NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3960 0.0000 0.0000 61.6391 32.8009 175.9604 2 K 3.6815 8.7956 121.3482 56.3551 32.4255 175.0467 3 I 3.7598 9.3645 125.8926 61.5157 38.3210 175.5291 4 K 4.2074 8.6222 125.6432 56.0093 32.3594 177.0222 5 T 4.0216 8.3795 118.9021 61.6582 68.0659 174.3335 6 V 3.8870 8.3010 127.1772 62.2367 30.8272 176.9470 7 R 4.0763 8.7038 128.2691 58.9867 29.8951 179.0595 8 G 3.6027 8.1210 104.8579 47.9639 0.0000 175.3779 9 A 4.2757 7.8592 123.6758 54.3984 18.0512 179.2814 10 A 4.2234 7.5892 118.3965 54.0764 18.7239 178.0024 11 K 4.5176 8.0035 116.0701 56.5233 32.1561 177.7677 12 R 4.4133 7.7452 116.4835 55.4939 33.4617 174.5848 13 F 5.2469 7.5888 114.3328 54.6878 42.9707 175.5378 14 K 4.4963 10.0269 122.4555 55.5772 33.7840 174.7841 15 K 3.4027 8.6127 127.8898 56.6487 33.0906 175.6551 16 T 4.7073 7.8536 118.2981 59.9812 71.3540 174.2944 17 G 3.6476 8.8544 109.1946 49.3030 0.0000 174.6498 18 K 4.2653 8.0128 116.7222 55.6106 32.1328 177.4502 19 G 3.7912 7.8372 106.6825 45.1243 0.0000 175.9226 20 G 3.9312 7.2547 109.5029 45.2662 0.0000 173.9986 21 F 4.8705 8.5359 112.7466 56.1290 43.7292 172.5918 22 K 4.6026 8.8284 121.1621 56.2025 33.2195 173.6109 23 H 4.9451 8.0276 115.6276 53.4891 31.8743 172.2003 24 K 4.3597 8.2094 120.5872 55.9275 32.8239 176.1748 25 H 4.4442 8.4595 120.8259 55.6387 29.3558 175.2278 26 A 4.3870 8.3071 125.1345 52.2063 19.8226 177.5336 27 N 4.6133 9.0284 115.7030 53.1265 36.6617 174.9560 28 L 4.7876 7.3955 118.6948 53.4121 41.6262 175.7266 29 R 4.5965 7.2877 114.9695 56.1695 33.4771 173.2376 30 H 4.2078 8.4273 114.0115 57.0236 32.2609 174.8795 31 I 3.1307 6.9261 116.9676 62.4044 35.0711 172.8765 32 L 4.4867 7.7496 128.4103 55.8659 43.5342 178.7248 33 T 3.8316 8.0362 111.8959 64.7921 67.0521 174.2133 34 K 4.2533 7.9177 117.5595 57.1355 33.4309 176.4107 35 K 4.4894 8.1507 119.8973 54.3499 34.1576 176.7517 36 A 4.1463 8.3323 124.1181 52.6788 20.2346 179.0813 37 T 3.8451 8.4093 118.4273 66.3523 68.2326 177.2163 38 K 3.7953 7.9065 121.2557 59.3267 32.1063 178.4408 39 R 3.9015 7.8688 117.0569 59.5317 29.4888 178.1040 40 K 4.0626 8.0236 117.4998 59.8098 32.0121 179.4571 41 R 4.1618 8.1121 119.0849 60.0034 29.9509 177.8188 42 H 4.4663 7.6853 113.5593 58.0190 28.7886 177.1532 43 L 4.1816 9.1726 120.2807 56.7335 41.6078 179.0371 44 R 4.1054 7.5199 118.2737 57.7859 30.3569 175.6118 45 P 4.3860 0.0000 0.0000 62.5627 31.7345 175.7159 46 K 4.4831 8.2411 118.6933 56.7891 33.4417 175.6724 47 A 4.5506 8.1382 119.8887 51.4859 22.7229 176.1237 48 M 4.7676 8.6668 119.7147 55.0382 33.0779 176.5893 49 V 4.2736 8.3647 121.1310 60.5176 33.6286 176.6400 50 S 4.5326 8.2457 117.1782 57.4756 65.2996 175.6191 51 K 4.0384 8.4450 120.8943 59.6410 31.7791 179.2602 52 G 3.8896 8.1497 105.4642 48.1887 0.0000 174.8601 53 D 4.2532 7.9829 119.7348 55.8954 41.0334 178.2665 54 L 3.9781 7.7927 121.3539 58.4267 41.9508 178.1949 55 G 3.6319 7.6935 105.3093 47.5072 0.0000 175.0753 56 L 3.8336 7.6873 122.0521 57.3160 42.1650 179.5374 57 V 3.2367 7.5384 117.3291 66.0181 31.2548 177.7374 58 I 3.5381 7.5096 119.0421 64.7086 36.8840 178.2109 59 A 4.1007 7.6434 119.3012 55.2173 18.3496 179.0591 60 C 4.3352 8.2668 115.7170 61.1828 29.4696 173.1744 61 L 5.2322 7.9125 120.4546 52.2705 41.3590 175.2913 62 P 4.2839 0.0000 0.0000 64.4166 31.9984 177.5458 63 Y 4.5236 7.6211 114.3079 57.4424 39.3143 175.3410 64 A 4.3060 7.7705 127.9692 52.5741 18.4211 177.2810 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 P 0.00 4.40 0.00 2.08 2.07 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.12 0.00 2 K 8.80 3.68 0.00 1.83 1.83 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.53 7.81 3 I 9.36 3.76 2.04 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.52 0.95 0.00 0.00 4 K 8.62 4.21 0.00 1.78 1.79 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.45 7.81 5 T 8.38 4.02 4.40 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 1.32 0.00 0.00 6 V 8.30 3.89 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 0.92 0.00 0.00 0.98 0.00 0.00 7 R 8.70 4.08 0.00 1.87 1.98 0.00 3.38 0.00 0.00 3.54 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 8 G 8.12 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.86 4.28 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.59 4.22 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 11 K 8.00 4.52 0.00 1.74 1.81 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.68 7.81 12 R 7.75 4.41 0.00 1.32 1.15 0.00 2.96 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.49 0.00 13 F 7.59 5.25 