NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4010 8.3049 120.3496 55.2002 33.4098 173.6469 2 K 4.4502 8.2091 116.8431 53.7405 35.5907 175.4031 3 F 4.8549 9.4924 123.7512 55.8758 42.8291 177.2357 4 V 4.0212 9.5137 118.3809 64.1173 31.5139 178.3143 5 Y 4.2184 8.7252 119.5319 60.7331 38.3740 178.4600 6 K 4.0629 8.2367 118.1165 59.4101 32.5514 178.7325 7 E 4.1201 8.2726 118.9633 59.3258 29.1149 179.0898 8 E 4.1579 8.4707 118.0753 56.9379 29.9373 176.6096 9 H 4.7832 7.1903 115.3284 52.7661 31.1461 172.3733 10 P 4.4040 0.0000 0.0000 62.4115 32.2607 176.7714 11 F 4.0569 9.2417 123.5578 62.0389 39.1696 177.6796 12 E 4.0593 8.4004 117.1918 59.3402 29.2880 179.4582 13 K 4.0203 8.1592 118.5680 59.2874 32.1461 179.7023 14 R 4.0205 7.7766 117.8481 59.4072 30.1192 178.8747 15 R 4.3077 8.0413 120.1361 58.8375 29.8317 178.4703 16 S 4.0103 7.9453 112.8452 61.3392 62.3619 175.8483 17 E 4.0645 8.3247 122.1177 59.0711 29.4394 178.8997 18 G 3.1530 8.6734 106.2705 47.7523 0.0000 175.3114 19 E 2.8176 8.1578 122.5233 58.1366 29.3740 178.8837 20 K 3.8060 7.6155 119.5558 59.4331 32.3103 178.9078 21 I 3.7448 7.7677 120.2202 64.5660 36.8048 178.7197 22 R 4.0685 7.6087 117.6060 58.6192 29.8176 178.9966 23 K 4.0549 7.1692 117.7849 59.1585 32.4403 179.1970 24 K 3.9060 7.7233 117.3949 57.9188 33.1836 177.0375 25 Y 4.7310 7.9129 117.2047 55.2161 38.2648 173.9345 26 P 4.4249 0.0000 0.0000 64.7386 32.2403 177.9064 27 D 4.6347 8.0297 117.8304 54.7309 41.3024 175.5058 28 R 5.0462 7.5695 117.3763 54.2397 34.0504 175.2309 29 V 4.0144 8.3534 114.8972 58.6733 34.8420 173.1877 30 P 5.0611 0.0000 0.0000 62.2193 32.9614 175.3093 31 V 4.9792 9.2329 122.9265 59.9544 35.0405 174.2372 32 I 4.6673 8.4103 124.9320 59.6483 39.0466 174.5916 33 V 5.1473 9.3878 128.5928 61.3042 33.3890 174.6195 34 E 5.1303 9.4907 126.5636 54.3202 33.9920 175.1172 35 K 3.4016 8.7367 123.3427 55.6818 32.9254 176.5056 36 A 4.0411 8.5135 128.5048 50.9293 19.6521 175.5090 37 P 4.1354 0.0000 0.0000 63.7957 31.8784 176.3867 38 K 3.6564 8.4999 122.5729 57.4017 30.3621 174.8304 39 A 4.5775 7.4011 119.4627 50.1764 20.0810 179.0190 40 R 4.3189 8.0171 123.3634 56.6649 29.2398 175.9848 41 I 4.6261 7.2933 109.8471 59.2399 40.8927 175.3953 42 G 3.7613 8.5307 109.8339 45.8537 0.0000 172.8685 43 D 5.0917 8.2969 120.8746 52.0925 42.6181 175.9830 44 L 4.4660 8.4716 123.5864 54.4043 42.6089 176.7217 45 D 4.6521 8.5781 120.0171 53.5285 40.5835 176.4054 46 K 4.4419 7.9631 120.4589 54.4223 34.2949 175.1130 47 K 4.7480 8.5611 124.4961 56.5012 34.4991 175.7208 48 K 5.0687 7.7787 120.7626 54.7046 34.1598 174.9746 49 Y 4.7495 9.2893 124.1318 56.1297 42.5551 174.4090 50 L 5.0057 8.7041 123.9132 53.5705 43.5325 175.4149 51 V 4.5279 8.0800 119.1607 58.3453 34.8838 173.8614 52 P 4.7313 0.0000 0.0000 62.6515 31.9492 177.8776 53 S 4.0415 9.1140 119.0561 60.8887 63.0032 175.4644 54 D 4.6105 7.8703 118.2417 53.3484 40.0722 176.2943 55 L 4.2036 7.8317 124.2473 55.3256 42.8502 176.3489 56 T 4.7916 9.3114 116.7472 60.8937 71.5379 176.2574 57 V 3.8325 8.9265 121.9294 66.1052 31.5531 178.6849 58 G 3.8348 8.3812 105.7603 48.0061 0.0000 175.8253 59 Q 4.2094 8.4218 120.5372 58.6296 28.6780 178.5544 60 F 4.3795 8.4354 121.8982 61.1982 39.3256 176.9184 61 Y 3.9774 8.3594 116.7517 60.9238 37.6055 178.3970 62 F 4.2349 8.3034 121.0009 61.2570 39.6507 176.9419 63 L 3.7588 7.9817 118.5960 58.0312 41.4571 179.7852 64 I 3.4236 7.4653 119.4018 64.1729 36.8884 178.6687 65 R 3.7934 8.1162 119.3407 59.2297 29.7047 179.1307 66 K 3.6557 8.0094 118.2689 59.0373 32.0986 178.4751 67 R 3.9543 7.4020 118.5760 58.2576 30.1646 177.3623 68 I 4.0924 7.4458 109.8191 59.7246 39.4358 174.9210 69 H 3.9298 7.6880 116.5795 56.9928 25.3068 173.6639 70 L 4.7050 8.2632 120.4798 53.0817 44.9556 176.1552 71 R 4.3720 9.0883 124.5638 54.7714 31.5525 177.3723 72 A 3.9405 8.7309 122.8178 55.5085 18.1967 179.3543 73 E 4.0367 8.0684 111.3648 58.5339 29.8143 176.7612 74 D 4.4918 7.8279 120.5164 53.4066 41.8531 175.8814 75 A 3.9286 8.3734 126.0523 51.7971 19.7999 176.1877 76 L 4.8609 7.4508 123.9040 53.9067 45.0861 174.7441 77 F 5.0586 9.9345 125.8422 55.7450 42.6570 174.3169 78 F 5.8713 9.1446 121.5393 56.4601 