NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.5484 8.3449 118.3629 58.6455 29.5445 173.4880 2 P 4.1800 0.0000 0.0000 62.5088 31.7215 174.6756 3 K 4.2311 8.8324 121.4441 57.4846 34.1214 176.5408 4 I 4.3661 7.4011 118.3911 59.2922 39.1298 174.2465 5 L 4.7533 8.1500 125.3383 55.0481 42.8475 173.7861 6 K 4.7748 8.4238 119.1773 55.2168 36.5361 174.9889 7 K 4.0654 8.3676 120.4333 56.9512 32.4378 175.6085 8 C 4.9489 9.0933 118.6487 53.8416 45.3244 174.5066 9 R 4.5370 9.2220 117.1593 54.8931 29.3417 175.0250 10 R 4.3136 7.2033 114.8697 56.3017 31.3985 174.6977 11 D 4.3559 8.1835 116.8007 56.7166 39.3456 178.8045 12 S 4.0882 8.0448 115.2919 61.1238 62.8480 175.4664 13 D 4.5328 7.6285 118.1512 55.9119 40.7298 175.4593 14 C 4.9376 8.2002 118.9824 53.5781 44.7309 171.7274 15 P 4.5125 0.0000 0.0000 62.5130 31.4763 177.2700 16 G 3.6436 8.5377 104.7948 46.7752 0.0000 174.5109 17 A 4.1582 7.8564 123.8724 54.5077 18.7008 176.9764 18 C 4.9027 7.5033 111.0924 58.9456 32.7297 173.1164 19 I 4.6908 8.8127 112.3112 59.2677 40.7710 174.0968 20 C 4.8329 8.8262 124.9331 56.9174 38.5073 173.6669 21 R 4.3665 9.2017 126.8910 54.9378 31.0062 177.8096 22 G 3.6966 8.5042 107.4071 48.4789 0.0000 174.3175 23 N 4.5862 8.2052 115.1569 53.0926 37.7416 175.2214 24 G 3.9350 8.5629 107.2463 46.4871 0.0000 172.6414 25 Y 5.8874 7.5626 114.6126 54.7324 42.8827 175.3532 26 C 4.7728 9.1357 119.0333 57.1264 39.0564 173.4835 27 G 4.2846 9.2502 110.4267 44.2029 0.0000 172.7337 28 S 4.6475 8.8188 121.3501 58.1771 63.7055 175.6371 29 G 3.6744 8.7336 112.7031 48.6240 0.0000 174.1063 30 S 4.7439 7.7759 115.7029 58.4474 63.5317 176.2199 31 D 4.8817 7.2569 122.4246 55.8097 39.8134 177.4341 32 G 3.9281 7.9505 109.5644 44.2853 0.0000 172.7722 33 G 4.0973 7.3300 115.6824 45.6738 0.0000 173.7812 34 V 3.9860 7.3499 118.4046 61.2529 32.6458 175.2535 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 C 8.34 4.55 0.00 2.97 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.18 0.00 2.12 1.99 0.00 3.65 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 3 K 8.83 4.23 0.00 1.74 1.85 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.35 7.81 4 I 7.40 4.37 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.71 0.92 0.00 0.00 5 L 8.15 4.75 0.00 1.87 1.66 0.75 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 6 K 8.42 4.77 0.00 1.80 1.93 0.00 1.50 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.44 7.81 7 K 8.37 4.07 0.00 1.48 1.62 0.00 0.97 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.26 1.09 7.81 8 C 9.09 4.95 0.00 3.04 3.08 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 0.00 0.00 0.00 0.00 9 R 9.22 4.54 0.00 1.82 1.96 0.00 3.29 0.00 0.00 3.38 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 10 R 7.20 4.31 0.00 1.98 2.07 0.00 2.96 0.00 0.00 3.38 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.48 0.00 11 D 8.18 4.36 0.00 2.92 2.97 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 0.00 0.00 0.00 12 S 8.04 4.09 0.00 3.87 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 13 D 7.63 4.53 0.00 2.85 2.70 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 14 C 8.20 4.94 0.00 2.85 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 P 0.00 4.51 0.00 2.26 2.17 0.00 3.76 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 2.08 1.97 0.00 16 G 8.54 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 0.00 0.00 0.00 0.00 17 A 7.86 4.16 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.50 4.90 0.00 2.83 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 19 I 8.81 4.69 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.23 0.92 0.00 0.00 20 C 8.83 4.83 0.00 3.07 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 9.20 4.37 0.00 2.11 1.87 0.00 3.36 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 22 G 8.50 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 23 N 8.21 4.59 0.00 2.94 2.98 0.00 0.00 5.89 6.97 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 24 G 8.56 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.56 5.89 0.00 2.85 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 26 C 9.14 4.77 0.00 2.91 3.05 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 27 G 9.25 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 0.00 0.00 0.00 0.00 28 S 8.82 4.65 0.00 3.90 3.80 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 29 G 8.73 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.78 4.74 0.00 3.89 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 D 7.26 4.88 0.00 2.73 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.95 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.33 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 34 V 7.35 3.99 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 0.91 0.00 0.00 1.00 0.00 0.00