NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3024 8.3044 120.3267 55.0789 34.1348 174.3447 2 N 3.9369 8.0299 116.9234 53.7485 38.5865 171.8143 3 G 4.2068 8.2633 113.2309 45.0180 0.0000 170.6812 4 E 4.5013 8.2579 117.8524 55.1207 30.7969 173.1169 5 V 3.4882 8.0190 119.9981 63.8356 32.4069 171.2479 6 A 3.7122 8.5184 125.5074 52.5110 15.0533 174.3776 7 P 4.4876 0.0000 0.0000 61.0478 32.6544 176.8764 8 P 4.2129 0.0000 0.0000 65.3142 31.4602 177.1534 9 K 4.0268 7.6030 118.4772 55.1773 32.4798 175.9024 10 E 5.7254 7.7299 133.0303 56.7218 32.6433 177.1322 11 D 5.0071 8.2509 124.7673 50.8595 39.7612 173.1748 12 P 4.1396 0.0000 0.0000 64.3445 31.5969 178.9475 13 V 4.2855 5.4500 116.8714 59.5645 31.5282 171.7050 14 P 4.7954 0.0000 0.0000 62.3121 32.8429 177.7342 15 L 4.8159 8.1143 120.9335 54.0885 42.0260 176.8012 16 P 3.7842 0.0000 0.0000 65.7118 31.7629 177.4483 17 E 4.4559 8.2460 115.7910 56.3920 29.2626 177.0444 18 L 4.6143 8.2403 122.8312 52.1218 42.6672 173.3601 19 P 4.9245 0.0000 0.0000 62.8343 32.8469 174.9517 20 C 4.3802 8.6116 118.8533 60.3993 26.8340 174.0278 21 E 4.4327 8.2007 124.0382 55.7828 31.6969 175.7250 22 K 4.7716 6.8628 119.2313 57.0847 35.1635 175.1978 23 S 4.6130 8.3931 110.6994 58.2357 62.7596 173.5042 24 D 4.6087 8.4984 114.9910 54.3205 37.5336 173.7625 25 A 4.8878 7.7006 122.1295 51.3171 22.1246 175.4103 26 Y 5.3375 7.2532 115.0719 56.7943 41.9603 174.1390 27 F 4.8164 9.2006 118.4394 56.2985 39.2229 175.1673 28 V 4.0837 7.8192 123.4220 61.4099 31.2728 175.0993 29 L 3.9422 8.5056 131.1531 56.0587 43.1383 176.2555 30 R 5.0302 8.5511 124.7972 54.9710 34.9236 173.7495 31 D 4.6677 8.5037 119.8255 53.7874 40.6164 174.5143 32 G 4.1132 6.9643 114.5026 45.2341 0.0000 172.9796 33 A 4.1154 6.3317 119.1547 50.3735 18.7345 177.2849 34 A 3.4989 7.7378 119.2294 50.5582 16.7168 179.2070 35 G 4.0276 5.3800 108.0189 46.9919 0.0000 175.6225 36 V 4.7970 7.6053 118.6661 59.3252 35.1754 173.0610 37 F 4.7540 8.2970 114.1972 57.2537 42.4108 172.5962 38 L 4.3313 7.4343 118.0232 53.2556 44.5811 176.1475 39 A 4.1490 6.8756 125.4136 50.1513 21.1562 175.9567 40 A 4.0610 7.3589 122.0395 51.5614 19.2939 178.5437 41 N 4.2021 8.3307 119.8544 55.1073 38.9811 175.5758 42 T 4.3045 7.4198 106.0427 61.6699 69.6567 174.3203 43 F 3.9167 7.6689 124.6819 58.0199 39.9230 173.5419 44 P 2.9700 0.0000 0.0000 62.7126 31.6002 177.7174 45 K 3.6331 7.7398 120.2671 59.2490 31.7404 175.8638 46 S 4.4172 7.8513 113.4842 57.0668 64.6186 173.8510 47 R 4.4202 8.4397 123.1866 56.1513 29.9713 177.3004 48 E 4.4331 8.0013 119.3224 57.0828 27.9692 175.9614 49 T 5.1165 9.2835 112.8043 57.6683 72.0774 173.6697 50 R 5.0048 8.7025 122.9236 55.7101 31.1393 173.0155 51 A 4.2576 8.6145 122.5742 51.6863 19.4128 175.4847 52 P 4.3986 0.0000 0.0000 61.6707 32.6132 175.6188 53 L 4.1248 8.5545 123.4540 55.3181 42.8982 177.4067 54 V 3.5763 8.1897 126.5888 66.2696 31.3373 177.6674 55 E 3.9619 8.1410 116.4012 59.8416 29.1515 178.9867 56 E 4.1608 8.1597 117.7734 58.3726 29.8329 178.6848 57 L 4.2203 8.1235 121.1198 58.1879 42.2705 178.1651 58 Y 3.8337 8.2190 119.5953 60.7461 38.5188 178.1452 59 R 4.0294 7.9794 118.1718 58.3922 30.3584 177.3889 60 F 4.5496 7.7644 116.5076 57.2780 39.5612 177.6680 61 R 3.8328 7.6337 122.0827 59.6738 29.5916 178.2188 62 D 4.3963 8.0525 116.9270 56.6094 40.9422 177.1414 63 R 4.4622 7.1966 114.8819 55.4104 31.4725 176.1538 64 L 3.8513 7.7323 120.6866 55.1629 42.3088 175.4360 65 P 4.6165 0.0000 0.0000 62.8927 31.6011 176.1427 66 E 4.2065 8.2250 125.5158 57.1566 30.1621 175.8747 67 K 4.5057 7.8689 113.8065 