NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9483 8.0544 120.3952 64.0848 32.5869 174.8894 2 S 4.2284 9.0278 120.9332 57.9248 62.3217 165.5762 3 E 4.4711 7.5571 121.2083 55.7861 29.9365 175.2022 4 I 3.9869 7.3346 113.9867 60.3343 40.1459 175.5620 5 Q 3.9434 8.6627 119.5924 59.6548 28.3375 178.4349 6 L 3.9642 7.7927 118.9437 58.1678 42.5178 178.0651 7 M 4.2185 7.9726 117.6694 59.1036 32.1272 177.4986 8 H 3.2202 8.5937 117.2449 59.0322 30.2726 176.4471 9 N 4.6557 8.3115 118.6772 54.9091 38.7294 173.7725 10 L 4.1655 7.8630 122.8347 55.9365 41.9142 176.5200 11 G 3.9130 9.2352 115.0804 46.2341 0.0000 172.3758 12 K 3.8253 9.0620 114.3561 56.6362 32.2682 170.3886 13 H 4.1451 8.4742 123.4348 55.7759 29.6024 174.0075 14 L 4.9178 8.1006 125.1124 53.7047 44.1604 173.7286 15 N 4.7874 8.4989 113.7801 54.4385 39.0686 174.6883 16 S 4.4834 6.9692 112.3260 57.9118 66.5740 175.6606 17 M 4.1705 7.9878 124.2459 58.0462 32.4944 178.4296 18 E 4.1405 8.0637 118.6692 59.3788 29.5700 178.7939 19 R 4.0345 8.1513 118.1301 58.9811 29.8622 178.5242 20 V 3.7660 7.6579 119.1079 64.8315 31.6923 177.6951 21 E 3.9866 8.2865 120.0635 58.8357 29.2275 178.6761 22 W 3.9953 8.3101 128.0048 60.4813 30.7409 177.8110 23 L 4.2958 8.1929 119.1878 58.8765 39.7077 179.5861 24 R 3.9691 8.4069 119.4971 59.1244 29.9569 178.8483 25 K 4.0162 8.3375 118.0945 58.9885 32.5166 178.7561 26 K 3.8149 7.9942 119.4641 59.0831 32.0159 179.0187 27 L 3.9280 7.5923 120.6511 57.9454 42.0833 178.0283 28 Q 4.8919 8.0100 118.6809 56.7484 28.6941 176.8807 29 D 4.3982 7.8038 119.3152 57.4281 41.0107 178.4172 30 V 3.5637 7.0263 117.1742 66.2606 31.3725 176.5931 31 H 4.4429 8.0471 115.0032 55.6304 30.9897 172.3539 32 N 4.8650 8.4048 112.4340 53.0360 37.4851 174.8340 33 F 4.1672 7.9439 119.5997 55.4334 38.0735 172.7072 34 V 3.8256 7.8890 122.0714 61.9228 32.0990 176.5742 35 A 4.8663 8.3488 130.6257 51.3768 19.3890 176.4612 36 L 4.1569 8.3117 115.3501 57.0363 40.2029 175.6746 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 V 8.05 3.95 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 0.96 0.00 0.00 0.94 0.00 0.00 2 S 9.03 4.23 0.00 4.11 4.15 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 0.00 0.00 0.00 0.00 3 E 7.56 4.47 0.00 2.08 2.02 0.00 0.00 0.00 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 2.32 0.00 4 I 7.33 3.99 1.89 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 1.55 0.92 0.93 0.00 0.00 5 Q 8.66 3.94 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.95 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 6 L 7.79 3.96 0.00 1.69 1.70 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 7 M 7.97 4.22 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.64 0.00 8 H 8.59 3.22 0.00 3.28 3.25 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 8.31 4.66 0.00 3.11 2.90 0.00 0.00 6.81 6.72 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 10 L 7.86 4.17 0.00 1.99 2.01 0.87 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 11 G 9.24 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 0.00 0.00 0.00 12 K 9.06 3.83 0.00 2.06 2.01 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.48 7.81 13 H 8.47 4.15 0.00 3.33 3.30 0.00 5.61 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.10 4.92 0.00 1.61 1.55 0.85 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.50 4.79 0.00 2.71 2.77 0.00 0.00 5.56 7.87 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 16 S 6.97 4.48 0.00 3.79 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.99 4.17 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 18 E 8.06 4.14 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 19 R 8.15 4.03 0.00 1.91 2.05 0.00 3.21 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.46 0.00 20 V 7.66 3.77 2.23 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 1.07 0.00 0.00 0.98 0.00 0.00 21 E 8.29 3.99 0.00 2.17 2.21 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 2.35 2.42 0.00 22 W 8.31 4.00 0.00 3.45 3.38 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 23 L 8.19 4.30 0.00 2.18 2.17 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.41 3.97 0.00 2.23 2.04 0.00 3.22 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 25 K 8.34 4.02 0.00 1.80 1.67 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.14 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.58 7.81 26 K 7.99 3.81 0.00 1.64 1.61 0.00 0.72 0.00 0.00 0.61 0.00 0.00 2.20 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.30 0.92 7.81 27 L 7.59 3.93 0.00 1.81 1.78 0.87 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 8.01 4.89 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.50 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 29 D 7.80 4.40 0.00 2.89 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.03 3.56 2.21 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 0.74 0.00 0.00 0.96 0.00 0.00 31 H 8.05 4.44 0.00 3.12 3.42 0.00 5.96 0.00 0.00 0.00 0.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.40 4.86 0.00 2.86 2.85 0.00 0.00 7.28 7.01 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 33 F 7.94 4.17 0.00 3.17 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.89 3.83 2.04 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 0.61 0.00 0.00 0.92 0.00 0.00 35 A 8.35 4.87 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.31 4.16 0.00 1.71 1.61 0.94 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00