NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1634 8.1627 120.2971 54.6159 33.1849 173.7720 2 K 3.8098 8.5937 127.9318 56.6779 32.6460 174.9054 3 G 3.9431 8.3748 115.9677 44.7129 0.0000 171.3557 4 D 4.5179 8.4301 119.5747 53.8617 41.7805 176.4228 5 K 3.8163 9.2012 127.4905 60.2035 32.0265 178.5085 6 I 3.6462 7.7692 119.0902 64.0187 36.9914 178.4727 7 V 3.7630 7.7371 118.2584 66.2546 31.3496 178.1856 8 I 3.8586 7.9133 119.4733 64.4924 36.9737 178.5208 9 Q 3.9674 8.1144 118.9918 59.0812 28.4851 178.4086 10 H 4.1469 8.3352 117.4886 58.9112 28.7896 177.8936 11 L 4.0503 8.4975 121.1561 57.9231 41.4063 179.3731 12 N 4.4382 8.6007 116.7145 55.7483 38.1755 177.4962 13 K 3.9714 7.6565 120.5535 59.3581 32.6351 178.6811 14 I 3.8476 7.7638 120.1843 64.1518 37.0197 177.8276 15 L 4.0315 8.0006 121.4236 58.4915 41.4124 179.4139 16 G 3.6703 7.9225 104.8094 47.8881 0.0000 175.3953 17 N 4.4049 8.1897 118.6906 56.1578 38.4958 177.4117 18 E 3.9701 8.0948 119.6455 59.1541 29.5947 179.0256 19 L 3.8902 7.8546 119.1557 57.8054 41.5949 179.5244 20 I 3.5384 7.3765 118.7286 64.2946 37.1136 178.0100 21 A 3.1896 7.6405 121.2449 55.3685 18.1485 179.1699 22 I 3.4660 8.0948 117.9587 65.1576 37.2260 178.0741 23 N 4.2803 8.1357 116.4128 56.4878 38.5365 177.3771 24 Q 3.9008 8.1741 121.1238 59.5339 29.0890 177.9895 25 Y 4.5086 8.3644 118.1205 60.9899 38.0080 178.0137 26 F 3.9931 8.3901 121.8767 60.8700 39.4882 177.1322 27 L 3.9868 8.2009 120.1648 58.5357 41.9298 178.6633 28 H 3.9786 8.3097 115.9551 58.5916 28.5554 177.5380 29 A 4.1304 8.3471 123.0225 55.5149 18.2303 179.9729 30 R 3.8059 7.6729 115.8295 59.1710 29.8586 179.1798 31 M 3.5340 7.4167 118.1547 58.0400 31.9856 178.1297 32 Y 4.3632 7.5580 116.8914 61.0422 38.1232 177.6161 33 E 3.9095 8.2069 120.3415 59.7633 29.4486 178.6437 34 D 4.4104 8.2251 116.1844 56.3893 41.3237 177.2046 35 W 4.9331 8.0506 117.6200 56.8996 29.3605 177.1110 36 G 4.0550 8.3273 107.9397 45.4004 0.0000 173.7818 37 L 4.7625 7.7051 121.8211 52.9911 38.4504 176.4929 38 E 3.9518 7.9801 123.0457 59.4294 30.1828 178.9447 39 K 3.8666 8.0306 118.1392 59.7100 32.1055 179.1916 40 L 4.0407 7.8811 118.4872 57.6837 41.4251 179.5863 41 G 4.3286 8.0593 106.8932 47.4191 0.0000 175.8120 42 K 3.8789 8.1234 121.2289 59.2403 32.0054 179.0172 43 H 3.8270 8.0393 118.0860 59.2853 29.8083 177.1548 44 E 3.8893 8.4475 120.6897 59.3793 29.2350 178.8227 45 Y 3.8530 8.0560 119.6170 61.1088 38.9792 177.7421 46 H 4.1379 8.3125 117.3095 58.9110 28.8398 177.5554 47 E 3.8189 8.1784 120.4511 59.3660 29.1258 179.4097 48 S 4.1915 7.8822 112.9562 61.6154 62.3913 176.3874 49 I 3.7005 7.5404 122.0038 63.8850 36.5966 178.1800 50 D 4.2877 7.8260 120.2333 57.1770 40.7196 178.5305 51 E 3.9379 8.0732 118.7220 59.3986 29.3311 179.3810 52 M 4.0307 7.8057 118.9006 58.2191 32.0043 178.8702 53 K 4.0305 7.6961 118.7076 59.4333 32.1506 179.2657 54 H 4.2051 8.4974 116.8126 58.8352 28.6453 177.4361 55 A 3.9653 8.1799 122.7270 55.3223 18.2064 178.8971 56 D 4.2878 8.1735 116.3471 57.6507 41.2433 178.7455 57 K 3.9620 8.0396 118.6621 59.5398 32.0245 179.3352 58 L 4.0003 7.9262 119.1073 57.7476 41.5468 179.4009 59 I 3.6997 8.0846 120.1535 64.6067 37.1345 178.5971 60 K 4.0158 8.1024 119.0171 59.3622 31.7493 179.5040 61 R 4.0144 8.0490 118.9600 59.4630 30.0969 178.4559 62 I 3.7128 8.1553 120.0483 64.5532 37.1361 178.3436 63 L 4.0223 8.0764 119.6034 57.7357 41.2233 179.3968 64 F 4.3811 8.1362 119.4066 61.3289 39.7538 176.7838 65 L 4.0124 8.0665 116.7176 53.5545 41.5512 176.8286 66 E 3.8619 7.9282 117.4248 57.8320 27.2760 173.4067 67 G 4.1195 8.0591 105.0737 43.6956 0.0000 172.1047 68 L 4.5024 8.1366 118.8842 51.9727 42.0411 175.0748 69 P 4.2961 0.0000 0.0000 63.1983 31.6756 176.4652 70 N 4.6458 