NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8470 8.3549 109.7331 45.5397 0.0000 173.3874 2 R 3.5680 8.1068 115.3967 56.4654 27.9453 176.1984 3 N 4.6306 8.7284 117.4869 52.0432 38.6884 175.1170 4 D 5.1665 7.5579 124.5809 51.7203 42.6966 175.8585 5 P 4.5647 0.0000 0.0000 63.0559 31.3429 179.7460 6 C 4.1456 9.2823 111.4566 58.7952 31.3250 172.2420 7 P 4.8223 0.0000 0.0000 63.3363 31.5273 176.2873 8 C 4.3066 8.3789 118.0881 61.6353 29.3821 174.3422 9 G 4.1587 7.9974 106.6420 45.1246 0.0000 172.1267 10 S 4.4660 7.2856 124.7992 58.1934 68.6136 178.9373 11 G 4.6019 8.8597 105.0580 45.2699 0.0000 171.5905 12 K 4.1095 8.4998 125.1926 57.7672 30.1815 178.0623 13 K 3.8525 7.1194 115.9818 59.2678 33.5311 177.3565 14 Y 3.9701 9.7027 119.2919 60.8027 38.9957 178.9113 15 K 4.0155 8.4002 119.3323 60.0981 32.0481 179.0769 16 Q 4.1347 8.6493 116.4045 58.2030 28.7471 176.9159 17 C 4.2364 7.8013 118.5565 60.4335 32.1951 173.3561 18 H 4.6523 8.0090 115.8757 55.3657 28.9475 176.0149 19 G 4.1832 7.8996 109.5574 47.2140 0.0000 175.1510 20 R 4.0599 7.7751 119.3265 56.1209 31.1879 175.9946 21 L 4.8280 8.1386 124.4722 53.9504 42.1993 175.7586 22 Q 4.0851 7.7011 123.8153 56.4355 29.3508 174.0882 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 8.35 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 2 R 8.11 3.57 0.00 1.98 1.97 0.00 3.20 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 3 N 8.73 4.63 0.00 2.54 2.66 0.00 0.00 6.95 8.09 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 4 D 7.56 5.17 0.00 2.99 2.75 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 0.00 0.00 0.00 0.00 5 P 0.00 4.56 0.00 2.30 1.75 0.00 3.43 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.77 0.00 6 C 9.28 4.15 0.00 3.04 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 7 P 0.00 4.82 0.00 2.20 2.17 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.99 0.00 8 C 8.38 4.31 0.00 3.24 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 9 G 8.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.29 4.47 0.00 3.95 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 11 G 8.86 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 4.11 0.00 2.02 1.97 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.42 7.81 13 K 7.12 3.85 0.00 1.86 1.95 0.00 1.65 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.55 7.81 14 Y 9.70 3.97 0.00 3.11 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.40 4.02 0.00 2.09 1.93 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.69 7.81 16 Q 8.65 4.13 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.52 0.00 17 C 7.80 4.24 0.00 2.82 2.75 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 0.00 0.00 0.00 0.00 18 H 8.01 4.65 0.00 1.40 2.69 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.90 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.78 4.06 0.00 1.79 1.83 0.00 3.17 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 21 L 8.14 4.83 0.00 1.60 1.53 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 7.70 4.09 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.43 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00