57.2088 32.5485 176.9423 68 L 3.8625 7.4406 117.1809 53.6236 43.5728 178.1463 69 R 3.7448 7.8242 119.8089 59.7925 29.7730 177.4486 70 Y 4.0491 6.8080 116.6471 60.0198 38.0072 177.4095 71 L 4.3135 6.7559 119.1687 57.6417 41.9489 178.9519 72 A 4.1368 7.9445 120.1503 55.2846 18.3538 179.1161 73 D 4.5123 7.7851 116.3376 56.4368 41.1682 177.1398 74 A 3.2224 7.2169 120.8735 51.0380 18.6658 175.1380 75 P 4.2877 0.0000 0.0000 63.2531 32.1222 176.0569 76 Q 4.5131 8.8420 116.2019 54.0010 29.7472 175.8221 77 Q 5.2424 6.1460 114.4824 56.1465 32.6143 170.5518 78 D 4.2847 7.0151 115.8291 51.3126 44.1624 174.6667 79 P 4.1646 0.0000 0.0000 65.1143 31.2696 177.4135 80 E 4.1154 8.1195 117.4729 57.2252 30.0774 175.7831 81 G 3.5940 8.0881 108.3744 45.3245 0.0000 171.6293 82 N 4.3340 8.1426 118.7872 51.5422 37.7054 174.2495 83 K 4.6010 8.3069 124.1215 56.3692 34.1076 175.3764 84 T 5.1138 8.2712 118.7320 62.1304 71.3628 173.8335 85 M 4.9407 8.4020 123.7112 53.5142 34.4830 175.2158 86 V 4.3247 7.9258 118.5069 62.9394 33.1024 175.0448 87 R 4.5680 8.3025 122.3919 54.9408 34.8066 173.3465 88 F 5.3506 8.4835 120.2884 57.2067 42.7211 174.0688 89 S 4.8708 7.7076 120.6479 56.9822 65.5285 175.3572 90 R 4.2738 8.6308 122.0838 57.5037 30.6521 178.7675 91 K 4.1244 7.9295 116.7972 59.1832 32.1059 177.9959 92 T 4.4569 7.4676 104.3943 60.5564 70.6430 174.0966 93 K 3.7264 7.3180 117.9245 57.7429 29.9672 172.5645 94 Q 4.6156 7.3235 117.3671 54.8601 34.5776 173.9871 95 Q 5.4122 8.7890 118.1854 54.8127 31.5536 174.5781 96 Y 5.5116 8.3292 121.8203 55.5396 41.1077 175.8899 97 V 4.5484 8.9239 116.2568 61.2119 34.1061 175.4346 98 S 5.7649 8.7309 117.4799 57.6864 67.1196 174.7303 99 S 4.5872 9.4753 121.0435 59.0891 63.7916 173.5359 100 E 4.6855 8.9389 120.0689 55.1341 34.6399 174.7533 101 K 4.4480 8.7615 125.1921 55.1887 32.3730 175.0169 102 D 4.7136 9.0669 127.6901 54.3155 39.2210 175.4608 103 G 4.1853 8.1455 111.0348 45.1386 0.0000 173.5185 104 K 4.3190 8.0464 116.9472 55.2007 33.4958 176.1195 105 A 3.7093 8.0815 118.5783 52.6875 14.5989 176.2175 106 T 3.7328 7.4418 107.4650 62.6566 69.3594 176.7496 107 G 5.0426 8.1544 126.3776 45.5338 0.0000 172.1892 108 W 4.2762 7.7383 130.4708 58.3657 31.8554 175.5378 109 S 4.9929 7.8392 120.8211 57.7075 64.3001 172.8522 110 A 4.9351 7.9629 128.1111 50.5313 20.7755 175.6718 111 F 5.3985 8.8775 117.6688 55.8665 42.9340 174.2342 112 Y 3.3942 8.2198 124.5081 56.1173 38.4578 173.9750 113 V 3.9681 7.4029 135.0000 62.4410 30.9741 178.6127 114 D 4.2338 8.3289 113.2675 54.0360 36.9921 175.5408 115 G 4.3761 7.3626 115.0977 46.8622 0.0000 171.6287 116 K 4.5825 6.5257 117.9152 52.9676 32.1491 175.6599 117 W 5.0497 8.4882 122.2632 57.8299 30.6166 175.4496 118 V 4.7230 9.3021 113.6982 60.6530 36.3873 173.5832 119 E 4.2677 8.8360 120.0480 54.7468 32.3108 177.4815 120 G 4.0968 8.2886 118.2114 43.1758 0.0000 172.7605 121 K 3.8405 7.6134 119.5618 57.0525 33.2913 176.2234 122 K 4.1781 8.2753 122.0003 57.2392 32.5655 175.9173 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 4.30 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 2 N 8.03 3.94 0.00 2.76 2.81 0.00 0.00 6.71 7.10 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 3 G 8.26 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 0.00 0.00 0.00 0.00 4 E 8.26 4.50 0.00 1.88 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 2.18 2.26 0.00 5 V 8.02 3.49 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 0.72 0.00 0.00 0.92 0.00 0.00 6 A 8.52 3.71 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 7 P 0.00 4.49 0.00 2.22 2.18 