NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.6880 8.4293 120.3581 56.7320 30.0689 172.1707 1D H 4.6940 7.8233 114.5071 54.4636 29.1813 174.1247 1E H 5.0937 7.7081 115.6567 54.2469 33.3377 173.9138 1F H 4.5818 8.9792 117.4484 55.9567 28.9896 174.3649 1G F 4.8577 8.4113 119.7022 57.8264 39.9681 174.5184 2 N 4.6108 8.4199 117.5303 52.4060 38.7036 174.5173 3 L 4.7537 8.0451 123.5523 52.0828 43.8249 174.8396 4 P 4.6014 0.0000 0.0000 61.5928 32.9253 175.8112 5 P 4.4254 0.0000 0.0000 62.2003 31.6042 175.8534 6 G 3.8382 8.6867 110.7906 44.9304 0.0000 171.0737 7 N 4.5461 8.0024 114.5268 51.4656 40.1258 174.0918 8 Y 4.8429 8.0045 115.3224 58.1504 38.3546 177.1611 9 K 4.1554 8.6554 122.8717 58.6066 32.2307 177.3055 10 K 4.7234 7.6183 115.4624 53.2849 35.4800 173.6901 11 P 4.7405 0.0000 0.0000 63.1030 32.3849 175.1974 12 K 4.9291 9.5102 119.2756 55.0746 37.4921 174.9674 13 L 4.9893 9.1434 121.5203 53.3294 44.2540 176.2407 14 L 4.9746 8.6487 123.9687 53.6828 42.4384 174.2218 15 Y 4.6892 9.2754 126.5069 57.0348 40.4081 173.3908 16 C 4.2233 8.5436 128.0111 57.7767 32.6614 173.9759 17 S 4.1011 8.1158 120.8219 60.0962 61.9306 174.8325 18 N 4.2691 7.9255 117.5904 56.7245 38.7762 175.4683 19 G 3.9128 7.3673 101.4808 44.4316 0.0000 172.8760 20 G 3.3217 7.8332 107.0766 45.7339 0.0000 173.5665 21 H 4.5465 7.2861 116.1469 54.8281 30.7613 174.1127 22 F 5.2714 8.7283 120.3225 55.8567 40.6336 175.2671 23 L 4.4671 8.9972 125.8971 55.3177 43.3293 175.6283 24 R 4.9827 9.3594 126.1279 54.6385 33.6645 173.7578 25 I 4.7847 8.2284 126.6307 59.4624 38.8410 175.7265 26 L 4.1215 8.7127 127.8897 53.3608 42.3573 176.7768 27 P 4.1854 0.0000 0.0000 65.8805 31.2729 177.2941 28 D 4.5236 7.9651 114.3500 53.6777 39.6358 177.0243 29 G 4.0712 8.4109 109.8838 45.3359 0.0000 174.0124 30 T 4.3390 8.3778 117.5413 63.3122 69.0970 173.6311 31 V 4.8631 8.0406 124.0513 61.2211 34.6632 174.4643 32 D 4.5893 8.5709 125.3714 52.9729 42.5803 174.1024 33 G 4.5915 8.5832 104.6575 45.5272 0.0000 172.3248 34 T 4.9903 8.7273 114.3946 60.7640 71.0207 174.6045 35 R 4.2151 8.7847 124.7469 56.5996 30.9672 176.2705 36 D 4.5854 8.1579 119.2370 53.6857 40.3082 176.8816 37 R 3.8772 8.6225 126.8382 58.2970 30.2545 178.0470 38 S 4.3655 8.4906 111.6532 58.4964 63.6675 174.1666 39 D 4.3619 7.7621 121.7873 55.1391 41.2163 175.9063 40 Q 4.4301 8.4244 122.7740 55.9679 29.4847 175.7774 41 H 4.8701 9.1754 115.7158 55.4956 29.1244 175.3376 42 I 4.5386 7.4281 111.1362 60.0382 38.1818 175.3034 43 Q 4.2538 7.8368 122.0073 55.6887 29.6242 174.7146 44 L 5.0193 8.9542 124.6200 52.7871 45.4935 175.3021 45 Q 4.7886 9.1688 123.9774 54.4479 31.1081 174.4167 46 L 5.5898 8.8361 126.0415 53.0008 44.1589 175.8066 47 S 4.4004 8.0855 113.7700 57.1831 66.2776 172.9939 48 A 4.6085 8.2023 122.8256 52.6121 20.3474 176.3537 49 E 4.1550 8.8788 120.4132 56.6033 29.8446 178.4981 50 S 4.5644 5.8100 114.0876 56.8948 64.9820 173.6810 51 V 3.8709 8.1615 121.5354 64.7541 31.5609 176.3849 52 G 3.9552 9.1593 114.6796 45.2047 0.0000 172.0596 53 E 5.1539 8.1334 119.8016 54.8117 31.9842 175.6031 54 V 4.9123 8.9686 116.1411 59.8941 36.7705 173.9063 55 Y 5.1052 8.8797 120.0716 56.4511 41.1173 175.2329 56 I 4.4694 8.5671 122.7629 59.7091 40.4053 174.3806 57 K 4.8960 8.7299 126.8640 54.1092 35.7274 175.8040 58 S 4.5754 8.7166 119.4803 58.5169 62.7471 175.0640 59 T 3.9555 8.6114 117.9808 64.2234 68.8574 175.9270 60 E 4.0738 8.3667 122.8821 58.4212 29.8638 176.9777 61 T 4.3486 8.2250 106.2043 60.5292 70.1381 175.2633 62 G 3.7983 8.1942 109.9490 45.6513 0.0000 173.7290 63 Q 4.4964 7.5957 118.8581 55.8684 30.5063 174.3952 64 Y 4.8455 8.9861 118.9109 55.9953 40.5005 175.3859 65 L 4.4026 9.1640 125.9749 55.4360 43.4517 175.5687 66 A 4.8836 8.6556 125.7838 50.8505 23.2059 174.4493 67 M 5.4007 8.5183 119.5131 53.8656 34.8266 175.7258 68 D 5.2431 9.5970 126.6016 52.5751 41.2235 176.7977 69 T 3.9812 8.5591 112.7109 64.8444 67.2160 174.1190 70 D 4.7060 8.9139 119.5928 53.8930 41.2357 177.0533 71 G 3.3504 8.5666 108.2074 45.1834 0.0000 172.7744 72 L 4.6887 7.7791 119.7440 53.3742 43.2389 