NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3787 8.2393 119.7086 56.5044 31.5792 175.2551 2 S 4.5447 7.9588 110.6599 54.2561 62.5958 172.1600 3 P 4.3172 0.0000 0.0000 66.6473 32.7545 179.4983 4 D 4.2688 7.8621 118.2126 57.1743 40.7382 178.6920 5 F 4.5949 7.6206 117.5985 60.7744 38.9958 177.7975 6 R 4.1634 7.8895 116.6489 59.1190 29.8096 179.0454 7 K 3.9938 8.5054 119.5739 59.4984 32.1419 178.7853 8 A 4.0497 8.7054 121.5184 55.1023 18.2896 179.3467 9 F 4.2581 8.9584 119.7080 61.3206 39.4691 177.2168 10 K 3.7217 8.6217 119.7199 59.4232 31.9763 178.7485 11 R 3.9578 8.5460 119.2937 59.5352 29.8358 178.5340 12 L 4.1709 8.6050 118.6456 57.7933 41.6866 179.1202 13 L 3.9990 7.9366 118.5393 57.8624 41.5547 178.8360 14 C 4.1720 7.6902 117.6171 62.2643 31.5839 173.8469 15 F 4.2837 8.0769 122.8154 57.7484 38.6199 174.9293 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 R 8.24 4.38 0.00 1.80 1.98 0.00 3.17 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 2 S 7.96 4.54 0.00 4.42 4.17 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.32 0.00 2.26 2.33 0.00 3.61 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 4 D 7.86 4.27 0.00 2.34 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 F 7.62 4.59 0.00 3.11 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 6 R 7.89 4.16 0.00 2.15 2.08 0.00 3.19 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.86 0.00 7 K 8.51 3.99 0.00 2.03 1.84 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.53 7.81 8 A 8.71 4.05 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.96 4.26 0.00 3.05 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.62 3.72 0.00 1.93 1.94 0.00 1.49 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.46 7.81 11 R 8.55 3.96 0.00 2.03 2.14 0.00 3.26 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.05 0.00 12 L 8.60 4.17 0.00 2.00 1.82 0.90 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.94 4.00 0.00 1.55 1.52 0.09 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 14 C 7.69 4.17 0.00 3.09 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.08 4.28 0.00 3.24 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