NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2712 8.3144 120.1355 55.6203 33.5313 175.0130 2 E 3.8126 8.5617 121.7652 54.8605 30.0951 176.0117 3 T 4.2332 8.7203 118.2799 61.2131 72.1830 175.0380 4 A 3.9962 8.5128 123.2762 55.2634 18.5297 179.9453 5 A 4.1152 7.9865 118.6401 55.3634 18.5285 179.6093 6 A 4.0286 8.1192 119.3958 55.0631 18.3407 179.7958 7 K 4.0240 8.3945 118.4748 59.4908 32.2802 178.7612 8 F 4.0869 8.4412 121.0025 61.3569 39.2981 176.9133 9 E 4.0202 8.3053 117.8407 59.5456 29.0941 179.3945 10 R 3.8945 7.9178 117.3720 59.5963 30.2228 178.2777 11 Q 3.9389 8.1288 117.1837 58.2330 28.9811 176.4825 12 H 4.6225 7.8996 114.3226 54.1841 31.8681 173.5900 13 M 4.7120 7.8908 118.1359 54.0297 33.6622 176.5371 14 D 4.7537 9.1130 122.7194 53.0419 41.9827 175.5935 15 S 4.5108 8.5706 116.3090 59.0849 63.5028 175.2025 16 S 4.5061 8.0851 114.6400 59.0859 63.4767 174.1242 17 T 4.7334 7.4031 109.8901 60.1881 71.5532 173.9025 18 S 4.3010 8.4714 117.7462 60.2414 63.5462 173.9942 19 A 3.8663 6.9882 119.5110 50.7358 21.3303 175.5343 20 A 3.3258 8.0924 123.2375 52.2303 18.7116 178.0551 21 S 4.5904 8.3203 115.6457 58.2040 64.5408 173.5775 22 S 4.6006 7.4195 114.8821 57.2433 65.1685 175.4612 23 S 4.2747 8.5925 115.2117 60.9116 62.8874 174.8855 24 N 4.6137 7.9045 116.5676 54.1215 38.9161 176.0427 25 Y 4.0337 8.1021 120.4007 61.2414 38.6449 177.5983 26 C 4.1868 8.3714 116.9201 60.0457 39.6935 175.7131 27 N 4.4111 8.2879 117.5311 56.6964 38.1030 177.3336 28 Q 3.9660 8.0456 119.0722 59.2438 28.8463 178.6867 29 M 3.7152 7.7693 119.8912 58.3388 31.8424 178.7224 30 M 4.0432 8.1495 119.3226 58.0785 32.0306 178.8207 31 K 3.9311 7.6368 118.4143 59.7884 32.2710 179.2765 32 S 4.1888 7.9585 114.0052 61.0650 62.7436 175.8683 33 R 4.2968 7.7599 118.3750 55.4815 29.9823 176.0479 34 N 4.3165 7.8477 115.0054 54.5741 36.1534 175.0493 35 L 4.3856 7.9722 117.6039 55.5466 42.1698 178.1099 36 T 5.3972 7.5536 106.9917 60.3906 69.3305 174.9966 37 K 4.1670 8.3673 124.4520 59.8661 32.3275 177.4328 38 D 4.7267 7.9101 115.9651 55.2660 42.2655 176.2092 39 R 3.9544 7.2603 112.9188 55.1177 31.5796 174.4547 40 C 4.7884 8.7303 117.0112 56.0679 40.2452 173.8802 41 K 4.2576 8.1228 127.9893 55.7147 32.4974 175.0929 42 P 4.7692 0.0000 0.0000 65.5847 32.5434 176.4803 43 V 5.1193 7.5833 110.6185 59.9971 35.8284 174.1348 44 N 4.7252 8.8335 120.0769 53.0356 42.6417 173.1012 45 T 4.8941 7.7541 118.4745 61.6199 72.3676 172.8383 46 F 4.8709 8.9691 124.2845 55.6321 42.2143 174.6297 47 V 4.5550 8.8426 122.6031 61.0524 33.5849 175.6824 48 H 5.4856 8.6569 128.6261 53.8661 26.2574 173.4023 49 E 4.8074 7.6957 117.7346 53.2626 34.5729 176.5779 50 S 4.3410 8.3896 115.0361 58.3423 64.9472 175.0199 51 L 4.0035 8.5394 124.6980 58.4334 41.9366 179.2225 52 A 4.2040 8.0085 120.2087 55.3961 18.1362 179.2198 53 D 4.3646 7.9873 116.5717 57.2736 41.1216 178.8850 54 V 3.7985 7.7692 118.5232 66.0361 31.7169 178.0653 55 Q 3.9016 8.5626 118.0369 58.9231 28.5053 178.7536 56 A 4.0420 8.1051 121.4385 54.6522 18.2631 179.6521 57 V 3.4357 7.6124 117.1476 66.1101 31.2885 177.0441 58 C 3.6657 7.7052 114.5268 58.0785 39.9245 174.2081 59 S 4.5938 7.5156 114.0367 57.9612 63.9214 174.8928 60 Q 4.1387 7.3771 122.1227 56.0191 27.4501 176.9558 61 K 4.3345 8.1194 129.4834 56.5950 33.1006 175.4805 62 N 4.4677 8.7985 127.3215 53.6166 39.1669 174.3091 63 V 4.5884 8.4078 118.0058 59.2581 36.8720 174.6118 64 A 4.2961 8.3966 125.2542 52.1647 19.0017 178.6113 65 C 4.6867 8.9846 120.1987 56.2936 41.0420 175.2208 66 K 3.7493 9.1536 