NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.3653 8.1233 123.5839 51.6937 18.5061 177.2949 5 L 3.7602 8.4535 123.1924 58.2717 41.6037 177.8514 6 L 4.4604 8.7469 119.7452 57.8919 41.9409 179.4745 7 R 3.9814 7.9064 117.2944 59.3895 30.2178 178.8269 8 Q 3.9897 8.7907 118.3656 58.9019 28.6827 178.7402 9 A 3.6461 9.2494 121.7771 55.5721 18.4014 178.5683 10 Y 4.0811 8.2521 118.0052 61.0187 38.6262 178.0179 11 S 4.0004 8.9429 114.4781 61.1047 62.5911 175.5836 12 A 4.4954 8.2159 120.8621 51.8017 19.7970 176.6615 13 L 4.4332 8.0641 115.4357 56.4691 43.8114 179.0933 14 F 5.0029 7.4215 114.8016 60.2167 39.1887 177.0471 15 R 3.6059 7.3954 120.7912 59.0183 30.2220 177.2048 16 R 4.1035 7.6899 118.5265 56.0016 31.1254 177.3181 17 T 3.8759 8.7916 122.0150 66.8841 68.2944 176.3790 18 S 4.1545 8.0227 115.7894 61.7769 63.3736 176.4171 19 T 3.8320 7.9892 114.0457 63.8832 68.2102 175.7682 20 F 4.2083 8.7740 124.5845 60.5986 39.5420 176.6398 21 A 4.1391 8.1314 119.9017 55.5335 18.1581 179.4993 22 L 3.9635 8.1841 117.3476 58.4183 41.6992 179.9930 23 T 3.8309 8.0735 115.7590 66.5101 68.2211 176.9028 24 V 3.4594 7.6823 120.2378 65.7428 31.6061 178.1670 25 V 3.5366 7.8125 117.9597 65.9447 31.4231 177.4992 26 L 4.0240 8.2824 120.4606 58.6760 41.8438 178.5509 27 G 3.6764 8.6228 105.1566 47.7639 0.0000 174.9454 28 A 4.0848 8.4791 122.9552 54.6885 18.4306 179.4796 29 V 3.6358 7.7312 116.0034 66.6449 31.5125 178.3613 30 L 4.0361 8.0487 118.1884 57.6029 41.4224 179.1823 31 F 4.1375 8.9890 121.0878 61.8860 39.3446 175.9829 32 E 3.8975 9.9009 118.3996 59.5592 29.1428 178.6999 33 R 3.8080 8.0988 116.8531 59.6819 30.4695 178.4106 34 A 3.9195 8.0080 119.7921 55.5449 18.4238 179.1011 35 F 3.7670 8.4883 118.9078 61.4842 39.3823 176.7409 36 D 4.2528 8.6287 118.4352 57.8215 40.7260 179.0119 37 Q 4.0081 8.2457 118.2809 59.0542 28.7356 179.0681 38 G 3.6519 8.1078 106.1043 47.8507 0.0000 175.1659 39 A 3.7104 7.9728 123.1440 55.0003 18.3564 179.2007 40 D 4.3133 7.9508 116.8083 57.5518 40.8779 178.8208 41 A 3.9886 8.2840 121.3640 55.6095 18.3620 179.6306 42 I 3.6173 8.1248 118.2013 64.4983 36.9501 178.3929 43 F 4.0919 8.3447 120.5168 61.5251 39.6775 176.5579 44 E 4.0743 8.8259 118.5744 59.7110 29.0267 179.1171 45 H 4.0892 8.2671 117.5066 59.2706 30.1629 177.1754 46 L 4.1569 7.7899 118.4068 56.2114 41.9811 176.8123 47 N 4.9793 7.6136 116.6891 52.1992 39.4597 174.4262 48 E 3.7628 8.1384 117.0851 57.6679 30.2200 178.3384 49 G 3.9251 8.2236 109.4662 46.0962 0.0000 174.1497 50 K 4.3485 7.7483 118.1553 56.9000 33.3683 177.0565 51 L 4.4493 7.5765 118.6532 53.3846 42.6860 177.5392 52 W 4.2107 8.7580 130.3608 59.8843 30.2859 178.3304 53 K 3.8520 7.9221 118.7542 59.9693 31.7998 177.9590 54 H 4.3753 7.7317 115.0322 58.9019 28.9457 177.6853 55 I 3.5991 7.9643 121.0667 65.8937 37.0798 179.9355 56 K 2.9372 7.2542 117.2381 56.4356 34.3315 176.3531 57 H 4.0121 7.7273 117.2595 58.6626 28.5687 176.7497 58 K 3.9046 7.5615 118.2882 58.4243 31.7582 177.0684 59 Y 5.3737 7.6713 112.3061 56.0029 40.0530 175.2482 60 E 4.2127 8.3683 120.0373 55.7155 28.4448 175.1387 61 A 3.8236 8.4304 130.5609 53.2425 16.3027 177.8281 62 S 4.6031 8.2892 114.6590 59.9381 64.4037 173.7581 63 E 4.6525 7.4438 118.1644 55.2018 32.9971 175.4382 64 E 4.1265 8.8475 120.0121 57.0784 29.5123 174.4709 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 4 A 8.12 4.37 1.32 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 0.00 0.00 5 L 8.45 3.76 0.00 1.81 1.75 0.94 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.75 4.46 0.00 1.72 1.78 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 7 R 7.91 3.98 0.00 2.04 2.01 0.00 3.14 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 8 Q 8.79 3.99 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 9 A 9.25 3.65 1.18 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 10 Y 8.25 4.08 0.00 3.29 3.25 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 11 S 8.94 4.00 0.00 4.05 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 12 A 8.22 4.50 1.22 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 0.00 0.00 13 L 8.06 4.43 0.00 0.80 1.40 0.60 1.12 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 14 F 7.42 5.00 0.00 3.11 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 15 R 7.40 3.61 0.00 0.99 