0.00 3.05 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 80 L 8.56 5.37 0.00 1.68 1.68 0.82 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.43 4.74 0.00 1.74 1.79 0.00 3.13 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 82 Q 8.34 4.57 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 5.87 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 83 K 8.35 3.92 0.00 1.79 2.23 0.00 1.86 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.26 1.35 7.81 84 R 7.94 3.56 0.00 2.00 2.01 0.00 3.45 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 85 M 8.24 3.02 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 86 P 0.00 4.92 0.00 2.04 1.96 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.89 0.00 87 H 8.64 5.20 0.00 3.08 3.17 0.00 5.60 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.54 4.72 2.22 0.00 0.00 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 1.33 1.76 1.08 0.00 0.00 89 V 9.72 4.94 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 1.05 0.00 0.00 1.02 0.00 0.00 90 V 8.65 5.27 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 1.23 0.00 0.00 0.96 0.00 0.00 91 K 8.24 5.40 0.00 1.89 1.65 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.44 7.81 92 C 8.70 4.61 0.00 3.05 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 93 L 8.22 4.39 0.00 2.01 1.72 0.98 0.93 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 94 E 8.23 4.21 0.00 1.96 1.99 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 2.33 2.28 0.00 95 C 7.52 4.64 0.00 3.07 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 96 G 7.71 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.92 4.83 0.00 3.49 3.11 0.00 5.77 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.45 4.62 1.90 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 1.35 0.70 0.93 0.00 0.00 99 M 9.14 5.02 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.63 0.00 100 R 8.41 5.14 0.00 1.77 1.72 0.00 3.21 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 101 Y 9.30 4.27 0.00 3.07 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 0.00 102 P 0.00 4.85 0.00 2.02 2.11 0.00 3.48 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 103 Y 8.41 4.53 0.00 3.01 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 0.00 104 I 8.31 4.63 1.87 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 1.32 0.71 0.93 0.00 0.00 105 K 8.82 4.24 0.00 1.82 1.72 0.00 1.85 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.51 7.81