NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2668 8.3044 118.1939 55.4029 32.5366 173.6066 2 K 3.7737 8.6580 123.7963 55.6281 32.6887 172.9213 3 K 4.7143 7.8947 118.8617 56.9500 39.7780 175.7339 4 L 4.4976 7.7249 124.1119 55.3804 43.0442 176.0510 5 R 3.8634 7.7738 118.5230 59.4908 29.8187 178.7184 6 E 4.0638 8.0760 117.4250 59.2863 29.2866 178.8929 7 E 3.8925 8.0368 118.0781 58.9104 29.9953 178.3445 8 A 4.0565 8.1938 120.8809 55.2316 18.1131 179.2931 9 A 3.0603 7.2841 117.6921 55.1076 18.3467 179.7487 10 K 3.7793 7.7975 117.9317 59.3896 32.2202 179.1392 11 L 3.8986 7.8542 119.4500 57.4973 41.5592 179.2067 12 F 2.5007 7.5657 117.5165 60.0148 38.6126 177.2521 13 E 4.0602 8.0162 118.5645 58.8391 29.1927 178.3813 14 E 3.9177 7.9074 119.0539 59.2971 29.5855 179.2827 15 W 4.4569 7.5539 117.9829 59.9603 29.2293 178.1377 16 K 3.9538 7.8069 118.5278 59.5059 31.4698 178.4092 17 K 3.8956 8.2405 119.9176 59.7672 32.1637 178.7875 18 L 4.3447 7.8712 118.6126 57.2662 41.3838 179.2986 19 A 4.0188 8.0280 121.2370 55.1301 18.1108 179.2654 20 E 3.9125 8.0234 116.7147 59.5408 29.6133 178.6402 21 E 4.1072 7.9718 117.0308 59.2203 29.4928 179.1769 22 A 4.0237 8.1426 120.8086 54.8849 18.4605 179.4519 23 A 4.0005 7.8717 119.3347 55.2863 18.3946 180.0031 24 K 4.0097 7.8402 116.6460 59.2952 31.8944 179.3077 25 L 4.0340 7.7034 119.6266 57.7140 42.1888 178.1145 26 L 4.1395 7.8827 119.7083 57.6057 42.4283 178.0984 27 E 4.2185 8.4131 118.3178 56.0159 30.2285 176.5192 28 G 3.8758 9.1891 106.6457 46.8206 0.0000 173.2009 29 G 4.3087 8.9638 112.7490 45.0833 0.0000 173.7452 30 G 4.1447 7.2960 105.6249 43.9223 0.0000 174.1327 31 G 3.6524 8.5542 111.9659 44.8473 0.0000 175.9200 32 G 3.7471 9.3266 105.8304 47.0562 0.0000 174.1128 33 G 3.9333 9.3627 112.6492 46.6590 0.0000 174.2486 34 G 3.6641 8.1026 114.4791 45.1233 0.0000 177.2829 35 G 3.9351 9.1254 120.7169 46.0286 0.0000 173.2114 36 E 4.0145 8.6913 127.1007 58.0951 29.7134 177.8713 37 L 4.0144 8.0622 119.1641 58.1565 41.1789 179.1462 38 M 4.0992 7.9550 116.2439 57.9720 31.3101 178.3274 39 K 4.0746 7.4628 118.0342 58.8642 32.0405 178.6194 40 L 3.9868 8.3668 121.4675 58.0887 41.6947 178.4259 41 C 3.9772 7.9239 118.8992 62.1633 31.3587 175.1407 42 E 3.9605 7.9276 120.0945 58.7871 29.2024 178.0474 43 E 3.8940 8.0090 119.4693 59.2850 29.1508 178.6044 44 A 3.9402 7.5620 119.9735 55.4180 18.1190 179.5955 45 A 3.8093 7.6080 118.6893 54.8178 18.3910 179.7759 46 K 4.0344 8.3332 119.0564 59.4194 32.2158 178.8953 47 K 3.9619 8.1782 119.8754 59.3905 31.6381 178.5089 48 A 4.2126 7.6829 120.7823 55.4413 18.1255 179.3025 49 E 4.2081 7.8656 115.3655 59.3446 29.5305 178.3082 50 E 4.1899 8.3264 119.4175 58.8702 29.6882 178.6671 51 L 4.2094 8.2854 119.4236 57.4323 41.6646 178.7516 52 F 3.8956 8.0931 119.7677 61.2113 39.2498 177.2098 53 K 4.0296 7.9596 118.1047 59.5212 32.1756 178.9165 54 L 4.1454 7.8629 118.6407 57.6553 41.6986 179.1222 55 A 3.9943 8.5462 121.1789 54.7374 18.0461 179.3435 56 E 3.8965 8.2062 118.3523 59.4775 29.5353 178.5869 57 E 4.2451 7.5696 118.1256 58.9095 29.7551 177.6911 58 R 4.1087 7.7698 118.2576 57.8945 30.1090 177.9288 59 L 4.3180 8.0813 122.3433 56.2819 42.6889 177.2104 60 K 4.3250 7.6595 120.8604 54.2558 32.0561 176.3387 61 K 4.0742 8.3738 126.9471 57.8819 32.8171 176.8070 62 L 3.9964 7.7766 122.4117 55.2872 41.6650 174.5462 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 M 8.30 4.27 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 2 K 8.66 3.77 0.00 1.98 1.82 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.31 1.51 7.81 3 K 7.89 4.71 0.00 1.70 1.75 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.48 7.81 4 L 7.72 4.50 0.00 1.81 1.84 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 5 R 7.77 3.86 0.00 1.90 2.00 0.00 3.16 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 6 E 8.08 4.06 0.00 1.99 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 2.39 2.35 0.00 7 E 8.04 3.89 0.00 1.94 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 0.00 2.28 2.36 0.00 8 A 8.19 4.06 1.31 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 0.00 0.00 9 A 7.28 3.06 1.14 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 0.00 0.00 10 K 7.80 3.78 0.00 1.78 1.96 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.61 7.81 11 L 7.85 3.90 0.00 1.94 1.45 0.97 0.81 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 12 F 7.57 2.50 0.00 2.87 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 13 