NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 G 4.4203 8.3016 109.1223 45.6010 0.0000 173.3184 6 K 4.2818 8.2600 119.9445 53.6381 34.2014 173.0491 7 E 4.3165 8.7501 118.0542 56.4099 32.1788 175.1449 8 L 5.3083 8.3508 119.4969 53.3660 44.9850 175.9277 9 V 4.9618 8.8197 113.9213 59.6975 36.5698 174.0102 10 L 5.1295 8.8613 124.8319 53.2569 44.3608 175.2763 11 A 4.4710 8.9017 128.9870 52.0503 18.7317 178.1209 12 L 3.8853 9.0966 123.8134 56.8307 42.4077 176.6481 13 Y 4.7776 7.4507 113.9563 56.2342 42.0762 173.9463 14 D 4.8657 8.5121 120.7996 55.0099 42.2229 176.2124 15 Y 4.5133 9.0651 122.5509 57.0698 42.0730 173.0432 16 Q 4.6424 8.0929 129.2625 54.3399 30.3076 175.0146 17 E 4.3850 8.8723 124.8941 57.2342 30.2543 177.7752 18 K 4.6343 9.4839 121.0200 56.2607 33.7568 175.8102 19 S 4.6578 7.5876 112.6204 56.0840 65.8150 173.0224 20 P 4.2394 0.0000 0.0000 65.9156 31.1361 177.8641 21 R 4.2997 7.8995 114.3766 56.9230 30.4820 175.8228 22 E 5.6979 8.2406 118.2316 54.7525 31.2490 175.7295 23 V 4.9027 8.1918 118.7493 59.5228 34.6677 174.9872 24 T 5.0515 8.6999 118.8613 63.1550 69.8593 173.8724 25 M 5.0421 9.2927 121.5615 53.8478 35.5960 173.7782 26 K 5.0920 8.9345 118.3938 53.9744 35.8035 176.0336 27 K 4.1708 9.2135 125.1469 58.4166 32.4847 176.9539 28 G 4.0390 8.8266 114.5962 45.2316 0.0000 173.7206 29 D 4.5481 8.0363 119.7073 54.6151 42.2011 175.6031 30 I 4.7861 8.3048 122.4377 59.8824 38.7457 174.9823 31 L 4.9737 9.0192 127.3077 53.1322 45.7046 175.7704 32 T 4.7236 8.2670 118.1915 62.1955 70.2182 174.0782 33 L 4.2838 8.9984 130.4300 55.3224 42.3262 177.1722 34 L 4.2892 9.0029 127.9285 57.0230 42.9281 177.4806 35 N 4.6454 7.7017 117.3765 52.3541 42.1023 174.9979 36 S 4.3411 8.2129 121.8981 57.8772 63.4245 175.4794 37 T 3.9796 8.3889 114.2197 64.8510 68.8015 174.1232 38 N 4.7921 8.1273 120.5040 52.1491 39.8728 174.7359 39 K 4.2506 8.8982 126.5031 59.0123 32.8102 176.8657 40 D 4.4641 8.7488 118.0083 54.4092 43.0764 176.7640 41 W 5.1292 8.4485 117.1873 54.6196 32.3350 174.9437 42 W 5.3978 9.0519 125.0636 54.9715 31.4130 175.1627 43 K 4.2097 8.9585 126.3430 55.7802 32.9843 176.0317 44 V 4.9882 8.9598 119.8665 59.5882 36.9612 173.8175 45 E 5.0048 8.9515 122.0533 54.5911 32.3464 174.4788 46 V 4.4609 9.2401 127.7136 60.7437 33.6479 175.7388 47 A 3.6751 8.8838 132.0990 53.8046 17.5596 177.1530 48 D 5.0142 8.8712 114.6337 56.5566 41.7357 175.1986 49 R 4.8614 8.3488 115.7440 54.1038 33.8849 175.1139 50 Q 5.0553 9.2056 119.8295 53.7720 33.0039 175.0477 51 G 3.9833 7.8176 107.5081 46.8429 0.0000 171.0379 52 F 5.4746 8.6575 118.5344 56.5304 41.1489 176.1250 53 V 4.9430 8.8861 114.0691 58.8095 36.7658 173.3030 54 P 3.2395 0.0000 0.0000 61.9548 31.4984 177.5301 55 A 2.8326 7.8200 126.5306 54.8322 18.1321 179.1072 56 A 3.9299 7.0437 115.8865 54.0055 18.8368 177.3450 57 Y 4.9458 7.5700 113.2254 58.0025 38.4213 175.4912 58 V 4.9325 7.2618 112.8730 59.1948 35.4826 174.6790 59 K 4.6881 8.8251 122.9005 54.2504 34.9279 175.6642 60 K 4.4288 9.0327 126.9220 57.0719 32.1141 177.2115 61 L 4.2134 8.8809 124.0249 56.4885 42.4734 177.0102 62 D 4.4969 7.9712 122.8427 54.3239 41.0294 176.1115 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 5 G 8.30 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.26 4.28 0.00 1.72 1.74 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.47 7.81 7 E 8.75 4.32 0.00 2.05 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 2.27 2.25 0.00 8 L 8.35 5.31 0.00 1.60 1.59 0.92 0.83 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 9 V 8.82 4.96 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.04 0.00 0.00 10 L 8.86 5.13 0.00 1.72 1.51 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.90 4.47 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 12 L 9.10 3.89 0.00 1.23 0.88 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 7.45 4.78 0.00 2.68 2.63 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 14 D 8.51 4.87 0.00 2.61 2.65 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 15 Y 9.07 4.51 0.00 3.32 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.09 4.64 0.00 2.