41.0733 174.8279 79 F 5.2787 10.1317 121.9185 55.7204 41.9618 174.2879 80 V 4.5486 8.5870 123.2309 60.9767 34.0599 175.1798 81 N 3.9499 9.5324 127.5972 54.8221 36.1013 173.9429 82 N 4.3962 8.5214 108.1119 53.9796 36.5107 175.7010 83 V 4.3026 7.7500 116.1040 61.5197 34.6596 173.5149 84 I 4.9423 8.6010 128.5117 58.8967 36.7223 174.0698 85 P 4.5541 0.0000 0.0000 61.5545 32.2517 174.5668 86 P 4.5930 0.0000 0.0000 62.5470 32.3409 177.6477 87 T 4.1487 8.5996 110.8439 64.5750 68.9011 176.1543 88 S 4.2968 8.0495 114.9856 59.6981 63.9074 174.3741 89 A 4.2236 7.8580 125.4741 52.1803 19.0194 176.6637 90 T 4.8322 8.0757 110.9575 60.7870 72.1045 176.1633 91 M 4.1103 9.1928 122.7871 58.3517 31.8825 179.5355 92 G 3.5987 8.1039 106.2984 47.6456 0.0000 175.9427 93 Q 4.0021 7.9020 119.8999 58.7670 28.7439 178.5160 94 L 4.0310 7.9502 119.9371 58.1554 41.7264 179.0025 95 Y 4.0276 8.1544 119.1300 60.9696 38.5012 178.1728 96 Q 4.0176 8.0914 117.5997 58.7520 28.9076 177.9168 97 E 4.2171 7.9047 118.0834 57.3636 30.0455 176.1111 98 H 4.8328 8.0261 112.5161 54.6978 31.0286 173.3505 99 H 4.1381 7.7245 115.4778 55.9416 28.5890 174.9293 100 E 4.5001 8.9778 121.5704 54.8332 31.0761 177.2168 101 E 3.9584 8.7642 118.9955 59.4055 29.5718 177.9670 102 D 4.6652 8.5035 116.8364 53.1771 39.7577 177.3299 103 F 3.8982 8.2114 116.9944 58.1216 37.1698 174.3695 104 F 4.9888 8.7628 119.8419 55.7967 41.7602 174.4219 105 L 4.8990 8.6288 123.9175 53.9117 43.6886 174.5622 106 Y 4.7698 8.6802 124.3509 56.4377 39.5829 175.1583 107 I 5.0028 9.0026 125.1156 59.5000 40.6820 174.4449 108 A 5.6490 9.6259 129.1067 50.5320 21.7525 175.0413 109 Y 5.9102 8.7143 117.9609 55.9258 42.0039 174.2926 110 S 4.8369 9.5112 114.9892 57.9707 66.6449 173.8252 111 D 5.3714 9.2013 118.8765 52.3861 39.8656 175.7897 112 E 4.9366 8.1965 116.9710 55.1917 32.6433 175.8824 113 S 4.6226 8.2745 119.3408 57.6812 61.9861 175.6099 114 V 4.0082 7.7945 120.8985 60.5560 32.3112 174.5732 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 4.40 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 2 K 8.21 4.45 0.00 1.76 1.80 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.45 7.81 3 F 9.49 4.85 0.00 3.05 3.16 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 4 V 9.51 4.02 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 1.00 0.00 0.00 1.24 0.00 0.00 5 Y 8.73 4.22 0.00 3.29 3.20 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 6 K 8.24 4.06 0.00 2.00 1.89 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.44 1.49 7.81 7 E 8.27 4.12 0.00 2.24 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 2.35 2.53 0.00 8 E 8.47 4.16 0.00 1.62 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.62 0.00 9 H 7.19 4.78 0.00 2.68 3.02 0.00 5.86 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 10 P 0.00 4.40 0.00 2.20 2.02 0.00 3.62 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 11 F 9.24 4.06 0.00 3.21 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 12 E 8.40 4.06 0.00 2.08 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 2.61 2.46 0.00 13 K 8.16 4.02 0.00 1.88 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.62 7.81 14 R 7.78 4.02 0.00 1.97 2.21 0.00 3.31 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 1.40 1.91 0.00 15 R 8.04 4.31 0.00 0.92 1.62 0.00 3.36 0.00 0.00 3.44 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.78 0.00 16 S 7.95 4.01 0.00 4.09 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 E 8.32 4.06 0.00 2.22 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 0.00 2.54 2.43 0.00 18 G 8.67 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 0.00 0.00 0.00 19 E 8.16 2.82 0.00 1.19 1.64 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 1.98 1.62 0.00 20 K 7.62 3.81 0.00 1.85 1.90 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.40 7.81 21 I 7.77 3.74 1.83 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 1.60 0.53 0.94 0.00 0.00 22 R 7.61 4.07 0.00 1.72 1.93 0.00 3.12 0.00 0.00 2.89 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.00 0.00 23 K 7.17 4.05 0.00 1.65 1.72 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.55 7.81 24 K 7.72 3.91 0.00 0.79 0.76 0.00 1.43 