176.1597 73 L 4.9953 8.5896 123.9667 55.1485 42.6716 175.6764 74 Y 4.9715 9.0575 120.0826 55.9410 42.0681 173.5766 75 G 4.2249 8.9293 108.7516 45.3038 0.0000 173.1916 76 S 5.0544 9.1419 121.2471 56.9143 63.9211 175.3236 77 Q 4.3657 9.0180 125.4346 58.1685 28.9874 176.2852 78 T 4.7865 7.5067 105.8264 58.5641 71.9190 171.5084 79 P 3.6480 0.0000 0.0000 62.3455 32.3243 175.2648 80 N 4.8845 7.9538 117.6183 51.5423 40.0121 174.3924 81 E 4.0177 8.6483 115.0937 58.8214 29.8540 177.3834 82 E 4.1788 8.8169 119.1069 57.3001 29.9021 177.8581 83 V 4.3425 7.3251 110.5882 60.7857 32.4934 175.8134 84 L 4.4398 7.1934 121.1306 53.7159 43.2413 175.6689 85 F 5.2632 8.7691 121.1720 55.5829 43.5087 174.3133 86 L 4.8773 9.2890 123.0524 53.9110 42.6148 175.4524 87 E 4.5933 9.0293 127.0694 55.2355 30.2814 175.6642 88 R 4.8303 8.5279 125.0997 54.0868 34.8483 174.5925 89 L 4.7332 8.7192 123.6697 55.1915 43.2317 175.7769 90 E 4.6983 9.0106 124.1331 55.2972 33.5783 174.9292 91 E 3.9957 9.6964 123.8980 57.6957 27.2886 174.2391 92 N 4.3282 8.5756 110.9011 54.2004 36.5805 174.0196 93 H 4.8032 8.4895 116.2096 57.7369 36.3282 173.4222 94 Y 4.7122 7.7823 116.0014 57.3780 40.2356 173.5581 95 N 5.5820 9.4930 118.0103 51.8822 41.5304 174.4840 96 T 5.2662 8.7251 112.7343 60.1365 72.9477 172.6236 97 Y 5.0970 8.6258 118.9025 56.6247 41.6759 174.1690 98 I 4.6484 8.4802 125.9805 59.1474 39.5487 175.4166 99 S 3.9629 8.8945 122.4701 58.6121 62.3711 173.9686 100 K 3.9644 8.6837 129.2054 59.4025 32.2702 178.5964 101 K 3.7363 7.9331 118.1176 59.1094 32.2334 176.7253 102 H 4.8833 8.2167 114.2431 54.2187 29.4883 176.1137 103 A 3.9545 7.7358 126.1638 55.1584 18.0422 180.7914 104 E 3.6037 7.9635 113.1360 58.4169 29.7957 178.1680 105 K 4.2351 7.5226 117.2967 55.2768 32.7098 175.8053 106 N 3.9247 7.5890 115.6540 53.9638 36.5557 174.7275 107 W 5.0218 7.6682 117.4050 55.9003 31.0060 177.4727 108 F 5.4525 9.2714 124.0779 55.5904 41.0396 175.6555 109 V 4.0096 9.0032 121.4866 62.9939 32.5309 175.1953 110 G 4.3770 8.5667 112.4492 45.2979 0.0000 171.5450 111 L 5.2923 8.4390 121.9443 52.5310 45.2159 177.0765 112 K 4.1567 9.0223 123.2182 55.2648 33.0591 178.3199 113 K 3.9136 8.4302 119.6281 59.3887 31.9525 177.8955 114 N 4.5795 8.0707 114.0133 52.6272 37.5759 175.9620 115 G 3.5306 8.1326 108.2389 45.3977 0.0000 173.7621 116 S 4.7642 7.9612 114.6993 57.0931 64.5414 173.4844 117 C 4.7684 8.2611 119.5357 59.8042 28.7591 173.4280 118 K 4.3137 8.7147 122.3003 55.8435 32.9142 176.8631 119 R 4.0004 8.5975 124.2059 55.9331 31.2550 177.0305 120 G 3.2791 8.9422 115.2714 48.3702 0.0000 174.1611 121 P 4.1964 0.0000 0.0000 64.3864 31.4378 177.6362 122 R 4.2569 7.7890 115.4139 56.6092 30.3998 176.3269 123 T 5.1278 7.6029 108.2826 59.8579 70.7716 173.3527 124 H 4.7536 7.8517 115.1158 54.9449 30.5483 173.0538 125 Y 3.8900 8.7249 118.4304 59.9327 38.0989 177.0131 126 G 4.0818 9.0206 111.3398 45.5326 0.0000 173.9980 127 Q 4.2610 7.4224 118.5713 55.1138 29.9078 177.1027 128 K 3.8468 8.2888 118.9283 58.6367 32.8452 179.4422 129 A 3.9644 8.0686 121.3745 54.0762 18.3221 178.5268 130 I 4.3854 7.1807 105.7087 60.5596 38.6126 175.2937 131 L 4.3753 7.3255 123.1801 53.9982 42.5128 175.7736 132 F 5.4991 9.3878 122.6832 55.5949 43.2191 174.4434 133 L 5.2967 9.3047 121.0490 52.3711 44.9232 174.0431 134 P 5.1213 0.0000 0.0000 62.6165 32.1807 175.6018 135 L 4.9252 9.2395 124.9006 51.8583 44.8748 174.5416 136 P 4.6109 0.0000 0.0000 62.6338 32.3174 177.0573 137 V 3.7514 8.1751 114.3710 61.7910 31.6153 176.3347 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 1C H 8.43 4.69 0.00 3.03 3.23 0.00 5.70 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 1D H 7.82 4.69 0.00 3.24 3.36 0.00 5.72 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.71 5.09 0.00 3.26 3.35 0.00 5.71 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.98 4.58 0.00 3.31 3.38 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.41 4.86 0.00 2.87 3.07 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 2 N 8.42 4.61 0.00 2.97 2.80 0.00 0.00 6.90 6.74 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 3 L 8.05 4.75 0.00 1.48 1.42 0.58 0.52 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 4 P 0.00 4.60 0.00 2.16 2.13 0.00 3.