NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 5.0077 8.2516 120.4249 54.9908 33.1206 174.5815 2 K 3.8274 8.5111 127.2415 56.4202 32.9039 171.4406 3 V 3.8819 9.1514 117.9892 62.9840 34.2062 177.3083 4 R 3.3965 7.7303 115.0071 57.1398 29.2387 175.0692 5 A 4.6738 8.4150 116.3980 52.3411 21.0179 176.3537 6 S 4.7652 7.6150 110.4358 57.2650 62.6454 174.0781 7 V 3.0337 7.0503 117.4048 61.7105 32.2189 173.6954 8 K 3.6584 7.9574 129.3910 54.0576 33.1646 176.2555 9 K 4.2659 8.2647 122.4019 57.0966 32.6704 174.6602 10 L 4.6172 7.5355 116.9686 55.7736 47.2435 180.2157 11 C 4.5919 7.8061 126.5266 58.7895 30.7575 174.7853 12 R 4.3244 8.5414 111.1194 57.6816 30.3578 176.8696 13 N 4.8698 8.0822 115.5844 53.7287 39.7177 173.8244 14 C 5.4882 7.6657 117.5739 58.1079 28.9907 172.8033 15 K 4.1217 9.0114 124.7204 58.5220 32.9836 177.1628 16 I 4.1606 8.0694 124.8106 63.6432 34.3007 173.2866 17 V 4.1674 7.6497 127.9058 63.5700 33.7019 175.6131 18 K 4.6611 7.7535 110.8807 56.3508 33.2093 176.1870 19 R 4.0534 7.7273 117.0696 57.1014 30.8528 178.1908 20 D 4.3572 9.7191 118.2956 54.9411 39.3985 174.4958 21 G 3.7893 7.9653 106.8450 45.5952 0.0000 173.6298 22 V 4.1371 7.8173 120.8620 60.5076 33.3977 174.3162 23 I 4.2645 8.5316 129.9556 62.2989 35.8910 175.8215 24 R 4.6153 8.3372 125.6633 54.3994 33.2881 174.8011 25 V 4.7269 8.0528 117.9648 61.5547 35.1772 174.1941 26 I 4.7751 8.3343 126.6009 59.6311 41.5142 173.5315 27 C 5.8336 8.8157 125.7205 56.3075 34.2868 173.9020 28 S 4.6776 8.8149 119.9837 58.5404 62.8561 173.6837 29 A 4.4711 7.8736 121.8913 53.6690 20.6417 176.8492 30 E 4.6179 7.5681 114.1785 53.7607 32.2505 175.7062 31 P 4.2881 0.0000 0.0000 65.3239 31.6752 178.5607 32 K 3.9774 8.0309 116.3482 59.0127 32.0717 177.3530 33 H 4.5298 7.8245 114.8232 57.5562 29.4051 175.9073 34 K 4.4508 8.2830 121.9126 56.6271 29.6713 176.1043 35 Q 5.3007 7.7419 121.6787 54.0349 31.2013 174.2133 36 R 4.6142 8.0744 121.9547 56.0475 33.0880 175.0218 37 Q 3.9387 8.5114 116.0691 55.9224 29.8743 178.5101 38 G 3.7589 8.3273 108.1853 46.6596 0.0000 173.2979 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 M 8.25 5.01 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.40 0.00 2 K 8.51 3.83 0.00 1.91 1.68 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.53 7.81 3 V 9.15 3.88 2.08 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 0.80 0.00 0.00 0.93 0.00 0.00 4 R 7.73 3.40 0.00 1.89 2.00 0.00 3.14 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 5 A 8.41 4.67 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 7.62 4.77 0.00 3.82 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.05 3.03 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.93 0.00 0.00 8 K 7.96 3.66 0.00 1.88 1.95 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.31 1.40 7.81 9 K 8.26 4.27 0.00 1.87 1.85 0.00 1.48 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.52 7.81 10 L 7.54 4.62 0.00 1.34 1.20 0.82 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 11 C 7.81 4.59 0.00 3.12 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 12 R 8.54 4.32 0.00 2.01 2.22 0.00 2.96 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 13 N 8.08 4.87 0.00 2.73 2.93 0.00 0.00 7.08 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 C 7.67 5.49 0.00 2.81 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 9.01 4.12 0.00 1.74 1.80 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.51 7.81 16 I 8.07 4.16 1.87 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 1.28 0.91 0.93 0.00 0.00 17 V 7.65 4.17 2.08 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 0.97 0.00 0.00 0.93 0.00 0.00 18 K 7.75 4.66 0.00 1.76 1.65 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.32 1.32 7.81 19 R 7.73 4.05 0.00 1.91 1.83 0.00 3.32 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 20 D 9.72 4.36 0.00 2.83 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.97 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 7.82 4.14 2.08 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 0.97 0.00 0.00 0.98 0.00 0.00 23 I 8.53 4.26 1.87 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 1.34 0.65 0.91 0.00 0.00 24 R 8.34 4.62 0.00 1.81 1.86 0.00 3.11 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 25 V 8.05 4.73 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 1.13 0.00 0.00 0.99 0.00 0.00 26 I 8.33 4.78 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 1.23 0.79 0.91 0.00 0.00 27 C 8.82 5.83 0.00 3.05 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 28 S 8.81 4.68 0.00 4.01 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.87 4.47 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 7.57 4.62 0.00 1.38 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 31 P 0.00 4.29 0.00 2.16 2.08 0.00 3.57 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 32 K 8.03 3.98 0.00 1.79 1.92 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 33 H 7.82 4.53 0.00 3.21 3.34 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.28 4.45 0.00 1.75 1.87 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.39 7.81 35 Q 7.74 5.30 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.49 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 36 R 8.07 4.61 0.00 1.92 1.66 0.00 3.28 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 37 Q 8.51 3.94 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 38 G 8.33 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00