NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5542 8.3049 118.3347 55.0876 32.6645 173.6620 2 K 4.5576 7.9663 116.0406 53.6797 35.4026 170.2392 3 V 4.9342 9.1133 122.7095 59.9040 32.6186 180.0176 4 R 4.2159 9.0864 123.8349 57.1818 28.2190 175.9949 5 A 3.9834 8.3827 121.5181 55.2989 18.7024 177.8662 6 S 4.2696 8.0170 112.1691 58.7819 61.6489 173.0085 7 V 3.8506 7.7927 128.2956 58.9570 32.7179 178.3026 8 K 3.4394 7.5990 119.9697 56.5956 33.4910 173.7865 9 K 4.5517 8.1586 116.1519 55.4803 34.1754 176.2095 10 L 4.4406 8.2498 119.7656 55.5586 43.1439 175.9386 11 C 4.7472 7.4833 111.8272 56.3646 32.3083 174.7838 12 R 3.9825 8.5723 116.4866 58.4694 28.5775 176.5990 13 N 4.7599 7.9933 117.4280 53.6596 38.8960 174.2500 14 C 4.8946 7.7591 114.9700 57.9723 30.0106 171.7209 15 K 4.2398 7.3753 118.1921 56.6051 33.5913 171.9682 16 I 3.9747 8.1928 125.9148 60.6101 37.3135 174.0005 17 V 4.0933 8.1473 116.0188 60.0246 35.1025 172.5543 18 K 3.7221 8.8755 126.7531 57.3185 32.2355 177.0257 19 R 4.5278 8.0669 129.5379 55.4191 29.5487 173.7276 20 D 4.8122 7.2301 118.9041 53.6395 37.9758 177.2464 21 G 4.1451 7.9239 112.6749 46.2064 0.0000 173.1041 22 V 3.8237 7.7577 114.2319 60.7409 31.3786 175.5726 23 I 4.2939 8.0988 126.9369 61.4102 35.6683 176.2549 24 R 4.5410 8.2415 126.2458 55.2458 32.2378 175.0096 25 V 4.6428 8.5039 119.8767 61.2977 34.2214 174.1068 26 I 4.6561 8.3900 127.9986 59.6729 39.7472 173.9488 27 C 5.0380 8.6902 126.2281 57.7722 33.5699 173.4944 28 S 4.4848 8.1372 116.0396 59.3382 63.6190 175.0168 29 A 4.0218 7.4025 123.8770 53.1720 18.6042 176.7927 30 E 4.6649 7.5394 114.9200 53.9228 32.4863 174.8221 31 P 4.5819 0.0000 0.0000 63.5199 32.2256 178.6678 32 K 4.1091 7.9163 117.5657 59.6711 32.0864 177.9770 33 H 4.4462 8.0054 113.9931 57.4307 28.6676 175.5577 34 K 4.4716 7.5611 121.8126 56.7333 33.2632 175.6022 35 Q 4.8306 8.5788 122.6420 55.2381 32.3997 173.1808 36 R 4.7228 9.7492 121.8732 55.0679 33.7729 171.4134 37 Q 3.7421 9.0667 128.2003 55.5592 30.0092 173.3299 38 G 3.6001 8.9149 111.0508 45.3902 0.0000 173.4801 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 4.55 0.00 2.04 2.36 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 2 K 7.97 4.56 0.00 1.66 1.71 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.34 1.64 7.81 3 V 9.11 4.93 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 1.06 0.00 0.00 0.93 0.00 0.00 4 R 9.09 4.22 0.00 1.97 2.08 0.00 3.20 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 5 A 8.38 3.98 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 6 S 8.02 4.27 0.00 3.84 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 7 V 7.79 3.85 2.20 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 0.82 0.00 0.00 0.98 0.00 0.00 8 K 7.60 3.44 0.00 1.96 1.89 0.00 1.55 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.39 7.81 9 K 8.16 4.55 0.00 1.85 1.83 0.00 1.43 0.00 0.00 1.69 0.00 0.00 3.22 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.49 7.81 10 L 8.25 4.44 0.00 1.27 1.54 0.80 0.79 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 C 7.48 4.75 0.00 3.07 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 12 R 8.57 3.98 0.00 1.94 2.12 0.00 3.02 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 13 N 7.99 4.76 0.00 2.73 2.80 0.00 0.00 6.97 8.35 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 14 C 7.76 4.89 0.00 3.00 2.88 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 0.00 0.00 0.00 15 K 7.38 4.24 0.00 1.69 1.70 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.41 7.81 16 I 8.19 3.97 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.94 0.91 0.00 0.00 17 V 8.15 4.09 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 0.58 0.00 0.00 0.93 0.00 0.00 18 K 8.88 3.72 0.00 1.71 1.78 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 19 R 8.07 4.53 0.00 2.00 1.84 0.00 3.30 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 20 D 7.23 4.81 0.00 2.78 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.92 4.15 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 0.00 0.00 0.00 22 V 7.76 3.82 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 0.82 0.00 0.00 0.93 0.00 0.00 23 I 8.10 4.29 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.47 0.91 0.00 0.00 24 R 8.24 4.54 0.00 1.77 1.85 0.00 3.06 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 25 V 8.50 4.64 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 0.99 0.00 0.00 0.99 0.00 0.00 26 I 8.39 4.66 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.06 0.91 0.00 0.00 27 C 8.69 5.04 0.00 2.97 2.84 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 28 S 8.14 4.48 0.00 4.06 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 29 A 7.40 4.02 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 30 E 7.54 4.66 0.00 1.62 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 2.14 2.10 0.00 31 P 0.00 4.58 0.00 2.16 2.06 0.00 3.56 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 32 K 7.92 4.11 0.00 1.71 1.90 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.45 7.81 33 H 8.01 4.45 0.00 3.11 3.33 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.56 4.47 0.00 1.96 1.81 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.59 7.81 35 Q 8.58 4.83 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.38 0.00 0.00 0.00 0.00 0.00 2.46 2.30 0.00 36 R 9.75 4.72 0.00 1.89 1.80 0.00 3.21 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 37 Q 9.07 3.74 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 38 G 8.91 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00