NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.5414 8.0433 122.7556 54.9912 43.8971 175.1865 2 E 5.0250 9.1804 124.8420 54.4570 32.7846 173.0478 3 C 5.2480 9.7670 120.4606 55.1928 43.8278 173.2740 4 H 5.1156 9.1710 119.0808 56.2134 29.4828 175.5922 5 N 5.8737 9.0687 115.9666 51.3513 38.9150 174.6076 6 Q 4.2475 8.0899 117.2194 56.0885 30.0160 175.3943 7 Q 4.4839 8.3508 117.9398 55.9299 30.8322 176.7287 8 S 3.4933 8.1436 114.8898 59.7992 62.1177 173.0565 9 S 4.6780 8.4434 114.0315 58.1282 63.2493 174.5747 10 Q 4.1948 7.6242 119.6976 56.2866 29.0295 176.4472 11 T 3.9053 8.2088 116.3067 63.1423 68.9476 172.8900 12 P 4.4128 0.0000 0.0000 63.1506 32.1079 175.5236 13 T 4.8795 8.5665 110.9803 60.3901 72.6992 172.6544 14 T 5.2669 8.3684 117.0562 62.2327 72.6818 173.3325 15 T 4.6586 8.9925 118.6095 60.1846 71.3659 172.6934 16 G 4.1861 8.5808 113.9696 45.6567 0.0000 174.4495 17 C 4.9404 8.9423 123.6630 55.7712 36.4040 173.8005 18 S 4.3869 8.6574 114.7390 58.2164 63.1026 175.7122 19 G 3.6192 8.7215 110.6613 48.4740 0.0000 174.8673 20 G 3.8203 7.8834 106.1080 45.6992 0.0000 173.5329 21 E 4.0949 8.0809 122.4645 56.4634 30.1489 176.9918 22 T 4.5842 8.5251 113.3407 61.2705 70.7600 172.9889 23 N 5.4449 8.7241 119.8348 51.7842 42.6884 172.7519 24 C 5.6129 9.2374 118.6662 55.5734 40.9971 172.4938 25 Y 5.5063 8.7030 118.0936 55.4763 41.9031 173.7643 26 K 4.9995 9.1579 120.8747 54.5821 35.8817 174.6763 27 K 5.3324 9.6892 128.3591 54.8363 35.3812 174.8664 28 R 5.4093 9.4868 126.0142 54.4326 34.1849 174.3933 29 W 5.6221 8.5837 118.1639 55.5053 32.3131 173.4674 30 R 4.5076 8.7397 119.3887 55.4444 31.0227 177.0150 31 D 4.4224 9.0427 122.6418 54.0548 41.8111 174.4389 32 H 3.9154 8.5100 118.9177 56.1405 28.8270 175.6703 33 R 3.9288 8.3128 119.0872 56.2437 29.7429 176.5722 34 G 4.0772 8.1324 106.9686 44.7127 0.0000 171.5118 35 Y 5.0183 8.1991 114.9805 56.0862 41.8135 175.6650 36 R 4.4172 8.3851 120.1018 54.5047 34.1415 174.7139 37 T 4.9770 8.0136 118.0079 61.6543 72.4218 172.4283 38 E 5.1368 9.5852 126.4664 54.5408 33.3927 174.7072 39 R 4.5990 8.1294 122.6555 54.6649 34.8831 175.1335 40 G 4.0966 6.6791 106.2770 46.6431 0.0000 171.5220 41 C 4.8296 8.9683 117.7018 57.3969 41.2473 172.3511 42 G 3.7495 9.0891 108.8421 45.0138 0.0000 173.7424 43 C 4.8590 8.0682 116.0793 54.4368 44.3948 171.1552 44 P 4.3691 0.0000 0.0000 61.6565 31.7824 177.5521 45 S 4.2639 8.3370 115.9175 57.7837 63.6346 174.4726 46 V 3.7563 8.0984 121.9891 62.2214 31.6119 175.1306 47 K 4.5246 8.0948 119.2092 55.0857 35.4808 174.5784 48 N 4.3120 8.5648 118.0659 55.5877 38.8025 174.7520 49 G 4.1449 9.7841 114.0422 45.0233 0.0000 172.8777 50 I 5.0235 7.3211 118.7281 59.6516 41.5388 174.4056 51 E 4.7433 9.3740 125.2002 54.7667 31.5207 174.8631 52 I 5.1054 8.4738 124.0684 59.2363 41.2461 173.9523 53 N 5.2417 9.3852 125.6800 51.8044 41.5461 172.9907 54 C 5.7937 8.6497 118.8251 55.8871 43.1425 171.7173 55 C 4.9195 8.8460 115.1426 54.9831 45.2299 174.0886 56 T 5.0099 8.6787 105.4734 60.1068 69.2247 173.3308 57 T 4.7170 7.4840 110.9803 59.6113 71.9315 172.7438 58 D 4.6829 8.6039 122.0838 56.1145 41.1114 176.7123 59 R 3.6623 8.6507 122.2982 57.2441 28.1727 175.2296 60 C 4.4159 7.9276 113.6113 57.3452 42.6492 173.5995 61 N 4.6188 7.7166 119.8202 52.0043 36.4535 174.7017 62 N 4.5334 7.8558 119.0578 54.4712 38.5882 175.6935 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 L 8.04 4.54 0.00 1.80 1.61 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 2 E 9.18 5.02 0.00 1.95 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.39 0.00 3 C 9.77 5.25 0.00 2.77 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 4 H 9.17 5.12 0.00 3.17 3.34 0.00 5.56 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 N 9.07 5.87 0.00 2.66 2.81 0.00 0.00 6.97 6.87 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 6 Q 8.09 4.25 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.94 0.00 0.00 0.00 0.00 0.00 2.27 2.54 0.00 7 Q 8.35 4.48 0.00 2.28 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 5.94 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 8 S 8.14 3.49 0.00 3.92 3.67 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 9 S 8.44 4.68 0.00 3.98 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 10 Q 7.62 4.19 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.98 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 11 T 8.21 3.91 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 12 P 0.00 4.41 0.00 1.91 1.50 0.00 3.57 