NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3120 8.1631 117.3743 63.1382 69.7807 173.6035 2 G 3.5581 8.5027 115.7799 44.8044 0.0000 171.9681 3 A 4.2431 8.6275 123.8793 53.8901 21.0998 177.1536 4 G 4.3796 7.4918 111.7712 44.8729 0.0000 175.8972 5 T 3.8798 9.0304 120.9509 66.1531 68.3008 173.9088 6 P 4.2868 0.0000 0.0000 66.0317 30.9490 177.8661 7 S 4.4438 7.8262 112.0683 59.7797 63.0733 175.6343 8 Q 4.3154 8.1975 121.4768 57.7560 28.4304 178.1623 9 G 3.6560 7.5502 107.1467 48.0921 0.0000 174.6886 10 K 4.1196 7.9222 116.9050 57.1993 32.2993 177.5181 11 K 4.3375 7.5760 119.7935 55.4748 30.6022 175.7288 12 N 5.0467 8.2466 118.9586 52.5110 38.4514 174.8335 13 T 4.3103 7.8996 114.5930 63.5857 69.6477 174.1363 14 T 4.4776 8.3029 121.7333 62.2922 69.3927 172.6859 15 T 4.2839 7.5455 115.0483 63.1074 71.3679 172.9112 16 H 4.9141 7.9489 119.7189 55.0141 30.0162 174.4715 17 T 4.8297 9.4551 113.4414 59.0256 72.9934 172.9850 18 K 4.3540 8.7109 123.1024 57.1797 32.7188 175.5260 19 C 4.2667 9.2938 128.7127 58.8098 32.3235 174.4053 20 R 3.6803 8.3269 126.3507 59.4289 30.1186 177.7979 21 R 3.6250 7.2324 116.6840 58.8595 30.1038 176.6476 22 C 4.3415 7.9371 109.3181 57.6417 30.8268 174.6369 23 G 3.9134 8.0827 108.3899 45.0657 0.0000 173.2446 24 E 4.3093 7.6540 119.1125 54.9028 31.2628 176.3940 25 K 4.5821 8.1740 124.7223 55.8976 29.7458 176.5430 26 S 4.7720 7.8060 113.6028 57.9876 66.7681 174.1031 27 Y 4.6389 9.0321 123.8852 57.0727 39.4716 174.3457 28 H 4.4143 8.9807 129.0830 56.0266 29.8990 175.6129 29 T 3.5047 9.0492 122.2919 63.9814 66.9526 175.0351 30 K 4.2706 8.0488 119.1536 58.4569 33.0126 177.6838 31 K 4.0993 8.0188 116.0873 56.0273 32.5575 176.4659 32 K 3.1959 8.6155 118.9161 57.0829 30.0039 175.2555 33 V 4.6398 6.8352 116.2679 61.0786 34.8972 173.2116 34 C 5.0073 9.2890 128.2105 58.7202 32.0201 174.3495 35 S 4.4287 8.9825 122.1713 60.1348 63.3945 175.2570 36 S 4.4730 8.2991 115.3579 60.1373 62.8209 174.1954 37 C 4.5724 8.2107 112.1525 57.4227 30.6029 175.0574 38 G 3.9872 8.3403 109.3528 45.0752 0.0000 173.3062 39 F 4.5071 8.1309 122.4346 60.1673 39.5997 175.5823 40 G 3.8154 8.7581 115.4848 46.0180 0.0000 173.5991 41 K 4.3801 8.3296 119.3379 57.2130 33.6460 176.3227 42 S 4.6983 7.6586 109.9358 56.1185 66.0208 173.7008 43 A 4.1602 8.7105 125.5851 55.1909 18.4616 178.7747 44 K 4.2371 7.7089 113.3727 56.1779 32.8453 176.7600 45 R 4.3254 8.2107 120.6832 55.6970 30.8826 176.5636 46 R 3.8488 8.6230 125.2448 56.9211 30.3871 175.1789 47 D 4.5352 7.7034 124.2604 53.4720 44.7531 173.7875 48 Y 4.5089 8.1213 119.5231 56.5060 41.9367 176.2701 49 E 4.0244 8.6951 122.9805 58.6293 29.8392 178.4170 50 W 4.6773 7.6016 113.7293 57.3047 28.4301 176.6518 51 Q 4.4193 7.5865 117.4279 56.9335 28.2879 175.3731 52 S 4.7179 7.5174 110.5639 56.2302 66.4915 174.0101 53 K 4.0486 8.5513 119.9298 56.3728 32.4938 177.8279 54 A 4.0071 8.9921 126.3887 55.5698 18.1433 179.1133 55 G 4.1005 7.9525 101.4821 45.2915 0.0000 173.2808 56 E 4.1776 8.2387 126.6541 56.1714 29.9138 174.6775 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 T 8.16 4.31 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 2 G 8.50 3.56 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 0.00 0.00 0.00 3 A 8.63 4.24 1.29 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 0.00 0.00 0.00 4 G 7.49 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.03 3.88 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 1.21 0.00 0.00 6 P 0.00 4.29 0.00 2.26 2.31 0.00 3.58 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 2.23 2.06 0.00 7 S 7.83 4.44 0.00 4.11 3.95 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 0.00 0.00 0.00 8 Q 8.20 4.32 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 9 G 7.55 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.92 4.12 0.00 1.76 1.87 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 11 K 7.58 4.34 0.00 1.82 1.79 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.37 