121.5641 59.4427 31.5745 178.1031 67 N 4.5941 8.0823 113.3789 52.7013 37.5944 175.7784 68 G 3.9627 8.1144 108.4683 45.4548 0.0000 174.4158 69 Q 4.1612 8.3134 119.1641 56.4702 29.1864 176.6796 70 T 4.5114 8.3362 109.0408 61.6349 69.2604 173.7836 71 N 4.9763 7.9753 118.3203 53.7513 38.6363 174.9456 72 C 5.3738 7.4402 116.1146 56.8515 44.3813 172.5297 73 Y 5.0723 8.7763 118.0969 56.4842 42.2109 173.8820 74 Q 5.1265 9.0755 125.5054 54.0971 31.3766 174.9275 75 S 4.5159 8.6746 121.5975 58.6056 63.2411 174.3732 76 Y 4.4665 9.0025 120.7375 60.1920 37.9822 176.0900 77 S 4.8980 7.8264 112.6092 56.0661 65.0353 173.2632 78 T 4.2183 8.0792 114.4404 61.9759 69.7070 173.4360 79 M 5.0530 8.9291 121.9322 53.3775 36.9029 174.6414 80 S 4.8549 9.2909 117.1806 58.3278 63.6165 173.1189 81 I 5.2267 8.8998 119.9645 59.4991 41.6643 174.1154 82 T 5.0848 8.8906 119.5325 61.8996 71.6957 172.5545 83 D 5.1308 9.1027 126.6865 53.1961 43.3794 174.2406 84 C 5.6692 9.2663 123.1996 55.2341 41.6641 172.9900 85 R 5.2920 8.9082 123.0807 54.1565 33.3761 173.8642 86 E 4.1402 9.0829 127.7527 56.8754 30.4889 176.5542 87 T 4.3945 8.4292 117.0716 60.1353 71.0474 175.9462 88 G 3.6361 8.6546 109.8743 48.1401 0.0000 174.6662 89 S 4.4268 7.4056 112.8059 58.6093 63.3145 174.4779 90 S 4.0560 7.5769 116.7484 58.0239 62.7254 173.6486 91 K 4.3009 8.7093 128.4181 55.2461 34.2207 174.2699 92 Y 4.2852 8.8065 127.7706 58.0214 38.8708 174.1769 93 P 3.3551 0.0000 0.0000 62.6500 32.6021 176.4876 94 N 4.6241 7.7888 119.9342 52.2441 36.9861 173.7129 95 C 4.6018 7.7933 116.3140 56.7960 42.8873 173.5237 96 A 5.0783 8.1789 124.7301 50.4693 22.1632 174.5172 97 Y 5.0799 9.1756 118.4279 56.0376 42.4980 174.8393 98 K 4.4583 9.2344 124.4298 55.9465 33.9829 175.3116 99 T 5.1120 8.5552 123.8301 62.5312 70.2069 174.1704 100 T 4.6816 8.8212 122.4891 61.8665 72.2292 173.3186 101 Q 4.8059 8.8074 124.8328 55.5473 30.3270 174.7327 102 A 4.6751 8.7116 122.7323 51.1357 23.6968 175.1273 103 N 5.3866 8.6004 115.3172 51.8960 41.5626 174.2894 104 K 4.7551 8.8618 122.4095 54.7588 37.5343 175.8515 105 H 4.7670 8.8859 119.0449 56.0089 30.0502 174.5527 106 I 4.8448 8.3832 114.9386 59.3245 40.6528 174.4018 107 I 4.8887 8.0969 124.2643 59.7185 40.1635 175.0467 108 V 4.7819 8.6435 119.2700 59.3797 36.0111 174.3432 109 A 5.1005 8.7505 124.7246 50.8703 20.9341 175.5896 110 C 5.1979 8.6638 118.5749 55.3282 39.1894 173.3268 111 E 4.7505 8.6092 119.7701 56.0155 34.4626 175.4002 112 G 4.1146 9.7995 107.4486 44.9277 0.0000 171.8861 113 N 5.0147 8.1345 115.8976 50.6576 40.4602 172.1081 114 P 4.3225 0.0000 0.0000 62.8664 31.9807 175.4750 115 Y 4.9301 8.3116 121.8638 56.6784 39.0954 174.6445 116 V 4.4517 8.1326 119.3678 58.5010 36.6413 173.4434 117 P 4.5217 0.0000 0.0000 62.8780 31.1542 176.8944 118 V 4.4688 8.5883 115.4953 61.1728 33.9626 175.2683 119 H 5.0383 7.9065 119.8374 54.7796 33.5298 171.6885 120 F 4.5812 8.7739 127.9412 57.4160 39.3879 174.4248 121 D 4.5960 8.4288 126.9765 56.1933 41.8193 175.9374 122 A 4.6432 6.6670 117.0298 51.3052 22.4557 174.7968 123 S 5.2027 8.8250 113.3743 56.7531 65.9736 174.6302 124 V 4.1505 8.5287 114.4032 61.8069 32.1880 175.1417 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 K 8.31 4.27 0.00 1.77 1.82 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.44 7.81 2 E 8.56 3.81 0.00 2.02 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 2.31 2.38 0.00 3 T 8.72 4.23 4.26 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 1.22 0.00 0.00 4 A 8.51 4.00 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 