NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3381 8.1133 119.7066 55.8713 32.4538 176.9949 2 M 3.9327 8.0477 119.5896 57.4583 31.8980 176.3009 3 K 3.7650 8.3143 119.4566 60.0261 32.3611 177.8412 4 Q 4.0409 8.1679 118.7020 59.1377 28.8149 178.4769 5 I 3.8194 7.4031 119.7141 64.2230 37.2311 177.8697 6 E 3.9429 8.7491 120.4795 59.2225 29.5226 178.2609 7 D 4.6634 8.3489 120.7408 56.8913 40.9382 179.2879 8 K 4.0196 7.7103 117.2521 59.2866 31.9298 179.3347 9 L 3.9664 7.9986 119.3089 57.9685 41.0518 179.3421 10 E 3.9721 8.3387 118.4061 59.5040 29.5352 179.1965 11 E 3.9863 8.0797 119.0409 59.1566 29.8499 178.6458 12 I 3.6726 8.2582 120.2759 64.5207 37.1657 177.8179 13 L 3.8926 8.1128 121.0929 58.4499 41.7683 179.0185 14 S 4.2718 8.0613 112.3052 61.4675 62.3720 176.0669 15 K 3.9537 8.0145 120.7885 59.7546 31.6947 179.2515 16 L 4.0691 7.8468 118.7405 57.8144 41.5339 179.0554 17 Y 4.1581 8.2505 117.0245 61.4014 37.7787 178.2048 18 H 4.2699 8.5948 119.2032 59.2890 29.9047 177.1991 19 I 3.7981 8.3084 122.0603 64.5258 36.8412 178.1235 20 E 3.9615 8.4303 119.3826 59.6583 29.4648 179.2384 21 N 4.3391 8.3307 116.3473 56.2068 38.5258 177.2578 22 E 3.9431 8.1101 120.0906 59.5718 29.5961 179.4696 23 L 4.0521 8.3574 118.7943 57.2415 41.6558 179.3674 24 A 4.0308 8.2740 121.4479 55.0576 18.3057 179.9431 25 R 3.8347 7.8837 116.1057 59.5491 30.0095 179.1279 26 I 3.7077 7.5786 118.1110 64.4126 37.2966 178.3139 27 K 4.1038 8.5010 119.4158 59.4592 32.0633 179.2762 28 K 3.8721 7.8034 118.1773 59.7548 31.8450 179.2718 29 L 4.1092 7.8956 117.1785 56.9172 41.5742 178.4888 30 L 4.4931 8.0098 117.3773 54.2164 42.1745 177.3667 31 G 3.9261 7.8249 107.0456 45.3304 0.0000 173.6085 32 E 4.2124 7.8605 123.8067 56.3182 29.6911 175.9436 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 R 8.11 4.34 0.00 1.86 2.02 0.00 3.26 0.00 0.00 3.34 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 2 M 8.05 3.93 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.60 0.00 3 K 8.31 3.77 0.00 1.78 1.83 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.47 7.81 4 Q 8.17 4.04 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.71 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 5 I 7.40 3.82 2.08 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.90 0.91 0.00 0.00 6 E 8.75 3.94 0.00 2.10 2.08 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 2.31 2.40 0.00 7 D 8.35 4.66 0.00 2.98 2.72 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 8 K 7.71 4.02 0.00 1.96 1.86 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.63 7.81 9 L 8.00 3.97 0.00 1.91 1.73 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.34 3.97 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 11 E 8.08 3.99 0.00 2.08 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 2.32 2.36 0.00 12 I 8.26 3.67 2.08 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.03 0.90 0.00 0.00 13 L 8.11 3.89 0.00 2.00 1.78 1.03 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.06 4.27 0.00 4.15 4.03 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.01 3.95 0.00 2.07 1.89 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.72 7.81 16 L 7.85 4.07 0.00 1.80 1.57 0.85 0.61 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 17 Y 8.25 4.16 0.00 3.16 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 H 8.59 4.27 0.00 3.31 3.55 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 8.31 3.80 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.61 0.89 0.00 0.00 20 E 8.43 3.96 0.00 2.21 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 2.60 2.48 0.00 21 N 8.33 4.34 0.00 2.90 2.87 0.00 0.00 7.07 6.96 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 22 E 8.11 3.94 0.00 2.11 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 0.00 2.26 2.29 0.00 23 L 8.36 4.05 0.00 1.79 1.70 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.27 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.88 3.83 0.00 1.90 1.98 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 26 I 7.58 3.71 1.98 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 1.52 0.62 0.91 0.00 0.00 27 K 8.50 4.10 0.00 1.81 1.86 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.60 1.58 7.81 28 K 7.80 3.87 0.00 1.94 1.88 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.65 7.81 29 L 7.90 4.11 0.00 1.78 1.74 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.01 4.49 0.00 1.85 1.70 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.82 3.93 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 0.00 0.00 0.00 32 E 7.86 4.21 0.00 1.96 1.86 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 2.25 2.46 0.00