NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8455 8.3549 109.7181 45.8646 0.0000 174.0878 3 K 4.0723 7.7464 115.3589 55.2324 33.2009 175.7642 4 G 3.7217 7.6429 106.2158 44.8508 0.0000 173.1266 5 D 4.4526 7.6592 120.2231 53.3377 39.5824 176.2849 6 R 4.4123 8.3123 117.5712 56.4927 29.0137 177.4255 7 R 4.1607 7.9702 114.2511 56.1313 29.7257 174.6910 8 T 4.5072 7.3660 107.3643 59.5226 71.5647 172.9394 9 R 3.9369 7.9187 119.8000 60.1020 29.6357 177.7094 10 R 4.1470 8.1016 118.7603 58.9172 30.4600 179.2012 11 G 3.6208 7.7134 106.0736 47.5788 0.0000 175.9169 12 K 4.1942 8.2972 120.6977 58.9375 32.0682 179.1433 13 I 3.6612 7.9065 118.7515 64.3497 37.0316 177.7567 14 W 4.2539 8.1077 127.7576 60.7575 30.8197 178.2529 15 R 3.9070 7.7476 114.7758 56.9138 29.4978 177.8425 16 G 3.6450 8.7149 107.4569 45.9362 0.0000 173.3373 17 T 4.2774 7.3711 109.3080 59.8761 70.9560 172.9748 18 Y 5.0712 7.8558 117.7783 56.7147 42.3976 176.0088 19 G 3.9154 8.5376 112.7122 46.0585 0.0000 175.4806 20 K 3.9701 8.9261 125.0031 57.2766 32.3995 176.6837 21 Y 4.4305 7.8360 113.5903 58.6127 39.9764 175.5298 22 R 4.4334 7.7406 119.6964 54.3511 31.6297 172.3529 23 P 5.0878 0.0000 0.0000 61.6037 33.5424 176.1387 24 R 4.0706 8.2537 116.9974 56.3474 30.3548 176.8904 25 K 4.1753 7.9688 123.1643 56.5583 31.4334 176.0812 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 2 G 8.35 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 7.75 4.07 0.00 1.33 0.89 0.00 1.51 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.20 1.34 7.81 4 G 7.64 3.72 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 0.00 0.00 0.00 5 D 7.66 4.45 0.00 2.59 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 4.41 0.00 1.98 2.04 0.00 3.06 0.00 0.00 3.30 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 7 R 7.97 4.16 0.00 1.01 1.72 0.00 2.89 0.00 0.00 3.09 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.18 0.00 8 T 7.37 4.51 4.19 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 1.13 0.00 0.00 9 R 7.92 3.94 0.00 1.99 1.88 0.00 3.32 0.00 0.00 3.40 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.85 0.00 10 R 8.10 4.15 0.00 2.02 2.00 0.00 3.17 0.00 0.00 3.34 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 11 G 7.71 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.30 4.19 0.00 2.05 1.99 0.00 1.70 0.00 0.00 1.88 0.00 0.00 3.29 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.54 1.56 7.81 13 I 7.91 3.66 2.11 0.00 0.00 0.91 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 0.73 0.96 0.00 0.00 14 W 8.11 4.25 0.00 3.36 3.42 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 15 R 7.75 3.91 0.00 1.91 1.96 0.00 3.38 0.00 0.00 3.30 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.00 0.00 16 G 8.71 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.37 4.28 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 18 Y 7.86 5.07 0.00 2.94 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.54 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 0.00 0.00 0.00 20 K 8.93 3.97 0.00 1.57 1.36 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.48 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.77 1.19 7.81 21 Y 7.84 4.43 0.00 3.04 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 22 R 7.74 4.43 0.00 1.92 1.96 0.00 3.15 0.00 0.00 3.37 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 23 P 0.00 5.09 0.00 2.05 1.97 0.00 3.75 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.08 0.00 24 R 8.25 4.07 0.00 1.67 1.78 0.00 2.90 0.00 0.00 2.31 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.38 0.00 25 K 7.97 4.18 0.00 1.76 2.14 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.27 1.33 7.81