NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0070 8.2127 109.7402 45.2387 0.0000 175.4911 2 I 3.3781 8.0181 119.1405 62.1001 38.4443 171.5377 3 V 3.5465 7.5250 119.1195 66.0401 31.4653 177.2273 4 E 4.0639 8.0144 115.8889 59.1127 29.7206 178.2103 5 Q 4.2266 7.5593 119.0285 57.7318 29.3211 175.4085 6 C 4.9507 7.9345 113.3504 56.6579 41.7851 173.9403 7 C 4.6091 7.8250 115.5384 59.5579 28.2341 174.3094 8 T 4.4869 7.8847 109.2569 61.5250 70.4831 174.2972 9 S 4.7811 7.7407 116.4297 55.9707 65.4310 173.7459 10 I 3.7973 8.2675 125.6235 61.5619 37.3221 176.2596 11 C 4.7736 8.6622 123.6378 55.7470 37.8601 174.4569 12 S 4.4296 8.7458 120.3977 58.4310 64.5016 175.2424 13 L 3.9960 8.6969 123.1096 58.5507 41.1037 179.4287 14 Y 4.1604 7.9672 117.8836 60.8780 38.7480 177.4453 15 Q 3.7750 8.0123 118.9011 58.8573 28.6651 178.8835 16 L 4.2217 8.0351 120.1086 57.6152 41.6429 178.7408 17 E 3.8905 8.1830 119.4468 59.6613 29.1416 178.7024 18 N 4.2165 7.5268 114.7316 55.6547 38.5359 175.7365 19 Y 4.4413 7.7321 116.1904 57.2248 38.7255 175.5802 20 C 4.4031 7.3901 118.5850 59.1574 29.0166 173.5104 21 N 4.4867 8.7734 119.0428 53.9212 38.0769 174.9973 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 G 8.21 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.02 3.38 0.74 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.55 0.66 0.00 0.00 3 V 7.52 3.55 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 1.00 0.00 0.00 0.87 0.00 0.00 4 E 8.01 4.06 0.00 2.17 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 0.00 2.41 2.31 0.00 5 Q 7.56 4.23 0.00 2.26 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 6 C 7.93 4.95 0.00 3.04 2.99 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 0.00 0.00 0.00 7 C 7.83 4.61 0.00 3.11 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.88 4.49 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 9 S 7.74 4.78 0.00 3.85 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.27 3.80 1.88 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 1.42 0.47 0.92 0.00 0.00 11 C 8.66 4.77 0.00 2.97 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.75 4.43 0.00 4.19 4.09 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 13 L 8.70 4.00 0.00 1.81 1.85 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.97 4.16 0.00 2.92 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 15 Q 8.01 3.77 0.00 2.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 16 L 8.04 4.22 0.00 1.93 1.77 0.99 0.79 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 17 E 8.18 3.89 0.00 2.08 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 0.00 2.30 2.40 0.00 18 N 7.53 4.22 0.00 2.27 2.39 0.00 0.00 6.99 7.34 0.00 0.00 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 Y 7.73 4.44 0.00 3.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.39 4.40 0.00 3.07 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.77 4.49 0.00 2.72 2.76 0.00 0.00 6.82 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00