0.00 3.70 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 2.06 1.97 0.00 8 P 0.00 4.21 0.00 2.07 2.21 0.00 3.68 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 9 K 7.60 4.03 0.00 1.74 1.71 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.46 7.81 10 E 7.73 5.73 0.00 2.03 1.89 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 2.06 2.03 0.00 11 D 8.25 5.01 0.00 2.74 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 12 P 0.00 4.14 0.00 2.21 1.98 0.00 3.74 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 2.17 1.95 0.00 13 V 5.45 4.29 2.18 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 0.94 0.00 0.00 0.93 0.00 0.00 14 P 0.00 4.80 0.00 2.34 2.17 0.00 3.79 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 2.02 2.03 0.00 15 L 8.11 4.82 0.00 1.70 0.81 0.76 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 16 P 0.00 3.78 0.00 1.83 1.42 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.62 0.00 17 E 8.25 4.46 0.00 2.23 2.25 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 2.28 2.37 0.00 18 L 8.24 4.61 0.00 1.65 1.44 1.04 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.92 0.00 2.08 2.05 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.18 0.00 20 C 8.61 4.38 0.00 2.96 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 21 E 8.20 4.43 0.00 1.95 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 2.23 2.56 0.00 22 K 6.86 4.77 0.00 1.77 1.76 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.20 1.18 7.81 23 S 8.39 4.61 0.00 3.79 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 24 D 8.50 4.61 0.00 2.96 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 25 A 7.70 4.89 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 7.25 5.34 0.00 3.11 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 F 9.20 4.82 0.00 2.90 2.98 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 28 V 7.82 4.08 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 0.60 0.00 0.00 0.92 0.00 0.00 29 L 8.51 3.94 0.00 1.72 1.70 0.94 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.55 5.03 0.00 1.77 2.10 0.00 3.09 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 31 D 8.50 4.67 0.00 2.71 2.67 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 32 G 6.96 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 33 A 6.33 4.12 0.58 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 0.00 0.00 34 A 7.74 3.50 1.02 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 0.00 0.00 35 G 5.38 4.03 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 0.00 36 V 7.61 4.80 2.18 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 0.96 0.00 0.00 1.04 0.00 0.00 37 F 8.30 4.75 0.00 3.15 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 38 L 7.43 4.33 0.00 1.65 1.49 1.05 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 39 A 6.88 4.15 0.83 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 40 A 7.36 4.06 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.33 4.20 0.00 1.90 1.66 0.00 0.00 7.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 T 7.42 4.30 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 1.20 0.00 0.00 43 F 7.67 3.92 0.00 3.07 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 44 P 0.00 2.97 0.00 1.65 0.73 0.00 3.58 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.57 0.00 45 K 7.74 3.63 0.00 1.66 2.01 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.47 7.81 46 S 7.85 4.42 0.00 3.78 3.72 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 47 R 8.44 4.42 0.00 1.80 2.01 0.00 3.23 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.67 