NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9673 8.3549 109.7365 45.8873 0.0000 172.8549 2 S 4.4130 8.5095 112.5724 58.3560 64.7569 174.7508 3 S 4.0883 8.3550 113.2572 59.8677 64.1450 175.0827 4 G 3.9268 7.9320 108.1171 43.9531 0.0000 172.5449 5 S 4.3777 8.2188 113.1657 57.7661 63.1754 174.1932 6 S 4.2612 8.7997 121.2645 60.3626 63.3319 174.5944 7 G 3.8865 7.3029 105.6160 44.4900 0.0000 172.8400 8 L 4.5596 8.5359 121.7818 52.8359 41.9920 175.8702 9 E 4.5896 8.2287 120.1274 54.0442 32.4678 175.6454 10 A 3.9804 8.4965 123.6283 52.7169 16.8736 177.0207 11 V 4.0228 8.0556 120.6268 60.9208 31.5221 175.8208 12 A 4.7687 8.0759 127.8361 49.2820 21.4605 175.9007 13 P 4.5663 0.0000 0.0000 63.0174 32.6466 174.8334 14 E 4.6522 8.1819 114.5423 56.4101 32.0478 173.9156 15 R 4.3129 7.6831 113.7107 54.2833 31.8752 174.5366 16 P 4.0620 0.0000 0.0000 62.4872 32.3340 174.9986 17 R 4.5952 7.7561 116.4273 55.1306 33.1787 175.1488 18 C 4.2703 9.3011 124.6141 59.3234 32.0204 173.6591 19 A 4.5914 8.0481 123.6839 51.9467 19.2564 176.4962 20 Y 4.6027 8.1644 116.6794 58.4949 40.9132 175.8177 21 C 4.6276 8.2142 110.3386 56.8820 31.2481 173.4285 22 S 4.1250 8.3369 114.2340 59.1385 60.0388 171.2181 23 A 4.7701 7.6317 119.7970 49.7036 22.1601 176.3801 24 E 4.2569 8.7963 118.8206 56.8452 29.7708 177.0043 25 A 4.6133 8.3704 126.1602 51.0380 20.0697 176.4972 26 S 4.5841 8.9813 112.5179 58.1740 65.1401 174.4802 27 K 4.8140 8.1908 118.1499 54.5646 34.5561 175.3373 28 R 4.5288 7.8426 120.1717 53.7629 32.5580 175.5291 29 C 4.0271 8.2061 119.4001 60.1330 31.4028 174.1971 30 S 4.3514 8.6646 120.7316 59.5778 62.3193 174.5527 31 R 4.3694 7.9933 118.1538 58.6172 29.5726 176.9490 32 C 4.6972 7.6822 109.7136 56.7002 31.4588 174.5311 33 Q 3.6910 8.6537 117.7456 56.9991 26.1348 173.6601 34 N 4.7769 7.6152 112.9246 52.9127 39.7432 173.6786 35 E 4.7853 7.6018 118.8323 54.0231 33.5843 173.9276 36 W 5.1805 8.6695 121.4804 55.2854 33.2602 174.8433 37 Y 5.0207 8.7274 119.6002 57.2724 41.0017 174.6664 38 C 4.3250 9.3446 120.4507 61.0165 30.1721 174.1888 39 C 4.9487 7.7632 115.4465 56.4152 33.0716 174.7746 40 R 3.8218 8.4853 122.1501 59.6340 29.6576 178.0174 41 E 3.7672 8.1793 118.5683 59.7539 29.3798 178.3274 42 C 3.5467 7.4253 115.4333 62.9762 28.1433 176.0471 43 Q 2.5200 7.3939 118.5743 57.6414 28.6880 177.4796 44 V 3.9183 7.6973 118.7870 64.6978 31.9240 177.9153 45 K 4.0461 7.5884 117.2309 59.7127 32.4192 178.3575 46 H 4.6287 8.8512 117.5028 57.7498 29.7915 176.6678 47 W 4.6148 7.8073 129.8849 61.3702 30.3129 177.1975 48 E 3.6858 8.1596 117.7384 59.3251 29.0091 178.6626 49 K 4.1071 8.5033 118.2382 59.1031 32.4060 178.4614 50 H 4.2248 7.7575 118.3667 58.9583 30.2006 177.4025 51 G 2.4280 7.4008 107.8392 46.9091 0.0000 175.3137 52 K 3.7790 6.7209 119.8585 59.3254 32.0530 177.8951 53 T 4.2684 7.7035 105.1964 61.1137 69.7573 173.9823 54 C 3.6754 6.7195 121.6166 60.1996 31.9491 172.2270 55 S 3.8712 8.7210 113.3107 58.8645 61.8383 174.3027 56 G 3.9268 8.6694 109.4450 45.6762 0.0000 176.1042 57 P 4.5650 0.0000 0.0000 61.3514 29.4495 175.3044 58 S 3.9809 7.5885 118.8437 59.3842 63.6205 174.9747 59 S 4.4905 8.6183 114.2551 57.4010 64.7983 176.0390 60 G 4.2377 8.8891 114.1786 45.9831 0.0000 173.2388 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 G 8.35 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 2 S 8.51 4.41 0.00 3.92 3.88 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 3 S 8.35 4.09 0.00 3.98 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 4 G 7.93 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 0.00 0.00 0.00 5 S 8.22 4.38 0.00 3.84 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 6 S 8.80 4.26 0.00 4.02 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 7 G 7.30 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 0.00 0.00 0.00 8 L 8.54 4.56 0.00 1.62 1.63 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.23 4.59 0.00 1.98 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 2.17 2.35 0.00 10 A 8.50 3.98 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 11 V 8.06 4.02 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.92 0.00 0.00 12 A 8.08 4.77 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.57 0.00 2.16 2.10 0.00 3.78 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 1.96 1.93 0.00 14 E 8.18 4.65 0.00 1.97 1.88 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 2.15 2.23 0.00 15 R 7.68 4.31 0.00 1.68 1.73 0.00 2.96 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.48 0.00 16 P 0.00 4.06 0.00 0.75 0.49 0.00 3.28 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.44 0.00 17 R 7.76 4.60 0.00 1.61 1.71 0.00 3.34 0.00 0.00 3.07 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.58 0.00 18 C 9.30 4.27 0.00 3.20 3.04 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 19 A 8.05 4.