NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3975 8.2893 118.3020 55.5641 32.9862 174.0063 2 Q 4.3946 8.0838 115.6331 53.4127 31.6289 171.9126 3 P 4.7416 0.0000 0.0000 61.9346 32.7529 177.6637 4 A 4.2281 8.6250 126.0099 51.6004 19.1769 177.7343 5 S 4.9182 8.5712 115.7387 58.9799 64.6177 172.9647 6 A 5.7624 9.6744 122.5663 51.0031 22.9224 175.2458 7 K 5.9967 8.9256 118.5833 54.0950 36.5318 174.8783 8 W 5.9642 8.3422 117.2291 55.6957 32.3435 172.8287 9 Y 4.9069 8.5848 117.9571 56.5605 41.1843 172.4347 10 D 5.2570 8.2753 118.1190 51.9976 42.9769 174.4458 11 R 4.2716 8.8725 118.1395 53.7447 33.8561 176.4440 12 R 2.0000 7.5619 117.2644 58.8610 29.7051 177.5763 13 D 4.5413 7.6410 114.2079 54.0316 42.6189 175.0342 14 Y 4.6847 7.2485 116.2083 55.8782 42.6760 174.2594 15 V 4.3077 8.2807 122.0795 60.9447 34.5395 174.1919 16 F 5.1660 9.1572 126.1592 55.6295 41.8092 174.3319 17 I 5.0180 8.6201 124.0204 59.3823 40.6201 173.9014 18 E 4.8984 9.1647 128.5855 54.4094 31.9879 174.3834 19 F 4.8490 8.8466 126.7261 56.5684 40.6270 175.2241 20 C 4.7261 8.9861 123.4060 58.5724 27.4089 172.1939 21 V 4.4537 7.9456 119.4825 60.8330 33.7255 174.5061 22 E 4.4572 9.0706 127.7356 56.3005 30.4911 176.4995 23 D 4.3915 8.9742 123.2762 55.4131 38.9821 173.9756 24 S 4.8110 7.7854 111.9834 58.1283 64.7499 173.7786 25 K 4.5765 8.6037 119.9507 56.5144 35.3817 175.5102 26 D 4.5080 8.7624 116.6913 54.9993 38.2419 174.2650 27 V 3.5910 7.8879 118.0464 63.7795 32.2416 174.8627 28 N 4.6786 9.0160 126.0235 52.1578 41.8852 172.7898 29 V 4.5173 8.2181 126.5855 60.9334 33.7655 174.0643 30 N 4.7513 9.0565 127.3522 51.8356 40.9890 173.0028 31 F 5.1661 8.6407 125.7232 56.6048 40.3371 175.4212 32 E 4.8512 9.2685 122.8739 53.8162 33.1951 176.6878 33 K 4.1096 9.0626 121.4434 58.6943 32.2839 177.8150 34 S 4.9883 8.0575 109.5951 57.4917 64.8325 173.1233 35 K 5.1750 8.2914 120.4044 55.3268 36.2352 174.4441 36 L 5.2704 8.9527 126.6562 53.6204 45.6798 175.1247 37 T 5.0690 8.7383 122.0900 61.7113 71.9820 172.5825 38 F 5.1694 9.2965 129.1400 56.2326 42.4097 173.8992 39 S 4.9906 7.8623 119.0848 56.3972 66.9190 172.4015 40 C 4.9081 7.4671 114.4186 58.2867 32.2068 171.8107 41 L 5.1105 8.6231 119.2268 52.9113 44.2079 176.1159 42 G 4.2946 9.2125 110.0200 45.4830 0.0000 174.6778 43 G 4.4102 8.6200 114.0908 44.5115 0.0000 174.4181 44 S 4.1741 8.5040 113.8426 61.1496 62.8811 175.4249 45 D 4.4596 8.1006 117.3340 53.4201 39.9725 175.3081 46 N 4.1155 7.7373 116.5884 54.4579 36.3339 174.7411 47 F 4.2268 8.5024 121.5461 58.1678 41.0844 174.9235 48 K 4.5388 7.9867 126.1099 56.2697 33.4548 175.4566 49 H 5.7261 8.8854 122.1233 53.1619 32.2047 173.1748 50 L 4.8502 8.1620 123.3353 53.7453 45.6526 174.0616 51 N 4.9838 9.5413 123.8314 51.3597 41.8769 173.3396 52 E 5.4011 8.8741 122.5033 54.5576 33.4082 175.1814 53 I 4.8303 8.6860 117.0452 59.4096 41.6133 173.8583 54 D 5.0725 8.8156 125.7672 53.9108 41.8630 175.7883 55 L 4.6637 8.8323 124.8384 54.5761 42.0800 177.0403 56 F 4.1887 9.0057 126.3061 61.2746 39.4611 174.8369 57 H 4.6092 6.1868 112.0751 53.3766 32.1754 173.5222 58 C 4.7538 8.5425 117.6374 59.9795 29.4137 172.7513 59 I 5.0720 9.1686 115.3445 59.3341 41.5291 173.9142 60 D 4.7780 9.0130 122.5311 52.0756 40.9627 174.8110 61 P 4.1883 0.0000 0.0000 65.4877 31.5823 178.6142 62 N 4.3359 7.9589 114.3768 55.7806 38.8697 174.4470 63 D 4.9530 7.9820 116.0217 54.0626 42.2711 175.2766 64 S 4.8396 7.8661 112.4511 56.3795 65.3546 173.2204 65 K 5.0530 8.3329 120.9355 56.3837 36.4758 174.0520 66 H 5.6565 8.7019 114.2473 54.1371 31.8295 172.8651 67 K 4.6975 9.3564 119.1092 54.7397 35.6258 175.2298 68 R 5.2514 8.7997 124.5864 55.0026 32.4398 174.6109 69 T 4.7909 8.7599 113.6361 59.9974 72.3558 174.3182 70 D 4.2552 8.6469 119.7689 56.6016 41.2804 178.8839 71 R 4.1406 7.9759 118.7059 57.9108 30.9998 175.8716 72 S 5.0143 7.0449 109.9474 58.1884 67.2308 174.7396 73 I 4.9598 8.5314 120.4138 59.6798 39.9499 174.7051 74 L 4.9824 9.0465 130.4174 53.8811 43.8869 174.7320 75 C 5.3454 