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 1.95 1.95 0.00 13 T 8.57 4.88 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 1.20 0.00 0.00 14 T 8.37 5.27 4.26 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 1.25 0.00 0.00 15 T 8.99 4.66 4.25 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 1.27 0.00 0.00 16 G 8.58 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 0.00 0.00 0.00 0.00 17 C 8.94 4.94 0.00 2.93 3.06 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 0.00 0.00 0.00 18 S 8.66 4.39 0.00 4.01 4.01 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 19 G 8.72 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.08 4.09 0.00 2.12 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 2.34 2.44 0.00 22 T 8.53 4.58 4.25 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 1.22 0.00 0.00 23 N 8.72 5.44 0.00 2.74 2.81 0.00 0.00 6.69 7.93 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 24 C 9.24 5.61 0.00 2.82 2.92 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 25 Y 8.70 5.51 0.00 3.17 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 26 K 9.16 5.00 0.00 1.81 1.68 0.00 1.55 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.36 7.81 27 K 9.69 5.33 0.00 2.18 2.05 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.75 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.66 1.53 7.81 28 R 9.49 5.41 0.00 1.80 1.80 0.00 3.13 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 29 W 8.58 5.62 0.00 3.40 3.28 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 0.00 30 R 8.74 4.51 0.00 1.75 1.77 0.00 3.19 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 31 D 9.04 4.42 0.00 2.72 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.51 3.92 0.00 3.21 3.34 0.00 5.80 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.31 3.93 0.00 1.73 1.93 0.00 3.10 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 34 G 8.13 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.20 5.02 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.39 4.42 0.00 0.67 1.07 0.00 3.12 0.00 0.00 3.38 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.00 0.00 37 T 8.01 4.98 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 1.23 0.00 0.00 38 E 9.59 5.14 0.00 2.40 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 0.00 2.41 2.43 0.00 39 R 8.13 4.60 0.00 1.75 1.73 0.00 3.34 0.00 0.00 3.42 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 40 G 6.68 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 0.00 0.00 0.00 41 C 8.97 4.83 0.00 3.05 3.08 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 0.00 0.00 0.00 42 G 9.09 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 43 C 8.07 4.86 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 44 P 0.00 4.37 0.00 2.02 1.82 0.00 3.39 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.21 0.00 45 S 8.34 4.26 0.00 3.98 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 46 V 8.10 3.76 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 0.77 0.00 0.00 0.95 0.00 0.00 47 K 8.09 4.52 0.00 1.88 1.88 0.00 1.47 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.39 7.81 48 N 8.56 4.31 0.00 2.68 2.79 0.00 0.00 7.26 7.98 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 49 G 9.78 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 50 I 7.32 5.02 1.90 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.74 1.05 0.00 0.00 51 E 9.37 4.74 0.00 1.97 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 2.30 2.32 0.00 52 I 8.47 5.11 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.83 0.94 0.00 0.00 53 N 9.39 5.24 0.00 2.67 2.70 0.00 0.00 6.65 7.25 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 54 C 8.65 5.79 0.00 2.83 2.98 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 55 C 8.85 4.92 0.00 2.99 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 56 T 8.68 5.01 4.32 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 1.28 0.00 0.00 57 T 7.48 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 1.21 0.00 0.00 58 D 8.60 4.68 0.00 2.67 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 59 R 8.65 3.66 0.00 1.82 1.69 0.00 3.12 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.43 0.00 60 C 7.93 4.42 0.00 3.08 3.24 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 61 N 7.72 4.62 0.00 2.88 2.89 0.00 0.00 6.08 8.04 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 62 N 7.86 4.53 0.00 2.74 2.78 0.00 0.00 7.06 7.56 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