NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.2703 8.1600 109.1421 45.1419 0.0000 174.5016 2 I 3.0211 7.9256 118.3700 62.8558 37.4389 172.5448 3 V 3.4996 8.3237 119.9868 66.0404 31.8465 177.3120 4 E 4.0489 8.0475 117.8895 59.4141 28.1045 178.9377 5 Q 4.0943 8.4441 119.7108 58.2303 28.9505 176.3633 6 C 5.1302 8.1143 113.8237 56.0867 40.8092 173.9217 7 C 4.3290 7.5670 116.9737 60.9897 29.3707 175.8072 8 T 4.0399 8.0660 115.5258 66.0712 68.3875 174.6173 9 S 4.8432 7.3105 113.2397 56.3184 66.1314 173.2015 10 I 4.1447 8.1273 122.7413 60.9477 37.7213 176.3197 11 C 5.0030 8.5352 122.8062 55.4711 42.2875 174.5150 12 S 4.5278 8.8747 119.6524 57.4738 65.1140 175.1602 13 L 3.7818 8.2164 122.7642 58.5068 41.3594 178.4879 14 Y 4.0329 7.2834 115.3413 61.1391 38.0730 177.9298 15 Q 4.2074 8.2680 119.0417 58.8605 28.7688 178.6720 16 L 4.2734 8.3466 120.3972 57.7615 41.7362 179.2343 17 E 4.0008 8.3230 118.5187 59.2443 29.0870 178.9662 18 N 4.2899 7.7277 115.8676 55.5949 38.5498 175.7758 19 Y 4.5090 7.6254 115.9249 57.3324 38.6913 175.6329 20 C 4.4736 7.2709 117.8343 59.0828 29.1185 173.4823 21 N 4.5350 8.5710 117.7476 53.8155 38.1112 175.3248 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 8.16 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 3.02 0.56 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 1.17 0.95 0.65 0.00 0.00 3 V 8.32 3.50 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 1.07 0.00 0.00 0.86 0.00 0.00 4 E 8.05 4.05 0.00 2.25 1.99 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 2.40 2.42 0.00 5 Q 8.44 4.09 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 6 C 8.11 5.13 0.00 3.00 3.03 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 0.00 0.00 0.00 0.00 7 C 7.57 4.33 0.00 3.08 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 8 T 8.07 4.04 4.25 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 1.21 0.00 0.00 9 S 7.31 4.84 0.00 3.83 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 4.14 1.89 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 1.42 0.49 0.92 0.00 0.00 11 C 8.54 5.00 0.00 2.98 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 12 S 8.87 4.53 0.00 4.22 4.11 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 0.00 0.00 0.00 0.00 13 L 8.22 3.78 0.00 1.50 1.04 0.77 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.28 4.03 0.00 3.08 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 15 Q 8.27 4.21 0.00 2.34 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 16 L 8.35 4.27 0.00 1.83 1.77 0.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.32 4.00 0.00 2.21 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.53 0.00 18 N 7.73 4.29 0.00 2.25 2.43 0.00 0.00 6.91 7.20 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 19 Y 7.63 4.51 0.00 3.07 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 20 C 7.27 4.47 0.00 3.08 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 8.57 4.54 0.00 2.72 2.74 0.00 0.00 6.81 7.58 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