5 A 7.99 4.12 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 6 A 8.12 4.03 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 7 K 8.39 4.02 0.00 1.93 2.04 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.46 1.45 7.81 8 F 8.44 4.09 0.00 3.24 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 9 E 8.31 4.02 0.00 2.31 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 2.50 2.68 0.00 10 R 7.92 3.89 0.00 1.80 2.08 0.00 3.37 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 11 Q 8.13 3.94 0.00 1.48 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.52 0.00 0.00 0.00 0.00 0.00 2.23 2.47 0.00 12 H 7.90 4.62 0.00 2.12 2.68 0.00 5.61 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.89 4.71 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.67 0.00 14 D 9.11 4.75 0.00 2.73 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.57 4.51 0.00 3.93 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 16 S 8.09 4.51 0.00 4.02 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 17 T 7.40 4.73 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 1.26 0.00 0.00 18 S 8.47 4.30 0.00 3.83 3.93 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 19 A 6.99 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.09 3.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.32 4.59 0.00 3.96 3.93 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 22 S 7.42 4.60 0.00 4.00 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 23 S 8.59 4.27 0.00 4.03 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 0.00 24 N 7.90 4.61 0.00 2.92 2.89 0.00 0.00 6.43 7.36 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 25 Y 8.10 4.03 0.00 3.12 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 26 C 8.37 4.19 0.00 3.17 3.12 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 27 N 8.29 4.41 0.00 2.91 2.93 0.00 0.00 7.12 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 28 Q 8.05 3.97 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 29 M 7.77 3.72 0.00 0.92 1.22 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.63 0.00 30 M 8.15 4.04 0.00 1.73 1.92 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 2.45 0.00 31 K 7.64 3.93 0.00 1.86 1.90 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 32 S 7.96 4.19 0.00 3.82 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 33 R 7.76 4.30 0.00 1.91 2.07 0.00 3.59 0.00 0.00 3.20 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 34 N 7.85 4.32 0.00 2.90 2.96 0.00 0.00 6.89 7.88 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 35 L 7.97 4.39 0.00 1.79 1.63 0.81 0.35 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 36 T 7.55 5.40 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 1.38 0.00 0.00 37 K 8.37 4.17 0.00 1.78 1.92 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.51 7.81 38 D 7.91 4.73 0.00 2.68 2.65 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 0.00 0.00 0.00 0.00 39 R 7.26 3.95 0.00 1.81 1.75 0.00 2.92 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 1.50 1.59 0.00 40 C 8.73 4.79 0.00 3.09 3.19 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 41 K 8.12 4.26 0.00 1.93 1.76 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.39 7.81 42 P 0.00 4.77 0.00 2.20 2.32 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 2.10 2.02 0.00 43 V 7.58 5.12 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 0.74 0.00 0.00 0.95 0.00 0.00 44 N 8.83 4.73 0.00 2.58 2.26 0.00 0.00 7.09 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 