NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9926 8.2127 109.7426 45.4798 0.0000 173.5555 2 I 2.7628 7.8385 117.5295 62.9538 37.4827 173.8927 3 V 3.4535 7.6606 119.0307 65.8620 31.9499 176.9446 4 E 3.9062 8.0623 118.5445 59.5545 29.2975 178.7018 5 Q 4.0705 8.1152 116.8512 58.4138 28.9060 176.9619 6 C 4.7968 8.3138 115.4378 57.1300 41.9604 174.9685 7 C 4.3919 7.7588 118.2892 61.6773 32.1161 175.3651 8 T 4.0077 7.9665 115.9891 66.8621 68.5124 175.0279 9 S 4.6779 7.8219 114.6381 57.2170 65.1242 172.8931 10 I 4.5019 8.1253 121.3727 59.9804 38.7881 174.2128 11 C 5.2464 8.5458 119.0836 53.3052 44.7284 174.2648 12 S 4.5949 8.8159 117.0101 57.3077 65.2137 175.1183 13 L 3.9369 8.4001 122.9168 58.4707 41.5835 178.0375 14 Y 3.9941 8.1145 118.8427 60.9905 38.5055 178.1442 15 Q 3.9648 8.0727 117.4688 58.8507 29.0535 178.2291 16 L 4.3004 8.2891 121.6271 58.3267 42.1947 178.9315 17 E 3.9646 8.4857 118.6329 59.0796 29.1420 178.4685 18 N 4.3518 7.4860 114.8474 54.7415 38.6564 175.6663 19 Y 4.5058 7.5810 117.2790 57.2794 38.7690 175.5891 20 C 4.2593 7.2649 118.2979 60.2497 29.0013 173.2473 21 N 4.4556 8.7421 119.4796 54.2901 39.5488 173.8647 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 3.99 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 0.00 0.00 0.00 2 I 7.84 2.76 0.56 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.90 0.63 0.00 0.00 3 V 7.66 3.45 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 1.03 0.00 0.00 0.86 0.00 0.00 4 E 8.06 3.91 0.00 2.07 2.09 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 2.39 2.41 0.00 5 Q 8.12 4.07 0.00 2.21 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.56 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 6 C 8.31 4.80 0.00 2.99 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 C 7.76 4.39 0.00 2.92 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 7.97 4.01 4.41 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 1.21 0.00 0.00 9 S 7.82 4.68 0.00 4.13 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 4.50 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 1.48 0.58 0.93 0.00 0.00 11 C 8.55 5.25 0.00 3.21 3.21 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 0.00 0.00 0.00 12 S 8.82 4.59 0.00 4.14 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 3.94 0.00 1.81 1.77 0.94 0.75 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 14 Y 8.11 3.99 0.00 3.05 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 15 Q 8.07 3.96 0.00 2.36 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.74 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 16 L 8.29 4.30 0.00 1.91 1.85 0.97 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.49 3.96 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 18 N 7.49 4.35 0.00 2.38 2.47 0.00 0.00 6.96 7.75 0.00 0.00 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 7.58 4.51 0.00 3.09 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 20 C 7.26 4.26 0.00 3.07 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 8.74 4.46 0.00 2.76 2.70 0.00 0.00 6.88 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