9.0913 121.7476 52.4772 37.7088 173.9480 71 L 4.5737 8.1397 122.0488 54.2703 42.3364 177.4076 72 Q 4.1785 8.1611 121.5955 57.9805 29.5991 176.0069 73 E 4.3081 8.1500 116.7239 55.3307 30.3618 175.6736 74 L 4.5961 8.2211 123.9824 52.9831 44.6123 176.9312 75 G 3.7466 8.4120 115.9796 44.7956 0.0000 172.5510 76 K 4.1655 8.3425 121.5891 55.1011 31.0410 177.0081 77 L 4.0390 8.2639 126.2173 54.7926 42.0664 177.8765 78 L 4.6329 8.1015 123.3400 52.7217 42.4528 177.0456 79 I 3.8012 8.4822 127.3407 60.6538 36.1506 177.5875 80 G 4.0913 9.2182 110.9268 45.5555 0.0000 173.9068 81 E 4.6234 9.2343 123.4427 56.2953 30.0495 175.9765 82 H 4.7476 7.8499 113.4918 53.9521 31.8968 174.2492 83 T 4.2485 8.6256 118.5565 67.3793 68.3564 176.0108 84 K 3.8191 8.3182 120.4107 59.8013 32.1179 178.3293 85 E 3.9099 8.0505 118.7945 59.5775 29.6796 178.4603 86 M 3.8282 8.4457 119.1500 58.2382 31.9588 178.8384 87 L 4.0786 8.3283 119.4092 57.8029 41.8223 179.2133 88 E 3.9435 8.1344 118.4030 59.8088 29.4854 178.9492 89 C 4.0513 8.9127 117.3795 63.4393 28.2789 176.3085 90 D 4.6517 8.3811 120.1067 57.1159 40.3938 178.6406 91 L 3.9323 8.0321 120.9372 57.9847 42.0840 178.4637 92 K 3.8142 8.4064 120.0745 59.7632 32.1697 177.9753 93 L 3.9827 8.1300 120.0577 58.5669 41.8144 178.9848 94 E 4.1938 8.2437 116.7782 59.2013 29.5734 179.2128 95 Q 4.1594 8.2016 118.0274 58.7442 28.8744 178.1490 96 A 4.0503 8.1832 121.4496 54.4470 18.6222 178.4465 97 G 3.9283 7.6762 103.2844 46.9118 0.0000 176.3122 98 L 3.9923 8.1276 120.8114 57.4218 41.4876 177.4107 99 P 4.2713 0.0000 0.0000 65.8166 31.2708 178.2557 100 D 4.3653 8.0741 116.9109 57.3189 40.8042 178.4901 101 L 4.0003 7.6709 119.2918 58.0300 41.6271 179.9207 102 K 3.9957 8.1371 117.9412 59.2835 31.8671 179.3569 103 A 3.9751 8.3151 121.0568 55.1801 18.2642 179.6050 104 A 3.6237 8.1194 119.3065 55.1256 18.5308 179.9276 105 I 3.6300 7.9826 118.2172 64.3925 37.1904 178.3790 106 A 3.9999 8.2048 121.7654 55.5224 18.3608 179.1311 107 Y 3.9486 8.2621 118.2538 60.9568 38.8417 177.9149 108 C 4.0416 8.4968 118.1505 62.5105 28.1402 176.0103 109 E 3.8104 7.9871 120.2458 59.2501 28.8756 179.2542 110 S 4.0144 7.3627 112.5339 61.4856 62.9990 176.3659 111 V 3.7960 6.9416 112.4812 60.8120 31.5526 177.0066 112 G 3.1176 7.1197 106.4606 46.0751 0.0000 175.1459 113 D 4.5080 7.3224 120.6398 52.7328 37.6836 176.1672 114 Y 4.1628 7.2180 121.3492 60.8867 38.3768 177.9616 115 A 4.0667 8.1462 121.2256 55.4657 18.5602 179.7552 116 S 4.1507 8.2544 113.3556 61.3594 62.8177 176.9051 117 R 3.8982 7.7217 121.7369 59.5340 29.9911 178.3418 118 E 4.2805 8.3483 119.7925 58.7048 29.2982 179.1213 119 L 3.9606 7.7205 120.3775 58.2905 42.1470 179.1434 120 L 4.0052 7.9634 118.8462 57.6324 41.5504 179.1301 121 E 3.9716 8.6151 119.0722 59.6253 29.5726 179.1482 122 D 4.4698 7.9161 118.0515 57.5630 40.9355 178.9308 123 I 3.5213 7.4220 120.2528 64.1406 37.0812 178.0487 124 L 3.9313 8.2524 121.4837 58.3797 41.7803 178.7020 125 E 4.0011 8.2777 118.3076 59.8532 29.4638 179.7256 126 S 4.2083 8.0199 114.4008 61.6837 62.8793 176.6301 127 E 4.2337 8.3448 121.3334 59.5700 29.3449 179.2879 128 E 4.1362 8.4320 118.4244 59.0405 29.3459 179.2221 129 D 4.4185 7.9052 119.3473 57.6235 40.9917 178.1061 130 H 4.3789 8.4247 118.7545 59.4636 29.7756 177.3865 131 I 3.7589 7.9825 121.7639 64.2446 37.0125 177.9120 132 D 4.4820 8.0582 118.7097 57.1577 41.1697 178.1258 133 W 4.0975 8.6740 129.2339 60.3153 30.6995 178.0659 134 L 3.7139 8.1962 119.0725 57.8124 41.1044 179.2990 135 E 3.9331 8.3276 118.6016 59.4855 29.2048 179.6673 136 T 3.7409 7.6109 115.5528 66.5545 68.5199 176.7073 137 Q 3.6591 7.2797 119.6123 58.8502 28.2987 178.7382 138 L 3.7475 7.5366 119.7935 58.0477 41.6931 179.5147 139 D 4.3435 8.1003 