NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 P 4.3976 0.0000 0.0000 62.2385 34.0210 176.2623 11 K 4.0363 7.5999 120.7320 55.1998 33.3134 175.7599 12 A 4.1708 9.0249 125.5407 52.0708 19.8941 177.4918 13 K 4.2502 8.1959 119.3817 55.8381 32.9794 178.2727 14 R 4.1433 8.2723 119.8772 55.5222 28.6791 175.1776 15 A 4.5824 8.1429 125.0843 50.6882 20.3676 177.0440 16 K 4.4369 8.5467 121.3143 56.6768 32.3935 177.2667 17 H 4.4742 8.0769 120.7304 57.9519 30.1912 174.0988 18 P 4.3206 0.0000 0.0000 61.7436 31.6503 173.9872 19 P 4.3953 0.0000 0.0000 63.6614 32.0010 175.4684 20 G 3.7182 8.4516 104.2336 47.2284 0.0000 175.0107 21 T 4.2649 7.7085 115.4352 60.3359 66.0779 172.9537 22 E 4.3147 8.1656 125.0779 55.4771 30.8102 177.7232 23 K 4.4628 8.1281 122.8238 54.0667 31.1062 173.8889 24 P 4.4472 0.0000 0.0000 62.3853 32.4959 178.5960 25 R 4.1544 8.4791 118.7589 57.9199 30.2459 178.1985 26 S 4.4006 7.9988 113.2030 59.8992 62.8751 175.2047 27 R 4.4473 7.6078 119.0760 56.6974 31.4867 177.4965 28 S 4.5432 7.6684 112.8799 59.9928 63.9603 175.9857 29 Q 3.9710 8.5804 123.0485 59.2234 28.8454 178.2596 30 S 4.2045 8.0787 114.6399 60.1279 63.2679 174.3477 31 E 4.5713 7.3134 119.7653 54.9763 30.7362 175.4201 32 Q 4.7277 8.0951 120.1109 53.0447 31.9734 173.5698 33 P 4.4228 0.0000 0.0000 61.9229 32.5120 175.4829 34 A 4.7581 9.0584 121.2687 50.9856 22.6707 175.4424 35 T 5.0386 8.5183 117.8547 61.7558 72.1877 173.2063 36 C 4.5459 8.9709 125.9104 57.9767 32.5079 172.5875 37 P 4.2840 0.0000 0.0000 64.1505 31.6145 176.9927 38 I 3.9272 7.4954 119.5729 63.2017 37.5218 176.4141 39 C 4.6790 7.7133 112.1176 57.3739 29.8023 173.5687 40 Y 4.2033 7.9809 113.4635 58.0287 35.4308 170.0388 41 A 4.1280 7.5127 120.8274 52.3792 19.6952 177.7119 42 V 4.5623 8.3701 121.7584 61.7200 32.6539 174.9003 43 I 4.4243 8.8943 130.0067 59.7967 39.1232 177.1745 44 R 3.8492 8.7999 126.5210 59.3603 30.1308 176.5673 45 Q 4.3039 7.8546 117.2262 55.1447 30.6220 177.2328 46 S 4.1787 8.5201 119.8168 61.4334 62.4968 177.0617 47 R 3.9090 7.9518 119.2412 59.3763 29.1598 178.5444 48 N 4.4204 7.9409 116.4731 55.4764 38.1997 177.1139 49 L 3.9704 7.5152 121.2612 58.2768 42.6104 178.8303 50 R 4.0652 7.6627 116.9549 59.3837 29.9911 179.0098 51 R 4.1504 7.9296 119.2512 59.1644 30.1389 177.8389 52 H 4.1928 8.4288 118.1223 58.9854 29.6780 177.2367 53 L 4.1938 7.8181 120.5741 58.1146 41.0839 179.4371 54 E 3.7801 8.2098 117.5361 58.8830 29.1850 179.1435 55 L 4.1001 7.6604 118.8812 57.1061 41.9369 178.9638 56 R 4.5051 7.4081 114.9850 56.6376 31.0214 176.4673 57 H 4.8061 7.8088 115.4842 56.9789 36.1907 174.1144 58 F 4.5660 9.6403 116.2721 58.0888 38.9932 177.3628 59 A 4.8215 7.6029 120.9416 52.5946 18.0999 178.9267 60 K 4.3883 7.3978 116.1714 54.4507 33.6048 175.1112 61 P 4.2402 0.0000 0.0000 63.4882 31.5796 177.4651 62 G 3.9320 8.6890 109.6603 46.3209 0.0000 173.7799 63 V 3.9130 7.2427 123.8467 62.8317 31.4654 175.2428 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 10 P 0.00 4.40 0.00 2.06 2.05 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 11 K 7.60 4.04 0.00 1.83 1.73 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.50 7.81 12 A 9.02 4.17 1.24 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 13 K 8.20 4.25 0.00 1.76 1.76 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 8.27 4.14 0.00 1.80 1.91 0.00 3.19 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 15 A 8.14 4.58 1.25 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 0.00 0.00 0.00 0.00 0.00 16 K 8.55 4.44 0.00 1.77 1.85 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.42 7.81 17 H 8.08 4.47 0.00 3.09 3.34 0.00 5.77 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.32 0.00 2.07 1.98 0.00 3.77 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 19 P 0.00 4.40 0.00 2.16 2.03 0.00 3.82 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 1.97 1.94 0.00 20 G 8.45 