NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 S 4.4065 8.1927 115.2898 57.4727 64.3902 174.9794 11 L 3.7654 7.8469 122.0981 58.0919 41.7290 175.5075 12 E 3.9519 8.9302 119.6405 59.3864 29.7960 178.3225 13 E 3.9580 8.0523 117.8521 59.9313 29.5964 179.2497 14 M 4.0785 8.2513 118.6599 58.4945 31.9771 178.9559 15 Q 3.9686 8.2012 118.1628 59.0218 28.8319 178.8209 16 R 3.9849 8.1611 119.3313 58.7760 30.0150 178.5805 17 R 3.9177 7.6928 118.6357 59.3497 30.2547 178.2238 18 A 4.0762 8.1956 120.5206 54.9076 18.2135 179.4850 19 D 4.2551 8.1365 117.8783 57.4830 40.9467 178.5353 20 Q 3.9510 7.7656 120.1454 59.3981 29.2311 178.5387 21 L 4.0651 8.0610 119.4659 57.3903 41.6951 179.3096 22 A 4.0773 7.8998 121.0660 54.9771 18.4263 179.3788 23 D 4.3311 8.4902 117.9391 57.6235 40.8380 178.8492 24 E 4.0759 8.3144 118.9769 59.2040 29.4886 179.5126 25 S 4.1362 7.9178 115.2507 61.1995 62.9168 176.3942 26 L 3.9683 7.8480 122.8361 58.0845 41.9122 178.7332 27 E 3.9622 8.2515 118.6102 59.4307 29.3003 179.2960 28 S 4.0839 8.2962 113.4663 61.6805 62.5456 176.4296 29 T 3.8824 7.8982 112.1035 64.6253 68.5369 176.7783 30 R 3.9643 7.8536 121.2012 59.1266 30.0718 179.1229 31 R 3.9447 7.9895 117.8733 59.4310 30.0018 178.6988 32 M 4.0330 8.2837 118.8056 58.4125 31.9302 178.6625 33 L 3.8990 7.7576 119.6637 58.1445 42.3529 178.6485 34 Q 3.9265 7.8875 119.1155 59.2886 29.0090 178.2681 35 L 3.9576 8.4336 120.1499 58.0107 41.7592 179.8503 36 V 3.7026 8.1045 117.9018 65.5099 31.2946 178.0462 37 E 3.9710 8.0707 118.8622 59.3527 29.1225 178.9246 38 E 3.9449 8.1388 118.6153 59.3986 29.4733 179.3361 39 S 4.3974 7.9663 115.2023 61.5876 62.8760 176.7387 40 K 3.8821 7.9216 121.7696 59.6746 31.9954 178.2452 41 D 4.3566 8.2791 118.9915 57.6122 40.8050 178.9527 42 A 4.1285 9.0780 122.1925 54.8788 18.3085 179.9523 43 G 3.5313 8.6937 104.6548 48.0806 0.0000 175.9348 44 I 3.7047 8.0245 123.2738 64.0238 37.1490 178.4280 45 R 3.9123 8.0720 119.3983 59.7292 29.7309 178.7636 46 T 3.8676 7.9717 115.4346 66.7172 68.5427 176.7554 47 L 3.9683 8.0569 120.9036 57.6324 41.4713 179.9072 48 V 3.5631 7.9188 118.2718 66.3293 31.5221 178.0727 49 M 4.3070 7.9922 119.7714 57.8522 31.6660 178.6956 50 L 4.0552 8.2333 119.4212 57.7820 41.8128 179.4030 51 D 4.3147 8.0653 118.6758 57.4737 40.3217 178.5369 52 E 3.9695 8.3466 119.2028 59.7534 29.4345 179.6457 53 Q 4.1734 8.6866 118.5246 58.7159 28.7454 178.8871 54 G 3.6508 8.4574 107.3039 47.8343 0.0000 175.6698 55 E 4.0206 8.1840 120.7337 59.2034 29.4116 179.3565 56 Q 4.0033 7.8766 117.6944 59.0162 28.7357 178.8845 57 L 3.9947 8.2563 120.3503 57.9051 41.5366 179.3728 58 D 4.3278 8.1203 118.8317 57.4445 40.7750 179.0424 59 R 3.6780 8.0449 118.6680 58.9893 29.9907 179.3732 60 V 3.5517 7.9036 118.2294 65.9671 31.6106 177.5934 61 E 3.9167 8.7891 119.4209 59.5093 29.4515 178.4809 62 E 4.0821 9.0610 119.6313 59.5611 29.4863 179.7168 63 G 3.6527 8.1917 105.6282 47.9708 0.0000 175.7082 64 M 4.1062 8.0485 121.0176 58.2437 31.9753 178.5464 65 N 4.3149 8.1714 116.6657 56.5150 38.6462 176.9239 66 H 4.2016 8.2435 119.5250 59.3759 29.9167 177.1832 67 I 3.6216 7.8595 121.6168 64.3900 36.8091 177.6362 68 N 4.2384 8.3127 117.8210 57.0419 38.7037 176.8057 69 Q 4.0085 8.0945 119.0803 59.1410 28.8026 178.6703 70 D 4.3034 8.3494 120.1917 57.6456 40.7722 178.7639 71 M 4.1262 8.3615 119.3392 58.1637 31.8508 178.9710 72 K 3.9956 7.8252 119.0672 59.3548 32.1151 179.2247 73 E 4.0027 7.7504 118.2928 59.1683 29.3015 179.1602 74 A 3.9609 8.0295 120.8809 55.1796 18.3922 179.5110 75 E 3.8617 8.4824 117.4590 59.3089 29.5506 179.4781 76 K 3.8905 8.4729 119.9149 59.8138 32.1014 178.1604 77 N 4.2436 8.5628 115.5042 56.1939 38.5717 176.4614 78 L 4.0520 8.5150 122.0828 58.5017 42.3099 179.2349 79 K 4.1770 8.2465 118.0517 59.4254 31.8081 180.5053 80 D 4.8185 7.8656 116.9929 54.0811 40.8301 176.5446 81 L 4.3415 8.8558 126.6758 55.0940 42.7882 176.4828 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 10 S 8.19 4.41 0.00 3.87 3.90 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 11 L 7.85 3.77 0.00 1.87 1.65 0.92 0.67 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 12 E 8.93 3.95 0.00 2.05 1.98 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 2.40 2.40 0.00 13 E 8.05 3.96 0.00 2.20 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 2.40 2.41 0.00 14 M 8.25 4.08 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.58 0.00 15 Q 8.20 3.97 0.00 2.40 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 16 R 8.16 3.98 0.00 2.05 1.92 0.00 3.08 0.00 0.00 3.09 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 17 R 7.69 3.92 0.00 1.98 2.11 0.00 3.19 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 18 A 8.20 4.08 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 19 D 8.14 4.26 0.00 2.87 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 20 Q 7.77 3.95 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.41 0.00 21 L 8.06 4.07 0.00 1.75 1.70 0.92 0.97 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 22 A 7.90 4.08 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 23 D 8.49 4.33 0.00 2.83 2.73 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 24 