7.81 12 N 8.25 5.05 0.00 2.76 2.81 0.00 0.00 6.29 7.71 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 13 T 7.90 4.31 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 14 T 8.30 4.48 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 15 T 7.55 4.28 3.64 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 1.12 0.00 0.00 16 H 7.95 4.91 0.00 3.10 3.50 0.00 5.64 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 17 T 9.46 4.83 4.33 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 18 K 8.71 4.35 0.00 1.81 1.79 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.59 7.81 19 C 9.29 4.27 0.00 3.14 2.86 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 20 R 8.33 3.68 0.00 1.55 1.44 0.00 3.22 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 21 R 7.23 3.63 0.00 0.67 1.44 0.00 3.26 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.35 0.00 22 C 7.94 4.34 0.00 3.08 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.08 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 0.00 0.00 0.00 24 E 7.65 4.31 0.00 1.95 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 2.38 2.27 0.00 25 K 8.17 4.58 0.00 1.80 1.78 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.52 7.81 26 S 7.81 4.77 0.00 3.86 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 27 Y 9.03 4.64 0.00 3.11 3.10 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 28 H 8.98 4.41 0.00 3.21 3.08 0.00 5.84 0.00 0.00 0.00 0.00 6.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 9.05 3.50 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 1.18 0.00 0.00 30 K 8.05 4.27 0.00 1.87 1.85 0.00 1.80 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.40 7.81 31 K 8.02 4.10 0.00 1.57 1.74 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.35 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.22 1.03 7.81 32 K 8.62 3.20 0.00 1.76 1.88 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.50 7.81 33 V 6.84 4.64 2.01 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 1.12 0.00 0.00 0.94 0.00 0.00 34 C 9.29 5.01 0.00 3.40 3.18 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 35 S 8.98 4.43 0.00 4.08 4.07 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 4.47 0.00 3.90 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 37 C 8.21 4.57 0.00 3.14 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 38 G 8.34 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 F 8.13 4.51 0.00 3.02 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 40 G 8.76 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 41 K 8.33 4.38 0.00 1.68 2.01 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.36 7.81 42 S 7.66 4.70 0.00 3.96 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 43 A 8.71 4.16 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 44 K 7.71 4.24 0.00 1.74 1.72 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 45 R 8.21 4.33 0.00 1.65 1.82 0.00 3.37 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 46 R 8.62 3.85 0.00 1.91 1.97 0.00 3.43 0.00 0.00 3.44 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 47 D 7.70 4.54 0.00 2.58 2.15 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 48 Y 8.12 4.51 0.00 1.48 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.70 4.02 0.00 2.04 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 2.38 2.25 0.00 50 W 7.60 4.68 0.00 3.45 3.19 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 51 Q 7.59 4.42 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.71 0.00 0.00 0.00 0.00 0.00 2.07 1.62 0.00 52 S 7.52 4.72 0.00 3.98 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 8.55 4.05 0.00 1.83 1.80 0.00 1.74 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 8.99 4.01 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 55 G 7.95 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 56 E 8.24 4.18 0.00 1.90 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 2.22 2.25 0.00