118.6250 57.2129 40.6636 178.7208 140 L 3.9615 7.9625 119.8330 57.9398 41.7361 179.6219 141 I 3.5633 7.5304 119.5920 64.4066 36.6866 178.2531 142 D 4.3460 7.3456 117.8228 57.0980 40.7179 178.5065 143 K 4.2038 7.8141 118.3753 57.9436 32.3342 177.7488 144 I 4.2885 8.1865 109.5952 59.8785 39.0005 176.4831 145 G 4.0002 8.0146 108.4174 45.9517 0.0000 174.4205 146 L 3.9708 8.5450 123.0253 58.0623 42.1653 179.2503 147 E 3.9836 8.1904 117.9889 59.5810 29.4206 179.0537 148 N 4.3260 8.0971 115.8555 56.4588 38.5116 176.6428 149 Y 3.9534 8.0980 119.9502 60.7328 39.1222 177.9192 150 L 4.0691 8.4714 120.3364 57.6748 41.4294 179.0218 151 Q 3.9649 8.2265 119.9003 59.1890 28.7682 178.0397 152 S 4.4103 7.7327 111.5989 59.2830 63.5252 174.9208 153 Q 4.3767 7.7234 121.3230 56.1633 28.7882 177.1344 154 M 4.3648 7.5208 120.4093 57.0364 32.3543 176.2121 155 D 4.5391 7.8673 121.6277 54.3489 41.6009 175.6320 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 8.16 4.16 0.00 1.53 1.89 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.39 0.00 2 K 8.59 3.81 0.00 1.83 1.68 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.46 7.81 3 G 8.37 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.43 4.52 0.00 2.83 2.63 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 5 K 9.20 3.82 0.00 1.85 1.82 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.54 7.81 6 I 7.77 3.65 1.96 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 1.39 0.44 0.09 0.00 0.00 7 V 7.74 3.76 2.36 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 1.06 0.00 0.00 1.14 0.00 0.00 8 I 7.91 3.86 2.03 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 1.52 0.67 0.90 0.00 0.00 9 Q 8.11 3.97 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 10 H 8.34 4.15 0.00 3.46 3.33 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 8.50 4.05 0.00 1.94 1.74 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.60 4.44 0.00 2.88 2.85 0.00 0.00 6.65 6.81 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 13 K 7.66 3.97 0.00 1.76 1.98 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.19 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.46 7.81 14 I 7.76 3.85 1.88 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 1.43 1.01 0.92 0.00 0.00 15 L 8.00 4.03 0.00 1.85 1.88 0.92 1.00 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 16 G 7.92 3.67 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 0.00 0.00 0.00 17 N 8.19 4.40 0.00 2.98 2.87 0.00 0.00 6.94 6.97 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 18 E 8.09 3.97 0.00 2.08 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 2.63 2.37 0.00 19 L 7.85 3.89 0.00 1.84 1.67 0.94 0.83 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 20 I 7.38 3.54 2.00 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 0.88 0.85 0.00 0.00 21 A 7.64 3.19 0.99 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 22 I 8.09 3.47 1.98 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 1.45 0.93 0.82 0.00 0.00 23 N 8.14 4.28 0.00 2.89 2.83 0.00 0.00 6.79 7.73 0.00 0.00 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 8.17 3.90 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.56 2.31 0.00 25 Y 8.36 4.51 0.00 3.02 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 26 F 8.39 3.99 0.00 3.35 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 27 L 8.20 3.99 0.00 1.85 1.76 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.31 3.98 0.00 3.49 3.19 0.00 5.70 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 29 A 8.35 4.13 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 30 R 7.67 3.81 0.00 1.74 1.87 0.00 3.14 0.00 0.00 2.88 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.74 0.00 31 M 7.42 3.53 0.00 0.65 