NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2978 8.3044 120.3496 54.4534 33.3750 174.2543 2 K 3.5467 8.6259 122.3842 56.5634 32.3990 174.8219 3 R 4.3649 8.3823 125.9878 55.5764 31.9274 177.1543 4 T 4.0752 8.5041 109.4876 62.9215 68.7291 173.7172 5 F 5.0563 8.0656 124.3760 56.8851 40.7005 174.5759 6 Q 4.1940 8.4038 127.3974 52.4028 29.6924 172.8714 7 P 3.9442 0.0000 0.0000 63.2796 31.7157 177.8978 8 S 4.3585 8.1647 113.7647 56.5820 64.0100 176.1336 9 V 3.6001 8.1412 129.4179 65.0336 31.0454 177.5816 10 L 3.8949 7.9372 119.5655 57.5470 42.0671 178.4723 11 K 4.1038 7.9369 118.6041 59.4048 32.2853 178.2810 12 R 3.8780 8.3450 119.3931 59.8695 29.7929 177.6876 13 N 4.4015 8.5596 116.7424 56.5008 38.8770 176.7998 14 R 4.0921 8.0247 118.4085 58.1345 30.1724 176.8945 15 S 4.7770 7.7439 111.9214 58.7262 63.9787 174.4014 16 H 4.7326 7.8665 110.4439 56.1307 32.7425 174.0349 17 G 3.8952 8.3956 110.3434 44.8192 0.0000 174.6027 18 F 4.1230 8.9025 120.9452 61.2560 39.4184 177.1875 19 R 3.6749 8.2499 116.7677 59.6147 29.7808 178.7290 20 A 3.9977 7.8400 117.9256 54.8190 18.4601 179.1235 21 R 3.9243 7.7468 117.1910 59.5006 30.2829 177.9015 22 M 4.0237 7.9770 116.7892 56.8214 33.5446 177.2545 23 A 4.4927 7.3292 122.0671 47.6272 15.7941 175.4808 24 T 4.6184 6.9447 126.8097 60.5605 69.9636 172.5507 25 K 4.2437 8.4271 129.1249 57.5291 32.3023 176.5020 26 N 4.8342 8.0171 115.3126 54.8112 40.5069 176.0957 27 G 3.7730 7.5021 106.3046 47.2062 0.0000 175.9786 28 R 4.0913 8.6450 120.4484 58.9235 28.9321 177.9866 29 Q 4.0701 8.0044 117.1362 57.7393 29.3667 177.2480 30 V 4.0103 8.2073 118.8070 65.5438 31.9909 177.0464 31 L 4.2737 8.1161 117.4369 55.9492 41.3963 178.9899 32 A 3.9839 7.7691 121.7256 55.3906 18.7092 179.8783 33 R 3.9549 7.9369 115.9120 59.0392 29.8875 179.3558 34 R 3.9026 7.6550 117.3469 59.5173 30.3895 178.9486 35 R 4.1496 8.2832 117.0512 58.3687 29.9508 178.7974 36 A 4.0069 7.7286 120.1306 54.3939 18.4359 178.7611 37 K 4.2787 7.9751 114.7109 56.2229 32.5551 176.6850 38 G 3.6995 9.0257 108.6642 41.6719 0.0000 169.9522 39 R 3.7097 8.2507 130.9577 54.4394 30.3673 175.3414 40 A 3.5635 8.3384 127.1332 56.4382 18.2361 177.4087 41 R 4.1043 8.0329 122.0858 54.6281 30.0909 177.3985 42 L 3.9857 8.3530 125.0080 56.6799 42.4048 176.7137 43 T 4.1892 7.8168 110.0323 62.3629 71.8113 172.7904 44 V 3.3271 7.9047 113.4121 63.2733 29.0667 173.7882 45 S 4.5717 7.9659 110.6586 58.4393 63.7161 174.5290 46 K 4.1854 7.8225 125.8956 56.8594 32.1872 175.8733 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 M 8.30 4.30 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 K 8.63 3.55 0.00 1.83 1.77 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.65 7.81 3 R 8.38 4.36 0.00 1.91 1.88 0.00 3.37 0.00 0.00 3.43 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.58 0.00 4 T 8.50 4.08 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 1.24 0.00 0.00 5 F 8.07 5.06 0.00 2.87 2.95 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 6 Q 8.40 4.19 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.63 0.00 0.00 0.00 0.00 0.00 2.40 2.23 0.00 7 P 0.00 3.94 0.00 2.00 1.68 0.00 3.47 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.68 0.00 8 S 8.16 4.36 0.00 4.01 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 9 V 8.14 3.60 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 0.86 0.00 0.00 0.95 0.00 0.00 10 L 7.94 3.89 0.00 1.66 1.77 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.94 4.10 0.00 1.88 1.79 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.51 7.81 12 R 8.35 3.88 0.00 1.93 2.09 0.00 3.21 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 13 N 8.56 4.40 0.00 2.85 2.89 0.00 0.00 6.84 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.02 4.09 0.00 2.11 1.96 0.00 3.26 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 15 S 7.74 4.78 0.00 3.93 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 16 H 7.87 4.73 0.00 3.33 3.29 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 8.40 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 18 F 8.90 4.12 0.00 3.05 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 19 R 8.25 3.67 0.00 1.90 1.99 0.00 3.24 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.86 0.00 20 A 7.84 4.00 1.27 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 0.00 0.00 0.00 21 R 7.75 3.92 0.00 1.87 2.04 0.00 3.32 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 1.60 1.58 0.00 22 M 7.98 4.02 0.00 1.36 1.29 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 23 A 7.33 4.49 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 24 T 6.94 4.62 4.20 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 1.23 0.00 0.00 25 K 8.43 4.24 0.00 1.77 1.78 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.48 7.81 26 N 8.02 4.83 0.00 2.72 2.77 0.00 0.00 7.00 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 27 G 7.50 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 28 R 8.64 4.09 0.00 1.89 2.32 0.00 2.78 0.00 0.00 3.06 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 29 Q 8.00 4.07 0.00 2.22 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 30 V 8.21 4.01 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 1.00 0.00 0.00 0.96 0.00 0.00 31 L 8.12 4.27 0.00 1.87 1.77 1.10 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.77 3.98 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 33 R 7.94 3.95 0.00 1.92 2.00 0.00 3.19 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 34 R 7.66 3.90 0.00 1.92 2.03 0.00 3.49 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.86 0.00 35 R 8.28 4.15 0.00 1.94 1.98 0.00 3.14 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 36 A 7.73 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.98 4.28 0.00 2.00 1.86 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.44 7.81 38 G 9.03 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.25 3.71 0.00 1.94 2.00 0.00 3.32 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.78 0.00 40 A 8.34 3.56 1.23 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 0.00 0.00 0.00 41 R 8.03 4.10 0.00 1.89 1.91 0.00 3.13 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.60 0.00 42 L 8.35 3.99 0.00 1.58 1.67 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 43 T 7.82 4.19 4.34 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 44 V 7.90 3.33 2.10 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 0.76 0.00 0.00 0.95 0.00 0.00 45 S 7.97 4.57 0.00 4.05 4.05 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.82 4.19 0.00 1.71 1.72 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.45 7.81