NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3203 8.1076 123.5827 52.3456 19.3876 176.2814 2 C 4.2745 8.8011 117.2977 53.8978 40.5985 172.0328 3 N 4.3625 7.3253 119.6660 53.1974 38.2990 176.8226 4 D 4.4983 8.6796 119.4520 56.6375 39.4603 178.1013 5 R 3.9492 8.0517 120.1102 59.7299 30.0401 178.1953 6 D 4.4317 8.3974 117.5015 57.2227 41.0472 178.2870 7 C 4.2584 8.2260 119.6290 59.5471 41.2741 175.5295 8 S 4.0797 8.3518 116.1223 61.5904 62.6122 176.0064 9 L 3.9329 7.6981 122.9933 57.5951 41.4464 179.3044 10 D 4.3753 8.1846 117.4407 57.4773 40.9899 177.5565 11 C 4.5087 8.6541 117.5987 60.2580 40.0147 176.2142 12 I 3.7977 8.1331 120.6746 64.2724 36.6782 178.0388 13 M 4.1959 7.6136 118.5943 57.9844 32.0672 178.1841 14 K 3.9489 8.5037 118.1710 58.5880 32.3376 176.9346 15 G 3.4196 7.3063 112.1836 45.5435 0.0000 173.4231 16 Y 4.7392 6.3162 124.1642 58.3899 39.3603 175.7103 17 N 4.9162 9.0463 117.7793 56.0689 42.0466 174.5523 18 T 4.5670 7.9365 111.0396 61.6552 71.8285 171.9513 19 G 4.9853 8.1750 109.3365 47.5789 0.0000 171.7184 20 S 4.7231 7.9195 114.5128 57.5124 67.8025 174.1831 21 C 5.5497 8.5905 121.1455 55.8692 42.6303 172.9092 22 V 4.3221 8.0815 124.7431 62.3028 33.3118 175.0692 23 R 3.8458 10.0374 124.9628 57.0078 27.7475 176.4977 24 G 3.9801 8.7713 102.8620 45.8174 0.0000 174.0347 25 S 4.8580 8.5932 117.5763 57.2100 67.1380 172.1166 26 C 5.1923 8.7682 122.8449 56.7434 46.0595 174.6163 27 Q 4.8382 8.8482 125.1548 54.3829 31.8928 174.0294 28 C 5.4851 8.3120 117.0283 55.4915 38.3445 173.7567 29 R 4.6520 9.4660 119.4311 55.0227 34.2187 175.0232 30 R 4.7208 8.6842 122.5127 55.3465 31.8961 176.9761 31 T 4.4909 7.9892 112.5896 58.6982 67.9817 173.2776 32 S 4.4795 7.5128 120.6214 58.6532 65.7246 176.6401 33 G 3.6193 9.0087 109.4339 45.4929 0.0000 173.8352 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 A 8.11 4.32 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.80 4.27 0.00 3.37 3.21 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 0.00 0.00 0.00 3 N 7.33 4.36 0.00 2.87 3.04 0.00 0.00 6.65 7.96 0.00 0.00 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 8.68 4.50 0.00 2.89 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.05 3.95 0.00 1.84 1.94 0.00 3.29 0.00 0.00 3.34 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 6 D 8.40 4.43 0.00 2.99 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.26 0.00 3.22 3.11 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 0.00 0.00 0.00 8 S 8.35 4.08 0.00 4.06 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 9 L 7.70 3.93 0.00 1.99 1.80 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.18 4.38 0.00 3.05 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.65 4.51 0.00 3.20 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 3.80 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.49 0.92 0.00 0.00 13 M 7.61 4.20 0.00 2.00 2.35 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.70 0.00 14 K 8.50 3.95 0.00 1.87 1.74 0.00 1.95 0.00 0.00 1.90 0.00 0.00 3.10 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.51 1.73 7.81 15 G 7.31 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 6.32 4.74 0.00 3.05 2.76 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 17 N 9.05 4.92 0.00 2.72 2.99 0.00 0.00 6.55 7.72 0.00 0.00 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 T 7.94 4.57 4.26 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 1.31 0.00 0.00 19 G 8.18 4.99 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 0.00 0.00 0.00 20 S 7.92 4.72 0.00 3.73 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.59 5.55 0.00 3.14 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 22 V 8.08 4.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.96 0.00 0.00 23 R 10.04 3.85 0.00 1.89 1.93 0.00 3.29 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 24 G 8.77 3.98 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 0.00 0.00 0.00 25 S 8.59 4.86 0.00 3.82 3.75 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 26 C 8.77 5.19 0.00 2.93 2.93 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 27 Q 8.85 4.84 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.39 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 28 C 8.31 5.49 0.00 1.91 2.93 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 R 9.47 4.65 0.00 1.56 1.73 0.00 3.07 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.55 0.00 30 R 8.68 4.72 0.00 1.75 1.91 0.00 3.25 0.00 0.00 3.51 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.88 0.00 31 T 7.99 4.49 4.25 0.00 0.00 0.00 0.00 0.00 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 32 S 7.51 4.48 0.00 3.95 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 9.01 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00