NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.6201 8.1200 121.8581 56.4034 35.2272 177.3688 3 V 3.9582 9.0616 123.2156 60.4072 31.5269 171.9022 4 R 4.5885 8.8276 125.7713 54.8740 33.4652 174.7724 5 A 4.3667 8.4788 118.8834 53.2008 19.3563 177.3899 6 S 4.5016 7.6646 109.9624 56.1930 62.2315 171.4070 7 V 3.9627 7.9085 123.6561 61.5234 32.1041 175.3711 8 K 4.6159 8.1623 124.7256 54.9248 36.0003 175.7736 9 R 4.1260 8.4769 119.9376 56.9995 30.4839 176.9355 10 I 4.4368 8.3186 119.5508 61.2518 39.7487 174.9967 11 C 4.8398 7.7290 116.8322 57.4692 30.9072 174.1254 12 D 4.4870 8.4713 119.4334 56.2488 39.3158 177.9549 13 K 4.1545 7.8773 117.1603 58.0275 32.4828 176.9814 14 C 5.1114 7.1684 115.7844 59.4723 28.7646 173.3260 15 K 4.6347 8.4184 122.6213 54.7987 35.4953 175.1353 16 V 4.7251 8.4428 126.3602 62.6068 33.0988 174.9706 17 I 4.5418 8.5548 125.2810 60.1648 42.0360 173.9619 18 R 5.4721 8.8382 126.2915 53.4635 29.6184 173.8639 19 R 4.4129 7.8317 119.0271 55.2267 31.6071 177.7071 20 H 3.9338 9.4655 115.2834 56.2881 27.0837 174.0296 21 G 3.4878 6.9543 111.4890 45.0086 0.0000 173.8221 22 R 4.7932 7.9067 118.6338 54.0759 34.4810 174.8926 23 V 4.7242 8.2445 119.8524 62.7001 33.0123 174.3386 24 Y 5.2941 9.5316 124.6985 56.3263 42.5404 174.5899 25 V 5.0203 8.4885 119.3876 61.6873 35.3502 174.1086 26 I 5.0568 8.6289 127.5007 60.1466 41.4925 173.6163 27 C 4.7048 8.2023 119.1543 59.3291 31.5103 174.1199 28 E 3.9406 9.0920 121.1271 58.8910 29.3506 176.5047 29 N 4.7725 7.9256 117.6414 50.5030 38.1193 173.8506 30 P 4.3006 0.0000 0.0000 64.5324 31.4918 178.1194 31 K 3.9346 8.1068 119.6154 59.2019 32.1254 176.5907 32 H 4.6409 8.2928 113.8395 55.1784 29.4220 175.0671 33 K 4.2751 8.0443 122.8879 57.4909 33.0819 175.4782 34 Q 4.9106 9.0963 123.9982 54.9605 34.2625 173.6002 35 R 4.4555 8.2184 119.5318 55.1045 34.0404 173.5722 36 Q 4.5254 8.5683 128.7268 55.6649 29.5906 175.8289 37 G 3.7919 9.0820 113.9214 46.6270 0.0000 171.9884 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 2 K 8.12 4.62 0.00 1.88 1.34 0.00 1.64 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.30 7.81 3 V 9.06 3.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.86 0.00 0.00 4 R 8.83 4.59 0.00 1.96 1.96 0.00 2.90 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 5 A 8.48 4.37 1.28 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 0.00 0.00 0.00 6 S 7.66 4.50 0.00 3.79 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 3.96 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 0.86 0.00 0.00 0.91 0.00 0.00 8 K 8.16 4.62 0.00 1.74 1.65 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.46 7.81 9 R 8.48 4.13 0.00 1.81 1.89 0.00 3.16 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 10 I 8.32 4.44 2.06 0.00 0.00 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 1.43 0.78 0.97 0.00 0.00 11 C 7.73 4.84 0.00 3.09 2.78 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 0.00 0.00 0.00 12 D 8.47 4.49 0.00 2.78 2.79 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 13 K 7.88 4.15 0.00 1.74 1.89 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.44 7.81 14 C 7.17 5.11 0.00 3.11 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 8.42 4.63 0.00 1.77 1.58 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.42 7.81 16 V 8.44 4.73 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 0.88 0.00 0.00 0.96 0.00 0.00 17 I 8.55 4.54 1.88 0.00 0.00 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 1.12 0.50 0.80 0.00 0.00 18 R 8.84 5.47 0.00 1.81 1.81 0.00 3.06 0.00 0.00 3.94 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 19 R 7.83 4.41 0.00 2.01 1.84 0.00 2.30 0.00 0.00 3.01 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.88 0.00 20 H 9.47 3.93 0.00 3.30 3.49 0.00 5.89 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 21 G 6.95 3.49 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 0.00 22 R 7.91 4.79 0.00 1.93 1.93 0.00 3.26 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 23 V 8.24 4.72 2.12 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 1.04 0.00 0.00 0.98 0.00 0.00 24 Y 9.53 5.29 0.00 2.80 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 V 8.49 5.02 2.11 0.00 0.00 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 0.97 0.00 0.00 26 I 8.63 5.06 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.72 0.94 0.00 0.00 27 C 8.20 4.70 0.00 2.79 2.92 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 28 E 9.09 3.94 0.00 1.90 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 2.29 2.30 0.00 29 N 7.93 4.77 0.00 3.06 2.98 0.00 0.00 5.98 7.76 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 30 P 0.00 4.30 0.00 2.25 2.37 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 31 K 8.11 3.93 0.00 1.77 1.89 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.46 7.81 32 H 8.29 4.64 0.00 3.13 3.35 0.00 5.92 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.04 4.28 0.00 1.95 1.78 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.52 7.81 34 Q 9.10 4.91 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.48 0.00 0.00 0.00 0.00 0.00 2.26 2.61 0.00 35 R 8.22 4.46 0.00 1.40 1.45 0.00 2.83 0.00 0.00 2.84 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.50 0.00 36 Q 8.57 4.53 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.48 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 37 G 9.08 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 0.00 0.00 0.00