NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 4.2561 8.3545 119.0729 56.1089 30.4468 174.9434 -1 K 4.5643 8.1825 124.7670 51.0975 36.3184 174.1343 0 L 3.5207 8.8107 118.9528 57.0067 42.2881 179.7217 1 C 4.3447 8.9963 126.6285 60.8158 39.8851 175.4448 2 S 3.8951 8.0832 114.4380 59.6811 62.8696 174.0928 3 L 4.2471 8.0642 123.5933 53.9121 41.1507 175.5243 4 D 4.1625 9.2187 129.2771 55.3990 39.7832 173.0273 5 N 4.1171 8.2147 109.0801 53.4638 37.6031 173.9762 6 G 4.0377 8.6976 101.0940 45.8781 0.0000 174.4979 7 D 4.3993 8.0716 115.2188 54.5424 40.4446 173.0102 8 C 4.7190 8.0355 114.7845 56.5180 41.0116 173.7450 9 D 4.5045 8.8426 124.0557 56.9987 42.0546 177.3757 10 Q 4.4100 7.4395 112.0674 55.7585 30.7235 179.5604 11 F 4.6794 6.5267 127.5177 58.5908 40.2147 172.6773 12 C 5.5076 8.7004 121.4532 55.2787 41.8504 172.7440 13 H 5.0866 9.1848 121.5316 54.2009 33.0806 171.9722 14 E 4.9377 8.8373 121.7528 55.0318 30.9471 175.3987 15 E 4.4638 9.2536 125.1888 55.6348 32.5884 175.1941 16 Q 3.3670 9.6863 126.1335 57.2413 26.4158 173.6245 17 N 4.3144 8.5018 110.3876 54.0569 37.9754 172.9987 18 S 4.7789 7.9724 110.2854 55.6879 66.1328 173.1822 19 V 4.2117 8.2161 121.7509 63.0081 32.3969 175.3579 20 V 4.4412 9.2424 127.0577 61.4614 34.2419 173.6523 21 C 5.4785 8.9511 125.4171 56.2082 37.4446 172.7453 22 S 4.8130 8.9692 115.5463 57.5050 66.8578 171.6490 23 C 4.7666 8.5799 115.4364 54.5131 40.0563 174.4002 24 A 4.5006 9.0862 124.5125 51.8952 18.6734 177.6386 25 R 4.1443 8.5159 118.6706 58.2648 30.5973 177.7378 26 G 3.9470 9.2884 109.6500 45.3055 0.0000 171.9639 27 Y 5.2667 7.7910 116.3256 56.0983 41.4207 175.1316 28 T 4.7354 9.1291 112.6036 59.4843 71.9611 173.0879 29 L 4.5572 8.5636 126.4988 55.0321 42.8660 176.4579 30 A 4.2909 9.1430 128.6873 51.5422 19.4837 177.9886 31 D 4.2940 8.7992 118.8248 57.6416 40.8432 178.1609 32 N 4.4270 8.1713 113.9431 53.1878 37.5494 175.1980 33 G 4.0153 8.3083 107.3153 46.6288 0.0000 174.6060 34 K 4.5032 8.6472 118.1562 57.2326 36.4198 176.9093 35 A 4.7772 8.2483 120.3675 51.4768 20.6170 176.8911 36 C 5.3676 8.9091 117.0300 55.2517 41.0616 173.7054 37 I 4.6385 8.9393 125.3731 58.6500 39.1336 173.6268 38 P 4.2110 0.0000 0.0000 62.8609 31.1691 176.8983 39 T 3.9911 8.7524 114.9986 64.3244 69.5406 174.3875 40 G 3.9736 7.2215 108.6090 44.4184 0.0000 170.5683 41 P 4.2096 0.0000 0.0000 62.9983 32.9226 174.9722 42 Y 3.5523 7.6338 114.7508 58.6062 35.1761 168.8316 43 P 4.3360 0.0000 0.0000 62.1177 32.7258 176.3836 44 C 4.3305 8.4032 114.9792 59.8349 29.9229 174.3367 45 G 3.9902 8.9869 109.3760 45.5030 0.0000 173.1057 46 K 4.6112 7.3313 118.2828 54.1580 33.9122 176.4359 47 Q 4.0924 8.6129 123.1532 56.1384 29.2156 176.7168 48 T 4.3952 8.3103 112.3960 60.5378 68.1907 174.8149 49 L 4.3695 8.1535 126.6356 55.0742 42.4351 176.8284 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 R 8.35 4.26 0.00 1.85 1.84 0.00 3.18 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 -1 K 8.18 4.56 0.00 1.72 1.69 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.09 7.81 0 L 8.81 3.52 0.00 1.95 0.91 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 1 C 9.00 4.34 0.00 3.08 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 2 S 8.08 3.90 0.00 4.05 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 3 L 8.06 4.25 0.00 1.86 1.73 0.92 1.40 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 4 D 9.22 4.16 0.00 2.90 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 5 N 8.21 4.12 0.00 2.98 2.79 0.00 0.00 7.56 7.90 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 6 G 8.70 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 0.00 0.00 0.00 7 D 8.07 4.40 0.00 2.82 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 