NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5011 V 3.7316 8.0544 120.3503 62.8151 32.5117 174.2145 5012 S 4.2390 8.0792 115.2069 56.3185 62.0955 171.2791 5013 Y 4.9984 7.8970 124.7593 55.4804 40.9437 173.6540 5014 P 4.8181 0.0000 0.0000 61.5567 33.4523 174.9474 5015 I 4.1276 7.9451 109.3932 60.6769 39.4053 175.8252 5016 F 3.7003 7.4601 120.0526 56.9245 39.1915 175.5513 5017 T 4.2775 7.4143 114.9697 61.4231 68.6235 175.1569 5018 V 3.8101 8.3908 124.7280 64.7749 31.3168 177.9291 5019 R 4.0890 8.0551 116.6776 57.4026 30.0419 176.8985 5020 W 4.4857 7.9673 127.3317 60.2682 31.2989 177.9502 5021 V 3.2836 8.1712 116.1167 65.9097 31.1664 177.1567 5022 A 3.9944 7.9776 120.5863 55.1630 18.1505 179.4035 5023 V 3.4164 7.6864 115.2217 66.5305 31.3288 177.2962 5024 H 4.1653 7.3644 112.1341 56.7712 28.5569 177.0792 5025 T 4.0736 7.6126 118.7939 65.9417 68.8979 176.2080 5026 L 4.1953 7.5512 120.1692 57.5010 41.3732 178.5766 5027 A 3.8830 8.0544 122.1955 54.9709 18.1189 180.0348 5028 V 3.5954 7.5189 117.5642 64.3284 31.5427 176.6599 5029 P 4.1527 0.0000 0.0000 65.6124 31.1016 178.6041 5030 T 3.7596 7.5231 115.7258 66.5162 66.9930 176.1464 5031 I 3.8688 7.7091 118.9363 62.8951 37.8795 177.1722 5032 F 4.6686 7.7719 120.9796 61.1476 39.4463 177.3569 5033 F 4.2770 8.7694 117.8167 60.8365 38.8696 177.7010 5034 L 3.7243 9.0329 118.9660 57.6307 41.1301 179.7737 5035 G 3.7160 7.5979 104.4523 46.9855 0.0000 175.7061 5036 A 4.1908 8.2600 123.1079 55.1317 18.3727 179.4702 5037 I 3.5461 8.5012 119.0696 64.8241 36.9452 178.3074 5038 A 3.5371 8.1588 121.0089 55.4736 18.3802 179.3662 5039 A 3.8894 8.0736 118.7070 54.9470 18.4337 179.4661 5040 M 4.0565 9.0428 118.6951 57.8971 32.0315 178.2305 5041 Q 4.0570 7.4762 115.2881 57.3843 29.0178 177.0357 5042 F 4.5916 8.5066 118.6399 58.5912 41.5134 175.8716 5043 I 3.7946 6.7277 118.2942 61.8354 37.5761 174.4000 5044 Q 4.3628 8.1795 117.7432 55.8846 30.6648 174.0549 5045 R 4.1747 8.8561 117.3840 56.7730 30.6289 175.0907 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 5011 V 8.05 3.73 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 0.75 0.00 0.00 0.78 0.00 0.00 5012 S 8.08 4.24 0.00 3.83 3.70 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 5013 Y 7.90 5.00 0.00 2.97 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5014 P 0.00 4.82 0.00 2.18 2.10 0.00 3.82 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 1.94 1.98 0.00 5015 I 7.95 4.13 1.34 0.00 0.00 0.40 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 -0.36 0.76 0.00 0.00 5016 F 7.46 3.70 0.00 2.88 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5017 T 7.41 4.28 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 1.30 0.00 0.00 5018 V 8.39 3.81 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.99 0.00 0.00 5019 R 8.06 4.09 0.00 1.84 2.03 0.00 3.40 0.00 0.00 3.24 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 5020 W 7.97 4.49 0.00 3.44 3.46 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 5021 V 8.17 3.28 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 1.00 0.00 0.00 1.31 0.00 0.00 5022 A 7.98 3.99 1.30 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 0.00 0.00 5023 V 7.69 3.42 1.91 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 1.03 0.00 0.00 0.92 0.00 0.00 5024 H 7.36 4.17 0.00 2.56 2.93 0.00 5.89 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5025 T 7.61 4.07 4.16 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 0.00 0.00 0.00 1.15 0.00 0.00 5026 L 7.55 4.20 0.00 1.71 1.79 0.92 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 5027 A 8.05 3.88 1.30 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 0.00 0.00 5028 V 7.52 3.60 1.99 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 0.89 0.00 0.00 0.97 0.00 0.00 5029 P 0.00 4.15 0.00 1.92 2.19 0.00 3.56 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 5030 T 7.52 3.76 4.40 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 5031 I 7.71 3.87 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.26 1.01 0.00 0.00 5032 F 7.77 4.67 0.00 3.28 3.17 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 0.00 0.00 0.00 0.00 5033 F 8.77 4.28 0.00 3.19 3.12 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 0.00 0.00 0.00 5034 L 9.03 3.72 0.00 1.73 1.79 0.96 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 5035 G 7.60 3.72 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 0.00 0.00 0.00 5036 A 8.26 4.19 1.56 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 0.00 0.00 0.00 0.00 0.00 0.00 5037 I 8.50 3.55 2.02 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 1.41 0.76 0.94 0.00 0.00 5038 A 8.16 3.54 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5039 A 8.07 3.89 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5040 M 9.04 4.06 0.00 1.98 2.23 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.58 0.00 5041 Q 7.48 4.06 0.00 1.81 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.73 0.00 0.00 0.00 0.00 0.00 2.74 2.60 0.00 5042 F 8.51 4.59 0.00 2.85 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5043 I 6.73 3.79 1.90 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 1.41 0.68 0.93 0.00 0.00 5044 Q 8.18 4.36 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 5.73 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 5045 R 8.86 4.17 0.00 1.85 2.27 0.00 3.27 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00