0.00 2.86 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 14 K 10.03 4.50 0.00 1.78 1.79 0.00 1.90 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.59 7.81 15 K 8.61 3.40 0.00 1.81 1.66 0.00 0.88 0.00 0.00 1.30 0.00 0.00 2.62 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.29 1.27 7.81 16 T 7.85 4.71 4.19 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 0.00 0.00 1.24 0.00 0.00 17 G 8.85 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 18 K 8.01 4.27 0.00 1.71 1.79 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.39 7.81 19 G 7.84 3.79 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 0.00 0.00 0.00 20 G 7.25 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 21 F 8.54 4.87 0.00 3.11 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.83 4.60 0.00 2.08 2.04 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.41 7.81 23 H 8.03 4.95 0.00 3.18 3.47 0.00 5.64 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.21 4.36 0.00 1.71 1.71 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.45 7.81 25 H 8.46 4.44 0.00 3.39 3.21 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.31 4.39 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 27 N 9.03 4.61 0.00 2.86 3.21 0.00 0.00 6.64 7.85 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 28 L 7.40 4.79 0.00 1.56 1.57 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.29 4.60 0.00 1.75 1.86 0.00 3.32 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 30 H 8.43 4.21 0.00 3.06 3.11 0.00 5.80 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 6.93 3.13 1.73 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.70 0.84 0.00 0.00 32 L 7.75 4.49 0.00 1.71 1.65 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.04 3.83 4.23 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 1.19 0.00 0.00 34 K 7.92 4.25 0.00 1.89 1.89 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.44 7.81 35 K 8.15 4.49 0.00 1.70 1.75 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.38 1.48 7.81 36 A 8.33 4.15 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 37 T 8.41 3.85 4.22 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 1.19 0.00 0.00 38 K 7.91 3.80 0.00 1.77 1.76 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.38 7.81 39 R 7.87 3.90 0.00 1.83 2.11 0.00 3.29 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 40 K 8.02 4.06 0.00 1.86 1.83 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.44 7.81 41 R 8.11 4.16 0.00 1.94 2.04 0.00 3.09 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 42 H 7.69 4.47 0.00 3.29 3.30 0.00 5.72 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 9.17 4.18 0.00 1.79 1.74 0.92 0.84 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 44 R 7.52 4.11 0.00 1.91 2.01 0.00 3.18 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 45 P 0.00 4.39 0.00 2.19 2.08 0.00 3.79 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 2.14 2.03 0.00 46 K 8.24 4.48 0.00 1.65 1.79 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.39 7.81 47 A 8.14 4.55 0.99 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 48 M 8.67 4.77 0.00 1.97 2.04 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 2.50 0.00 49 V 8.36 4.27 2.22 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 0.98 0.00 0.00 0.87 0.00 0.00 50 S 8.25 4.53 0.00 4.09 4.09 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 51 K 8.44 4.04 0.00 1.73 1.91 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.57 7.81 52 G 8.15 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 53 D 7.98 4.25 0.00 2.79 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.79 3.98 0.00 1.93 1.67 1.14 0.85 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 55 G 7.69 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.69 3.83 0.00 1.61 1.69 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.54 3.24 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 -0.46 0.00 0.00 -0.27 0.00 0.00 58 I 7.51 3.54 1.98 0.00 0.00 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 1.64 0.67 0.92 0.00 0.00 59 A 7.64 4.10 1.30 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 0.00 0.00 60 C 8.27 4.34 0.00 3.13 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 61 L 7.91 5.23 0.00 1.58 1.62 0.78 0.93 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 62 P 0.00 4.28 0.00 1.56 1.99 0.00 3.85 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 63 Y 7.62 4.52 0.00 3.07 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.77 4.31 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00