#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a1h s PRO 4 N 0.00 2.17 0.73 1.61 0.04 -1.26 -5.01 135.00 133.29 3a1h s PRO 4 Ca 0.00 0.91 -0.15 0.00 0.04 0.00 0.00 61.00 61.80 3a1h s PRO 4 Cb 0.00 -1.91 0.04 0.00 0.04 0.00 0.00 34.50 32.67 3a1h s PRO 4 CO 0.00 -1.63 1.21 -2.14 0.04 0.00 0.00 177.00 174.48 3a1h s PRO 5 N -5.01 2.10 1.31 0.56 0.02 -1.26 -5.01 135.00 127.71 3a1h s PRO 5 Ca 0.61 1.77 -0.21 0.00 0.02 0.00 0.00 61.00 63.18 3a1h s PRO 5 Cb -0.16 -1.83 0.33 0.00 0.02 0.00 0.00 34.50 32.86 3a1h s PRO 5 CO 0.55 -1.87 1.04 0.20 -0.33 0.00 0.00 177.00 176.60 3a1h s GLY 6 N -2.03 1.52 0.82 0.52 0.00 -1.26 -5.05 107.32 101.84 3a1h s GLY 6 Ca 0.74 -0.96 -0.08 0.00 0.00 0.00 0.00 44.72 44.43 3a1h s GLY 6 CO 0.46 0.01 1.13 2.56 0.00 0.00 0.00 173.10 177.25 3a1h s PRO 7 N -5.33 1.35 0.31 2.90 0.04 -1.26 -5.01 135.00 127.99 3a1h s PRO 7 Ca 0.71 -0.68 -0.29 0.00 0.04 0.00 0.00 61.00 60.78 3a1h s PRO 7 Cb -0.10 -2.11 -0.10 0.00 0.04 0.00 0.00 34.50 32.23 3a1h s PRO 7 CO 0.56 -1.80 1.21 -2.14 0.04 0.00 0.00 177.00 174.88 3a1h s PRO 8 N -5.46 4.48 1.15 0.56 0.02 -1.26 -5.00 135.00 129.49 3a1h s PRO 8 Ca 0.68 2.03 -0.17 0.00 0.02 0.00 0.00 61.00 63.56 3a1h s PRO 8 Cb -0.06 -3.13 0.22 0.00 0.02 0.00 0.00 34.50 31.56 3a1h s PRO 8 CO 0.48 -0.01 0.44 0.41 -0.33 0.00 0.00 177.00 177.99 3a1h n GLY 9 N 1.01 -2.82 3.78 0.52 0.00 -1.26 -4.98 105.19 101.45 3a1h n GLY 9 Ca -0.00 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 3a1h n GLY 9 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a1h s PRO 10 N -3.90 1.11 0.35 1.61 0.04 -1.26 -4.98 135.00 127.98 3a1h s PRO 10 Ca 0.48 0.29 -0.28 0.00 0.04 0.00 0.00 61.00 61.53 3a1h s PRO 10 Cb -0.09 -1.84 -0.11 0.00 0.04 0.00 0.00 34.50 32.50 3a1h s PRO 10 CO 0.46 -2.22 1.42 -2.14 0.04 0.00 0.00 177.00 174.56 3a1h s PRO 11 N -5.27 4.21 0.00 0.56 0.02 -1.26 -5.24 135.00 128.02 3a1h s PRO 11 Ca 0.64 2.42 0.00 0.00 0.02 0.00 0.00 61.00 64.08 3a1h s PRO 11 Cb -0.15 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.36 3a1h s PRO 11 CO 0.53 -0.40 0.00 0.41 -0.33 0.00 0.00 177.00 177.22 3a1h n GLY 12 N 0.70 -2.81 3.85 0.52 0.00 -1.26 -5.22 105.19 100.96 3a1h n GLY 12 Ca 0.01 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 3a1h n GLY 12 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a1h s THR 14 N 0.00 5.10 1.04 2.61 2.01 -1.26 -5.24 115.64 119.90 3a1h s THR 14 Ca 0.00 0.72 -0.12 0.00 0.31 0.00 0.00 61.69 62.60 3a1h s THR 14 Cb 0.00 -3.67 0.22 0.00 0.01 0.00 0.00 72.50 69.06 3a1h s THR 14 CO 0.00 0.55 1.08 -0.83 -0.69 0.00 0.00 174.62 174.73 3a1h s GLY 15 N -1.15 1.61 0.78 4.40 0.00 -1.26 -5.01 107.32 106.69 3a1h