9.5501 124.4752 58.2997 31.0471 172.3448 76 C 4.3375 9.5751 124.3605 57.6491 33.3566 172.2474 77 L 4.5222 8.4059 127.9256 52.8173 43.4533 176.1062 78 R 3.7667 8.3093 125.6107 55.4554 30.6978 175.8754 79 K 4.2218 8.4316 127.3254 56.6173 32.5978 178.5680 80 G 3.4418 9.0086 112.0009 48.5212 0.0000 173.4596 81 E 4.5903 8.0797 121.6857 54.1845 32.4911 174.2336 82 S 4.4456 8.0873 120.3610 59.3001 62.6982 174.5904 83 G 4.0986 8.5439 114.8003 45.1173 0.0000 173.4708 84 Q 3.9308 7.6880 120.0403 56.7456 29.4373 176.1564 85 S 4.9872 8.9210 119.3050 56.9837 63.3459 173.6477 86 W 4.7503 9.0680 128.3560 54.1491 29.1497 173.4197 87 P 4.5757 0.0000 0.0000 64.8070 31.2974 176.7662 88 R 4.8308 6.8844 113.1414 54.8226 32.3296 174.1340 89 L 4.1495 7.8869 119.4943 56.4638 43.0831 176.0846 90 T 4.9978 7.4817 107.6115 59.7387 70.6639 174.9393 91 K 4.0883 8.8845 125.1404 59.6092 32.4053 177.2184 92 E 4.5021 7.9925 117.0653 54.8887 30.8285 177.2434 93 R 4.1277 8.3522 120.1800 56.1233 28.1519 175.2481 94 A 4.7224 8.0107 123.8138 50.0258 21.6755 177.1177 95 K 4.2660 8.2561 122.1293 54.8110 31.3136 174.5307 96 L 4.0981 7.6989 122.8541 53.5739 42.0286 177.9492 97 N 4.5389 8.8072 121.7711 54.2169 37.6403 175.4325 98 W 4.7787 7.6262 115.2743 56.1164 29.3922 174.5912 99 L 5.2800 7.0690 122.2067 53.4935 43.3067 175.4276 100 S 4.7740 8.9131 119.1325 56.6027 67.0723 173.2780 101 V 3.3388 7.9573 120.8629 62.7520 32.2295 176.0014 102 D 4.4945 8.6546 128.1446 52.9621 39.6110 176.6395 103 F 4.4031 8.0242 123.7602 59.5824 39.5138 176.9309 104 N 4.4895 7.9997 117.6078 55.5164 38.3262 175.5514 105 N 4.4477 7.7252 112.2484 52.3409 39.8006 174.9286 106 W 4.1906 7.5202 128.5583 57.5043 31.3371 175.1261 107 K 4.6005 7.0819 121.8296 55.5332 36.2999 176.5300 108 D 4.4762 8.3067 123.2691 52.3732 39.4868 177.6309 109 W 4.2883 7.5323 116.8872 59.1196 28.8681 176.8999 110 E 3.9124 6.3776 122.0806 56.5808 28.7217 176.5462 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 8.29 4.40 0.00 1.82 2.01 0.00 0.00 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 2 Q 8.08 4.39 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 3 P 0.00 4.74 0.00 1.36 0.70 0.00 3.73 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.82 0.00 4 A 8.63 4.23 1.27 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 0.00 0.00 5 S 8.57 4.92 0.00 4.06 4.14 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 6 A 9.67 5.76 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 K 8.93 6.00 0.00 1.88 1.90 0.00 1.63 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.29 7.81 8 W 8.34 5.96 0.00 3.60 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 9 Y 8.58 4.91 0.00 3.03 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 10 D 8.28 5.26 0.00 2.65 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 11 R 8.87 4.27 0.00 1.80 1.67 0.00 3.28 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 12 R 7.56 2.00 0.00 1.31 1.57 0.00 3.09 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.35 0.00 13 D 7.64 4.54 0.00 2.61 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 0.00 0.00 0.00 14 Y 7.25 4.68 0.00 2.68 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 0.00 0.00 0.00 15 V 8.28 4.31 1.48 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 0.59 0.00 0.00 -0.47 0.00 0.00 16 F 9.16 5.17 0.00 1.66 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 17 I 8.62 5.02 1.82 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 1.16 0.92 0.42 0.00 0.00 18 E 9.16 4.90 0.00 2.05 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 2.21 2.28 0.00 19 F 8.85 4.85 0.00 2.43 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.99 4.73 0.00 2.91 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 21 V 7.95 4.45 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 0.94 0.00 0.00 1.05 0.00 0.00 22 E 9.07 4.46 0.00 1.92 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 2.33 2.37 0.00 23 D 8.97 4.39 0.00 2.85 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 