NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3209 8.2493 123.5820 52.1099 19.6678 176.5388 2 M 4.2060 8.4486 121.0266 54.6537 32.3519 175.0013 3 S 4.3132 8.6575 116.6214 60.6607 64.6136 176.2900 4 Q 3.9548 8.0422 120.3701 56.4562 29.0689 175.7017 5 I 4.4882 8.0365 124.4044 59.3983 39.3397 175.6539 6 K 4.1242 8.7012 126.0071 58.8681 32.3282 178.0810 7 L 4.3712 7.7460 119.3061 54.3109 42.2806 177.5753 8 T 4.1865 8.8949 114.8665 60.7098 70.8250 173.7900 9 P 4.2430 0.0000 0.0000 65.8275 31.3323 178.5048 10 E 3.9169 8.1409 117.4545 59.4192 29.6220 178.6175 11 E 3.9945 8.2007 118.5726 59.3980 29.4386 179.2992 12 L 4.0465 8.4866 119.4233 57.9102 41.6482 179.8653 13 R 3.9305 8.3093 118.2655 59.1798 29.7595 179.0175 14 S 4.3029 8.0547 112.3029 61.3623 62.6524 175.9006 15 S 4.2733 8.3179 115.7435 61.2928 62.2106 175.7667 16 A 4.1442 8.3518 123.7497 55.5341 18.0351 179.5523 17 Q 4.0185 8.2199 116.3806 59.1669 28.6778 179.3653 18 K 3.9788 8.0854 119.5393 59.4180 31.9515 179.0892 19 Y 3.8642 7.9579 116.6253 61.4032 37.9427 178.3855 20 T 3.8779 8.1807 113.7791 64.8917 67.4397 176.2151 21 A 4.1148 8.3177 123.1671 55.0746 18.3210 179.8687 22 G 3.5288 8.3346 104.4885 47.7456 0.0000 175.7568 23 S 4.0543 8.2590 115.7079 61.3556 62.3279 176.1163 24 Q 3.9732 8.1205 122.0709 59.2122 28.7913 178.0640 25 Q 3.9372 8.1972 120.5792 59.1492 29.0456 178.2814 26 V 3.6575 8.0889 119.5116 66.4268 31.5590 178.1666 27 T 3.9116 8.1052 115.4535 66.6064 68.1671 176.5486 28 E 4.0058 8.5109 120.8330 59.3092 29.4498 179.6040 29 V 3.5956 7.8897 118.2148 65.9488 31.5791 177.7384 30 L 4.0462 8.2132 120.3200 58.2397 42.0113 178.6188 31 N 4.3563 8.6305 116.7280 56.3371 38.5737 177.0658 32 L 3.9758 8.2174 121.7942 58.2166 42.1718 178.7258 33 L 4.2746 8.2671 117.9961 56.8346 41.6564 179.3605 34 T 3.8062 8.3592 116.7429 66.6765 68.4594 176.3192 35 Q 3.9606 8.0206 121.1904 59.1626 29.0642 177.8505 36 E 3.9833 8.3061 120.3406 59.0742 29.5347 178.7337 37 Q 3.9018 8.2879 118.5748 58.7667 28.6280 178.5697 38 A 3.9713 7.7977 121.8163 54.8476 18.4915 179.8116 39 V 3.5113 7.6408 116.8586 66.2380 31.4722 178.3734 40 I 3.6438 7.8233 119.5046 64.2940 36.6852 177.8227 41 D 4.3826 8.1015 117.9195 57.6473 41.1887 178.0794 42 E 4.2169 8.2947 117.2319 58.1914 29.4784 177.4252 43 N 4.8430 7.6112 113.8056 52.3861 39.0536 174.7141 44 W 4.9821 7.8315 128.5952 55.4585 31.6798 174.4176 45 D 4.5211 8.6511 124.9678 55.0193 41.1926 177.7419 46 G 3.8405 8.7726 108.6920 44.9170 0.0000 173.2292 47 S 5.1629 8.1873 111.4650 57.5283 63.7550 175.8323 48 T 3.7314 7.8023 118.5922 66.8484 68.3570 174.5719 49 F 4.4472 7.3238 120.5566 58.1724 39.7125 176.5159 50 D 4.2934 7.9737 121.3765 58.0207 40.3598 178.6541 51 S 3.9045 7.6765 113.1024 61.2454 62.4955 175.9873 52 F 3.7889 7.3615 119.9849 60.1565 38.4929 176.9765 53 E 3.8931 7.9164 118.7918 59.3494 29.4645 178.8097 54 A 3.9932 8.2383 121.0774 55.2269 18.4320 179.6247 55 Q 3.8959 8.3019 116.8819 58.9729 28.8005 178.7503 56 F 4.0097 8.3824 121.6273 61.5481 39.2582 177.0242 57 N 4.5486 8.3489 114.8199 56.1673 38.3438 176.7926 58 E 4.0712 8.1463 120.3382 59.1701 30.0300 178.4780 59 L 4.0794 7.7923 118.5752 57.0846 41.7130 178.8997 60 S 3.8735 7.8917 113.5135 61.3357 62.1899 174.8949 61 P 4.3086 0.0000 0.0000 65.3747 30.9623 178.8086 62 K 4.0263 8.1003 117.6491 59.2621 31.8079 179.5103 63 I 3.7395 7.5047 119.7637 64.6827 37.1643 178.2287 64 T 3.8973 8.0070 116.5661 66.8703 68.2091 176.4732 65 E 4.0187 8.4748 120.4583 59.1721 29.4637 179.1132 66 F 4.2083 8.6501 120.8211 61.4250 39.6089 177.0176 67 A 3.9149 8.3658 120.5314 55.1876 18.0548 179.4246 68 Q 3.8735 8.2446 118.1033 59.0545 29.0530 177.9251 69 L 3.8828 8.2076 121.8411 58.3018 42.0484 179.0334 70 L 3.9550 7.7437 118.7033 57.7695 41.5179 179.1581 71 E 3.9225 8.0707 119.0523 59.3182 29.5848 178.5628 72 D 4.3213 8.3453 119.3680 57.3339 40.7712 178.8643 73 I 3.4775 7.8483 120.4552 64.1527 37.0330 177.5925 74 N 4.1541 8.0224 117.9308 57.1606 38.6889 176.7806 75 Q 3.9728 8.0969 118.9423 59.1623 28.7257 178.9219 76 Q 4.0241 8.1557 118.9886 58.6048 28.6756 178.5568 77 L 3.9361 8.1448 120.5990 57.7783 41.6262 179.5465 78 L 3.9841 8.0555 118.9244 57.5840 41.5129 179.7282 79 K 3.9268 8.0279 118.5078 59.5348 31.9486 179.6274 80 V 3.5712 8.1525 118.6480 65.8024 31.3241 177.8011 81 A 3.9837 8.2019 120.7227 55.3765 18.2105 179.4043 82 D 4.2910 8.1299 117.3394 57.3510 40.8452 179.0426 83 I 3.6655 7.7290 120.3408 64.5442 37.1576 178.5386 84 I 3.7004 8.0282 120.9132 64.3452 36.9175 178.1184 85 E 3.9593 8.5151 120.5179 59.2003 29.3485 178.6724 86 Q 3.9456 8.0605 