NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.5779 8.3244 119.4760 57.4982 41.1732 175.1184 2 V 4.0713 7.9177 116.6847 62.3016 34.0629 171.0000 3 N 4.4999 10.1014 124.8625 54.0512 38.7269 173.6331 4 Q 4.5602 7.7113 115.2255 57.2108 31.8402 177.1773 5 H 4.2953 8.2456 116.6684 58.9343 29.6085 177.2366 6 L 4.1158 8.0095 120.0672 57.8667 41.8361 178.4186 7 C 4.4071 8.1445 118.3903 62.2612 31.5832 175.6352 8 G 3.7193 8.1360 107.3746 47.6358 0.0000 175.8462 9 S 4.0848 7.6882 115.1473 61.4745 63.0069 176.1862 10 H 4.2778 8.0123 119.1921 57.9251 28.3464 177.7651 11 L 3.9018 7.5871 120.7887 57.9835 41.7643 179.6474 12 V 2.8623 7.3333 111.3015 63.6103 30.8778 178.1962 13 E 4.0045 7.7078 118.8272 58.8222 29.4582 178.3949 14 A 4.0220 7.8779 121.0078 54.9915 18.4725 179.6502 15 L 3.6353 8.5268 118.7420 57.6341 41.3788 179.0211 16 Y 4.1444 7.6834 119.5945 60.6259 38.5227 178.2511 17 L 3.7164 7.3435 117.7790 57.7669 41.8611 179.4447 18 V 3.6531 7.9176 117.0060 66.0846 31.5644 177.4327 19 C 4.2880 8.3066 115.6160 59.7130 28.9513 176.2648 20 G 3.6626 8.3096 107.7781 46.1519 0.0000 174.7433 21 E 3.9601 9.3042 121.4612 59.3170 29.2661 178.1670 22 R 3.8830 8.0964 115.9686 57.4386 30.2781 177.9145 23 G 4.0215 9.0027 106.0983 45.3618 0.0000 172.1037 24 F 4.9482 7.9238 110.3454 56.1181 40.0018 173.2572 25 F 4.3776 8.9659 120.9809 56.1979 40.4128 175.1898 26 Y 4.8082 8.5814 124.8555 56.2811 39.5391 175.3191 27 T 4.3518 7.8934 118.1835 58.6685 69.0386 172.1095 28 P 4.1851 0.0000 0.0000 63.1549 33.0753 178.8157 29 K 3.2696 9.0745 121.4707 57.4840 31.9424 175.0195 30 T 3.6848 8.5714 111.8895 63.8205 68.2043 171.3707 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 F 8.32 4.58 0.00 2.95 3.24 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.92 4.07 2.20 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 0.70 0.00 0.00 1.02 0.00 0.00 3 N 10.10 4.50 0.00 2.92 2.98 0.00 0.00 6.90 7.08 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 4 Q 7.71 4.56 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 5 H 8.25 4.30 0.00 3.24 3.34 0.00 5.87 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.01 4.12 0.00 1.66 1.75 1.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.14 4.41 0.00 3.01 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.14 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.69 4.08 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.01 4.28 0.00 3.35 3.37 0.00 5.61 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.59 3.90 0.00 1.77 1.69 1.10 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.33 2.86 2.20 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 0.19 0.00 0.00 0.86 0.00 0.00 13 E 7.71 4.00 0.00 2.30 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 0.00 2.30 2.29 0.00 14 A 7.88 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.53 3.64 0.00 0.64 0.26 0.80 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.68 4.14 0.00 3.26 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 17 L 7.34 3.72 0.00 1.91 1.66 1.10 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.92 3.65 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 0.78 0.00 0.00 0.91 0.00 0.00 19 C 8.31 4.29 0.00 3.07 3.17 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 20 G 8.31 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.30 3.96 0.00 1.95 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 2.31 2.40 0.00 22 R 8.10 3.88 0.00 1.94 2.07 0.00 3.34 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 23 G 9.00 4.02 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 0.00 0.00 0.00 24 F 7.92 4.95 0.00 3.24 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 25 F 8.97 4.38 0.00 3.06 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 8.58 4.81 0.00 3.11 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.89 4.35 4.19 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 28 P 0.00 4.19 0.00 1.97 1.91 0.00 3.68 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.53 0.00 29 K 9.07 3.27 0.00 1.79 1.36 0.00 1.87 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.42 7.81 30 T 8.57 3.68 4.19 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00