#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2drn s MET 2 N 0.00 0.91 -0.08 -0.41 1.75 -1.26 -4.98 119.30 115.24 2drn s MET 2 Ca 0.00 -0.87 0.12 0.00 -1.25 0.00 0.00 55.69 53.69 2drn s MET 2 Cb 0.00 -0.22 -0.18 0.00 2.84 0.00 0.00 34.83 37.27 2drn s MET 2 CO 0.00 -1.27 0.15 0.41 -0.65 0.00 0.00 175.02 173.65 2drn n GLY 3 N 3.61 -0.62 0.00 2.11 0.00 -1.26 -5.01 105.19 104.02 2drn n GLY 3 Ca 0.16 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2drn n GLY 3 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2drn n HIS 4 N -2.26 0.00 -4.93 1.61 -0.00 -1.26 -5.11 115.22 103.26 2drn n HIS 4 Ca -0.13 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.26 2drn n HIS 4 Cb 0.68 0.00 -0.13 0.00 -0.00 0.00 0.00 29.99 30.54 2drn n HIS 4 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 2drn s ILE 5 N 2.14 2.97 0.00 1.59 1.09 -1.26 -5.12 121.20 122.60 2drn s ILE 5 Ca 0.00 -0.76 0.00 0.00 -1.10 0.00 0.00 60.65 58.79 2drn s ILE 5 Cb 0.00 -2.15 0.00 0.00 -1.06 0.00 0.00 42.46 39.25 2drn s ILE 5 CO 0.00 0.59 0.00 1.67 -0.10 0.00 0.00 174.94 177.10 2drn n GLN 6 N 2.35 2.63 -1.61 2.79 7.27 -1.26 -5.05 117.38 124.50 2drn n GLN 6 Ca -0.17 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.47 2drn n GLN 6 Cb 0.52 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.14 2drn n GLN 6 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 2drn n ILE 7 N 0.00 0.47 -2.32 1.69 -0.00 -1.26 -4.90 119.36 113.04 2drn n ILE 7 Ca 0.00 -0.34 -0.42 0.00 -0.00 0.00 0.00 62.75 61.98 2drn n ILE 7 Cb 0.00 -2.43 -0.03 0.00 -0.00 0.00 0.00 39.64 37.19 2drn n ILE 7 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2drn s PRO 8 N 5.71 4.37 0.80 0.38 0.04 -1.26 -5.02 135.00 140.01 2drn s PRO 8 Ca 0.97 1.88 -0.12 0.00 0.04 0.00 0.00 61.00 63.77 2drn s PRO 8 Cb -0.40 -3.38 0.08 0.00 0.04 0.00 0.00 34.50 30.83 2drn s PRO 8 CO 0.39 -0.38 1.16 -1.25 0.04 0.00 0.00 177.00 176.95 2drn s PRO 9 N 1.43 2.02 0.00 0.56 0.04 -1.26 -4.28 135.00 133.50 2drn s PRO 9 Ca 0.61 0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.87 2drn s PRO 9 Cb -0.31 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2drn s PRO 9 CO 0.28 -1.58 0.00 0.41 0.04 0.00 0.00 177.00 176.15 2drn n GLY 10 N -3.07 2.98 0.39 0.56 0.00 -1.26 -4.92 105.19 99.86 2drn n GLY 10 Ca 0.08 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.28 2drn n GLY 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2drn h LEU 11 N 0.00 0.25 0.19 0.99 5.85 -2.01 -2.29 115.31 118.29 2drn h LEU 11 Ca 0.00 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.75 2drn h LEU 11 Cb 0.00 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 2drn h LEU 11 CO 0.00 0.12 -0.42 0.74 -0.34 0.00 0.00 178.44 178.55 2drn h THR 12 N 0.26 0.16 -0.10 1.05 2.02 -1.94 0.19 112.91 114.56 2drn h THR 12 Ca 0.36 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.57 2drn h THR 12 Cb 1.01 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.58 2drn h THR 12 CO -0.08 0.00 0.11 -0.08 0.37 0.00 0.00 175.52 175.83 2drn h GLU 13 N -0.69 0.00 0.09 6.66 4.81 -1.83 0.22 114.58 123.84 