1.57 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.16 0.00 32 Y 7.56 4.36 0.00 3.20 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 33 E 8.21 3.91 0.00 2.25 1.90 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 2.22 2.34 0.00 34 D 8.23 4.41 0.00 2.60 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 35 W 8.05 4.93 0.00 3.66 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 36 G 8.33 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 37 L 7.71 4.76 0.00 2.15 1.67 1.03 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.98 3.95 0.00 2.14 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 2.41 2.54 0.00 39 K 8.03 3.87 0.00 1.88 1.97 0.00 1.84 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.46 1.55 7.81 40 L 7.88 4.04 0.00 1.51 0.84 1.09 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.06 4.33 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 0.00 42 K 8.12 3.88 0.00 1.93 1.83 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.37 7.81 43 H 8.04 3.83 0.00 3.06 2.93 0.00 5.59 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 44 E 8.45 3.89 0.00 2.40 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 2.63 3.07 0.00 45 Y 8.06 3.85 0.00 2.96 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 46 H 8.31 4.14 0.00 3.03 3.20 0.00 5.68 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 8.18 3.82 0.00 1.96 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 2.14 1.96 0.00 48 S 7.88 4.19 0.00 4.13 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 49 I 7.54 3.70 1.73 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.28 0.86 0.00 0.00 50 D 7.83 4.29 0.00 2.79 2.54 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 51 E 8.07 3.94 0.00 2.09 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 2.69 2.50 0.00 52 M 7.81 4.03 0.00 1.98 2.24 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.50 0.00 53 K 7.70 4.03 0.00 1.90 1.86 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.72 7.81 54 H 8.50 4.21 0.00 3.33 3.33 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 8.18 3.97 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 8.17 4.29 0.00 2.87 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 57 K 8.04 3.96 0.00 2.07 1.86 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.68 7.81 58 L 7.93 4.00 0.00 1.87 1.73 0.95 0.87 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 59 I 8.08 3.70 2.06 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.98 0.92 0.00 0.00 60 K 8.10 4.02 0.00 1.98 1.87 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.47 1.62 7.81 61 R 8.05 4.01 0.00 2.00 2.11 0.00 3.35 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 62 I 8.16 3.71 2.11 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 0.88 0.97 0.00 0.00 63 L 8.08 4.02 0.00 2.07 1.78 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.14 4.38 0.00 2.94 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 65 L 8.07 4.01 0.00 2.01 1.60 0.79 1.15 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 66 E 7.93 3.86 0.00 2.01 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 0.00 2.21 2.16 0.00 67 G 8.06 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 68 L 8.14 4.50 0.00 1.60 1.62 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.30 0.00 2.03 2.01 0.00 3.69 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 2.04 2.11 0.00 70 N 9.09 4.65 0.00 2.63 2.73 0.00 0.00 7.09 7.32 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 71 L 8.14 4.57 0.00 1.64 1.63 0.90 0.94 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 72 Q 8.16 4.18 0.00 1.97 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.43 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 73 E 