24 S 7.79 4.81 0.00 4.07 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 25 K 8.60 4.58 0.00 1.89 1.90 0.00 1.45 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.32 1.39 7.81 26 D 8.76 4.51 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 27 V 7.89 3.59 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 0.80 0.00 0.00 1.00 0.00 0.00 28 N 9.02 4.68 0.00 2.55 2.36 0.00 0.00 6.34 7.26 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 29 V 8.22 4.52 1.67 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 0.05 0.00 0.00 0.81 0.00 0.00 30 N 9.06 4.75 0.00 2.70 2.55 0.00 0.00 6.74 7.62 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 31 F 8.64 5.17 0.00 3.02 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 32 E 9.27 4.85 0.00 2.17 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 2.25 2.24 0.00 33 K 9.06 4.11 0.00 1.80 1.86 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.60 7.81 34 S 8.06 4.99 0.00 3.88 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 35 K 8.29 5.18 0.00 1.89 1.67 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.62 7.81 36 L 8.95 5.27 0.00 1.98 1.62 0.90 1.13 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 37 T 8.74 5.07 4.17 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 0.00 0.00 1.12 0.00 0.00 38 F 9.30 5.17 0.00 2.43 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 0.00 0.00 0.00 39 S 7.86 4.99 0.00 3.58 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 40 C 7.47 4.91 0.00 2.98 2.53 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 41 L 8.62 5.11 0.00 1.54 1.58 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 42 G 9.21 4.29 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 0.00 43 G 8.62 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.50 4.17 0.00 3.89 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 45 D 8.10 4.46 0.00 2.85 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 N 7.74 4.12 0.00 2.85 2.91 0.00 0.00 6.88 7.34 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 47 F 8.50 4.23 0.00 3.08 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 48 K 7.99 4.54 0.00 1.42 1.49 0.00 1.52 0.00 0.00 1.68 0.00 0.00 2.72 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.37 1.31 7.81 49 H 8.89 5.73 0.00 3.04 3.18 0.00 5.61 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 50 L 8.16 4.85 0.00 1.56 1.33 0.83 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 51 N 9.54 4.98 0.00 2.45 2.41 0.00 0.00 6.32 7.93 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 52 E 8.87 5.40 0.00 1.85 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 2.19 2.25 0.00 53 I 8.69 4.83 2.01 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.92 1.39 0.00 0.00 54 D 8.82 5.07 0.00 2.73 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 55 L 8.83 4.66 0.00 1.68 1.99 1.15 1.00 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 56 F 9.01 4.19 0.00 2.77 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 0.00 0.00 0.00 0.00 57 H 6.19 4.61 0.00 1.52 3.16 0.00 5.77 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.54 4.75 0.00 2.89 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 9.17 5.07 1.98 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.02 1.08 0.00 0.00 60 D 9.01 4.78 0.00 2.62 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 61 P 0.00 4.19 0.00 2.27 2.35 0.00 3.66 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 62 N 7.96 4.34 0.00 2.69 2.92 0.00 0.00 6.99 8.88 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 63 D 7.98 4.95 0.00 2.75 2.48 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 0.00 64 S 7.87 4.84 0.00 2.72 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 65 K 8.33 5.05 0.00 1.85 1.90 0.00 1.24 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.39 7.81 66 H 8.70 5.66 0.00 3.40 3.51 0.00 5.47 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 9.36 4.70 0.00 1.72 1.73 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.58 