NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3612 0.0000 0.0000 62.2260 33.7142 174.6758 3 K 4.4810 8.4801 125.6285 54.6028 34.1364 172.9854 4 H 5.0043 9.6700 126.2589 55.0556 31.1738 173.7509 5 E 5.0888 8.4848 122.3845 54.4468 32.3717 174.6547 6 F 5.2768 9.5276 124.9530 55.7203 43.6002 173.7502 7 S 5.0564 9.2553 117.0230 57.0323 63.9384 173.0402 8 V 4.7511 8.4409 126.8620 60.9855 33.7934 176.1028 9 D 4.7438 8.8582 129.5145 54.4464 38.3553 174.1497 10 M 4.5275 7.9900 120.7129 53.8217 33.8095 176.2284 11 T 4.6005 8.0675 111.2617 60.7993 69.9785 172.6498 12 C 4.6633 7.5566 115.4816 56.4580 31.9783 174.8115 13 G 3.7784 8.6167 107.0230 47.9767 0.0000 176.0355 14 G 3.6602 8.0914 107.3514 47.8173 0.0000 175.4661 15 C 4.1662 8.0147 118.6987 62.6096 28.1077 176.0162 16 A 4.0012 7.9038 121.9862 55.0519 18.0157 179.1018 17 E 3.8709 8.4490 117.7758 59.3310 29.8160 178.9068 18 A 3.9484 8.0396 120.9203 55.0559 18.4082 179.8020 19 V 3.4127 7.6184 116.3048 66.1204 31.6094 178.1439 20 S 3.7536 8.1152 112.9152 61.3987 62.2061 176.4492 21 R 3.9380 8.1477 120.7985 59.4010 29.9349 179.5179 22 V 3.6507 7.6379 111.8526 64.2246 31.4902 178.7000 23 L 3.9408 7.7444 118.9579 57.6604 41.1486 179.2037 24 N 4.4784 8.1032 115.8626 56.1125 38.5258 177.0523 25 K 4.0836 7.9087 120.3747 59.2638 32.3475 178.3343 26 L 4.0431 7.5997 119.7255 56.1394 42.2651 178.1493 27 G 4.0328 7.8197 103.1680 46.0142 0.0000 172.4158 28 G 3.9723 8.6694 104.1357 46.6786 0.0000 174.0227 29 V 4.8631 7.8522 110.2619 59.0017 36.0913 175.2523 30 K 4.6505 8.9727 124.4183 54.8095 34.7941 174.5723 31 Y 5.9749 8.0196 123.9018 55.6384 41.7390 173.6307 32 D 4.9660 8.8012 118.0791 51.8632 43.0380 174.0133 33 I 4.9718 8.6298 122.1526 59.5538 40.0894 174.4648 34 D 4.7105 9.0994 127.2121 52.5491 42.5643 176.5533 35 L 3.9376 8.6660 128.4288 57.7715 42.5989 177.1499 36 P 4.2451 0.0000 0.0000 65.5293 31.2288 176.9114 37 N 4.6284 8.5358 112.1003 52.2437 39.3560 174.8787 38 K 3.8758 7.9251 117.8997 57.7469 30.4635 174.5091 39 K 5.2849 8.1364 116.1909 54.6435 36.9142 177.1378 40 V 4.8971 9.0073 122.8255 61.5352 34.8471 173.7502 41 C 5.4744 9.0614 125.5468 58.2240 31.0048 172.9921 42 I 5.2178 9.3858 123.4880 59.6024 41.1699 173.7365 43 E 5.6021 9.3617 128.2334 54.1731 31.3937 174.5607 44 S 4.8577 8.4921 119.8036 57.9499 65.1540 174.2333 45 E 4.2973 8.8258 121.4513 57.7632 29.8767 177.2640 46 H 4.3702 7.7145 116.3125 55.4998 29.4613 175.9557 47 S 4.4486 8.3988 117.2346 57.8905 65.1244 174.8874 48 M 3.8134 8.5145 121.2622 59.2428 31.7870 177.9363 49 D 4.3432 8.0373 118.1087 57.6372 40.9199 178.8961 50 T 3.8134 7.7715 115.5860 66.6959 68.5388 176.6263 51 L 3.8556 7.8568 120.8042 57.6612 41.5935 179.4317 52 L 3.8416 8.1645 120.0454 58.0985 42.0932 178.9063 53 A 3.9856 8.3444 121.1443 55.4204 18.0652 179.7408 54 T 3.7593 7.8217 113.5357 66.7240 68.9165 176.6491 55 L 4.0018 7.7833 120.8483 57.6602 41.6433 179.6711 56 K 4.0035 8.3869 118.8492 59.2780 31.7369 179.3840 57 K 4.1269 7.9091 117.8621 58.8126 31.9824 178.8762 58 T 4.0383 7.5173 109.0898 62.9146 68.8010 175.5013 59 G 3.9030 8.0397 109.7459 45.1564 0.0000 173.4327 60 K 4.4270 7.2715 118.0413 55.0297 33.8150 176.3779 61 T 4.2063 8.2196 118.0837 63.6203 69.3248 173.8782 62 V 5.2124 8.4047 126.0004 61.2344 34.9760 174.5921 63 S 4.8613 9.0075 119.8649 57.0213 66.7674 172.2205 64 Y 4.4357 8.7588 123.4372 57.4810 38.8316 174.7359 65 L 4.1912 9.4216 126.1658 54.6580 43.7934 177.5338 66 G 3.4508 5.3800 104.3901 44.5523 0.0000 172.8653 67 L 4.9379 7.7436 120.2566 53.8884 42.5299 176.3221 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 2 P 0.00 4.36 0.00 2.08 2.01 0.00 3.53 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 3 K 8.48 4.48 0.00 1.89 1.66 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.58 7.81 4 H 9.67 5.00 0.00 3.38 3.22 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.48 5.09 0.00 1.89 1.49 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 2.06 2.21 0.00 6 F 9.53 5.28 0.00 2.97 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 7 S 9.26 5.06 0.00 3.87 3.77 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 8 V 8.44 4.75 2.09 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 0.77 0.00 0.00 0.94 0.00 0.00 9 D 8.86 4.74 0.00 2.75 2.59 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 10 M 7.99 4.53 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.49 0.00 11 T 8.07 4.60 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 1.25 0.00 0.00 12 C 7.56 4.66 0.00 3.06 3.02 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 13 G 8.62 3.78 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 0.00 0.00 0.00 14 G 8.09 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 