NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9529 8.2127 109.7353 45.4353 0.0000 175.8264 2 I 3.1428 8.7823 124.8900 62.6721 38.5159 170.1870 3 V 3.5163 8.3894 120.1138 66.0545 31.6224 177.3465 4 E 3.9761 7.9959 116.5068 59.3629 29.1491 178.6726 5 Q 4.1379 8.3369 119.6361 58.7573 29.0541 176.5949 6 C 5.2808 8.3740 115.5084 56.3442 41.4007 174.6244 7 C 4.3229 7.9896 117.3493 60.1322 28.3414 173.9442 8 T 4.4544 7.6981 116.3769 64.0195 70.0497 174.3232 9 S 4.6090 7.3000 111.1083 56.5540 66.0154 173.5005 10 I 4.0600 8.2129 122.7404 61.6118 37.0478 176.5791 11 C 4.8519 8.5788 123.6611 55.8644 40.5233 174.4861 12 S 4.5731 8.6617 119.0922 57.6921 65.0194 175.5038 13 L 3.9605 8.3467 121.5899 58.1409 40.9795 179.4724 14 Y 4.0640 7.7305 115.8644 60.6954 37.9585 177.5190 15 Q 4.2855 8.3145 117.4015 57.8439 29.1666 178.0102 16 L 4.3694 8.0534 121.8539 57.6663 41.7664 178.5075 17 E 4.0839 8.1055 118.6540 58.7146 29.2696 178.3822 18 N 4.3467 7.6048 114.2783 55.7542 38.6019 175.7703 19 Y 4.5198 7.6076 115.9642 57.5106 38.6460 175.6403 20 C 4.3696 7.0991 117.8658 59.5941 28.9888 173.2699 21 N 4.5069 8.5429 118.6940 54.0033 38.5806 174.8483 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 3.95 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 0.00 0.00 0.00 2 I 8.78 3.14 1.04 0.00 0.00 0.29 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 0.42 0.69 0.00 0.00 3 V 8.39 3.52 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 0.99 0.00 0.00 0.88 0.00 0.00 4 E 8.00 3.98 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 5 Q 8.34 4.14 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.65 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 6 C 8.37 5.28 0.00 2.86 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.32 0.00 3.12 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 7.70 4.45 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 9 S 7.30 4.61 0.00 4.01 3.91 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 10 I 8.21 4.06 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 8.58 4.85 0.00 3.00 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 8.66 4.57 0.00 4.24 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 8.35 3.96 0.00 1.38 1.50 0.82 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.73 4.06 0.00 3.01 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 15 Q 8.31 4.29 0.00 2.39 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 16 L 8.05 4.37 0.00 1.91 1.82 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.11 4.08 0.00 2.15 2.11 0.00 0.00 0.00 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 2.33 0.00 18 N 7.60 4.35 0.00 2.54 2.27 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 7.61 4.52 0.00 3.15 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 20 C 7.10 4.37 0.00 3.14 2.88 0.00 0.00 0.00 0.00 0.00 0.00 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 8.54 4.51 0.00 2.69 2.70 0.00 0.00 6.86 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