NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1H T 3.9951 8.0333 110.9146 61.2056 69.9009 172.9849 1G F 4.0158 8.2784 119.7005 58.0278 39.5682 171.7688 1F G 3.6871 9.0285 116.9129 45.7640 0.0000 173.6964 1E S 4.5864 8.2694 113.9513 60.5223 66.0069 172.5611 1D G 3.5608 7.0314 107.8446 44.6799 0.0000 173.4381 1C E 4.1740 8.5071 124.5287 55.7506 29.5367 176.8703 1B A 3.8762 8.0635 127.8598 53.5206 17.7445 179.1042 1A D 4.7650 7.6972 113.7838 52.9285 39.9893 174.6162 1 C 4.6910 7.4770 117.0523 57.2297 32.6128 176.0150 2 G 3.9026 8.6771 107.3830 45.8359 0.0000 173.3961 3 L 4.5653 7.3987 120.0417 52.8877 42.7349 176.3190 4 R 4.3607 9.1206 124.3989 54.7405 30.9827 175.8948 5 P 4.2447 0.0000 0.0000 65.7016 31.3858 177.3618 6 L 4.1286 7.7984 114.6155 55.2440 42.0895 176.3440 7 F 4.6208 7.2934 114.5405 57.7340 42.1751 176.5978 8 E 4.0351 8.9827 121.5249 60.0456 30.1152 180.0580 9 K 3.9438 8.0053 116.2552 58.6225 32.1180 177.8934 10 K 4.3626 7.8139 115.2589 55.1976 32.7039 175.5650 11 S 3.7533 7.9660 112.5477 59.4989 61.1542 171.5636 12 L 4.8419 8.1229 117.4702 52.7423 43.9459 176.1590 13 E 4.9277 8.5555 120.7824 54.6078 31.7012 175.8255 14 D 4.8138 9.0379 122.7197 52.0123 40.6106 177.4732 14A K 3.9999 8.4719 118.2272 58.9421 32.7427 177.5386 14B T 4.6039 8.1860 108.8957 60.5156 69.8171 175.5110 14C E 3.9046 7.9718 122.8911 59.4896 29.4364 178.7447 14D R 3.7876 8.0187 119.5146 59.5646 29.7625 177.5856 14E E 3.9135 7.6133 117.6858 59.3048 29.8796 178.7811 14F L 3.8087 7.6148 118.7273 57.7573 41.9423 179.3140 14G L 3.6405 7.5376 118.2243 57.8377 41.2015 179.4482 14H E 3.9807 8.5722 119.0866 59.0756 29.3036 178.9393 14I S 4.3213 7.5973 112.5233 59.9093 62.8792 174.2876 14J Y 4.8590 7.0814 119.7430 57.8755 39.6911 175.0725 14K I 2.9867 8.2623 116.7322 62.4944 34.9464 172.3025 14L D 4.4632 8.0210 123.3027 54.2517 39.9737 173.3545 14M G 4.0563 8.4629 113.2485 45.5957 0.0000 172.2752 15 R 4.1740 8.0126 121.8480 56.4320 29.4126 174.7105 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 8.03 4.00 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 1.21 0.00 0.00 1G F 8.28 4.02 0.00 3.31 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 9.03 3.69 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 0.00 0.00 0.00 1E S 8.27 4.59 0.00 3.65 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 1D G 7.03 3.56 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 0.00 1C E 8.51 4.17 0.00 1.92 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 0.00 2.13 2.22 0.00 1B A 8.06 3.88 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.70 4.76 0.00 2.60 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 7.48 4.69 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.68 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 3 L 7.40 4.57 0.00 1.64 1.65 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 4 R 9.12 4.36 0.00 2.18 2.06 0.00 3.18 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 5 P 0.00 4.24 0.00 2.04 2.14 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 6 L 7.80 4.13 0.00 1.51 1.02 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.29 4.62 0.00 3.05 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 8.98 4.04 0.00 2.13 2.06 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 2.45 2.47 0.00 9 K 8.01 3.94 0.00 1.96 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.58 7.81 10 K 7.81 4.36 0.00 1.65 1.76 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.51 7.81 11 S 7.97 3.75 0.00 3.99 3.92 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 L 8.12 4.84 0.00 1.55 1.56 0.83 0.70 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 8.56 4.93 0.00 1.99 1.87 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 2.26 2.30 0.00 14 D 9.04 4.81 0.00 2.45 1.72 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 14A K 8.47 4.00 0.00 1.89 2.00 0.00 1.53 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.41 7.81 14B T 8.19 4.60 4.20 0.00 0.00 0.00 0.00 0.00 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 7.97 3.90 0.00 2.26 2.30 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 2.50 2.28 0.00 14D R 8.02 3.79 0.00 1.87 1.95 0.00 3.17 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 1.77 1.68 0.00 14E E 7.61 3.91 0.00 1.90 2.01 0.00 0.00 0.00 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 2.32 0.00 14F L 7.61 3.81 0.00 1.86 1.42 0.87 0.67 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 14G L 7.54 3.64 0.00 1.69 1.68 1.10 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 14H E 8.57 3.98 0.00 1.92 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 2.28 2.41 0.00 14I S 7.60 4.32 0.00 4.04 4.09 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 0.00 0.00 0.00 14J Y 7.08 4.86 0.00 2.97 2.88 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 0.00 0.00 0.00 14K I 8.26 2.99 1.92 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 1.23 0.65 0.93 0.00 0.00 14L D 8.02 4.46 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 14M G 8.46 4.06 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 0.00 0.00 0.00 15 R 8.01 4.17 0.00 1.90 1.86 0.00 3.10 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 1.54 1.58 0.00