NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 3.6996 8.2993 120.1061 56.0372 33.4376 173.8503 2 W 5.1578 6.8783 115.8231 55.3469 31.6807 174.0003 3 K 4.8333 8.0810 113.9026 56.0661 34.9006 177.8562 4 L 4.0480 7.8306 121.7221 58.2875 41.1786 179.5571 5 F 3.9865 8.3400 119.7473 59.3949 39.4312 175.1077 6 K 4.6251 7.9166 117.6591 57.0351 33.7442 177.3482 7 K 3.9802 7.7623 119.6096 59.0650 32.0773 176.3827 8 I 3.7058 7.6775 120.2693 61.1335 37.0655 174.5736 9 P 4.2423 0.0000 0.0000 65.3311 31.3853 178.2257 10 K 3.9599 8.1100 117.1527 59.3244 32.4555 178.5808 11 F 4.3301 7.7998 122.0531 61.3564 38.9893 176.8723 12 L 3.9760 8.0099 118.7710 57.5888 41.7184 177.9228 13 H 4.2897 7.9491 117.6908 58.9088 30.1350 176.5842 14 S 4.3106 8.0076 115.7401 60.2338 63.0544 176.1573 15 A 3.8307 7.6156 124.5220 55.0615 17.9169 179.4589 16 K 4.0600 7.4787 114.2648 59.0914 32.9343 178.2204 17 K 4.3513 7.4679 118.5439 56.4633 32.1646 176.3182 18 F 4.2468 7.7931 122.4188 58.0404 39.4258 174.8868 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 3.70 0.00 1.58 1.50 0.00 1.45 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 1.23 7.81 2 W 6.88 5.16 0.00 3.38 3.27 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 3 K 8.08 4.83 0.00 1.84 1.83 0.00 1.75 0.00 0.00 1.99 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.36 7.81 4 L 7.83 4.05 0.00 1.85 1.94 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 5 F 8.34 3.99 0.00 3.09 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 6 K 7.92 4.63 0.00 2.03 1.90 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.54 1.58 7.81 7 K 7.76 3.98 0.00 1.73 2.03 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.42 7.81 8 I 7.68 3.71 1.72 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.44 0.90 0.00 0.00 9 P 0.00 4.24 0.00 2.29 2.32 0.00 3.71 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 10 K 8.11 3.96 0.00 1.87 1.97 0.00 1.51 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.60 7.81 11 F 7.80 4.33 0.00 3.08 3.26 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 0.00 12 L 8.01 3.98 0.00 1.87 1.67 1.05 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 13 H 7.95 4.29 0.00 3.25 3.46 0.00 5.80 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.01 4.31 0.00 4.00 4.05 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 A 7.62 3.83 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 16 K 7.48 4.06 0.00 1.95 1.94 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.55 1.38 7.81 17 K 7.47 4.35 0.00 1.83 2.00 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.51 1.48 7.81 18 F 7.79 4.25 0.00 3.09 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