NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9625 8.2127 109.7390 45.3758 0.0000 174.7672 2 I 3.2376 8.2455 118.2604 63.3163 37.8183 173.5211 3 V 3.6031 8.3826 119.9953 65.8369 31.9260 177.3781 4 E 3.9464 7.9057 117.9102 59.6453 29.2933 179.1999 5 Q 4.1167 8.0563 116.5381 58.1357 28.8265 176.9696 6 C 4.8437 8.5626 115.9357 56.9469 42.2058 174.9113 7 C 4.3777 7.7986 118.3589 61.6145 32.1136 175.3606 8 T 3.9786 7.7893 115.8638 67.3331 68.5528 174.9761 9 S 4.6456 7.8037 113.6024 56.8113 64.6470 172.5790 10 I 4.6358 8.0784 112.5729 59.2666 39.6202 173.4542 11 C 5.0242 8.3272 115.8979 53.7389 39.5826 173.5736 12 S 4.7158 8.3039 115.2918 57.1762 64.0230 175.2003 13 L 4.0356 8.2033 120.2490 57.7157 40.9630 179.3545 14 Y 4.1039 7.7415 116.0545 61.0369 38.1898 177.8077 15 Q 4.3411 8.1253 119.0359 58.9546 28.9707 178.5939 16 L 4.3773 8.0525 119.3778 57.6553 41.8007 178.9308 17 E 4.1417 7.8853 117.6980 58.7226 29.1147 178.3975 18 N 4.3781 8.0001 115.4889 54.8316 38.6797 175.0675 19 Y 4.4947 7.1207 115.9952 57.7478 38.6805 175.7982 20 C 4.4345 7.4743 117.8395 59.3943 28.9815 173.5060 21 N 4.5418 8.5806 118.4235 53.7439 38.2185 175.2901 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 G 8.21 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.25 3.24 0.88 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.50 0.67 0.00 0.00 3 V 8.38 3.60 2.03 0.00 0.00 0.00 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 0.87 0.00 0.00 4 E 7.91 3.95 0.00 2.33 1.98 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 2.40 2.45 0.00 5 Q 8.06 4.12 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.61 0.00 6 C 8.56 4.84 0.00 2.94 3.07 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 0.00 0.00 0.00 0.00 7 C 7.80 4.38 0.00 2.92 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 8 T 7.79 3.98 4.39 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 1.21 0.00 0.00 9 S 7.80 4.65 0.00 3.87 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 10 I 8.08 4.64 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 1.48 0.86 0.92 0.00 0.00 11 C 8.33 5.02 0.00 3.09 3.25 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 12 S 8.30 4.72 0.00 4.20 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 13 L 8.20 4.04 0.00 1.52 1.49 0.89 0.71 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 14 Y 7.74 4.10 0.00 3.03 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 15 Q 8.13 4.34 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 16 L 8.05 4.38 0.00 1.85 1.83 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.89 4.14 0.00 2.27 2.02 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 2.33 2.48 0.00 18 N 8.00 4.38 0.00 2.08 2.40 0.00 0.00 6.89 6.80 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 19 Y 7.12 4.49 0.00 3.10 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 20 C 7.47 4.43 0.00 3.10 2.87 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 21 N 8.58 4.54 0.00 2.72 2.73 0.00 0.00 6.81 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00