NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0151 8.2127 109.7437 45.2481 0.0000 175.6729 2 I 3.3291 8.2982 120.4193 62.5521 37.8245 173.1116 3 V 3.5257 8.4045 119.9967 65.9447 31.6911 177.1729 4 E 3.9625 8.0659 116.5758 59.6355 29.4572 178.7649 5 Q 4.1836 8.2990 118.5046 58.4716 29.2730 175.8506 6 C 5.1614 8.0981 112.6899 55.6429 41.9704 174.1106 7 C 4.2675 8.1779 116.6785 60.0563 28.7180 174.6026 8 T 4.3169 7.9391 109.2811 62.5272 69.4736 174.9921 9 S 4.7909 7.4900 114.5802 55.5069 66.2032 173.1243 10 I 3.9353 8.2491 122.3748 61.6628 37.4978 176.2611 11 C 5.1053 8.4299 121.6454 55.1377 40.5663 174.6928 12 S 4.5032 9.0450 119.3301 57.8249 64.9406 175.4809 13 L 3.9487 8.2675 122.1411 58.2697 41.0326 179.4185 14 Y 4.3541 7.5281 115.3572 61.2699 38.0083 178.2312 15 Q 4.2257 8.2694 118.9536 58.9258 28.7610 178.6608 16 L 4.2910 8.1462 120.1526 57.6200 41.6441 178.9330 17 E 4.0007 8.4693 119.1760 58.9716 29.2340 178.4138 18 N 4.3125 7.7898 115.8000 55.8868 38.3184 175.6267 19 Y 4.4962 8.0823 116.7977 57.2615 38.3046 175.4000 20 C 4.4038 7.2406 118.1722 59.3327 29.0185 173.5200 21 N 4.5445 8.5663 117.5612 53.8189 38.1302 175.3741 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 4.02 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 0.00 0.00 0.00 2 I 8.30 3.33 0.88 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 1.16 1.08 0.68 0.00 0.00 3 V 8.40 3.53 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 8.07 3.96 0.00 2.15 2.02 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 2.33 2.44 0.00 5 Q 8.30 4.18 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.69 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 6 C 8.10 5.16 0.00 3.05 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 8.18 4.27 0.00 3.10 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 8 T 7.94 4.32 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 7.49 4.79 0.00 3.97 3.95 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 10 I 8.25 3.94 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.54 0.91 0.00 0.00 11 C 8.43 5.11 0.00 2.96 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 12 S 9.05 4.50 0.00 4.07 4.05 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 13 L 8.27 3.95 0.00 1.35 1.58 0.81 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.53 4.35 0.00 3.01 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 8.27 4.23 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 16 L 8.15 4.29 0.00 1.91 1.79 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.47 4.00 0.00 2.31 2.12 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 2.35 2.41 0.00 18 N 7.79 4.31 0.00 2.52 2.51 0.00 0.00 6.95 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 8.08 4.50 0.00 3.09 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 20 C 7.24 4.40 0.00 3.06 2.89 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 0.00 0.00 0.00 21 N 8.57 4.54 0.00 2.73 2.74 0.00 0.00 6.79 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