45 T 7.75 4.89 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 0.89 0.00 0.00 46 F 8.97 4.87 0.00 2.94 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 47 V 8.84 4.55 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 1.16 0.00 0.00 1.00 0.00 0.00 48 H 8.66 5.49 0.00 3.14 3.40 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.70 4.81 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 2.26 2.27 0.00 50 S 8.39 4.34 0.00 4.07 4.02 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 51 L 8.54 4.00 0.00 1.83 1.74 1.03 1.30 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 52 A 8.01 4.20 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 53 D 7.99 4.36 0.00 2.85 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 54 V 7.77 3.80 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 1.24 0.00 0.00 1.07 0.00 0.00 55 Q 8.56 3.90 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 56 A 8.11 4.04 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 57 V 7.61 3.44 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 1.07 0.00 0.00 0.98 0.00 0.00 58 C 7.71 3.67 0.00 2.85 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 59 S 7.52 4.59 0.00 3.93 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 60 Q 7.38 4.14 0.00 1.80 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.89 0.00 0.00 0.00 0.00 0.00 2.02 2.24 0.00 61 K 8.12 4.33 0.00 2.00 1.79 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.42 7.81 62 N 8.80 4.47 0.00 2.77 2.64 0.00 0.00 7.00 7.71 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 63 V 8.41 4.59 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 0.66 0.00 0.00 0.81 0.00 0.00 64 A 8.40 4.30 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 65 C 8.98 4.69 0.00 3.07 3.10 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 66 K 9.15 3.75 0.00 1.71 1.88 0.00 1.86 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.51 7.81 67 N 8.08 4.59 0.00 2.81 2.90 0.00 0.00 6.29 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 68 G 8.11 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 69 Q 8.31 4.16 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 70 T 8.34 4.51 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 71 N 7.98 4.98 0.00 2.95 3.15 0.00 0.00 6.08 7.68 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 72 C 7.44 5.37 0.00 2.85 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 73 Y 8.78 5.07 0.00 2.81 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 74 Q 9.08 5.13 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 75 S 8.67 4.52 0.00 3.93 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 76 Y 9.00 4.47 0.00 3.05 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 77 S 7.83 4.90 0.00 3.87 3.78 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 78 T 8.08 4.22 4.26 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 1.01 0.00 0.00 79 M 8.93 5.05 0.00 1.96 2.00 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 2.54 2.49 0.00 80 S 9.29 4.85 0.00 3.91 3.79 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 81 I 8.90 5.23 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 1.04 0.00 0.00 82 T 8.89 5.08 4.41 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 1.32 0.00 0.00 83 D 9.10 5.13 0.00 2.73 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.27 5.67 0.00 2.89 2.87 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 85 R 8.91 5.29 0.00 1.94 1.77 0.00 3.14 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 