0.00 48 E 8.00 4.43 0.00 2.02 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 2.41 2.41 0.00 49 T 9.28 5.12 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 1.27 0.00 0.00 50 R 8.70 5.00 0.00 2.10 2.24 0.00 3.09 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 51 A 8.61 4.26 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 52 P 0.00 4.40 0.00 2.24 2.19 0.00 3.78 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 2.09 1.97 0.00 53 L 8.55 4.12 0.00 1.70 1.69 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.19 3.58 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 0.92 0.00 0.00 0.87 0.00 0.00 55 E 8.14 3.96 0.00 2.21 2.15 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 2.32 2.40 0.00 56 E 8.16 4.16 0.00 2.15 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 0.00 2.36 2.38 0.00 57 L 8.12 4.22 0.00 1.90 1.68 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 58 Y 8.22 3.83 0.00 3.10 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 59 R 7.98 4.03 0.00 1.82 2.07 0.00 3.11 0.00 0.00 2.71 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.51 0.00 60 F 7.76 4.55 0.00 3.33 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 61 R 7.63 3.83 0.00 1.69 1.64 0.00 3.01 0.00 0.00 2.95 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.58 0.00 62 D 8.05 4.40 0.00 2.62 2.69 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 63 R 7.20 4.46 0.00 2.11 2.10 0.00 3.43 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 64 L 7.73 3.85 0.00 1.76 1.54 0.84 0.64 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 65 P 0.00 4.62 0.00 2.22 2.12 0.00 3.85 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 66 E 8.23 4.21 0.00 2.12 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 0.00 2.20 2.40 0.00 67 K 7.87 4.51 0.00 2.02 1.94 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.49 7.81 68 L 7.44 3.86 0.00 1.60 1.48 0.86 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.82 3.74 0.00 1.88 1.99 0.00 3.22 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.03 0.00 70 Y 6.81 4.05 0.00 1.43 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 71 L 6.76 4.31 0.00 1.57 1.80 1.08 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.94 4.14 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 73 D 7.79 4.51 0.00 3.03 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 74 A 7.22 3.22 -0.08 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 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.29 0.00 1.66 1.76 0.00 2.97 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.09 0.00 76 Q 8.84 4.51 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.63 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 77 Q 6.15 5.24 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.54 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 78 D 7.02 4.28 0.00 2.56 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 79 P 0.00 4.16 0.00 2.04 2.09 0.00 3.54 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 80 E 8.12 4.12 0.00 1.87 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 2.23 2.33 0.00 81 G 8.09 3.59 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 0.00 0.00 0.00 82 N 8.14 4.33 0.00 2.95 3.06 0.00 0.00 6.71 6.48 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 83 K 8.31 4.60 0.00 1.73 1.77 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.72 1.43 7.81 84 T 8.27 5.11 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 1.52 0.00 0.00 85 M 8.40 4.94 0.00 2.07 2.21 