NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3205 8.1127 119.7062 56.5242 32.6826 177.3475 2 M 3.8870 7.9582 117.0653 56.4672 32.2662 176.5917 3 K 3.9480 8.1662 118.8389 60.1368 33.1189 178.3214 4 Q 3.9339 8.0003 120.5578 58.4887 28.9932 177.7387 5 L 3.9108 8.0025 121.3031 58.3106 42.1856 178.6875 6 E 3.9807 8.2498 118.4711 59.5924 29.3847 179.2313 7 D 4.3479 8.0405 118.5548 57.3953 40.8343 179.0594 8 K 4.0093 8.2988 119.2150 59.2900 32.0270 179.6622 9 V 3.5505 8.1919 119.0141 66.0989 31.4839 177.9707 10 E 3.9737 8.3413 118.3858 59.2968 29.1867 178.9963 11 E 3.9272 8.2645 119.4627 59.0890 29.6300 178.5720 12 L 3.8849 8.1556 120.6849 57.9747 42.0489 178.6776 13 L 3.6531 7.9235 120.2106 58.2472 42.0204 178.9457 14 S 4.2539 8.0727 112.9909 61.3858 62.1970 176.2871 15 K 4.0461 8.4037 121.2828 59.1414 31.6622 179.2510 16 A 3.9519 8.2520 121.5662 55.3952 18.2832 179.3355 17 Y 4.2707 8.0817 115.6142 61.3575 37.8474 178.2084 18 H 4.2272 8.5824 119.3296 59.2652 30.0316 177.0663 19 L 3.8681 8.2716 122.4823 58.0091 41.9099 178.3166 20 E 3.9186 8.4666 119.5457 59.6043 29.4927 178.5122 21 N 4.3951 8.2681 116.8383 56.4999 38.9303 176.7031 22 E 3.9097 8.3714 120.4239 59.3275 29.4471 179.4685 23 V 3.5549 8.3158 118.4972 65.8840 31.7135 177.9374 24 A 3.9840 8.0897 120.5646 55.2745 18.0822 179.8677 25 R 3.8993 8.2838 116.8256 59.2459 29.8851 179.0625 26 L 3.9682 7.9365 119.5183 57.9292 42.1483 178.5617 27 K 4.0549 8.1189 119.0326 59.2970 32.1205 178.6037 28 K 4.1129 7.7406 117.8147 59.3257 32.1087 177.4665 29 L 4.2909 7.4470 122.1411 55.0718 41.6860 176.8826 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 4.32 0.00 1.89 2.04 0.00 3.09 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 2 M 7.96 3.89 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.72 0.00 3 K 8.17 3.95 0.00 1.98 2.05 0.00 1.50 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.44 7.81 4 Q 8.00 3.93 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.95 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 5 L 8.00 3.91 0.00 1.91 1.86 0.91 0.77 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 6 E 8.25 3.98 0.00 2.06 1.99 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 2.33 2.57 0.00 7 D 8.04 4.35 0.00 2.88 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 8 K 8.30 4.01 0.00 1.75 1.84 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.58 7.81 9 V 8.19 3.55 2.07 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 1.01 0.00 0.00 0.97 0.00 0.00 10 E 8.34 3.97 0.00 2.02 1.99 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 2.51 2.47 0.00 11 E 8.26 3.93 0.00 2.13 2.11 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 2.30 2.31 0.00 12 L 8.16 3.88 0.00 1.83 1.79 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.92 3.65 0.00 1.67 1.70 0.37 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.07 4.25 0.00 4.02 4.08 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 0.00 0.00 0.00 15 K 8.40 4.05 0.00 1.95 1.85 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.60 7.81 16 A 8.25 3.95 1.22 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 0.00 0.00 17 Y 8.08 4.27 0.00 3.18 2.92 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 18 H 8.58 4.23 0.00 3.33 3.51 0.00 5.61 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.27 3.87 0.00 1.82 1.84 0.91 0.93 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 20 E 8.47 3.92 0.00 2.23 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 2.35 2.36 0.00 21 N 8.27 4.40 0.00 2.92 2.81 0.00 0.00 7.28 7.80 0.00 0.00 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 8.37 3.91 0.00 2.14 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 23 V 8.32 3.55 2.22 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 1.08 0.00 0.00 0.94 0.00 0.00 24 A 8.09 3.98 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 25 R 8.28 3.90 0.00 1.98 1.99 0.00 3.13 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 26 L 7.94 3.97 0.00 1.73 1.87 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.12 4.05 0.00 1.89 2.02 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.53 7.81 28 K 7.74 4.11 0.00 2.01 1.86 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.68 1.63 7.81 29 L 7.45 4.29 0.00 1.70 1.59 0.92 1.25 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