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 5 P 0.00 4.43 0.00 2.16 1.99 0.00 3.89 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 6 G 8.69 3.84 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 0.00 7 N 8.00 4.55 0.00 2.63 2.67 0.00 0.00 5.89 7.55 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 8 Y 8.00 4.84 0.00 3.06 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 9 K 8.66 4.16 0.00 1.89 1.89 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.49 7.81 10 K 7.62 4.72 0.00 1.70 1.68 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.38 7.81 11 P 0.00 4.74 0.00 2.06 2.04 0.00 3.72 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 1.98 1.98 0.00 12 K 9.51 4.93 0.00 1.64 1.82 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.62 7.81 13 L 9.14 4.99 0.00 1.64 1.55 0.62 0.55 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 14 L 8.65 4.97 0.00 1.58 1.59 0.36 0.86 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 15 Y 9.28 4.69 0.00 3.33 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 16 C 8.54 4.22 0.00 2.45 2.44 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 17 S 8.12 4.10 0.00 4.01 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.93 4.27 0.00 2.61 2.58 0.00 0.00 6.74 7.98 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 19 G 7.37 3.91 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 0.00 0.00 0.00 20 G 7.83 3.32 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 0.00 21 H 7.29 4.55 0.00 3.01 3.23 0.00 5.80 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 22 F 8.73 5.27 0.00 3.18 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 23 L 9.00 4.47 0.00 1.81 1.51 0.95 0.20 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 24 R 9.36 4.98 0.00 1.92 2.05 0.00 3.30 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.80 0.00 25 I 8.23 4.78 1.86 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 1.19 0.75 0.90 0.00 0.00 26 L 8.71 4.12 0.00 1.79 1.51 0.92 0.77 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 27 P 0.00 4.19 0.00 2.00 2.12 0.00 3.53 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 28 D 7.97 4.52 0.00 2.77 2.77 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 0.00 0.00 0.00 29 G 8.41 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 0.00 0.00 0.00 30 T 8.38 4.34 4.34 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 1.22 0.00 0.00 31 V 8.04 4.86 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 0.89 0.00 0.00 1.00 0.00 0.00 32 D 8.57 4.59 0.00 2.98 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 33 G 8.58 4.59 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 34 T 8.73 4.99 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 1.35 0.00 0.00 35 R 8.78 4.22 0.00 1.85 1.97 0.00 3.19 0.00 0.00 3.07 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.35 0.00 36 D 8.16 4.59 0.00 2.84 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 37 R 8.62 3.88 0.00 1.85 1.89 0.00 3.42 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.85 0.00 38 S 8.49 4.37 0.00 3.93 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 39 D 7.76 4.36 0.00 2.81 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 40 Q 8.42 4.43 0.00 1.88 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.00 0.00 0.00 0.00 0.00 0.00 2.26 2.21 0.00 41 H 9.18 4.87 0.00 3.33 3.47 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.43 4.54 1.86 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.05 1.05 0.00 0.00 43 Q 7.84 4.25 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 44 L 8.95 5.02 0.00 1.59 1.44 0.81 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.17 4.79 0.00 2.06 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 46 L 8.84 5.59 0.00 1.78 1.59 0.