8.15 4.31 0.00 2.00 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 2.31 2.22 0.00 74 L 8.22 4.60 0.00 1.51 1.48 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.41 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 0.00 0.00 0.00 76 K 8.34 4.17 0.00 1.71 1.78 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.52 7.81 77 L 8.26 4.04 0.00 1.65 1.58 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.10 4.63 0.00 1.83 1.67 1.02 0.92 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 79 I 8.48 3.80 1.92 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 1.37 0.76 0.96 0.00 0.00 80 G 9.22 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 0.00 0.00 0.00 81 E 9.23 4.62 0.00 2.02 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 2.36 2.28 0.00 82 H 7.85 4.75 0.00 3.26 3.29 0.00 5.70 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 83 T 8.63 4.25 4.44 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 1.50 0.00 0.00 84 K 8.32 3.82 0.00 1.84 1.95 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.70 1.48 7.81 85 E 8.05 3.91 0.00 1.83 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 2.34 2.37 0.00 86 M 8.45 3.83 0.00 1.86 2.32 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.29 0.00 87 L 8.33 4.08 0.00 2.02 1.68 1.08 1.06 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 88 E 8.13 3.94 0.00 2.20 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 2.32 2.43 0.00 89 C 8.91 4.05 0.00 3.21 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 90 D 8.38 4.65 0.00 2.99 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 91 L 8.03 3.93 0.00 1.88 1.88 0.92 0.22 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 K 8.41 3.81 0.00 2.02 2.07 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.50 7.81 93 L 8.13 3.98 0.00 1.95 2.04 0.97 0.91 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 94 E 8.24 4.19 0.00 2.23 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 2.74 2.54 0.00 95 Q 8.20 4.16 0.00 2.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 96 A 8.18 4.05 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 97 G 7.68 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 0.00 0.00 0.00 98 L 8.13 3.99 0.00 1.88 1.76 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.27 0.00 2.17 2.13 0.00 3.65 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 2.13 2.21 0.00 100 D 8.07 4.37 0.00 2.88 2.74 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 0.00 0.00 0.00 101 L 7.67 4.00 0.00 1.86 1.74 0.95 1.25 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 0.00 102 K 8.14 4.00 0.00 1.96 1.87 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.64 7.81 103 A 8.32 3.98 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 0.00 104 A 8.12 3.62 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 0.00 105 I 7.98 3.63 2.03 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 1.47 1.32 0.93 0.00 0.00 106 A 8.20 4.00 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 0.00 107 Y 8.26 3.95 0.00 3.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.50 4.04 0.00 3.11 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 0.00 109 E 7.99 3.81 0.00 2.13 1.97 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 2.39 2.51 0.00 110 S 7.36 4.01 0.00 3.87 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 0.00 111 V 6.94 3.80 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 0.10 0.00 0.00 0.73 0.00 0.00 112 G 7.12 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 0.00 0.00 0.00 113 D 7.32 4.51 0.00 2.70 2.45 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 0.00 114 Y 7.22 4.16 0.00 3.08 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 0.00 115 A 8.15 4.07 