NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.9282 8.2876 117.8744 55.5529 30.5110 175.0625 2 P 4.3073 0.0000 0.0000 64.0033 30.7457 172.5541 3 V 3.5167 8.5223 119.1335 65.1215 32.0360 178.0327 4 Y 4.1668 7.7956 115.7389 60.5129 37.7101 177.6687 5 T 4.0723 8.5384 117.3186 66.2242 68.4876 177.0036 6 I 3.9558 7.3824 121.5089 64.0179 36.9629 178.3480 7 L 4.0091 7.7210 119.5413 57.3938 41.0903 179.4434 8 A 4.0412 7.7647 120.7396 55.2461 18.3751 179.7124 9 V 3.4891 7.5255 114.1379 64.8685 31.2510 178.0040 10 A 4.0399 7.7573 120.9188 55.0704 17.9820 178.7538 11 S 4.7736 7.6608 109.9202 58.5777 63.1599 175.5447 12 A 4.4175 7.2709 125.5241 54.5289 19.5809 180.1608 13 T 3.9149 7.6400 114.0772 66.5634 68.7064 177.1637 14 V 3.6935 7.4681 119.1923 64.8468 31.5123 178.0464 15 A 4.0170 7.3329 121.0898 55.4382 18.3401 178.8508 16 M 4.2963 7.8872 113.7167 56.7311 32.5302 177.7525 17 M 4.3102 7.6378 119.5210 57.7116 33.0945 178.4237 18 I 4.0317 7.7667 119.5575 64.1762 36.7467 178.9403 19 G 3.5836 8.1492 106.9749 47.5032 0.0000 175.7754 20 V 3.8571 7.6673 119.5833 65.2093 31.7254 178.1588 21 T 3.9223 8.3668 116.2702 66.4799 67.9760 176.8215 22 V 3.6413 7.8686 119.5807 65.2839 31.1657 177.6275 23 A 4.1324 7.7070 119.4538 53.6939 18.4302 179.1309 24 V 3.9932 7.7180 116.4773 65.1154 32.2226 178.0334 25 L 4.0127 8.0143 118.8516 57.9429 41.4452 179.0260 26 C 4.1121 7.9425 118.0112 62.0000 31.5147 175.3811 27 A 4.0898 7.4628 122.9847 54.8922 17.9164 179.4491 28 C 4.1148 8.5135 115.9204 62.9857 28.2303 176.2891 29 L 3.9911 8.2267 120.4680 57.5398 40.9152 179.3748 30 A 4.0159 7.8737 120.2568 54.7193 18.5997 179.2705 31 R 4.1682 7.8203 115.6162 58.1737 30.0237 179.0442 32 R 4.1351 8.1718 118.4052 58.3833 30.1915 177.6662 33 E 4.4975 8.1597 115.7193 56.6750 29.4175 176.7713 34 C 4.7143 7.8285 116.8841 61.0679 30.7985 175.5426 35 L 4.1509 7.7149 118.0714 57.4759 41.5681 177.1808 36 T 4.1058 7.4544 119.0498 63.7574 68.3327 174.2205 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 H 8.29 4.93 0.00 3.25 3.47 0.00 5.59 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 P 0.00 4.31 0.00 2.36 2.34 0.00 3.79 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 3 V 8.52 3.52 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.87 0.00 0.00 4 Y 7.80 4.17 0.00 3.21 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 T 8.54 4.07 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 6 I 7.38 3.96 1.94 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 1.53 1.41 0.90 0.00 0.00 7 L 7.72 4.01 0.00 1.72 1.68 0.81 0.71 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 8 A 7.76 4.04 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.53 3.49 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 1.01 0.00 0.00 1.02 0.00 0.00 10 A 7.76 4.04 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 11 S 7.66 4.77 0.00 3.92 3.87 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 12 A 7.27 4.42 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.64 3.91 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 14 V 7.47 3.69 2.16 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 1.01 0.00 0.00 0.96 0.00 0.00 15 A 7.33 4.02 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.89 4.30 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.57 0.00 17 M 7.64 4.31 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.56 0.00 18 I 7.77 4.03 2.03 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 1.45 1.08 0.91 0.00 0.00 19 G 8.15 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.67 3.86 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.95 0.00 0.00 21 T 8.37 3.92 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 1.21 0.00 0.00 22 V 7.87 3.64 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.95 0.00 0.00 23 A 7.71 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.72 3.99 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.99 0.00 0.00 25 L 8.01 4.01 0.00 1.85 1.70 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 26 C 7.94 4.11 0.00 3.06 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 27 A 7.46 4.09 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.51 4.11 0.00 3.12 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 29 L 8.23 3.99 0.00 1.68 1.71 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.87 4.02 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.82 4.17 0.00 1.94 1.98 0.00 3.12 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 32 R 8.17 4.14 0.00 1.89 1.96 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 33 E 8.16 4.50 0.00 2.08 1.96 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 0.00 2.33 2.36 0.00 34 C 7.83 4.71 0.00 2.99 2.91 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 35 L 7.71 4.15 0.00 1.70 1.73 0.95 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.45 4.11 4.35 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 1.21 0.00 0.00