NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.0859 8.3144 120.1354 57.1070 33.0514 176.1804 2 K 3.8015 8.4713 124.8576 53.8900 31.8725 173.7543 3 K 4.4014 8.1418 117.5710 56.2279 33.5618 174.7516 4 C 4.8300 6.7633 112.5425 56.3284 44.9690 172.5118 5 I 4.3651 7.5913 119.8355 60.0004 38.2541 175.5448 6 A 4.1707 8.5802 127.4732 52.0722 18.5458 176.8740 7 K 4.2652 7.8061 119.9274 55.1008 31.8366 175.5391 8 D 4.4010 8.7475 125.7867 55.4286 39.6795 176.3253 9 Y 3.3239 8.4286 118.0128 59.0204 36.1136 171.3718 10 G 4.0438 7.7366 107.0692 44.6588 0.0000 174.0381 11 R 4.5186 8.7133 125.0056 56.9942 30.4833 174.5081 12 C 5.1938 8.4722 119.8250 54.4932 43.8025 173.0154 13 K 4.5894 8.2747 117.0695 55.4202 34.9011 177.4810 14 W 4.6202 8.6836 125.0737 58.7906 29.1439 176.8024 15 G 4.4358 8.0539 106.9807 44.8126 0.0000 172.5333 16 G 4.1364 7.6973 116.0353 45.1726 0.0000 176.9006 17 T 4.4805 8.7773 125.5443 61.4651 70.2276 171.5694 18 P 5.0635 0.0000 0.0000 62.5056 30.1004 180.1003 19 C 5.1003 8.7560 108.7704 55.3463 37.9347 172.8782 20 C 4.3844 8.0952 118.9381 57.6168 40.5298 176.0255 21 R 3.5965 7.8499 125.0270 59.0910 30.1992 176.7868 22 G 4.1579 7.5266 106.7863 45.7816 0.0000 174.2164 23 R 4.3145 8.0227 119.7865 55.0619 32.6211 175.7434 24 G 3.9440 8.4068 106.6616 44.6840 0.0000 172.0013 25 C 4.7429 9.0343 126.5643 57.0205 37.6981 171.9134 26 I 4.7218 8.6312 127.1427 59.8311 39.3863 175.0610 27 C 5.6021 9.1140 124.1756 55.8663 41.2905 173.8133 28 S 4.5723 8.0972 117.5538 59.3902 62.3987 175.3681 29 I 3.7875 8.1693 117.3235 62.0885 36.0309 173.1355 30 M 4.6424 7.3229 115.8141 54.3977 33.0484 176.5694 31 G 3.5880 8.2563 104.7875 46.0296 0.0000 173.2911 32 T 4.5172 6.8943 107.8462 59.5599 71.7730 172.9464 33 N 4.2027 8.6675 114.8479 54.2458 36.4712 175.3644 34 C 4.6259 7.9169 114.5065 57.1599 41.3505 172.9507 35 E 5.3389 8.8388 121.2334 55.2216 34.5792 173.6076 36 C 5.0121 8.9473 120.9247 56.3724 39.4836 172.7742 37 K 4.7500 8.3570 123.9014 53.8436 34.1827 174.9130 38 P 4.7010 0.0000 0.0000 61.5411 32.9416 175.8902 39 R 4.3241 8.0236 119.3641 56.0366 29.2813 175.8816 40 L 4.5553 7.6908 117.8818 55.2948 43.7769 175.9028 41 I 4.6065 7.2444 117.3285 59.4818 37.4165 174.5376 42 M 4.1631 7.9634 118.3940 56.3601 31.8703 176.7513 43 E 3.3960 8.7504 117.9545 57.8602 29.8394 176.1078 44 G 3.7664 8.3083 100.2015 45.0451 0.0000 176.3121 45 L 3.0292 7.0603 123.0242 55.7125 45.9756 176.5441 46 G 3.8973 7.3276 109.6237 47.7325 0.0000 177.7966 47 L 3.1449 7.7008 117.4429 55.5161 45.1022 173.8808 48 A 4.2497 6.9435 126.2466 52.3794 18.6683 177.7252 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 K 8.31 4.09 0.00 1.77 1.84 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.39 7.81 2 K 8.47 3.80 0.00 2.06 1.99 0.00 1.71 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.49 7.81 3 K 8.14 4.40 0.00 1.91 1.88 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.42 7.81 4 C 6.76 4.83 0.00 3.16 3.11 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 5 I 7.59 4.37 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.92 1.00 0.00 0.00 6 A 8.58 4.17 1.28 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 0.00 0.00 7 K 7.81 4.27 0.00 1.82 1.76 0.00 1.79 0.00 0.00 1.91 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.44 7.81 8 D 8.75 4.40 0.00 2.98 2.77 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 0.00 0.00 0.00 9 Y 8.43 3.32 0.00 3.10 3.13 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 10 G 7.74 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 11 R 8.71 4.52 0.00 1.72 1.96 0.00 3.16 0.00 0.00 3.27 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 12 C 8.47 5.19 0.00 3.16 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 4.59 0.00 1.68 1.69 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.71 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.35 1.29 7.81 14 W 8.68 4.62 0.00 3.41 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 15 G 8.05 4.44 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 0.00 0.00 0.00 16 G 7.70 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 17 T 8.78 4.48 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 1.26 0.00 0.00 18 P 0.00 5.06 0.00 2.19 1.27 0.00 3.73 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 2.00 2.00 0.00 19 C 8.76 5.10 0.00 2.99 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 C 8.10 4.38 0.00 3.05 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 21 R 7.85 3.60 0.00 1.78 2.01 0.00 3.23 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 22 G 7.53 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 23 R 8.02 4.31 0.00 1.70 2.09 0.00 3.16 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 24 G 8.41 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 25 C 9.03 4.74 0.00 3.09 3.22 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 0.00 26 I 8.63 4.72 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.75 0.93 0.00 0.00 27 C 9.11 5.60 0.00 2.97 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 28 S 8.10 4.57 0.00 3.83 3.86 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 0.00 0.00 0.00 29 I 8.17 3.79 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.72 0.94 0.00 0.00 30 M 7.32 4.64 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.44 0.00 31 G 8.26 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 32 T 6.89 4.52 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 1.15 0.00 0.00 33 N 8.67 4.20 0.00 2.81 2.91 0.00 0.00 6.92 7.67 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 34 C 7.92 4.63 0.00 2.87 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 35 E 8.84 5.34 0.00 1.81 1.71 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 2.33 2.30 0.00 36 C 8.95 5.01 0.00 2.88 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 37 K 8.36 4.75 0.00 1.54 1.53 0.00 1.52 0.00 0.00 1.53 0.00 0.00 2.70 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.30 0.69 7.81 38 P 0.00 4.70 0.00 2.12 2.13 0.00 3.86 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 39 R 8.02 4.32 0.00 1.79 1.93 0.00 3.21 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 40 L 7.69 4.56 0.00 1.67 1.70 0.94 1.06 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 41 I 7.24 4.61 1.92 0.00 0.00 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 1.52 0.84 0.94 0.00 0.00 42 M 7.96 4.16 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 43 E 8.75 3.40 0.00 2.03 1.88 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 2.22 2.28 0.00 44 G 8.31 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.06 3.03 0.00 1.71 1.94 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.33 3.90 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 0.00 0.00 0.00 47 L 7.70 3.14 0.00 1.69 1.60 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 48 A 6.94 4.25 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