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 2.49 2.48 0.00 86 V 7.93 4.32 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 0.95 0.00 0.00 1.07 0.00 0.00 87 R 8.30 4.57 0.00 0.67 0.97 0.00 3.23 0.00 0.00 3.02 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.34 0.00 88 F 8.48 5.35 0.00 3.00 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 89 S 7.71 4.87 0.00 3.76 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 90 R 8.63 4.27 0.00 1.92 2.07 0.00 3.21 0.00 0.00 3.44 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.85 0.00 91 K 7.93 4.12 0.00 1.63 1.79 0.00 1.58 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.45 7.81 92 T 7.47 4.46 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 1.12 0.00 0.00 93 K 7.32 3.73 0.00 1.99 2.01 0.00 2.02 0.00 0.00 1.87 0.00 0.00 2.87 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.68 1.65 7.81 94 Q 7.32 4.62 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.14 6.67 0.00 0.00 0.00 0.00 0.00 2.21 2.51 0.00 95 Q 8.79 5.41 0.00 2.23 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.08 0.00 0.00 0.00 0.00 0.00 2.60 2.74 0.00 96 Y 8.33 5.51 0.00 2.68 3.14 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 97 V 8.92 4.55 2.15 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 0.44 0.00 0.00 0.69 0.00 0.00 98 S 8.73 5.76 0.00 3.89 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 99 S 9.48 4.59 0.00 3.89 4.04 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 0.00 100 E 8.94 4.69 0.00 1.90 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 2.28 2.32 0.00 101 K 8.76 4.45 0.00 1.77 1.70 0.00 1.82 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.41 7.81 102 D 9.07 4.71 0.00 2.86 2.60 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 0.00 103 G 8.15 4.19 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 0.00 104 K 8.05 4.32 0.00 1.90 1.91 0.00 1.93 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.37 7.81 105 A 8.08 3.71 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 0.00 106 T 7.44 3.73 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 1.24 0.00 0.00 107 G 8.15 5.04 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 0.00 108 W 7.74 4.28 0.00 3.60 3.31 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 0.00 109 S 7.84 4.99 0.00 3.54 3.97 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 0.00 110 A 7.96 4.94 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 0.00 111 F 8.88 5.40 0.00 3.04 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 0.00 112 Y 8.22 3.39 0.00 1.43 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 0.00 0.00 0.00 0.00 113 V 7.40 3.97 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 0.79 0.00 0.00 0.93 0.00 0.00 114 D 8.33 4.23 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.36 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 0.00 0.00 0.00 0.00 116 K 6.53 4.58 0.00 1.87 1.62 0.00 1.57 0.00 0.00 2.17 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.49 7.81 117 W 8.49 5.05 0.00 3.43 3.37 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 0.00 118 V 9.30 4.72 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 0.88 0.00 0.00 1.26 0.00 0.00 119 E 8.84 4.27 0.00 1.81 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 2.51 2.37 0.00 120 G 8.29 4.10 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 0.00 121 K 7.61 3.84 0.00 1.71 1.77 0.00 1.70 0.00 0.00 1.85 0.00 0.00 3.24 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.55 7.81 122 K 8.28 4.18 0.00 1.84 1.68 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.44 7.81