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.64 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 17 E 8.87 4.38 0.00 2.18 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 2.32 2.34 0.00 18 K 9.48 4.63 0.00 1.95 1.90 0.00 1.58 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.39 7.81 19 S 7.59 4.66 0.00 3.88 3.85 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 20 P 0.00 4.24 0.00 2.05 2.18 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 21 R 7.90 4.30 0.00 1.79 2.12 0.00 3.33 0.00 0.00 3.37 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.54 0.00 22 E 8.24 5.70 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.06 0.00 23 V 8.19 4.90 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 1.04 0.00 0.00 1.00 0.00 0.00 24 T 8.70 5.05 4.30 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 1.30 0.00 0.00 25 M 9.29 5.04 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.76 0.00 26 K 8.93 5.09 0.00 1.88 1.73 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.51 7.81 27 K 9.21 4.17 0.00 1.66 1.73 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.30 7.81 28 G 8.83 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 29 D 8.04 4.55 0.00 2.76 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 30 I 8.30 4.79 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.85 0.92 0.00 0.00 31 L 9.02 4.97 0.00 1.58 1.75 0.99 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.27 4.72 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 33 L 9.00 4.28 0.00 1.68 1.57 0.70 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 34 L 9.00 4.29 0.00 1.45 1.62 0.85 0.92 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 35 N 7.70 4.65 0.00 2.69 2.61 0.00 0.00 6.73 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 36 S 8.21 4.34 0.00 2.72 2.63 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 37 T 8.39 3.98 4.28 0.00 0.00 0.00 0.00 0.00 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 38 N 8.13 4.79 0.00 2.88 3.30 0.00 0.00 6.92 6.68 0.00 0.00 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 K 8.90 4.25 0.00 1.82 1.88 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.48 7.81 40 D 8.75 4.46 0.00 2.85 2.40 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 41 W 8.45 5.13 0.00 3.12 3.32 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 0.00 0.00 0.00 0.00 42 W 9.05 5.40 0.00 3.25 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 43 K 8.96 4.21 0.00 0.95 1.38 0.00 1.28 0.00 0.00 1.46 0.00 0.00 2.70 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.03 0.34 7.81 44 V 8.96 4.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.05 0.00 0.00 45 E 8.95 5.00 0.00 1.99 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 2.32 2.34 0.00 46 V 9.24 4.46 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.99 0.00 0.00 47 A 8.88 3.68 1.03 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 0.00 0.00 48 D 8.87 5.01 0.00 2.60 2.63 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 49 R 8.35 4.86 0.00 1.91 1.79 0.00 3.15 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 50 Q 9.21 5.06 0.00 1.86 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.08 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 51 G 7.82 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 0.00 0.00 0.00 52 F 8.66 5.47 0.00 3.13 3.35 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 53 V 8.89 4.94 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 1.03 0.00 0.00 1.01 0.00 0.00 54 P 0.00 3.24 0.00 0.49 0.49 0.00 2.47 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.48 0.00 55 A 7.82 2.83 -0.18 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 0.00 0.00 56 A 7.04 3.93 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 7.57 4.95 0.00 2.99 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 58 V 7.26 4.93 2.20 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 0.74 0.00 0.00 1.13 0.00 0.00 59 K 8.83 4.69 0.00 1.77 1.62 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.41 7.81 60 K 9.03 4.43 0.00 1.76 1.87 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.52 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.45 1.69 7.81 61 L 8.88 4.21 0.00 1.60 1.73 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 62 D 7.97 4.50 0.00 2.65 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00