119.5639 59.4526 29.0707 178.2343 87 T 3.8473 7.8434 116.7172 66.8580 68.4335 176.1666 88 D 4.3392 8.5486 120.7988 57.4185 40.8335 178.8393 89 A 3.9839 8.1271 121.1397 55.2571 18.3139 179.4946 90 D 4.2975 8.3284 117.6862 57.4732 40.8596 179.1094 91 I 3.6766 8.1476 120.4822 64.1984 37.1315 178.2109 92 A 3.9714 8.2129 121.8977 55.3853 18.3632 179.6752 93 S 4.0299 8.2213 111.6038 61.3624 62.2148 175.9660 94 Q 3.9606 8.0186 121.4562 59.4665 28.8845 178.2987 95 I 3.9078 7.7145 119.6565 64.3078 37.2427 178.3213 96 S 4.3891 8.1644 114.2647 60.7215 63.0806 174.9922 97 G 3.8556 7.8001 112.9308 44.8766 0.0000 173.1852 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 A 8.25 4.32 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 2 M 8.45 4.21 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.62 0.00 3 S 8.66 4.31 0.00 3.88 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 4 Q 8.04 3.95 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 5 I 8.04 4.49 1.87 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 1.41 0.98 0.96 0.00 0.00 6 K 8.70 4.12 0.00 1.75 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.46 7.81 7 L 7.75 4.37 0.00 1.64 1.62 0.94 0.87 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 8 T 8.89 4.19 4.24 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 1.26 0.00 0.00 9 P 0.00 4.24 0.00 2.18 2.30 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 10 E 8.14 3.92 0.00 2.03 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 2.38 2.41 0.00 11 E 8.20 3.99 0.00 2.21 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 2.34 2.36 0.00 12 L 8.49 4.05 0.00 1.79 1.71 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.31 3.93 0.00 2.00 1.98 0.00 3.21 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 14 S 8.05 4.30 0.00 3.88 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 15 S 8.32 4.27 0.00 4.02 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 16 A 8.35 4.14 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 17 Q 8.22 4.02 0.00 2.36 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.64 0.00 18 K 8.09 3.98 0.00 1.84 1.70 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.65 7.81 19 Y 7.96 3.86 0.00 3.09 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 20 T 8.18 3.88 4.27 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 1.33 0.00 0.00 21 A 8.32 4.11 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 22 G 8.33 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 23 S 8.26 4.05 0.00 3.93 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 24 Q 8.12 3.97 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 25 Q 8.20 3.94 0.00 2.31 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 26 V 8.09 3.66 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 1.20 0.00 0.00 1.15 0.00 0.00 27 T 8.11 3.91 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 1.24 0.00 0.00 28 E 8.51 4.01 0.00 2.17 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 2.35 2.48 0.00 29 V 7.89 3.60 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 1.04 0.00 0.00 1.07 0.00 0.00 30 L 8.21 4.05 0.00 1.81 1.84 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.63 4.36 0.00 2.95 2.89 0.00 0.00 6.71 6.44 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 32 L 8.22 3.98 0.00 1.84 1.71 0.94 0.98 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 33 L 8.27 4.27 0.00 2.09 1.89 1.05 0.64 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 34 T 8.36 3.81 4.52 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 1.29 0.00 0.00 35 Q 8.02 3.96 0.00 2.17 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 36 E 8.31 3.98 0.00 2.26 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 2.29 2.35 0.00 37 Q 8.29 3.90 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.33 0.00 0.00 0.00 0.00 0.00 1.88 1.16 0.00 38 A 7.80 3.97 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 39 V 7.64 3.51 2.21 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 0.99 0.00 0.00 0.98 0.00 0.00 40 I 7.82 3.64 1.84 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.70 0.27 0.00 0.00 41 D 8.10 4.38 0.00 2.76 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 42 E 8.29 4.22 0.00 1.99 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 2.58 2.49 0.00 43 N 7.61 4.84 0.00 2.83 2.76 0.00 0.00 6.65 7.33 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 44 W 7.83 4.98 0.00 3.14 2.88 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 45 D 8.65 4.52 0.00 2.81 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 46 G 8.77 