NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Y 4.8028 8.1331 118.3579 58.8561 39.1589 172.8632 2 G 3.5465 9.3758 116.2947 45.2722 0.0000 171.1027 3 C 3.9250 8.0113 120.3658 56.8020 43.9592 171.2875 4 L 4.4258 8.1847 128.5690 53.9311 44.2651 174.8902 5 D 5.2901 8.7288 125.7536 51.6918 41.4216 176.4663 6 R 4.6171 8.2017 111.5216 55.8689 30.3264 174.0900 7 I 4.5802 7.4309 110.2938 60.3496 40.6353 174.1009 8 F 4.7121 8.5343 119.9325 58.0464 39.8725 175.6038 9 V 3.7466 7.0057 118.1188 62.5568 31.8625 179.0618 10 C 4.1603 7.6982 120.2217 61.0523 39.5557 175.3707 11 T 3.7008 7.9320 116.7676 67.2666 67.7451 176.4050 12 S 4.2267 7.6961 115.1302 61.2340 63.2632 176.3239 13 W 4.7620 7.5595 120.2661 59.7707 28.5556 178.2008 14 A 4.2297 8.8236 121.1008 55.1250 17.9020 179.0211 15 R 4.3479 7.6181 110.0484 56.7192 30.1503 177.3570 16 K 4.5194 8.6651 119.9633 56.2234 32.8608 176.5065 17 G 3.9868 8.1210 106.5493 46.1526 0.0000 175.0816 18 F 3.7071 8.3727 122.8394 60.6685 39.5007 176.6190 19 C 5.4120 8.3297 116.5630 57.0494 40.2160 173.3087 20 D 5.4622 8.0053 117.7832 54.3058 46.5573 177.1071 21 V 4.1145 8.0446 110.6016 62.4952 33.0383 177.6374 22 R 4.1596 7.2609 114.8613 55.5810 30.3329 177.7402 23 Q 4.0510 7.9484 120.4109 58.9981 27.9799 178.9903 24 R 3.6881 7.8259 118.8077 58.9035 29.9710 176.9181 25 L 4.3267 8.4977 119.6825 56.7745 42.8428 177.9237 26 M 4.1951 7.8759 117.3960 57.6254 32.0317 177.8178 27 K 3.1958 7.8795 119.2675 59.2476 32.3680 178.2923 28 R 4.4357 7.6881 112.1608 56.9203 30.7313 178.1348 29 L 4.3009 7.5704 120.6379 56.7880 42.8368 176.0964 30 C 5.1004 8.2565 118.5474 53.6833 42.4029 172.3945 31 P 4.3098 0.0000 0.0000 64.6921 31.3883 178.8316 32 R 3.9112 7.8850 117.7298 59.8116 29.8536 178.0121 33 S 4.2407 7.7780 113.0079 61.2409 62.2861 175.1717 34 C 4.1719 8.0130 120.2605 57.3794 41.2012 172.5278 35 D 4.2065 7.3532 117.4562 55.1198 38.7048 173.4516 36 F 4.8869 8.3515 113.7697 57.6604 39.6533 176.3059 37 C 4.3634 8.4556 124.2095 57.7928 41.0308 173.9064 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 Y 8.13 4.80 0.00 3.07 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 2 G 9.38 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.01 3.92 0.00 3.01 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.18 4.43 0.00 1.57 1.74 0.90 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 5 D 8.73 5.29 0.00 2.89 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 4.62 0.00 1.87 1.96 0.00 3.02 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 7 I 7.43 4.58 1.76 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.44 0.95 0.00 0.00 8 F 8.53 4.71 0.00 3.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.01 3.75 1.60 0.00 0.00 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 0.24 0.00 0.00 10 C 7.70 4.16 0.00 2.91 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 11 T 7.93 3.70 4.18 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 0.00 0.00 0.00 1.20 0.00 0.00 12 S 7.70 4.23 0.00 3.64 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.56 4.76 0.00 3.40 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.82 4.23 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.62 4.35 0.00 2.06 2.10 0.00 3.09 0.00 0.00 3.19 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.74 0.00 16 K 8.67 4.52 0.00 2.15 2.37 0.00 1.82 0.00 0.00 1.88 0.00 0.00 3.22 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.63 1.59 7.81 17 G 8.12 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 0.00 0.00 0.00 18 F 8.37 3.71 0.00 3.42 3.22 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 0.00 19 C 8.33 5.41 0.00 3.07 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 20 D 8.01 5.46 0.00 2.75 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.04 4.11 1.97 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 0.81 0.00 0.00 0.78 0.00 0.00 22 R 7.26 4.16 0.00 0.67 0.66 0.00 2.91 0.00 0.00 2.98 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 1.19 0.00 23 Q 7.95 4.05 0.00 2.16 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.23 0.00 24 R 7.83 3.69 0.00 1.73 1.94 0.00 3.31 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 25 L 8.50 4.33 0.00 1.69 1.74 0.90 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 26 M 7.88 4.20 0.00 2.45 2.40 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 3.09 0.00 27 K 7.88 3.20 0.00 1.50 1.69 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.30 1.17 7.81 28 R 7.69 4.44 0.00 1.96 2.03 0.00 3.00 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 29 L 7.57 4.30 0.00 1.98 1.93 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 30 C 8.26 5.10 0.00 3.10 3.11 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 0.00 0.00 0.00 0.00 31 P 0.00 4.31 0.00 2.46 2.73 0.00 3.83 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.14 0.00 32 R 7.88 3.91 0.00 1.80 2.01 0.00 3.15 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 33 S 7.78 4.24 0.00 3.94 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 C 8.01 4.17 0.00 2.86 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 7.35 4.21 0.00 2.71 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.35 4.89 0.00 3.18 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 C 8.46 4.36 0.00 3.05 3.19 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 0.00