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.71 4.26 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 1.21 0.00 0.00 22 E 8.17 4.31 0.00 2.00 1.86 0.00 0.00 0.00 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 2.32 0.00 23 K 8.13 4.46 0.00 1.72 1.75 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.39 7.81 24 P 0.00 4.45 0.00 2.21 2.17 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 25 R 8.48 4.15 0.00 1.90 2.00 0.00 3.13 0.00 0.00 3.34 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 26 S 8.00 4.40 0.00 3.86 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 27 R 7.61 4.45 0.00 1.76 1.96 0.00 3.31 0.00 0.00 3.27 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 28 S 7.67 4.54 0.00 4.03 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.58 3.97 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.02 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 30 S 8.08 4.20 0.00 3.88 3.92 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 31 E 7.31 4.57 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 32 Q 8.10 4.73 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.85 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 33 P 0.00 4.42 0.00 2.04 2.03 0.00 3.71 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 34 A 9.06 4.76 1.19 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 0.00 0.00 0.00 35 T 8.52 5.04 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 36 C 8.97 4.55 0.00 2.88 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 37 P 0.00 4.28 0.00 2.13 2.09 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 38 I 7.50 3.93 1.54 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.47 0.72 0.00 0.00 39 C 7.71 4.68 0.00 3.14 3.20 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 0.00 40 Y 7.98 4.20 0.00 3.21 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 41 A 7.51 4.13 1.17 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 0.00 0.00 42 V 8.37 4.56 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 0.80 0.00 0.00 1.00 0.00 0.00 43 I 8.89 4.42 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.86 0.94 0.00 0.00 44 R 8.80 3.85 0.00 1.88 1.97 0.00 3.12 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 45 Q 7.85 4.30 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 46 S 8.52 4.18 0.00 4.08 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 47 R 7.95 3.91 0.00 2.06 2.23 0.00 3.05 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 48 N 7.94 4.42 0.00 2.95 2.93 0.00 0.00 6.61 6.71 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 49 L 7.52 3.97 0.00 1.66 1.88 0.93 1.00 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 50 R 7.66 4.07 0.00 2.08 1.95 0.00 3.17 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 51 R 7.93 4.15 0.00 1.89 2.09 0.00 3.23 0.00 0.00 3.23 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 52 H 8.43 4.19 0.00 3.33 3.55 0.00 5.84 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.82 4.19 0.00 1.96 1.89 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.21 3.78 0.00 2.08 2.03 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 2.41 2.50 0.00 55 L 7.66 4.10 0.00 1.71 1.68 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 56 R 7.41 4.51 0.00 1.33 1.69 0.00 3.26 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.73 0.00 57 H 7.81 4.81 0.00 3.40 2.87 0.00 5.61 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 9.64 4.57 0.00 3.15 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 59 A 7.60 4.82 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 60 K 7.40 4.39 0.00 1.72 1.74 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.36 7.81 61 P 0.00 4.24 0.00 2.18 2.01 0.00 3.59 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 62 G 8.69 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 63 V 7.24 3.91 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 0.73 0.00 0.00 0.94 0.00 0.00