NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1H T 4.4466 8.1593 115.2649 60.7920 69.8861 174.0163 1G F 4.4756 7.8301 113.8416 56.9684 42.7243 171.2980 1F G 3.8377 9.4231 108.9299 47.8605 0.0000 173.8135 1E S 3.4447 8.9611 115.5360 59.0282 61.1064 174.4373 1D G 3.7772 7.5437 104.8263 45.4611 0.0000 175.6861 1C E 4.7077 7.8264 120.2370 53.9086 33.9874 174.7843 1B A 4.1022 9.2978 122.1414 55.0760 18.5999 178.2874 1A D 4.8147 7.9205 112.6908 53.6689 41.6937 175.4230 1 C 4.1151 7.7830 112.3943 60.1798 29.6991 174.3131 2 G 3.9276 8.8449 109.6849 45.4380 0.0000 173.2081 3 L 4.4881 7.1253 118.3754 53.0296 42.3533 176.4974 4 R 4.2675 9.4038 124.7844 55.0668 30.7026 176.1952 5 P 4.2471 0.0000 0.0000 65.3771 31.4349 177.1576 6 L 4.2531 7.8209 114.6647 54.6332 42.8732 176.4123 7 F 4.6423 7.6732 114.3352 57.3778 41.1252 176.5518 8 E 4.1158 9.5576 124.5001 60.2542 30.1734 180.0621 9 K 4.1393 8.1431 115.6377 58.3212 32.1251 177.9274 10 K 4.3848 8.5983 117.3598 55.1663 32.7012 175.7163 11 S 3.7575 7.8189 112.2929 59.3214 61.2246 171.4906 12 L 4.7815 7.8465 116.6548 52.6685 43.6046 175.8873 13 E 4.8267 8.5869 121.8987 54.6859 31.1660 175.9140 14 D 4.7787 9.1639 123.6442 52.1124 40.4549 176.7135 14A K 4.1787 8.4335 118.1048 59.0319 32.6776 177.4722 14B T 4.6000 9.2113 108.7227 60.0147 70.3670 175.4077 14C E 3.8624 8.3357 121.8165 59.4298 29.2934 178.6040 14D R 3.7769 8.0610 119.4259 59.5261 29.7637 177.6819 14E E 3.8546 7.5075 117.0146 59.8904 29.7557 179.3480 14F L 3.7789 7.7020 117.9677 57.5548 41.6962 179.0509 14G L 3.5734 7.6746 118.6097 58.2844 41.0666 179.7648 14H E 3.7357 8.4130 118.6056 58.9036 29.4040 179.3212 14I S 4.2862 8.2775 114.7666 61.0242 62.7758 175.4035 14J Y 4.7236 6.7627 116.0935 58.2085 37.9708 177.2204 14K I 3.5216 8.4716 119.4645 61.6305 38.4849 172.6530 14L D 4.6632 7.3465 115.3569 53.3939 42.2080 175.4936 14M G 3.8953 9.5655 115.4084 44.5316 0.0000 171.9584 15 R 4.1575 8.4461 119.1747 56.9750 31.0127 174.3344 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 1H T 8.16 4.45 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 1G F 7.83 4.48 0.00 3.25 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F G 9.42 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 0.00 0.00 0.00 1E S 8.96 3.44 0.00 3.85 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D G 7.54 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1C E 7.83 4.71 0.00 1.85 1.88 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 2.32 2.26 0.00 1B A 9.30 4.10 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1A D 7.92 4.81 0.00 2.76 2.62 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 1 C 7.78 4.12 0.00 3.08 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 G 8.84 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 0.00 0.00 0.00 3 L 7.13 4.49 0.00 1.72 1.66 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 4 R 9.40 4.27 0.00 2.20 2.09 0.00 3.14 0.00 0.00 3.11 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 5 P 0.00 4.25 0.00 2.04 2.13 0.00 3.73 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 6 L 7.82 4.25 0.00 1.51 1.05 0.82 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.67 4.64 0.00 3.17 3.04 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 0.00 0.00 0.00 0.00 8 E 9.56 4.12 0.00 2.21 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 0.00 2.45 2.49 0.00 9 K 8.14 4.14 0.00 1.91 1.88 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.43 7.81 10 K 8.60 4.38 0.00 1.70 1.73 0.00 1.70 0.00 0.00 1.46 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.27 7.81 11 S 7.82 3.76 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 12 L 7.85 4.78 0.00 1.55 1.58 0.77 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.59 4.83 0.00 2.00 1.89 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 2.26 2.31 0.00 14 D 9.16 4.78 0.00 2.41 1.76 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 14A K 8.43 4.18 0.00 1.89 2.00 0.00 1.52 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.41 7.81 14B T 9.21 4.60 4.19 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 0.00 0.00 0.00 1.18 0.00 0.00 14C E 8.34 3.86 0.00 2.16 2.18 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 2.65 2.32 0.00 14D R 8.06 3.78 0.00 1.86 1.94 0.00 3.20 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.71 0.00 14E E 7.51 3.85 0.00 2.16 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 2.31 2.35 0.00 14F L 7.70 3.78 0.00 1.76 1.36 0.84 0.59 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 14G L 7.67 3.57 0.00 1.69 1.69 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14H E 8.41 3.74 0.00 1.89 1.93 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 2.20 2.53 0.00 14I S 8.28 4.29 0.00 3.98 3.99 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 14J Y 6.76 4.72 0.00 3.00 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 14K I 8.47 3.52 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 1.22 0.47 0.94 0.00 0.00 14L D 7.35 4.66 0.00 2.64 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14M G 9.57 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.45 4.16 0.00 1.90 1.89 0.00 3.26 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 1.40 1.38 0.00