NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1A D 4.5832 8.2076 120.1920 53.4681 42.9664 174.8563 1 C 3.7232 8.0389 112.3461 59.6474 29.5491 172.3398 2 G 3.8242 9.6056 110.3741 46.0293 0.0000 174.3063 3 L 4.5886 7.3633 118.8719 52.5563 42.6815 176.5438 4 R 4.2568 8.7933 124.3754 55.0603 30.7222 176.4045 5 P 4.2452 0.0000 0.0000 65.1809 31.4229 177.0579 6 L 4.3465 7.8801 114.5028 54.3164 41.8813 176.1089 7 F 4.4993 7.6505 115.3494 58.3255 42.3794 176.9679 8 E 3.9597 8.5946 120.6372 59.8756 30.0810 179.8043 9 K 4.1485 8.1140 116.0168 58.2923 32.2042 177.5503 10 K 4.3802 7.8309 115.6911 55.1231 33.0347 175.5091 11 S 3.7522 7.7779 112.4373 59.4289 61.1945 171.4838 12 L 4.8249 8.5699 117.8883 52.7031 43.9109 176.1174 13 E 4.9626 8.4953 120.6291 54.6067 31.8384 175.8855 14 D 4.7557 9.1543 122.3307 52.3666 40.3720 177.5980 14A K 4.2655 8.5035 118.9619 59.0426 32.5769 177.5251 14B T 4.6197 8.2471 108.8506 60.4494 70.0016 175.4969 14C E 3.9947 8.0370 121.9234 59.6639 29.3515 178.9039 14D R 3.8265 7.9685 119.4398 59.3472 29.8620 177.7849 14E E 3.9282 7.5752 116.8885 59.0597 29.8754 178.7053 14F L 3.8019 7.6082 118.4715 57.6888 41.9744 179.1684 14G L 3.6231 7.3661 118.2403 57.7960 41.3932 179.4087 14H E 4.0872 8.2805 117.2378 58.2860 29.4251 178.5633 14I S 4.4042 7.2484 113.1316 59.4366 64.5943 174.0728 14J Y 4.5395 7.4060 121.9338 60.9756 37.0472 175.4679 14K I 3.7093 7.5117 117.1967 61.4075 39.3447 174.3856 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 1A D 8.21 4.58 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.04 3.72 0.00 3.20 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 2 G 9.61 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.36 4.59 0.00 1.67 1.64 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 4 R 8.79 4.26 0.00 2.23 2.08 0.00 3.14 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 5 P 0.00 4.25 0.00 2.04 2.14 0.00 3.71 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 6 L 7.88 4.35 0.00 1.48 1.03 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.65 4.50 0.00 3.11 3.02 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 8 E 8.59 3.96 0.00 2.14 2.05 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 2.45 2.46 0.00 9 K 8.11 4.15 0.00 1.92 1.88 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.42 7.81 10 K 7.83 4.38 0.00 1.76 1.74 0.00 1.78 0.00 0.00 1.49 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.32 7.81 11 S 7.78 3.75 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 4.82 0.00 1.50 1.54 0.78 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.50 4.96 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 14 D 9.15 4.76 0.00 2.51 1.90 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 14A K 8.50 4.27 0.00 2.15 2.01 0.00 1.63 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.00 7.81 14B T 8.25 4.62 4.20 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 0.00 0.00 0.00 1.18 0.00 0.00 14C E 8.04 3.99 0.00 2.23 2.26 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 2.45 2.30 0.00 14D R 7.97 3.83 0.00 1.83 1.94 0.00 3.32 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 14E E 7.58 3.93 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 14F L 7.61 3.80 0.00 1.88 1.42 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 14G L 7.37 3.62 0.00 1.59 1.67 1.10 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 14H E 8.28 4.09 0.00 1.87 1.95 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 2.30 2.38 0.00 14I S 7.25 4.40 0.00 4.01 3.99 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 0.00 0.00 0.00 14J Y 7.41 4.54 0.00 3.03 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14K I 7.51 3.71 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.38 0.94 0.00 0.00