NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2910 8.2993 120.1348 56.4969 33.4056 173.3634 2 C 5.0788 8.2789 115.9618 52.6382 42.8695 171.7022 3 L 4.3656 8.0627 119.7476 54.1279 42.7271 177.2084 4 P 4.8417 0.0000 0.0000 61.5243 33.1784 173.7029 5 P 4.3569 0.0000 0.0000 64.0184 31.5733 176.5217 6 G 4.0583 9.4272 111.3771 44.8261 0.0000 173.3383 7 K 4.5024 7.6919 118.7153 54.5432 33.7628 174.6075 8 P 4.6268 0.0000 0.0000 63.0300 31.9342 175.9677 9 C 4.5341 8.2296 123.5392 55.3359 45.3882 173.5849 10 Y 4.3909 8.5259 123.6204 56.9387 37.2729 178.0136 11 G 3.7558 8.2640 114.9740 46.1588 0.0000 171.8231 12 A 4.8907 8.3762 119.3405 51.4839 19.9926 177.5283 13 T 4.6958 7.6005 111.9202 62.5392 68.7653 172.0405 14 Q 4.7608 7.7375 122.2929 53.9896 32.1514 175.5924 15 K 4.4592 8.4393 117.6299 56.3662 32.1241 176.5140 16 I 4.7036 7.3711 119.3574 58.7347 40.6439 172.7807 17 P 4.5724 0.0000 0.0000 62.9460 32.6520 176.3219 18 C 4.7036 8.6336 119.8500 56.2525 41.3294 174.6770 19 C 4.4776 8.8570 119.6562 60.0431 41.3526 175.1082 20 G 4.0249 7.7110 102.3030 46.1374 0.0000 176.7453 21 V 4.5965 7.4224 128.0561 61.0759 36.0809 171.6563 22 C 5.0636 8.6939 122.6517 55.3000 38.6871 172.5458 23 S 4.6359 8.8268 120.6429 57.9394 65.3601 173.2217 24 H 4.1935 9.3012 120.5255 57.4171 26.3093 174.2203 25 N 4.1427 8.1431 110.6695 53.5103 36.2632 173.8577 26 K 4.8300 7.5807 115.1935 56.9146 36.8289 172.9109 27 C 6.0797 9.5911 117.5229 54.4729 43.2505 174.9223 28 T 4.2234 8.4622 112.2688 61.8837 68.4097 174.6199 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 K 8.30 4.29 0.00 1.77 1.82 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.39 7.81 2 C 8.28 5.08 0.00 3.04 3.04 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 0.00 0.00 0.00 0.00 3 L 8.06 4.37 0.00 1.65 1.65 1.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.84 0.00 2.11 2.19 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 5 P 0.00 4.36 0.00 2.20 2.22 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 6 G 9.43 4.06 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 0.00 0.00 0.00 7 K 7.69 4.50 0.00 1.87 1.72 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.64 7.81 8 P 0.00 4.63 0.00 1.68 1.91 0.00 3.72 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.92 0.00 9 C 8.23 4.53 0.00 2.98 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 10 Y 8.53 4.39 0.00 3.06 2.90 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 11 G 8.26 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.38 4.89 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.60 4.70 4.26 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 1.24 0.00 0.00 14 Q 7.74 4.76 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 7.30 0.00 0.00 0.00 0.00 0.00 2.48 2.59 0.00 15 K 8.44 4.46 0.00 1.73 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.41 7.81 16 I 7.37 4.70 1.89 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 1.43 0.72 0.97 0.00 0.00 17 P 0.00 4.57 0.00 2.16 2.16 0.00 3.75 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 18 C 8.63 4.70 0.00 2.88 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 19 C 8.86 4.48 0.00 3.05 3.15 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 20 G 7.71 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.42 4.60 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.93 0.00 0.00 22 C 8.69 5.06 0.00 3.01 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 23 S 8.83 4.64 0.00 3.78 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.30 4.19 0.00 3.30 3.31 0.00 5.93 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.14 4.14 0.00 2.95 2.81 0.00 0.00 6.45 6.90 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 26 K 7.58 4.83 0.00 1.85 1.84 0.00 1.23 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.46 1.52 7.81 27 C 9.59 6.08 0.00 2.88 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 28 T 8.46 4.22 4.24 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 1.21 0.00 0.00