2drn h GLU 13 Ca 0.01 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2drn h GLU 13 Cb 0.69 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.07 2drn h GLU 13 CO -0.20 0.00 -0.04 1.25 -0.73 0.00 0.00 179.01 179.29 2drn h LEU 14 N 0.00 -0.10 0.32 1.64 5.85 -0.89 -2.73 115.31 119.40 2drn h LEU 14 Ca 0.05 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 2drn h LEU 14 Cb 0.26 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.32 2drn h LEU 14 CO -0.00 0.53 -0.15 -0.07 -0.34 0.00 0.00 178.44 178.40 2drn h LEU 15 N -0.97 -0.36 -0.69 2.25 4.07 -0.46 -2.88 115.31 116.26 2drn h LEU 15 Ca -0.01 -0.10 0.14 0.00 0.08 0.00 0.00 57.88 57.98 2drn h LEU 15 Cb 0.44 0.09 -0.10 0.00 1.08 0.00 0.00 40.66 42.18 2drn h LEU 15 CO 0.02 0.11 0.20 -0.61 -1.08 0.00 0.00 178.44 177.07 2drn h GLN 16 N -1.04 0.31 -0.95 1.13 4.15 -0.76 0.29 115.11 118.24 2drn h GLN 16 Ca -0.04 -0.02 0.12 0.00 0.77 0.00 0.00 58.65 59.48 2drn h GLN 16 Cb 0.45 -0.07 -0.08 0.00 0.21 0.00 0.00 27.48 27.99 2drn h GLN 16 CO 0.07 0.21 0.60 0.78 -1.93 0.00 0.00 178.83 178.56 2drn h GLY 17 N 0.32 1.44 2.00 2.39 0.00 -1.55 0.48 103.07 108.14 2drn h GLY 17 Ca 0.38 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2drn h GLY 17 CO -0.44 0.15 -0.13 -1.82 0.00 0.00 0.00 176.54 174.31 2drn h TYR 18 N 0.89 0.00 0.00 5.60 3.20 -0.22 -1.74 116.97 124.70 2drn h TYR 18 Ca 0.46 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 62.17 2drn h TYR 18 Cb 0.53 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.77 2drn h TYR 18 CO -0.00 0.13 -0.78 1.15 -1.64 0.00 0.00 178.16 177.01 2drn h THR 19 N 0.00 1.45 0.00 1.81 2.02 0.49 -2.28 112.91 116.40 2drn h THR 19 Ca -0.00 -2.78 -0.04 0.00 0.77 0.00 0.00 66.41 64.36 2drn h THR 19 Cb 0.29 2.54 -0.01 0.00 -1.74 0.00 0.00 68.15 69.24 2drn h THR 19 CO 0.02 0.77 -0.19 0.58 0.37 0.00 0.00 175.52 177.06 2drn h VAL 20 N 0.00 0.34 0.00 3.16 2.07 -0.63 -3.02 116.25 118.17 2drn h VAL 20 Ca -0.01 -1.38 -0.18 0.00 0.82 0.00 0.00 66.70 65.95 2drn h VAL 20 Cb 1.48 2.08 -0.03 0.00 -1.52 0.00 0.00 31.29 33.30 2drn h VAL 20 CO 0.10 0.19 -1.19 -0.62 0.02 0.00 0.00 177.57 176.07 2drn n GLU 21 N -3.17 0.53 -0.35 1.57 1.02 -1.03 -2.74 120.64 116.48 2drn n GLU 21 Ca 0.03 0.51 0.11 0.00 -0.02 0.00 0.00 57.16 57.79 2drn n GLU 21 Cb 0.57 -1.69 0.29 0.00 -0.02 0.00 0.00 31.44 30.59 2drn n GLU 21 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2drn h VAL 22 N -1.00 0.76 0.10 2.62 2.07 -1.55 0.34 116.25 119.60 2drn h VAL 22 Ca -0.28 -0.28 -0.28 0.00 0.82 0.00 0.00 66.70 66.68 2drn h VAL 22 Cb 1.10 -0.12 0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2drn h VAL 22 CO -0.17 0.15 -1.20 -0.07 0.02 0.00 0.00 177.57 176.30 2drn h LEU 23 N 0.81 0.73 -1.43 2.57 4.07 -1.71 -1.92 115.31 118.43 2drn h LEU 23 Ca 0.55 -0.67 -0.03 0.00 0.08 0.00 0.00 57.88 57.80 2drn h LEU 23 Cb 0.78 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 42.28 2drn h LEU 23 CO -0.35 1.49 -0.16 -0.09 -1.08 0.00 0.00 178.44 178.25 2drn h ARG 24 N 0.23 0.00 -1.76 1.13 9.65 -1.01 -3.33 114.38 119.29 2drn h ARG 24 Ca -0.16 0.00 -0.49 