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.09 4.40 0.00 3.85 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 48 A 8.20 4.61 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 49 E 8.88 4.15 0.00 1.59 1.65 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 2.18 2.36 0.00 50 S 5.81 4.56 0.00 4.10 3.81 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 51 V 8.16 3.87 2.33 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 0.95 0.00 0.00 1.03 0.00 0.00 52 G 9.16 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 53 E 8.13 5.15 0.00 1.94 1.72 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 2.23 2.28 0.00 54 V 8.97 4.91 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 0.73 0.00 0.00 1.24 0.00 0.00 55 Y 8.88 5.11 0.00 2.89 2.96 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 56 I 8.57 4.47 1.74 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.67 0.68 0.00 0.00 57 K 8.73 4.90 0.00 1.46 1.32 0.00 1.11 0.00 0.00 1.25 0.00 0.00 2.30 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.58 1.14 7.81 58 S 8.72 4.58 0.00 3.86 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 59 T 8.61 3.96 4.20 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 1.17 0.00 0.00 60 E 8.37 4.07 0.00 1.98 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 2.23 2.37 0.00 61 T 8.23 4.35 4.25 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 1.25 0.00 0.00 62 G 8.19 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 0.00 0.00 0.00 63 Q 7.60 4.50 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.72 0.00 0.00 0.00 0.00 0.00 2.55 2.35 0.00 64 Y 8.99 4.85 0.00 2.84 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 65 L 9.16 4.40 0.00 1.61 1.52 0.81 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.66 4.88 0.49 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 0.00 0.00 67 M 8.52 5.40 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.70 0.00 68 D 9.60 5.24 0.00 2.86 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 69 T 8.56 3.98 4.32 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 1.25 0.00 0.00 70 D 8.91 4.71 0.00 2.73 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 71 G 8.57 3.35 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 0.00 0.00 0.00 0.00 72 L 7.78 4.69 0.00 1.95 1.63 0.90 0.60 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 73 L 8.59 5.00 0.00 1.57 1.62 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.06 4.97 0.00 2.98 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 75 G 8.93 4.22 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 0.00 76 S 9.14 5.05 0.00 3.75 3.71 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 77 Q 9.02 4.37 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.51 4.79 4.20 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 1.24 0.00 0.00 79 P 0.00 3.65 0.00 1.94 1.15 0.00 3.64 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.79 0.00 80 N 7.95 4.88 0.00 2.89 2.91 0.00 0.00 6.01 7.66 0.00 0.00 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 8.65 4.02 0.00 2.02 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 2.23 2.24 0.00 82 E 8.82 4.18 0.00 2.28 2.29 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 2.36 2.33 0.00 83 V 7.33 4.34 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 0.85 0.00 0.00 1.00 0.00 0.00 84 L 7.19 4.44 0.00 1.35 1.33 0.77 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.77 5.26 0.00 3.06 3.07 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 86 L 9.29 4.88 0.00 1.55 1.63 0.92 0.97 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 87 E 9.03 4.59 0.00 2.15 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 2.18 1.94 0.00 88 R 8.53 4.83 0.00 1.81 1.88 0.00 3.07 0.00 0.00 2.90 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.67 0.00 89 L 8.72 4.73 0.00 1.50 1.61 0.94 0.80 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 90 E 9.01 4.70 0.00 2.23 1.87 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 2.30 2.44 0.00 91 E 9.70 4.00 0.00 2.43 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 2.30 2.40 0.00 92 N 8.58 4.33 0.00 2.84 2.89 0.00 0.00 6.85 8.16 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 93 H 8.49 4.80 0.00 2.84 2.87 