s GLY 15 Ca 0.24 0.17 -0.11 0.00 0.00 0.00 0.00 44.72 45.02 3a1h s GLY 15 CO 0.13 0.75 1.10 2.56 0.00 0.00 0.00 173.10 177.64 3a1h s PRO 16 N -4.57 2.17 0.79 2.90 0.04 -1.26 -5.00 135.00 130.07 3a1h s PRO 16 Ca 0.67 1.24 -0.12 0.00 0.04 0.00 0.00 61.00 62.83 3a1h s PRO 16 Cb -0.24 -1.88 0.07 0.00 0.04 0.00 0.00 34.50 32.50 3a1h s PRO 16 CO 0.61 -1.72 1.15 -2.14 0.04 0.00 0.00 177.00 174.94 3a1h s PRO 17 N -4.79 1.88 1.03 0.56 0.02 -1.26 -5.01 135.00 127.43 3a1h s PRO 17 Ca 0.62 1.50 -0.13 0.00 0.02 0.00 0.00 61.00 63.02 3a1h s PRO 17 Cb -0.18 -1.83 0.21 0.00 0.02 0.00 0.00 34.50 32.71 3a1h s PRO 17 CO 0.55 -1.98 1.09 0.20 -0.33 0.00 0.00 177.00 176.53 3a1h s GLY 18 N -2.64 1.56 0.84 0.52 0.00 -1.26 -5.04 107.32 101.30 3a1h s GLY 18 Ca 0.68 -0.43 -0.13 0.00 0.00 0.00 0.00 44.72 44.84 3a1h s GLY 18 CO 0.52 0.22 1.20 2.56 0.00 0.00 0.00 173.10 177.60 3a1h s PRO 19 N -4.99 1.70 0.77 2.90 0.04 -1.26 -5.01 135.00 129.15 3a1h s PRO 19 Ca 0.66 0.02 -0.14 0.00 0.04 0.00 0.00 61.00 61.58 3a1h s PRO 19 Cb -0.18 -1.93 0.06 0.00 0.04 0.00 0.00 34.50 32.49 3a1h s PRO 19 CO 0.58 -1.76 1.20 -2.14 0.04 0.00 0.00 177.00 174.92 3a1h s PRO 20 N -5.63 1.91 0.64 0.56 0.02 -1.26 -5.01 135.00 126.23 3a1h s PRO 20 Ca 0.64 1.74 -0.11 0.00 0.02 0.00 0.00 61.00 63.30 3a1h s PRO 20 Cb -0.10 -1.81 0.15 0.00 0.02 0.00 0.00 34.50 32.76 3a1h s PRO 20 CO 0.50 -2.00 0.76 0.41 -0.33 0.00 0.00 177.00 176.33 3a1h n GLY 21 N 0.39 -1.75 3.85 0.52 0.00 -1.26 -5.05 105.19 101.90 3a1h n GLY 21 Ca 0.13 -1.63 -0.31 0.00 0.00 0.00 0.00 46.02 44.22 3a1h n GLY 21 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a1h s PRO 22 N -4.68 2.99 0.53 1.61 0.04 -1.26 -4.98 135.00 129.25 3a1h s PRO 22 Ca 0.45 0.73 -0.21 0.00 0.04 0.00 0.00 61.00 62.00 3a1h s PRO 22 Cb -0.02 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 3a1h s PRO 22 CO 0.32 -1.00 1.24 -1.25 0.04 0.00 0.00 177.00 176.35 3a1h s PRO 23 N -5.18 3.30 1.33 0.56 0.04 -1.26 -4.99 135.00 128.81 3a1h s PRO 23 Ca 0.58 1.94 -0.18 0.00 0.04 0.00 0.00 61.00 63.38 3a1h s PRO 23 Cb -0.12 -2.20 0.34 0.00 0.04 0.00 0.00 34.50 32.55 3a1h s PRO 23 CO 0.54 -0.97 0.96 0.20 0.04 0.00 0.00 177.00 177.76 3a1h s GLY 24 N -1.30 1.46 0.54 0.56 0.00 -1.26 -4.97 107.32 102.35 3a1h s GLY 24 Ca 0.71 -0.47 -0.18 0.00 0.00 0.00 0.00 44.72 44.78 3a1h s GLY 24 CO 0.38 0.42 1.04 2.56 0.00 0.00 0.00 173.10 177.50 3a1h s PRO 25 N -4.71 3.58 0.00 2.90 0.04 -1.26 -5.31 135.00 130.24 3a1h s PRO 25 Ca 0.69 1.24 0.06 0.00 0.04 0.00 0.00 61.00 63.02 3a1h s PRO 25 Cb -0.20 -2.07 0.35 0.00 0.04 0.00 0.00 34.50 32.63 3a1h s PRO 25 CO 0.62 -0.60 0.82 -0.35 0.04 0.00 0.00 177.00 177.53