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.16 4.60 0.00 3.12 3.09 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 21 C 8.21 4.63 0.00 3.18 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 4.12 0.00 4.02 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 23 A 7.63 4.77 1.26 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 0.00 0.00 0.00 24 E 8.80 4.26 0.00 1.83 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 2.25 2.31 0.00 25 A 8.37 4.61 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 26 S 8.98 4.58 0.00 3.85 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 27 K 8.19 4.81 0.00 1.89 1.72 0.00 1.79 0.00 0.00 1.94 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.42 7.81 28 R 7.84 4.53 0.00 1.22 1.32 0.00 2.45 0.00 0.00 2.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 29 C 8.21 4.03 0.00 3.17 3.01 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 30 S 8.66 4.35 0.00 3.83 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 31 R 7.99 4.37 0.00 1.98 2.08 0.00 3.31 0.00 0.00 3.43 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 32 C 7.68 4.70 0.00 3.07 3.24 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 33 Q 8.65 3.69 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.95 0.00 0.00 0.00 0.00 0.00 2.24 2.52 0.00 34 N 7.62 4.78 0.00 2.85 2.83 0.00 0.00 6.71 7.54 0.00 0.00 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 E 7.60 4.79 0.00 2.09 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 2.15 1.62 0.00 36 W 8.67 5.18 0.00 3.27 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.73 5.02 0.00 2.90 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 38 C 9.34 4.33 0.00 3.14 3.31 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 0.00 0.00 0.00 0.00 39 C 7.76 4.95 0.00 2.95 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.49 3.82 0.00 1.87 1.87 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 41 E 8.18 3.77 0.00 1.99 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 42 C 7.43 3.55 0.00 3.47 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.39 2.52 0.00 1.18 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 1.93 1.32 0.00 44 V 7.70 3.92 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 0.86 0.00 0.00 0.79 0.00 0.00 45 K 7.59 4.05 0.00 1.55 1.95 0.00 0.61 0.00 0.00 1.30 0.00 0.00 2.80 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.30 1.43 7.81 46 H 8.85 4.63 0.00 3.57 3.71 0.00 5.63 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 W 7.81 4.61 0.00 3.67 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.16 3.69 0.00 2.06 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 2.28 2.44 0.00 49 K 8.50 4.11 0.00 1.61 1.78 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.46 7.81 50 H 7.76 4.22 0.00 3.42 3.41 0.00 5.91 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 7.40 2.43 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 0.00 52 K 6.72 3.78 0.00 1.63 1.80 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.46 7.81 53 T 7.70 4.27 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 1.17 0.00 0.00 54 C 6.72 3.68 0.00 2.57 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 55 S 8.72 3.87 0.00 4.09 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 56 G 8.67 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 0.00 0.00 0.00 57 P 0.00 4.56 0.00 2.19 2.11 0.00 3.82 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 58 S 7.59 3.98 0.00 4.00 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 59 S 8.62 4.49 0.00 3.95 3.71 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 60 G 8.89 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 0.00 0.00 0.00 0.00