NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.1592 8.1600 109.1433 45.1988 0.0000 174.6940 2 I 3.2843 8.1133 121.5664 62.7445 37.8168 173.2202 3 V 3.5381 8.4227 120.1577 65.9567 31.7151 177.3125 4 E 3.9498 8.0464 117.8571 59.4989 29.1978 178.9636 5 Q 4.0443 7.9463 118.3508 58.2709 29.2910 176.2864 6 C 5.1307 8.3180 115.6971 55.9039 41.6235 174.6028 7 C 4.3242 7.8861 117.4483 60.2976 28.2740 174.9211 8 T 4.2929 7.6684 117.3629 64.0734 69.0778 174.4732 9 S 4.7405 7.0195 114.0710 55.7890 66.1717 173.2263 10 I 3.9268 8.3118 122.8479 61.9339 36.9805 176.4240 11 C 4.7807 8.6240 123.9885 55.8795 42.4360 174.6496 12 S 4.5587 8.5518 119.9453 57.9552 64.8404 175.4162 13 L 3.8918 8.4053 122.1114 58.2473 41.0253 179.4271 14 Y 4.1061 7.8686 115.2623 60.7954 37.8249 177.5810 15 Q 4.2449 8.0302 117.9226 58.9649 28.9604 178.6294 16 L 4.3019 8.1985 119.6386 57.1961 41.7743 178.8627 17 E 4.1006 8.2369 119.4163 58.6619 29.3477 177.6872 18 N 4.5675 7.7951 114.1992 54.7080 38.6911 174.8693 19 Y 4.4099 7.5647 116.5954 57.8625 38.8915 175.5532 20 C 4.5183 7.6813 117.9357 59.1057 29.1853 173.4799 21 N 4.5404 8.4959 116.9571 53.8110 38.2669 175.5519 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 8.16 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 2 I 8.11 3.28 0.79 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.93 0.68 0.00 0.00 3 V 8.42 3.54 2.05 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 0.99 0.00 0.00 0.88 0.00 0.00 4 E 8.05 3.95 0.00 2.27 1.99 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 2.41 2.43 0.00 5 Q 7.95 4.04 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.71 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 6 C 8.32 5.13 0.00 2.94 3.03 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 0.00 0.00 0.00 7 C 7.89 4.32 0.00 3.14 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 8 T 7.67 4.29 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 1.22 0.00 0.00 9 S 7.02 4.74 0.00 3.95 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 10 I 8.31 3.93 1.89 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 0.54 0.93 0.00 0.00 11 C 8.62 4.78 0.00 2.97 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 12 S 8.55 4.56 0.00 4.32 4.13 0.00 0.00 0.00 0.00 0.00 0.00 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 8.41 3.89 0.00 1.10 1.28 0.88 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.87 4.11 0.00 2.96 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 15 Q 8.03 4.24 0.00 2.47 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 16 L 8.20 4.30 0.00 1.86 1.75 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.24 4.10 0.00 2.16 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 2.32 2.35 0.00 18 N 7.80 4.57 0.00 2.47 2.66 0.00 0.00 6.88 7.12 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 19 Y 7.56 4.41 0.00 3.16 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 7.68 4.52 0.00 3.02 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 4.54 0.00 2.72 2.73 0.00 0.00 6.72 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