NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3027 8.3044 120.3499 54.4667 33.3770 174.3035 2 K 3.5542 8.6115 122.4509 56.5888 32.3214 174.9322 3 R 4.3878 8.2759 125.8844 55.4552 32.0007 177.1158 4 T 4.0539 8.4869 108.8998 62.9686 68.6947 173.6611 5 F 4.9830 8.1119 124.9234 56.8003 41.0218 174.7059 6 Q 4.1099 8.0667 126.7866 52.4545 29.8349 172.7545 7 P 3.8383 0.0000 0.0000 63.2539 31.7335 177.8758 8 S 4.4505 7.9954 110.0071 56.6554 64.0728 176.6897 9 V 3.6542 7.9835 130.2993 65.0368 30.9094 177.7297 10 L 3.9269 7.8405 119.5067 57.7862 42.1737 178.5517 11 K 4.0662 8.0137 118.8151 59.6253 32.2255 178.4513 12 R 3.8526 8.1077 118.2100 59.6992 30.1927 177.4012 13 N 4.5018 8.3800 116.5320 56.6685 38.8914 176.9899 14 R 3.9330 8.1891 119.0502 58.4891 30.0507 177.0682 15 S 4.8216 7.7576 112.0871 58.2954 63.5935 174.0919 16 H 4.7546 8.1236 114.5650 55.9813 33.9853 173.9174 17 G 3.9173 8.7251 109.8400 44.9766 0.0000 174.5035 18 F 4.2658 8.9942 120.9416 61.3574 39.6601 177.3764 19 R 3.7268 8.3466 118.8273 59.1407 29.9611 178.4923 20 A 4.0395 7.4149 117.7768 53.8765 19.0330 178.4195 21 R 3.9877 8.0395 116.8937 58.6411 30.3212 177.3857 22 M 4.0018 7.4618 114.4937 55.8379 33.0227 176.0930 23 A 4.3634 6.9393 122.9118 49.2516 17.6884 176.3617 24 T 4.4771 6.8216 123.6156 61.3605 70.2122 172.5853 25 K 4.2213 8.5410 128.9799 57.0580 32.5281 176.0796 26 N 4.7760 7.7836 114.0586 54.3382 40.5481 175.7484 27 G 3.9044 7.8733 103.7802 46.8614 0.0000 175.5259 28 R 4.0454 8.0153 120.9564 58.2730 28.9405 178.2072 29 Q 3.5176 8.1762 118.2579 58.5652 29.2126 178.4310 30 V 3.8436 8.4395 119.6131 65.9160 31.3377 177.2805 31 L 4.1754 8.7385 116.2688 55.6876 41.1187 178.2813 32 A 4.2764 7.8596 122.9152 54.4974 19.4775 180.0722 33 R 4.0673 7.8264 115.3377 58.4863 30.0170 179.3766 34 R 3.9546 7.8205 117.3899 59.3792 30.6252 178.5693 35 R 4.1735 7.7926 116.5413 58.1737 30.0126 178.6730 36 A 4.1009 7.7571 119.5607 54.1844 18.4480 178.7640 37 K 4.2753 7.6517 115.2441 56.5876 32.6805 175.9389 38 G 3.6514 8.5239 109.1981 41.4530 0.0000 170.2787 39 R 3.5685 7.9094 131.6468 54.5532 29.7279 175.6768 40 A 3.4749 8.1823 125.6471 56.9361 18.6581 177.8918 41 R 4.2219 7.8188 120.6631 54.0900 29.3656 177.2949 42 L 3.9118 8.1722 124.9207 57.8827 42.4331 178.1044 43 T 4.2865 7.9264 108.2602 62.8246 70.5237 173.5320 44 V 3.3196 7.6309 113.1469 62.7854 28.9925 174.8519 45 S 4.6648 8.0349 112.9924 58.5999 63.6642 174.3484 46 K 4.1827 7.5171 124.9922 56.8299 32.0426 175.8755 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 8.61 3.55 0.00 1.83 1.76 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.66 7.81 3 R 8.28 4.39 0.00 1.92 1.88 0.00 3.37 0.00 0.00 3.42 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.59 0.00 4 T 8.49 4.05 4.29 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 1.24 0.00 0.00 5 F 8.11 4.98 0.00 2.89 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 6 Q 8.07 4.11 0.00 1.92 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.66 0.00 0.00 0.00 0.00 0.00 2.37 2.22 0.00 7 P 0.00 3.84 0.00 2.01 1.75 0.00 3.45 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.76 0.00 8 S 8.00 4.45 0.00 3.98 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 9 V 7.98 3.65 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 0.84 0.00 0.00 0.95 0.00 0.00 10 L 7.84 3.93 0.00 1.66 1.75 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.01 4.07 0.00 1.87 1.77 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.51 7.81 12 R 8.11 3.85 0.00 1.89 2.05 0.00 3.37 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 13 N 8.38 4.50 0.00 2.91 2.86 0.00 0.00 6.85 7.02 0.00 0.00 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 8.19 3.93 0.00 2.09 1.97 0.00 3.26 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 15 S 7.76 4.82 0.00 3.94 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 8.12 4.75 0.00 3.31 3.32 0.00 5.90 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 8.73 3.92 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 0.00 0.00 0.00 18 F 8.99 4.27 0.00 3.01 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 8.35 3.73 0.00 1.94 1.97 0.00 3.24 0.00 0.00 3.39 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.79 0.00 20 A 7.41 4.04 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 8.04 3.99 0.00 1.89 1.94 0.00 3.13 0.00 0.00 3.11 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 22 M 7.46 4.00 0.00 1.31 1.27 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 23 A 6.94 4.36 1.26 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 0.00 0.00 0.00 24 T 6.82 4.48 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 1.24 0.00 0.00 25 K 8.54 4.22 0.00 1.74 1.78 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.40 7.81 26 N 7.78 4.78 0.00 2.73 2.77 0.00 0.00 6.96 7.86 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 27 G 7.87 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 28 R 8.02 4.05 0.00 1.93 2.31 0.00 3.06 0.00 0.00 3.15 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.50 0.00 29 Q 8.18 3.52 0.00 2.19 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.14 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 30 V 8.44 3.84 2.23 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 0.99 0.00 0.00 0.96 0.00 0.00 31 L 8.74 4.18 0.00 1.84 1.75 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.86 4.28 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.83 4.07 0.00 1.92 1.99 0.00 3.18 0.00 0.00 3.46 7.64 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 7.82 3.95 0.00 1.88 2.02 0.00 3.58 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 1.73 1.69 0.00 35 R 7.79 4.17 0.00 1.96 1.98 0.00 3.14 0.00 0.00 3.19 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 36 A 7.76 4.10 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 7.65 4.28 0.00 1.98 1.87 0.00 1.81 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 1.42 1.44 7.81 38 G 8.52 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 R 7.91 3.57 0.00 1.93 1.97 0.00 3.33 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 40 A 8.18 3.47 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 41 R 7.82 4.22 0.00 1.89 1.91 0.00 3.13 0.00 0.00 3.26 7.25 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 8.17 3.91 0.00 1.58 1.71 0.98 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 T 7.93 4.29 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 44 V 7.63 3.32 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 0.87 0.00 0.00 0.95 0.00 0.00 45 S 8.03 4.66 0.00 4.05 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 46 K 7.52 4.18 0.00 1.76 1.72 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.37 7.81