E 8.02 4.06 0.00 2.26 1.93 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 2.32 2.43 0.00 14 E 7.91 3.92 0.00 1.87 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 2.27 2.43 0.00 15 W 7.55 4.46 0.00 3.38 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 16 K 7.81 3.95 0.00 2.09 2.01 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.57 7.81 17 K 8.24 3.90 0.00 2.08 1.89 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.65 7.81 18 L 7.87 4.34 0.00 1.89 1.74 1.00 0.85 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 19 A 8.03 4.02 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 20 E 8.02 3.91 0.00 2.02 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 2.34 2.37 0.00 21 E 7.97 4.11 0.00 2.24 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 2.34 2.34 0.00 22 A 8.14 4.02 1.41 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 0.00 0.00 0.00 23 A 7.87 4.00 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 24 K 7.84 4.01 0.00 1.95 1.87 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.63 7.81 25 L 7.70 4.03 0.00 1.64 1.69 0.92 0.94 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 26 L 7.88 4.14 0.00 1.70 1.67 0.96 0.83 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 27 E 8.41 4.22 0.00 2.12 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 2.34 2.50 0.00 28 G 9.19 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 0.00 0.00 0.00 29 G 8.96 4.31 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 0.00 0.00 0.00 30 G 7.30 4.14 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 0.00 0.00 0.00 31 G 8.55 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 32 G 9.33 3.75 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 0.00 0.00 0.00 33 G 9.36 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 34 G 8.10 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 35 G 9.13 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 0.00 0.00 0.00 36 E 8.69 4.01 0.00 2.05 1.94 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 2.36 2.39 0.00 37 L 8.06 4.01 0.00 1.69 1.72 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 38 M 7.95 4.10 0.00 2.40 2.32 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 2.65 2.77 0.00 39 K 7.46 4.07 0.00 1.97 1.98 0.00 1.52 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.49 7.81 40 L 8.37 3.99 0.00 1.81 1.78 0.92 0.67 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 41 C 7.92 3.98 0.00 2.99 2.91 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 42 E 7.93 3.96 0.00 2.31 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 2.32 2.38 0.00 43 E 8.01 3.89 0.00 2.29 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 2.32 2.40 0.00 44 A 7.56 3.94 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 45 A 7.61 3.81 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 46 K 8.33 4.03 0.00 2.08 1.91 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.47 7.81 47 K 8.18 3.96 0.00 1.96 1.83 0.00 1.60 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.55 7.81 48 A 7.68 4.21 1.52 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 0.00 0.00 0.00 49 E 7.87 4.21 0.00 2.13 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 0.00 2.41 2.52 0.00 50 E 8.33 4.19 0.00 2.16 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 0.00 2.37 2.40 0.00 51 L 8.29 4.21 0.00 2.25 2.03 1.03 0.90 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 52 F 8.09 3.90 0.00 3.33 2.97 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 53 K 7.96 4.03 0.00 1.94 1.84 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.66 7.81 54 L 7.86 4.15 0.00 1.88 1.72 0.94 1.12 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 55 A 8.55 3.99 1.04 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 56 E 8.21 3.90 0.00 2.29 2.19 0.00 0.00 0.00 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 2.50 0.00 57 E 7.57 4.25 0.00 2.08 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 2.32 2.21 0.00 58 R 7.77 4.11 0.00 1.98 1.83 0.00 3.40 0.00 0.00 3.23 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.82 0.00 59 L 8.08 4.32 0.00 1.63 1.71 0.77 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.66 4.33 0.00 1.72 1.83 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.37 7.81 61 K 8.37 4.07 0.00 1.75 1.78 0.00 1.98 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.46 7.81 62 L 7.78 4.00 0.00 1.81 1.62 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00