0.00 -1.10 0.00 0.00 59.98 58.23 2drn h ARG 24 Cb 1.87 0.00 -0.36 0.00 -1.39 0.00 0.00 29.97 30.09 2drn h ARG 24 CO 0.22 0.16 -1.06 0.00 2.80 0.00 0.00 179.97 182.08 2drn n GLN 25 N -3.40 0.82 -1.33 0.20 10.64 0.11 -5.06 117.38 119.36 2drn n GLN 25 Ca -0.00 -3.11 -0.33 0.00 -1.83 0.00 0.00 57.00 51.73 2drn n GLN 25 Cb 0.35 -1.39 -0.15 0.00 -0.86 0.00 0.00 30.24 28.19 2drn n GLN 25 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 2drn n GLN 26 N 0.99 0.00 -1.57 2.61 7.27 -0.73 -4.74 117.38 121.21 2drn n GLN 26 Ca 0.21 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.98 2drn n GLN 26 Cb 0.59 -1.25 0.09 0.00 2.41 0.00 0.00 30.24 32.08 2drn n GLN 26 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2drn s PRO 27 N 7.65 2.13 0.31 3.69 0.04 -1.26 -4.96 135.00 142.60 2drn s PRO 27 Ca 1.20 0.64 0.12 0.00 0.04 0.00 0.00 61.00 63.00 2drn s PRO 27 Cb -1.05 -1.92 0.49 0.00 0.04 0.00 0.00 34.50 32.06 2drn s PRO 27 CO 0.45 -1.59 1.68 -1.00 0.04 0.00 0.00 177.00 176.58 2drn h PRO 28 N -1.07 0.00 -2.79 0.56 0.13 -2.00 -3.43 132.00 123.40 2drn h PRO 28 Ca -0.47 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.49 2drn h PRO 28 Cb 1.27 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.10 2drn h PRO 28 CO 0.59 0.52 -0.45 -0.51 -0.23 0.00 0.00 178.00 177.93 2drn s ASP 29 N -6.80 -0.06 0.17 1.44 1.11 -1.26 -5.03 116.67 106.24 2drn s ASP 29 Ca -0.01 0.71 -0.09 0.00 0.18 0.00 0.00 52.55 53.34 2drn s ASP 29 Cb 0.13 0.78 0.04 0.00 1.07 0.00 0.00 42.92 44.94 2drn s ASP 29 CO 0.74 -0.21 1.56 0.25 1.18 0.00 0.00 175.17 178.69 2drn h LEU 30 N 7.83 0.98 0.22 1.23 5.85 -1.98 -1.33 115.31 128.11 2drn h LEU 30 Ca -0.24 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.11 2drn h LEU 30 Cb 1.13 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 2drn h LEU 30 CO 0.21 1.16 -0.44 0.58 -0.34 0.00 0.00 178.44 179.60 2drn h VAL 31 N 0.82 0.00 -0.50 1.05 2.07 -1.99 1.01 116.25 118.72 2drn h VAL 31 Ca 0.11 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 2drn h VAL 31 Cb 0.79 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2drn h VAL 31 CO 0.07 0.00 0.22 -0.78 0.02 0.00 0.00 177.57 177.10 2drn h ASP 32 N -0.72 0.63 -0.23 0.57 1.82 -1.99 -2.11 116.42 114.39 2drn h ASP 32 Ca -0.02 -0.06 -0.12 0.00 -0.39 0.00 0.00 57.03 56.44 2drn h ASP 32 Cb 0.68 -0.16 -0.01 0.00 0.68 0.00 0.00 39.33 40.52 2drn h ASP 32 CO -0.17 0.55 -0.28 0.15 -1.61 0.00 0.00 179.24 177.87 2drn h PHE 33 N 0.70 0.83 -0.40 0.28 3.57 -0.44 -2.22 116.94 119.25 2drn h PHE 33 Ca 0.17 -0.20 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 2drn h PHE 33 Cb 0.10 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 2drn h PHE 33 CO 0.01 0.92 0.20 0.00 -2.23 0.00 0.00 178.31 177.20 2drn h ALA 34 N 1.07 1.59 0.02 2.41 0.00 0.17 -1.72 119.26 122.81 2drn h ALA 34 Ca 0.08 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2drn h ALA 34 Cb 0.79 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2drn h ALA 34 CO 0.06 0.33 -0.01 0.28 0.00 0.00 0.00 179.25 179.92 2drn h VAL 35 N 0.56 1.47 -0.87 0.00 2.07 -1.25 -2.27 116.25 115.97 