E 8.31 4.08 0.00 2.03 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 2.33 2.67 0.00 25 S 7.92 4.14 0.00 4.02 3.90 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 26 L 7.85 3.97 0.00 1.79 1.86 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.25 3.96 0.00 2.23 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 2.59 2.47 0.00 28 S 8.30 4.08 0.00 3.99 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 29 T 7.90 3.88 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 1.27 0.00 0.00 30 R 7.85 3.96 0.00 2.11 2.01 0.00 3.29 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 31 R 7.99 3.94 0.00 2.03 1.97 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 32 M 8.28 4.03 0.00 2.04 2.27 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.56 0.00 33 L 7.76 3.90 0.00 1.95 1.76 0.92 0.78 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 34 Q 7.89 3.93 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.56 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 35 L 8.43 3.96 0.00 1.83 1.70 0.92 0.80 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 36 V 8.10 3.70 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 1.03 0.00 0.00 0.95 0.00 0.00 37 E 8.07 3.97 0.00 2.30 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 2.51 2.49 0.00 38 E 8.14 3.94 0.00 2.03 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 2.33 2.35 0.00 39 S 7.97 4.40 0.00 4.07 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 40 K 7.92 3.88 0.00 1.85 1.98 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 41 D 8.28 4.36 0.00 2.90 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 42 A 9.08 4.13 1.33 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 43 G 8.69 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 44 I 8.02 3.70 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 1.41 0.86 0.91 0.00 0.00 45 R 8.07 3.91 0.00 1.89 2.10 0.00 3.09 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 46 T 7.97 3.87 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 1.21 0.00 0.00 47 L 8.06 3.97 0.00 1.82 1.72 0.92 0.70 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 48 V 7.92 3.56 2.23 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 1.11 0.00 0.00 1.02 0.00 0.00 49 M 7.99 4.31 0.00 2.12 2.10 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 2.75 2.44 0.00 50 L 8.23 4.06 0.00 1.82 1.72 0.92 1.35 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 51 D 8.07 4.31 0.00 3.06 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 52 E 8.35 3.97 0.00 2.11 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 2.33 2.64 0.00 53 Q 8.69 4.17 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 54 G 8.46 3.65 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 0.00 0.00 0.00 55 E 8.18 4.02 0.00 2.19 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 2.56 2.49 0.00 56 Q 7.88 4.00 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 57 L 8.26 3.99 0.00 1.83 1.72 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 58 D 8.12 4.33 0.00 2.87 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 R 8.04 3.68 0.00 2.02 1.97 0.00 3.12 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 60 V 7.90 3.55 2.23 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 1.00 0.00 0.00 0.98 0.00 0.00 61 E 8.79 3.92 0.00 2.03 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 2.31 2.36 0.00 62 E 9.06 4.08 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 2.33 2.49 0.00 63 G 8.19 3.65 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 0.00 0.00 0.00 64 M 8.05 4.11 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.92 0.00 65 N 8.17 4.31 0.00 2.97 2.88 0.00 0.00 6.66 8.25 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 66 H 8.24 4.20 0.00 3.20 3.41 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 67 I 7.86 3.62 2.01 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 1.40 0.63 0.90 0.00 0.00 68 N 8.31 4.24 0.00 2.89 3.06 0.00 0.00 7.27 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 69 Q 8.09 4.01 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.68 0.00 70 D 8.35 4.30 0.00 2.70 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 71 M 8.36 4.13 0.00 2.00 2.23 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.86 0.00 72 K 7.83 4.00 0.00 1.95 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.68 7.81 73 E 7.75 4.00 0.00 2.28 1.98 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 2.50 2.46 0.00 74 A 8.03 3.96 1.35 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 75 E 8.48 3.86 0.00 2.26 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 2.33 2.31 0.00 76 K 8.47 3.89 0.00 1.88 1.97 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.48 7.81 77 N 8.56 4.24 0.00 2.87 2.85 0.00 0.00 7.03 8.36 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 78 L 8.51 4.05 0.00 1.87 1.74 0.92 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.25 4.18 0.00 2.06 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.64 7.81 80 D 7.87 4.82 0.00 2.79 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 81 L 8.86 4.34 0.00 1.61 1.48 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00