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 47 S 8.19 5.16 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 48 T 7.80 3.73 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 1.31 0.00 0.00 49 F 7.32 4.45 0.00 1.81 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.97 4.29 0.00 2.85 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 51 S 7.68 3.90 0.00 3.67 3.47 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 52 F 7.36 3.79 0.00 1.62 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 0.00 0.00 0.00 0.00 53 E 7.92 3.89 0.00 2.07 2.07 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 2.32 2.36 0.00 54 A 8.24 3.99 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 55 Q 8.30 3.90 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.45 6.29 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 56 F 8.38 4.01 0.00 3.23 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 57 N 8.35 4.55 0.00 2.93 2.93 0.00 0.00 7.10 7.25 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 58 E 8.15 4.07 0.00 2.08 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 0.00 2.29 2.36 0.00 59 L 7.79 4.08 0.00 1.54 1.53 0.84 0.92 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 60 S 7.89 3.87 0.00 3.89 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 61 P 0.00 4.31 0.00 2.12 2.09 0.00 4.00 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 2.10 2.06 0.00 62 K 8.10 4.03 0.00 1.87 1.83 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.59 7.81 63 I 7.50 3.74 1.93 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.72 0.92 0.00 0.00 64 T 8.01 3.90 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 1.23 0.00 0.00 65 E 8.47 4.02 0.00 2.25 2.05 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 2.35 2.48 0.00 66 F 8.65 4.21 0.00 3.07 3.23 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 67 A 8.37 3.91 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.24 3.87 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.71 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 69 L 8.21 3.88 0.00 1.75 1.73 0.89 0.57 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 70 L 7.74 3.95 0.00 1.76 1.87 0.61 0.27 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 71 E 8.07 3.92 0.00 2.09 2.05 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 2.29 2.38 0.00 72 D 8.35 4.32 0.00 2.80 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 73 I 7.85 3.48 1.54 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.71 -0.09 0.00 0.00 74 N 8.02 4.15 0.00 2.86 3.04 0.00 0.00 7.29 7.01 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 75 Q 8.10 3.97 0.00 2.26 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.66 0.00 76 Q 8.16 4.02 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 77 L 8.14 3.94 0.00 1.75 1.67 0.72 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.06 3.98 0.00 1.82 1.70 0.91 0.60 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 79 K 8.03 3.93 0.00 1.94 1.84 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.59 7.81 80 V 8.15 3.57 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 1.08 0.00 0.00 1.01 0.00 0.00 81 A 8.20 3.98 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 82 D 8.13 4.29 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 83 I 7.73 3.67 2.00 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 1.51 0.71 0.90 0.00 0.00 84 I 8.03 3.70 1.87 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 1.40 0.68 0.95 0.00 0.00 85 E 8.52 3.96 0.00 2.09 2.07 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 2.30 2.32 0.00 86 Q 8.06 3.95 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.97 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 87 T 7.84 3.85 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 1.21 0.00 0.00 88 D 8.55 4.34 0.00 2.81 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 89 A 8.13 3.98 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 90 D 8.33 4.30 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 91 I 8.15 3.68 1.87 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 1.45 0.70 0.91 0.00 0.00 92 A 8.21 3.97 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 93 S 8.22 4.03 0.00 3.90 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 94 Q 8.02 3.96 0.00 2.12 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 95 I 7.71 3.91 1.87 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 1.75 0.92 0.91 0.00 0.00 96 S 8.16 4.39 0.00 4.03 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 97 G 7.80 3.86 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 0.00 0.00 0.00