7.81 68 R 8.80 5.25 0.00 1.93 1.86 0.00 3.25 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 69 T 8.76 4.79 4.28 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 1.25 0.00 0.00 70 D 8.65 4.26 0.00 2.79 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 71 R 7.98 4.14 0.00 1.90 1.99 0.00 3.35 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 72 S 7.04 5.01 0.00 3.94 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 73 I 8.53 4.96 1.96 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.88 1.14 0.00 0.00 74 L 9.05 4.98 0.00 1.85 1.64 1.10 1.19 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 75 C 9.55 5.35 0.00 3.16 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 76 C 9.58 4.34 0.00 2.89 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.41 4.52 0.00 1.32 1.42 0.98 0.93 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 78 R 8.31 3.77 0.00 1.91 1.78 0.00 2.52 0.00 0.00 2.48 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.41 0.00 79 K 8.43 4.22 0.00 1.59 1.93 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.24 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.14 1.17 7.81 80 G 9.01 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 0.00 0.00 0.00 81 E 8.08 4.59 0.00 1.88 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 2.21 2.23 0.00 82 S 8.09 4.45 0.00 3.81 3.73 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 0.00 0.00 0.00 0.00 83 G 8.54 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 84 Q 7.69 3.93 0.00 2.44 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.63 0.00 0.00 0.00 0.00 0.00 2.05 2.30 0.00 85 S 8.92 4.99 0.00 4.04 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 86 W 9.07 4.75 0.00 3.61 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.58 0.00 2.06 2.17 0.00 2.95 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.71 0.00 88 R 6.88 4.83 0.00 1.79 1.83 0.00 3.03 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.37 0.00 89 L 7.89 4.15 0.00 0.27 1.01 0.54 0.34 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 90 T 7.48 5.00 4.23 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 1.11 0.00 0.00 91 K 8.88 4.09 0.00 1.86 1.87 0.00 1.52 0.00 0.00 1.48 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.43 7.81 92 E 7.99 4.50 0.00 2.00 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 2.27 2.27 0.00 93 R 8.35 4.13 0.00 1.80 1.91 0.00 3.31 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 94 A 8.01 4.72 1.17 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 0.00 0.00 0.00 0.00 0.00 95 K 8.26 4.27 0.00 1.73 1.76 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.42 7.81 96 L 7.70 4.10 0.00 1.01 0.54 0.55 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.81 4.54 0.00 2.91 2.99 0.00 0.00 6.18 8.88 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 98 W 7.63 4.78 0.00 3.63 3.42 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 99 L 7.07 5.28 0.00 0.41 0.96 1.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.91 4.77 0.00 3.89 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 0.00 101 V 7.96 3.34 0.67 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 -0.64 0.00 0.00 0.34 0.00 0.00 102 D 8.65 4.49 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 8.02 4.40 0.00 3.04 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 0.00 104 N 8.00 4.49 0.00 2.78 2.83 0.00 0.00 6.87 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 0.00 105 N 7.73 4.45 0.00 1.53 1.42 0.00 0.00 6.84 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 0.00 106 W 7.52 4.19 0.00 3.43 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 0.00 107 K 7.08 4.60 0.00 1.70 1.65 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.34 1.54 7.81 108 D 8.31 4.48 0.00 2.76 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 7.53 4.29 0.00 3.53 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 0.00 110 E 6.38 3.91 0.00 1.59 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 1.93 1.47 0.00