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.20 1.41 7.81 25 Y 7.91 4.73 0.00 2.99 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 26 P 0.00 4.42 0.00 2.15 2.13 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 27 D 8.03 4.63 0.00 2.77 2.71 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 28 R 7.57 5.05 0.00 1.59 1.67 0.00 2.91 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.53 0.00 29 V 8.35 4.01 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 0.47 0.00 0.00 0.75 0.00 0.00 30 P 0.00 5.06 0.00 1.53 1.87 0.00 3.05 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.47 0.00 31 V 9.23 4.98 1.91 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 0.88 0.00 0.00 0.90 0.00 0.00 32 I 8.41 4.67 1.09 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 -0.26 0.91 0.00 0.00 33 V 9.39 5.15 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 0.87 0.00 0.00 0.98 0.00 0.00 34 E 9.49 5.13 0.00 2.04 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 2.42 2.58 0.00 35 K 8.74 3.40 0.00 1.36 1.53 0.00 1.87 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.12 0.79 7.81 36 A 8.51 4.04 1.09 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 0.00 0.00 37 P 0.00 4.14 0.00 1.96 1.93 0.00 3.67 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 1.91 1.95 0.00 38 K 8.50 3.66 0.00 1.83 1.82 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.39 7.81 39 A 7.40 4.58 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 40 R 8.02 4.32 0.00 2.06 2.03 0.00 3.02 0.00 0.00 3.29 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 41 I 7.29 4.63 2.02 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.79 1.06 0.00 0.00 42 G 8.53 3.76 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 0.00 0.00 0.00 43 D 8.30 5.09 0.00 2.71 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 44 L 8.47 4.47 0.00 1.86 1.81 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.58 4.65 0.00 2.78 2.80 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 46 K 7.96 4.44 0.00 1.55 1.53 0.00 1.49 0.00 0.00 1.08 0.00 0.00 2.74 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.55 1.07 7.81 47 K 8.56 4.75 0.00 1.74 1.92 0.00 1.98 0.00 0.00 1.92 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.47 7.81 48 K 7.78 5.07 0.00 1.51 1.52 0.00 1.89 0.00 0.00 1.46 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.41 7.81 49 Y 9.29 4.75 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 50 L 8.70 5.01 0.00 1.49 1.44 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.08 4.53 1.98 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 0.67 0.00 0.00 0.68 0.00 0.00 52 P 0.00 4.73 0.00 2.28 1.95 0.00 3.60 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 53 S 9.11 4.04 0.00 3.95 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 54 D 7.87 4.61 0.00 2.80 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 55 L 7.83 4.20 0.00 1.79 1.60 1.07 0.71 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 56 T 9.31 4.79 4.48 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 1.28 0.00 0.00 57 V 8.93 3.83 2.49 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 1.16 0.00 0.00 1.06 0.00 0.00 58 G 8.38 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 0.00 0.00 0.00 59 Q 8.42 4.21 0.00 2.41 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 60 F 8.44 4.38 0.00 3.19 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 61 Y 8.36 3.98 0.00 3.33 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 62 F 8.30 4.23 0.00 3.10 3.30 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 63 L 7.98 3.76 0.00 1.62 1.49 1.09 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 64 I 7.47 3.42 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 0.92 0.81 0.55 0.00 0.00 65 R 8.12 3.79 0.00 1.89 2.02 0.00 3.16 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 1.57 1.72 0.00 66 K 8.01 3.66 0.00 0.98 1.59 0.00 1.40 0.00 0.00 1.41 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.20 7.81 67 R 7.40 3.95 0.00 1.88 1.93 0.00 3.39 0.00 0.00 3.49 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 68 I 7.45 4.09 1.89 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 1.63 