NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3995 8.1133 119.0794 55.2248 31.4476 176.1915 2 P 4.2659 0.0000 0.0000 64.7380 31.2386 175.8303 3 E 4.0178 8.9954 118.2609 59.5452 29.8916 179.0204 4 I 3.7222 7.7799 119.2882 64.1317 37.2634 178.1086 5 W 4.1374 8.5487 129.0735 60.3637 30.4631 177.8333 6 A 3.7255 8.6095 120.8363 55.0563 17.7820 179.3410 7 A 3.8617 8.1573 119.4483 55.5121 18.4005 179.7233 8 Q 3.8246 8.1627 118.0107 58.9274 29.0173 178.0164 9 E 3.6054 7.7301 120.5065 59.2098 29.5890 178.8751 10 I 3.6414 7.7070 120.0120 64.2938 37.1688 178.3987 11 R 3.8724 8.2424 119.9483 59.4125 29.9252 178.9117 12 R 3.8847 8.0091 117.9420 59.3684 30.1237 179.1374 13 I 3.8505 8.1973 120.2375 64.0375 36.9650 178.7701 14 G 3.6071 8.4536 107.1539 48.0357 0.0000 175.5957 15 D 4.4032 8.0727 121.5681 56.6737 40.7987 178.4235 16 E 3.9212 8.1264 119.8510 59.5129 29.6838 178.7037 17 N 4.5203 8.3231 116.4430 56.3179 38.6611 176.9520 18 N 4.3878 8.7062 118.6395 56.7632 38.8840 176.7846 19 A 4.0455 8.0900 121.0954 55.2177 18.4968 178.7120 20 Y 4.1249 7.7396 117.1291 61.0515 39.3157 177.4088 21 Y 4.1033 8.1845 116.1250 59.2331 38.0510 176.9977 22 A 4.1013 7.5091 119.9801 53.1518 18.3971 177.4838 23 R 4.1082 7.7020 122.2941 56.3660 30.6448 175.9163 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 4.40 0.00 1.75 1.88 0.00 3.22 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.23 0.00 2 P 0.00 4.27 0.00 2.29 2.17 0.00 3.60 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 3 E 9.00 4.02 0.00 2.05 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 2.43 2.44 0.00 4 I 7.78 3.72 2.06 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.90 0.96 0.00 0.00 5 W 8.55 4.14 0.00 3.40 3.44 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 6 A 8.61 3.73 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.16 3.86 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 8 Q 8.16 3.82 0.00 2.22 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 9 E 7.73 3.61 0.00 1.38 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.12 0.00 10 I 7.71 3.64 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.54 0.87 0.00 0.00 11 R 8.24 3.87 0.00 1.93 2.03 0.00 3.07 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 12 R 8.01 3.88 0.00 1.91 1.90 0.00 3.31 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.74 0.00 13 I 8.20 3.85 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.79 0.94 0.00 0.00 14 G 8.45 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.07 4.40 0.00 2.73 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.13 3.92 0.00 2.11 2.14 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 2.27 2.32 0.00 17 N 8.32 4.52 0.00 3.09 3.05 0.00 0.00 6.73 6.54 0.00 0.00 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 N 8.71 4.39 0.00 3.00 2.96 0.00 0.00 7.11 8.27 0.00 0.00 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 A 8.09 4.05 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 20 Y 7.74 4.12 0.00 2.94 3.06 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 0.00 0.00 0.00 0.00 21 Y 8.18 4.10 0.00 3.17 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 22 A 7.51 4.10 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 7.70 4.11 0.00 1.94 2.16 0.00 3.33 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00