86 E 9.08 4.14 0.00 2.15 1.77 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 0.00 2.09 1.84 0.00 87 T 8.43 4.39 4.21 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 0.00 0.00 1.17 0.00 0.00 88 G 8.65 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 89 S 7.41 4.43 0.00 3.89 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 90 S 7.58 4.06 0.00 3.83 3.75 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 K 8.71 4.30 0.00 1.81 1.60 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.40 7.81 92 Y 8.81 4.29 0.00 2.96 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 93 P 0.00 3.36 0.00 1.80 1.27 0.00 3.66 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 94 N 7.79 4.62 0.00 2.86 2.76 0.00 0.00 6.99 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 95 C 7.79 4.60 0.00 3.14 3.05 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 96 A 8.18 5.08 1.12 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 97 Y 9.18 5.08 0.00 2.98 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 98 K 9.23 4.46 0.00 1.84 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.45 7.81 99 T 8.56 5.11 4.31 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 1.28 0.00 0.00 100 T 8.82 4.68 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 1.23 0.00 0.00 101 Q 8.81 4.81 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 102 A 8.71 4.68 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 0.00 103 N 8.60 5.39 0.00 2.54 2.72 0.00 0.00 6.69 7.61 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 0.00 104 K 8.86 4.76 0.00 1.73 1.69 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 8.89 4.77 0.00 3.09 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.38 4.84 1.76 0.00 0.00 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 1.27 0.65 1.12 0.00 0.00 107 I 8.10 4.89 1.68 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.74 0.80 0.00 0.00 108 V 8.64 4.78 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 0.69 0.00 0.00 0.82 0.00 0.00 109 A 8.75 5.10 1.25 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 0.00 0.00 0.00 110 C 8.66 5.20 0.00 2.00 1.63 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 0.00 111 E 8.61 4.75 0.00 1.85 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 0.00 2.25 2.23 0.00 112 G 9.80 4.11 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 0.00 0.00 0.00 113 N 8.13 5.01 0.00 2.64 2.70 0.00 0.00 6.92 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 0.00 114 P 0.00 4.32 0.00 2.22 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.31 4.93 0.00 2.79 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 0.00 116 V 8.13 4.45 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 0.71 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.52 0.00 0.49 1.25 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 1.62 1.77 0.00 118 V 8.59 4.47 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 0.58 0.00 0.00 0.96 0.00 0.00 119 H 7.91 5.04 0.00 3.28 3.12 0.00 5.85 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 0.00 120 F 8.77 4.58 0.00 2.71 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 0.00 121 D 8.43 4.60 0.00 2.63 2.59 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 0.00 122 A 6.67 4.64 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 0.00 0.00 0.00 0.00 0.00 123 S 8.82 5.20 0.00 4.02 4.06 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 0.00 124 V 8.53 4.15 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 0.65 0.00 0.00 0.94 0.00 0.00