0.73 0.86 0.00 0.00 69 H 7.69 3.93 0.00 3.33 3.36 0.00 5.64 0.00 0.00 0.00 0.00 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.26 4.70 0.00 1.48 1.45 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 71 R 9.09 4.37 0.00 1.98 1.98 0.00 3.25 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 72 A 8.73 3.94 1.26 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 0.00 0.00 73 E 8.07 4.04 0.00 2.07 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 2.26 2.27 0.00 74 D 7.83 4.49 0.00 2.81 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.37 3.93 1.29 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 0.00 0.00 76 L 7.45 4.86 0.00 1.49 1.26 1.24 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 77 F 9.93 5.06 0.00 3.23 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 78 F 9.14 5.87 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 79 F 10.13 5.28 0.00 3.10 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 80 V 8.59 4.55 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 0.97 0.00 0.00 0.95 0.00 0.00 81 N 9.53 3.95 0.00 2.87 2.92 0.00 0.00 7.20 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.52 4.40 0.00 2.93 2.97 0.00 0.00 6.87 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 83 V 7.75 4.30 2.26 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 1.01 0.00 0.00 1.02 0.00 0.00 84 I 8.60 4.94 1.84 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 1.39 0.98 0.00 0.00 85 P 0.00 4.55 0.00 2.26 2.11 0.00 4.02 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 86 P 0.00 4.59 0.00 2.29 2.26 0.00 3.76 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.99 0.00 87 T 8.60 4.15 4.35 0.00 0.00 0.00 0.00 0.00 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 88 S 8.05 4.30 0.00 4.03 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 89 A 7.86 4.22 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 90 T 8.08 4.83 4.43 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 1.22 0.00 0.00 91 M 9.19 4.11 0.00 1.77 2.01 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.74 0.00 92 G 8.10 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 93 Q 7.90 4.00 0.00 2.36 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 94 L 7.95 4.03 0.00 1.87 1.77 0.89 0.66 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 95 Y 8.15 4.03 0.00 3.13 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 96 Q 8.09 4.02 0.00 2.42 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.67 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 97 E 7.90 4.22 0.00 1.91 1.81 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 1.76 2.17 0.00 98 H 8.03 4.83 0.00 3.22 3.32 0.00 5.73 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 99 H 7.72 4.14 0.00 2.51 2.11 0.00 5.74 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 0.00 100 E 8.98 4.50 0.00 2.50 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 2.32 2.48 0.00 101 E 8.76 3.96 0.00 2.22 2.30 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 2.31 2.21 0.00 102 D 8.50 4.67 0.00 3.04 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 0.00 103 F 8.21 3.90 0.00 3.13 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 0.00 104 F 8.76 4.99 0.00 3.14 2.31 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 0.00 105 L 8.63 4.90 0.00 2.09 1.73 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.68 4.77 0.00 2.61 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 0.00 0.00 0.00 107 I 9.00 5.00 1.85 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.72 0.67 0.00 0.00 108 A 9.63 5.65 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 0.00 109 Y 8.71 5.91 0.00 3.46 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.51 4.84 0.00 3.90 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 0.00 111 D 9.20 5.37 0.00 2.89 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 0.00 112 E 8.20 4.94 0.00 2.02 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 2.25 2.28 0.00 113 S 8.27 4.62 0.00 3.60 3.69 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 0.00 0.00 0.00 0.00 114 V 7.79 4.01 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 0.75 0.00 0.00 0.93 0.00 0.00