8 C 8.04 4.72 0.00 3.05 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 9 D 8.84 4.50 0.00 2.62 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.44 4.41 0.00 1.46 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.96 0.00 0.00 0.00 0.00 0.00 1.83 1.94 0.00 11 F 6.53 4.68 0.00 3.01 2.81 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 12 C 8.70 5.51 0.00 3.02 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 13 H 9.18 5.09 0.00 3.15 3.13 0.00 5.85 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.84 4.94 0.00 1.86 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 2.26 2.30 0.00 15 E 9.25 4.46 0.00 1.89 1.75 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 2.20 2.26 0.00 16 Q 9.69 3.37 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.34 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 17 N 8.50 4.31 0.00 2.83 2.90 0.00 0.00 7.01 7.63 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 18 S 7.97 4.78 0.00 3.98 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 19 V 8.22 4.21 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 20 V 9.24 4.44 2.13 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 0.95 0.00 0.00 1.06 0.00 0.00 21 C 8.95 5.48 0.00 3.01 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 22 S 8.97 4.81 0.00 4.01 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 23 C 8.58 4.77 0.00 2.81 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 24 A 9.09 4.50 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 25 R 8.52 4.14 0.00 1.90 1.96 0.00 3.29 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 26 G 9.29 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 0.00 0.00 0.00 27 Y 7.79 5.27 0.00 2.92 2.81 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 28 T 9.13 4.74 4.26 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 0.00 0.00 0.00 1.22 0.00 0.00 29 L 8.56 4.56 0.00 1.68 1.64 1.00 1.09 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 30 A 9.14 4.29 1.34 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 0.00 0.00 0.00 31 D 8.80 4.29 0.00 2.68 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.17 4.43 0.00 2.81 2.94 0.00 0.00 5.99 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 33 G 8.31 4.02 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 0.00 0.00 0.00 34 K 8.65 4.50 0.00 1.78 1.92 0.00 1.65 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.56 7.81 35 A 8.25 4.78 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 36 C 8.91 5.37 0.00 2.65 2.84 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 37 I 8.94 4.64 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.29 0.91 0.00 0.00 38 P 0.00 4.21 0.00 1.74 1.57 0.00 3.65 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 39 T 8.75 3.99 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 40 G 7.22 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 41 P 0.00 4.21 0.00 2.05 1.84 0.00 3.66 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 42 Y 7.63 3.55 0.00 3.18 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 43 P 0.00 4.34 0.00 1.90 1.63 0.00 3.59 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.79 0.00 44 C 8.40 4.33 0.00 3.20 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 45 G 8.99 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 0.00 0.00 0.00 46 K 7.33 4.61 0.00 1.90 1.77 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.59 7.81 47 Q 8.61 4.09 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.14 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 48 T 8.31 4.40 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 1.42 0.00 0.00 49 L 8.15 4.37 0.00 1.61 1.56 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00