0.00 0.00 0.00 15 C 8.01 4.17 0.00 3.23 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 16 A 7.90 4.00 1.37 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 0.00 0.00 17 E 8.45 3.87 0.00 2.06 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 0.00 2.31 2.34 0.00 18 A 8.04 3.95 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 19 V 7.62 3.41 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 0.79 0.00 0.00 0.94 0.00 0.00 20 S 8.12 3.75 0.00 4.00 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 21 R 8.15 3.94 0.00 2.00 1.95 0.00 3.17 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 22 V 7.64 3.65 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 0.94 0.00 0.00 0.88 0.00 0.00 23 L 7.74 3.94 0.00 1.34 1.46 0.27 0.49 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 24 N 8.10 4.48 0.00 2.95 2.93 0.00 0.00 6.99 7.22 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 25 K 7.91 4.08 0.00 1.75 1.98 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.44 7.81 26 L 7.60 4.04 0.00 1.63 1.85 0.72 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.82 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 28 G 8.67 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 0.00 0.00 0.00 29 V 7.85 4.86 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 0.89 0.00 0.00 1.18 0.00 0.00 30 K 8.97 4.65 0.00 1.80 1.64 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.27 1.27 7.81 31 Y 8.02 5.97 0.00 3.08 2.94 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 0.00 0.00 0.00 32 D 8.80 4.97 0.00 2.72 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 33 I 8.63 4.97 1.95 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.86 0.94 0.00 0.00 34 D 9.10 4.71 0.00 2.68 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 35 L 8.67 3.94 0.00 1.77 1.65 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.25 0.00 2.08 2.12 0.00 3.95 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 37 N 8.54 4.63 0.00 2.98 2.85 0.00 0.00 7.20 7.07 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 38 K 7.93 3.88 0.00 1.96 2.03 0.00 1.61 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.39 7.81 39 K 8.14 5.28 0.00 1.69 1.67 0.00 1.60 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.62 7.81 40 V 9.01 4.90 2.16 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 0.96 0.00 0.00 0.93 0.00 0.00 41 C 9.06 5.47 0.00 3.36 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 42 I 9.39 5.22 2.17 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.86 1.07 0.00 0.00 43 E 9.36 5.60 0.00 2.02 1.85 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 2.23 2.28 0.00 44 S 8.49 4.86 0.00 4.00 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 45 E 8.83 4.30 0.00 1.93 1.96 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 2.28 2.32 0.00 46 H 7.71 4.37 0.00 3.22 3.23 0.00 5.65 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 47 S 8.40 4.45 0.00 4.05 4.01 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 48 M 8.51 3.81 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.40 0.00 49 D 8.04 4.34 0.00 2.70 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 50 T 7.77 3.81 4.39 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 1.12 0.00 0.00 51 L 7.86 3.86 0.00 1.96 1.60 1.07 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.16 3.84 0.00 2.00 1.85 1.16 1.12 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 53 A 8.34 3.99 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 54 T 7.82 3.76 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 1.10 0.00 0.00 55 L 7.78 4.00 0.00 1.59 1.52 -0.06 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.39 4.00 0.00 1.85 1.84 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.63 7.81 57 K 7.91 4.13 0.00 1.69 1.84 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.65 7.81 58 T 7.52 4.04 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 1.20 0.00 0.00 59 G 8.04 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 0.00 0.00 0.00 60 K 7.27 4.43 0.00 1.73 1.73 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.37 7.81 61 T 8.22 4.21 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 1.23 0.00 0.00 62 V 8.40 5.21 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 0.93 0.00 0.00 0.95 0.00 0.00 63 S 9.01 4.86 0.00 3.96 3.94 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 0.00 0.00 0.00 64 Y 8.76 4.44 0.00 2.92 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 65 L 9.42 4.19 0.00 1.33 1.50 0.87 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 66 G 5.38 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.74 4.94 0.00 1.58 1.49 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00