NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 3.8552 8.0249 121.4247 61.0364 38.2901 174.5573 2 R 4.0564 8.1433 124.8487 53.8040 31.0082 175.3053 3 F 4.5528 8.3236 122.7508 57.2026 41.4303 174.1610 4 G 4.3563 9.1482 109.2849 46.4089 0.0000 174.4946 5 M 4.3381 7.9453 117.8186 55.1024 30.8144 177.0754 6 G 4.1300 8.1319 105.4261 46.2009 0.0000 176.4982 7 K 4.1032 7.8365 120.1825 58.4094 32.2444 176.9929 8 V 4.4963 7.3164 117.2830 60.1435 32.4766 171.9305 9 P 5.0554 0.0000 0.0000 62.0949 32.4303 176.8750 10 C 4.6297 8.7961 121.8578 55.8327 41.0091 171.9073 11 P 4.4419 0.0000 0.0000 61.9370 31.8232 175.4751 12 D 4.2002 8.7060 120.9097 56.4271 41.7554 174.2938 13 G 3.7844 8.0216 111.9332 44.1357 0.0000 172.5028 14 E 4.3872 8.6806 122.6274 55.8034 29.0846 176.9815 15 V 3.5018 8.9330 126.1319 61.4548 31.5941 177.6503 16 G 3.8799 8.4038 114.1150 47.0287 0.0000 172.4466 17 Y 4.6236 6.5337 116.4001 54.9003 41.2963 175.3999 18 T 4.1537 8.6264 117.6926 64.6071 69.4433 173.7858 19 C 4.8768 8.6109 123.9491 56.3436 49.3630 171.2814 20 D 5.0102 8.9636 120.7725 54.4183 42.3830 173.8386 21 C 4.6108 9.3190 122.5165 57.7047 40.8680 175.3463 22 G 3.5938 8.4428 115.0979 46.7295 0.0000 173.4535 23 E 4.6411 8.2719 120.0956 54.6809 32.0814 176.6574 24 K 4.3147 7.7727 119.8165 55.5212 33.4193 175.4943 25 I 4.3879 8.0597 123.6320 60.5399 38.1381 176.0534 26 C 4.5259 9.1757 129.7480 55.2680 44.2563 172.9693 27 L 4.4110 8.4413 126.8042 54.4663 42.2386 176.4195 28 Y 4.0669 8.1078 123.1838 59.4077 38.4288 177.3072 29 G 4.0228 9.7202 117.8187 45.1594 0.0000 172.0072 30 Q 4.8561 7.5809 115.2876 54.6960 34.0879 174.6555 31 S 5.7899 8.9912 115.4326 55.8247 66.1630 170.4510 32 C 5.1982 8.7894 118.0740 53.6469 43.0565 172.8023 33 N 4.9821 8.7576 119.5769 52.0392 39.7630 175.0486 34 D 4.1626 8.2257 126.8534 55.4878 41.5238 176.2761 35 G 3.9275 8.6317 100.9315 43.6828 0.0000 173.1482 36 Q 4.3304 7.4172 115.4800 55.3436 33.1285 171.6788 37 C 5.0672 8.9252 122.8524 55.2853 37.8734 173.1067 38 S 4.8398 9.4856 119.4511 55.3602 64.8741 174.4591 39 G 4.1597 7.3763 111.1964 46.0812 0.0000 171.9178 40 D 4.6038 7.2593 117.8534 51.3406 41.6680 172.9090 41 P 4.4720 0.0000 0.0000 63.0158 29.1450 176.7043 42 K 4.6702 7.7928 124.3133 56.1040 34.8305 176.1880 43 P 4.4725 0.0000 0.0000 62.0969 31.1788 176.6154 44 S 3.7327 9.2344 106.0862 59.7449 60.1813 170.5652 45 S 4.1663 8.2381 115.2506 57.9177 62.8438 169.5959 46 E 4.4552 8.5989 120.7832 56.2665 30.9228 176.0842 47 F 4.4047 7.8494 119.4411 56.4681 39.6481 175.3033 48 E 4.2090 8.7644 126.0697 55.9361 30.2245 176.1291 49 E 3.9830 8.4343 122.5474 56.2523 30.1881 176.1064 50 F 5.0125 7.3084 115.2341 55.5845 41.1850 172.8892 51 E 4.7703 8.7446 121.2683 54.6935 30.8172 173.8712 52 I 4.5121 7.7339 124.5001 57.9289 43.2504 175.1886 53 D 4.0455 8.2655 119.8122 54.4910 40.3534 174.8933 54 E 4.8481 8.3685 117.2510 55.9874 29.0205 177.0655 55 E 4.4909 7.6844 116.3807 55.8888 29.9702 175.9724 56 E 3.9514 7.9920 119.1151 57.1245 30.3976 178.2050 57 K 4.1920 8.6070 122.1682 56.4885 32.4456 176.1474 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 I 8.02 3.86 1.53 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.95 0.34 0.00 0.00 2 R 8.14 4.06 0.00 1.76 1.80 0.00 3.34 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.61 0.00 3 F 8.32 4.55 0.00 3.10 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 4 G 9.15 4.36 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 0.00 5 M 7.95 4.34 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.54 0.00 6 G 8.13 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 7.84 4.10 0.00 1.70 1.87 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.61 1.49 7.81 8 V 7.32 4.50 2.39 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 1.36 0.00 0.00 0.97 0.00 0.00 9 P 0.00 5.06 0.00 2.16 2.08 0.00 3.89 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 10 C 8.80 4.63 0.00 2.86 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 11 P 0.00 4.44 0.00 2.18 2.09 0.00 3.56 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.88 