NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 3.9887 8.3149 120.0607 56.4103 33.2046 173.9487 2 R 3.2528 8.1393 122.1721 55.8631 28.5801 173.4128 3 F 3.2652 9.5561 129.7567 57.0417 37.5729 175.2953 4 W 4.9967 8.2793 126.2360 54.2131 28.7927 174.6701 5 P 4.4499 0.0000 0.0000 64.8068 31.1456 178.6747 6 L 4.7037 7.2673 118.8731 54.7599 43.0110 178.0684 7 V 3.4037 7.8401 118.4927 64.6328 31.5404 176.0304 8 P 4.0698 0.0000 0.0000 64.3187 31.7429 176.7124 9 V 4.0034 7.4099 117.1153 62.4866 32.2078 176.7943 10 A 4.0220 7.3856 121.2136 55.8016 18.2581 178.8681 11 I 4.1178 7.6023 114.6066 61.5843 37.1759 175.9034 12 N 4.8055 8.3442 119.8199 53.8364 40.0625 175.8783 13 T 4.4116 7.7721 112.5096 63.9695 70.7998 175.5240 14 V 3.8335 7.8372 120.6716 64.8415 32.1601 177.9108 15 A 4.1106 7.9891 121.3132 54.7632 17.9541 179.1355 16 A 4.0323 8.0227 118.4516 55.2592 18.5285 179.6214 17 G 3.7049 7.9314 102.6235 48.1566 0.0000 175.5887 18 I 3.9412 7.2629 119.9881 63.0417 37.3625 176.9137 19 N 4.9178 8.3479 117.3795 53.9033 40.2677 175.9230 20 L 4.4155 7.7637 121.6491 56.5994 43.2129 175.9607 21 Y 3.7598 7.9402 119.0208 60.7875 38.3173 178.0450 22 K 4.0448 8.2528 119.6590 59.2079 32.1039 178.6284 23 A 4.0360 7.8089 120.1259 55.0520 18.6107 178.7283 24 I 4.1241 7.9016 115.0939 61.5929 37.4251 176.3891 25 R 4.5132 7.0950 118.7506 55.8117 31.2814 175.8427 26 R 4.5456 7.3624 112.4109 55.7958 31.6077 174.3260 27 K 4.1352 7.9312 123.6947 56.7753 32.2309 175.8824 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 8.31 3.99 0.00 2.00 1.95 0.00 1.93 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.45 1.64 7.81 2 R 8.14 3.25 0.00 2.08 2.03 0.00 3.35 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.70 0.00 3 F 9.56 3.27 0.00 3.16 3.20 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 0.00 4 W 8.28 5.00 0.00 3.21 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.45 0.00 2.08 2.15 0.00 3.77 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.25 0.00 6 L 7.27 4.70 0.00 1.52 1.50 0.87 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.84 3.40 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.66 0.00 0.00 8 P 0.00 4.07 0.00 2.26 2.23 0.00 3.51 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.29 0.00 9 V 7.41 4.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.92 0.00 0.00 10 A 7.39 4.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.60 4.12 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.52 0.89 0.00 0.00 12 N 8.34 4.81 0.00 2.87 2.82 0.00 0.00 6.74 7.11 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 13 T 7.77 4.41 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 14 V 7.84 3.83 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.90 0.00 0.00 15 A 7.99 4.11 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.02 4.03 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 7.93 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 7.26 3.94 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.73 0.91 0.00 0.00 19 N 8.35 4.92 0.00 2.70 2.84 0.00 0.00 7.09 8.09 0.00 0.00 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 L 7.76 4.42 0.00 1.98 1.63 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.94 3.76 0.00 3.08 2.89 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 0.00 0.00 0.00 22 K 8.25 4.04 0.00 1.96 1.84 0.00 1.72 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.60 7.81 23 A 7.81 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.90 4.12 1.75 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.80 0.84 0.00 0.00 25 R 7.09 4.51 0.00 1.82 2.00 0.00 3.52 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.79 0.00 26 R 7.36 4.55 0.00 1.89 1.82 0.00 3.32 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 27 K 7.93 4.14 0.00 1.88 1.66 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.42 7.81