NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4237 0.0000 0.0000 62.4288 32.7706 176.4400 2 C 4.4480 8.5729 118.8988 53.4231 41.6798 171.5931 3 P 4.6666 0.0000 0.0000 61.2836 33.1975 175.0592 4 P 4.1959 0.0000 0.0000 66.4525 30.7625 178.9804 5 V 3.7258 7.7367 111.2525 64.0408 31.2653 178.8571 6 C 5.0874 8.0503 117.5377 59.0627 40.1684 175.8229 7 V 3.6351 7.6983 118.6016 65.7903 31.3407 177.3216 8 A 4.3110 7.8116 118.8349 52.9193 19.2695 177.5724 9 Q 4.4457 7.8311 116.1586 54.8263 33.2183 174.2137 10 C 4.9713 8.4991 124.2014 55.4499 36.7707 173.0287 11 V 4.0796 7.2578 117.3869 59.6173 32.6544 175.9464 12 P 4.3432 0.0000 0.0000 65.4191 31.3108 178.2770 13 T 4.1041 7.7310 107.1884 63.6260 69.3420 175.9302 14 C 4.4225 7.4837 119.9167 55.6076 42.0235 171.6554 15 P 4.1586 0.0000 0.0000 62.3312 31.2386 177.0806 16 Q 3.8665 8.5932 123.0160 59.4447 28.6793 178.0068 17 Y 4.3019 7.3367 116.5755 59.1875 38.3627 177.4789 18 C 4.6664 7.5909 117.2268 56.8713 41.0493 172.9616 19 C 4.4293 7.2327 121.5625 56.1071 43.7414 171.9037 20 P 4.5739 0.0000 0.0000 62.0337 30.9122 175.2141 21 A 4.0949 8.3753 128.2018 51.3750 18.8045 178.2408 22 K 4.1889 8.7437 123.2545 56.0550 29.5619 176.1415 23 R 4.3392 7.2668 121.2359 55.8261 33.0022 174.3512 24 K 4.0445 8.4820 118.9984 57.6672 31.8890 174.7648 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 P 0.00 4.42 0.00 2.08 2.08 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.14 0.00 2 C 8.57 4.45 0.00 3.06 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 3 P 0.00 4.67 0.00 2.21 2.16 0.00 3.68 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 4 P 0.00 4.20 0.00 2.28 2.37 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 5 V 7.74 3.73 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 0.80 0.00 0.00 0.91 0.00 0.00 6 C 8.05 5.09 0.00 3.05 3.09 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 0.00 0.00 0.00 0.00 7 V 7.70 3.64 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.93 0.00 0.00 8 A 7.81 4.31 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.83 4.45 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 10 C 8.50 4.97 0.00 2.91 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 11 V 7.26 4.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.91 0.00 0.00 12 P 0.00 4.34 0.00 2.02 2.10 0.00 3.65 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 13 T 7.73 4.10 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 C 7.48 4.42 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 15 P 0.00 4.16 0.00 0.59 1.68 0.00 3.56 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 16 Q 8.59 3.87 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.95 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 17 Y 7.34 4.30 0.00 3.11 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 18 C 7.59 4.67 0.00 2.94 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 7.23 4.43 0.00 2.95 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 20 P 0.00 4.57 0.00 2.12 2.09 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.16 0.00 21 A 8.38 4.09 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.74 4.19 0.00 1.76 1.80 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.43 7.81 23 R 7.27 4.34 0.00 1.71 1.75 0.00 3.28 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.48 0.00 24 K 8.48 4.04 0.00 1.84 1.69 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.19 1.25 7.81