1.63 0.00 3.18 0.00 0.00 3.10 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.47 0.00 16 R 7.69 4.10 0.00 1.87 1.86 0.00 3.18 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 17 T 8.79 3.88 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 1.18 0.00 0.00 18 S 8.02 4.15 0.00 4.07 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 19 T 7.99 3.83 4.31 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 1.20 0.00 0.00 20 F 8.77 4.21 0.00 3.36 3.30 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 0.00 21 A 8.13 4.14 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.18 3.96 0.00 1.83 1.74 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.07 3.83 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 24 V 7.68 3.46 2.19 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 1.03 0.00 0.00 0.68 0.00 0.00 25 V 7.81 3.54 2.24 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 0.94 0.00 0.00 1.00 0.00 0.00 26 L 8.28 4.02 0.00 1.88 1.80 0.93 0.94 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 27 G 8.62 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.48 4.08 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.73 3.64 2.35 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 1.04 0.00 0.00 1.00 0.00 0.00 30 L 8.05 4.04 0.00 1.82 1.74 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.99 4.14 0.00 3.09 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 32 E 9.90 3.90 0.00 2.30 2.06 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 2.52 2.44 0.00 33 R 8.10 3.81 0.00 1.98 1.99 0.00 3.20 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 34 A 8.01 3.92 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 35 F 8.49 3.77 0.00 1.94 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 D 8.63 4.25 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 37 Q 8.25 4.01 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 38 G 8.11 3.65 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 0.00 0.00 0.00 39 A 7.97 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 D 7.95 4.31 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 41 A 8.28 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.12 3.62 2.02 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.00 0.93 0.00 0.00 43 F 8.34 4.09 0.00 2.93 3.25 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 44 E 8.83 4.07 0.00 2.07 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 2.49 2.63 0.00 45 H 8.27 4.09 0.00 3.17 3.52 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.79 4.16 0.00 1.62 1.62 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 47 N 7.61 4.98 0.00 2.44 2.56 0.00 0.00 6.85 7.96 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 48 E 8.14 3.76 0.00 1.84 1.76 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 2.37 2.12 0.00 49 G 8.22 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 50 K 7.75 4.35 0.00 1.84 1.88 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.55 7.81 51 L 7.58 4.45 0.00 1.33 1.54 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.76 4.21 0.00 3.45 3.12 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 0.00 0.00 0.00 0.00 53 K 7.92 3.85 0.00 1.78 1.65 0.00 1.85 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.55 7.81 54 H 7.73 4.38 0.00 3.23 3.26 0.00 5.73 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.96 3.60 1.63 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 1.70 0.95 1.05 0.00 0.00 56 K 7.25 2.94 0.00 1.27 1.46 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.26 1.44 7.81 57 H 7.73 4.01 0.00 3.16 3.41 0.00 5.78 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.56 3.90 0.00 0.79 1.07 0.00 1.50 0.00 0.00 1.52 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.24 7.81 59 Y 7.67 5.37 0.00 3.06 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 60 E 8.37 4.21 0.00 2.13 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 2.36 2.45 0.00 61 A 8.43 3.82 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.29 4.60 0.00 4.00 3.87 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 0.00 0.00 0.00 63 E 7.44 4.65 0.00 2.05 1.78 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 2.26 2.28 0.00 64 E 8.85 4.13 0.00 2.15 1.97 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 2.22 2.31 0.00