2drn h VAL 35 Ca 0.14 -1.74 0.12 0.00 0.82 0.00 0.00 66.70 66.05 2drn h VAL 35 Cb 0.06 2.60 -0.07 0.00 -1.52 0.00 0.00 31.29 32.36 2drn h VAL 35 CO -0.02 0.43 0.56 -0.33 0.02 0.00 0.00 177.57 178.23 2drn h GLU 36 N -0.81 0.70 0.18 1.57 4.39 -1.26 0.37 114.58 119.71 2drn h GLU 36 Ca -0.00 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 2drn h GLU 36 Cb 0.73 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 2drn h GLU 36 CO 0.00 0.47 -0.08 -0.92 -1.16 0.00 0.00 179.01 177.32 2drn h TYR 37 N 0.73 -0.22 -0.78 4.33 3.20 -1.37 -2.68 116.97 120.18 2drn h TYR 37 Ca 0.42 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.38 2drn h TYR 37 Cb 0.61 0.07 -0.07 0.00 1.54 0.00 0.00 36.73 38.88 2drn h TYR 37 CO -0.00 -0.14 0.42 0.74 -1.64 0.00 0.00 178.16 177.54 2drn h PHE 38 N -0.72 0.76 -0.89 -3.82 0.04 -1.32 -0.68 116.94 110.31 2drn h PHE 38 Ca -0.02 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.79 2drn h PHE 38 Cb 0.18 -0.22 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 2drn h PHE 38 CO 0.02 0.29 0.59 1.15 -0.60 0.00 0.00 178.31 179.76 2drn h THR 39 N 0.70 1.20 0.00 -1.55 2.02 -0.38 -0.49 112.91 114.41 2drn h THR 39 Ca 0.38 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 2drn h THR 39 Cb 0.38 -0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 2drn h THR 39 CO -0.26 0.21 -0.17 -0.09 0.37 0.00 0.00 175.52 175.58 2drn h ARG 40 N 1.17 0.00 -0.13 6.66 2.43 -0.77 -2.09 114.38 121.65 2drn h ARG 40 Ca 0.34 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.39 2drn h ARG 40 Cb -0.08 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2drn h ARG 40 CO -0.08 0.17 -0.43 -0.07 -1.51 0.00 0.00 179.97 178.04 2drn h LEU 41 N 0.00 0.32 -1.18 3.80 3.38 -0.62 -2.72 115.31 118.29 2drn h LEU 41 Ca -0.00 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.74 2drn h LEU 41 Cb 0.35 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2drn h LEU 41 CO 0.02 0.72 -0.41 -0.09 0.09 0.00 0.00 178.44 178.78 2drn h ARG 42 N 0.25 0.01 0.00 1.13 2.43 -1.19 0.26 114.38 117.26 2drn h ARG 42 Ca 0.02 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 2drn h ARG 42 Cb 0.87 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.41 2drn h ARG 42 CO 0.07 0.41 -0.27 0.93 -1.51 0.00 0.00 179.97 179.60 2drn h GLU 43 N 0.01 0.00 -0.01 0.20 5.08 -1.40 -3.02 114.58 115.43 2drn h GLU 43 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2drn h GLU 43 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 2drn h GLU 43 CO 0.05 0.27 0.00 0.00 -1.00 0.00 0.00 179.01 178.34 2drn n ALA 44 N -2.31 2.25 -2.08 3.43 0.00 -0.90 -4.95 120.51 115.96 2drn n ALA 44 Ca -0.01 -2.37 -0.28 0.00 0.00 0.00 0.00 53.44 50.79 2drn n ALA 44 Cb 0.40 -0.34 -0.05 0.00 0.00 0.00 0.00 19.45 19.46 2drn n ALA 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2drn s ARG 45 N -2.59 2.60 0.00 0.00 3.00 0.85 -5.05 118.95 117.76 2drn s ARG 45 Ca 0.28 -0.59 0.00 0.00 -1.00 0.00 0.00 55.73 54.41 2drn s ARG 45 Cb 0.24 -5.13 0.00 0.00 0.00 0.00 0.00 34.95 30.06 2drn s ARG 45 CO 0.03 -3.49 0.00 2.89 0.00 0.00 0.00 175.30 174.73