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 0.00 116 S 8.25 4.15 0.00 4.03 3.95 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 0.00 117 R 7.72 3.90 0.00 1.83 2.15 0.00 3.22 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 118 E 8.35 4.28 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 2.36 2.23 0.00 119 L 7.72 3.96 0.00 1.64 1.93 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 120 L 7.96 4.01 0.00 1.90 1.71 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.62 3.97 0.00 2.11 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 2.62 0.00 122 D 7.92 4.47 0.00 2.86 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 0.00 123 I 7.42 3.52 1.95 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.63 0.81 0.00 0.00 124 L 8.25 3.93 0.00 1.83 1.91 0.95 0.87 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 0.00 125 E 8.28 4.00 0.00 2.27 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 2.52 0.00 126 S 8.02 4.21 0.00 4.18 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 0.00 127 E 8.34 4.23 0.00 2.17 2.19 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 2.62 2.55 0.00 128 E 8.43 4.14 0.00 2.20 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 2.37 2.57 0.00 129 D 7.91 4.42 0.00 2.91 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 0.00 130 H 8.42 4.38 0.00 3.28 3.52 0.00 5.61 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 0.00 131 I 7.98 3.76 2.06 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.77 0.93 0.00 0.00 132 D 8.06 4.48 0.00 3.03 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 0.00 133 W 8.67 4.10 0.00 3.51 3.49 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 0.00 134 L 8.20 3.71 0.00 1.87 1.65 0.78 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.33 3.93 0.00 1.96 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 2.68 0.00 136 T 7.61 3.74 4.16 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 1.10 0.00 0.00 137 Q 7.28 3.66 0.00 1.59 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.76 0.00 0.00 0.00 0.00 0.00 1.23 1.16 0.00 138 L 7.54 3.75 0.00 1.72 1.61 0.86 0.75 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 0.00 139 D 8.10 4.34 0.00 2.78 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 0.00 140 L 7.96 3.96 0.00 1.91 1.74 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.53 3.56 1.80 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.42 0.79 0.00 0.00 142 D 7.35 4.35 0.00 2.79 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 0.00 143 K 7.81 4.20 0.00 1.74 1.85 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.58 7.81 144 I 8.19 4.29 1.89 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 1.55 0.73 0.93 0.00 0.00 145 G 8.01 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 0.00 146 L 8.55 3.97 0.00 1.75 1.67 0.95 0.93 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 0.00 147 E 8.19 3.98 0.00 2.05 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 2.39 2.40 0.00 148 N 8.10 4.33 0.00 3.13 2.89 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 8.10 3.95 0.00 2.99 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 0.00 150 L 8.47 4.07 0.00 1.73 1.72 0.94 0.94 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 8.23 3.96 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.93 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 152 S 7.73 4.41 0.00 3.98 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 0.00 153 Q 7.72 4.38 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.70 6.85 0.00 0.00 0.00 0.00 0.00 1.87 2.03 0.00 154 M 7.52 4.36 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.48 0.00 155 D 7.87 4.54 0.00 2.58 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