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.78 4.71 0.00 3.07 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 95 N 9.49 5.58 0.00 3.00 2.54 0.00 0.00 6.96 6.60 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 96 T 8.73 5.27 4.56 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 1.37 0.00 0.00 97 Y 8.63 5.10 0.00 2.75 2.77 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 0.00 0.00 0.00 98 I 8.48 4.65 1.68 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.55 0.62 0.00 0.00 99 S 8.89 3.96 0.00 4.07 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 0.00 100 K 8.68 3.96 0.00 1.69 1.65 0.00 1.67 0.00 0.00 1.45 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.30 7.81 101 K 7.93 3.74 0.00 1.75 1.66 0.00 1.50 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.27 1.02 7.81 102 H 8.22 4.88 0.00 3.04 2.17 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.74 3.95 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 0.00 104 E 7.96 3.60 0.00 1.91 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 2.18 2.16 0.00 105 K 7.52 4.24 0.00 0.79 1.42 0.00 1.50 0.00 0.00 1.44 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 1.00 7.81 106 N 7.59 3.92 0.00 2.99 2.99 0.00 0.00 6.88 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 0.00 107 W 7.67 5.02 0.00 3.32 3.08 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 0.00 108 F 9.27 5.45 0.00 2.84 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 0.00 109 V 9.00 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 0.63 0.00 0.00 0.42 0.00 0.00 110 G 8.57 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 0.00 111 L 8.44 5.29 0.00 1.46 1.44 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.02 4.16 0.00 1.92 1.67 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.35 7.81 113 K 8.43 3.91 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.44 7.81 114 N 8.07 4.58 0.00 2.78 2.88 0.00 0.00 6.16 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 0.00 115 G 8.13 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.96 4.76 0.00 3.99 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 C 8.26 4.77 0.00 2.88 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 0.00 118 K 8.71 4.31 0.00 1.70 1.68 0.00 1.61 0.00 0.00 1.55 0.00 0.00 3.03 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.33 7.81 119 R 8.60 4.00 0.00 1.79 1.63 0.00 3.18 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.55 0.00 120 G 8.94 3.28 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 0.00 121 P 0.00 4.20 0.00 1.90 2.17 0.00 3.03 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 122 R 7.79 4.26 0.00 1.86 1.92 0.00 3.29 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 123 T 7.60 5.13 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 1.26 0.00 0.00 124 H 7.85 4.75 0.00 3.38 3.51 0.00 5.47 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.72 3.89 0.00 3.13 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 0.00 126 G 9.02 4.08 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 0.00 127 Q 7.42 4.26 0.00 1.88 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.76 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 128 K 8.29 3.85 0.00 1.77 1.64 0.00 1.54 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.27 7.81 129 A 8.07 3.96 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 0.00 130 I 7.18 4.39 1.65 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.06 0.57 0.00 0.00 131 L 7.33 4.38 0.00 1.03 0.68 0.24 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.39 5.50 0.00 3.41 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 0.00 133 L 9.30 5.30 0.00 1.85 1.66 1.07 0.92 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 0.00 134 P 0.00 5.12 0.00 2.16 2.22 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 135 L 9.24 4.93 0.00 1.67 1.63 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.61 0.00 1.93 1.98 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 137 V 8.18 3.75 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 0.66 0.00 0.00 0.91 0.00 0.00