0.00 12 D 8.71 4.20 0.00 2.63 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 8.02 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 E 8.68 4.39 0.00 1.97 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 2.30 2.28 0.00 15 V 8.93 3.50 1.92 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 0.74 0.00 0.00 0.47 0.00 0.00 16 G 8.40 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 17 Y 6.53 4.62 0.00 2.84 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 18 T 8.63 4.15 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 0.97 0.00 0.00 19 C 8.61 4.88 0.00 3.31 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 20 D 8.96 5.01 0.00 2.97 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 21 C 9.32 4.61 0.00 2.96 2.85 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 0.00 0.00 0.00 22 G 8.44 3.59 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 0.00 0.00 0.00 23 E 8.27 4.64 0.00 2.04 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 2.16 2.29 0.00 24 K 7.77 4.31 0.00 1.79 1.73 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.38 7.81 25 I 8.06 4.39 1.76 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.47 0.61 0.00 0.00 26 C 9.18 4.53 0.00 2.91 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 27 L 8.44 4.41 0.00 1.54 1.57 0.89 0.82 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 28 Y 8.11 4.07 0.00 2.94 2.90 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 29 G 9.72 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 30 Q 7.58 4.86 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 31 S 8.99 5.79 0.00 3.86 3.96 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 32 C 8.79 5.20 0.00 3.16 3.17 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 0.00 0.00 0.00 33 N 8.76 4.98 0.00 2.82 2.77 0.00 0.00 6.54 7.88 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 34 D 8.23 4.16 0.00 2.75 1.98 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 35 G 8.63 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 36 Q 7.42 4.33 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.73 6.69 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 37 C 8.93 5.07 0.00 2.94 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 38 S 9.49 4.84 0.00 3.74 3.64 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 39 G 7.38 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 40 D 7.26 4.60 0.00 2.76 2.52 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 41 P 0.00 4.47 0.00 2.13 2.05 0.00 3.67 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 42 K 7.79 4.67 0.00 1.60 1.70 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.28 1.41 7.81 43 P 0.00 4.47 0.00 1.36 1.34 0.00 3.71 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.21 0.00 44 S 9.23 3.73 0.00 4.09 4.07 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 0.00 0.00 0.00 0.00 45 S 8.24 4.17 0.00 4.09 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 46 E 8.60 4.46 0.00 1.90 1.92 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 2.01 1.58 0.00 47 F 7.85 4.40 0.00 3.09 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 48 E 8.76 4.21 0.00 2.00 1.98 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 2.36 2.38 0.00 49 E 8.43 3.98 0.00 1.97 1.74 0.00 0.00 0.00 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 2.27 0.00 50 F 7.31 5.01 0.00 3.06 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 51 E 8.74 4.77 0.00 1.98 1.92 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 2.24 2.33 0.00 52 I 7.73 4.51 1.98 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.95 0.95 0.00 0.00 53 D 8.27 4.05 0.00 2.86 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.37 4.85 0.00 2.10 2.08 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 2.28 2.26 0.00 55 E 7.68 4.49 0.00 1.95 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 2.22 2.31 0.00 56 E 7.99 3.95 0.00 2.11 1.90 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 2.41 2.41 0.00 57 K 8.61 4.19 0.00 1.70 1.69 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.66 7.81