#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2drn n MET 2 N 0.00 0.29 -3.03 -0.41 -0.00 -1.26 -5.02 117.12 107.69 2drn n MET 2 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.70 57.29 2drn n MET 2 Cb 0.00 -0.75 -0.05 0.00 -0.00 0.00 0.00 33.22 32.42 2drn n MET 2 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2drn s GLY 3 N -3.28 1.88 -0.40 3.17 0.00 -1.26 -5.02 107.32 102.41 2drn s GLY 3 Ca 0.00 -0.27 0.04 0.00 0.00 0.00 0.00 44.72 44.49 2drn s GLY 3 CO 0.00 1.53 0.13 -1.58 0.00 0.00 0.00 173.10 173.18 2drn s HIS 4 N 2.42 3.57 -0.10 1.90 5.65 -1.26 -5.07 115.29 122.40 2drn s HIS 4 Ca 0.30 -3.04 -0.07 0.00 0.25 0.00 0.00 55.06 52.50 2drn s HIS 4 Cb -0.16 -2.91 0.03 0.00 -1.18 0.00 0.00 32.58 28.37 2drn s HIS 4 CO 0.09 -0.88 0.25 0.42 -0.65 0.00 0.00 174.74 173.97 2drn s ILE 5 N 0.51 -0.02 -0.23 0.89 1.01 -1.26 -5.05 121.20 117.05 2drn s ILE 5 Ca 0.13 0.07 0.22 0.00 0.00 0.00 0.00 60.65 61.07 2drn s ILE 5 Cb -0.21 -0.37 0.48 0.00 0.01 0.00 0.00 42.46 42.37 2drn s ILE 5 CO -0.05 0.03 1.15 1.67 0.00 0.00 0.00 174.94 177.74 2drn n GLN 6 N 3.53 1.45 -4.03 2.79 -0.06 -1.26 -5.04 117.38 114.77 2drn n GLN 6 Ca -0.18 -3.10 -0.31 0.00 -2.00 0.00 0.00 57.00 51.41 2drn n GLN 6 Cb 0.56 -1.21 -0.15 0.00 -4.06 0.00 0.00 30.24 25.38 2drn n GLN 6 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 2drn s ILE 7 N -2.95 2.17 -0.30 1.69 1.09 -1.26 -5.07 121.20 116.56 2drn s ILE 7 Ca 0.26 -1.99 -0.29 0.00 -1.10 0.00 0.00 60.65 57.54 2drn s ILE 7 Cb 0.34 -2.46 -0.01 0.00 -1.06 0.00 0.00 42.46 39.27 2drn s ILE 7 CO -0.06 -0.35 1.57 -2.16 -0.10 0.00 0.00 174.94 173.83 2drn s PRO 8 N 1.02 3.66 1.06 2.79 0.04 -1.26 -5.00 135.00 137.31 2drn s PRO 8 Ca 0.02 1.38 -0.16 0.00 0.04 0.00 0.00 61.00 62.29 2drn s PRO 8 Cb -0.19 -4.05 0.22 0.00 0.04 0.00 0.00 34.50 30.52 2drn s PRO 8 CO -0.07 -1.46 1.15 -1.25 0.04 0.00 0.00 177.00 175.41 2drn s PRO 9 N 4.88 -0.11 0.00 0.56 0.04 -1.26 -4.09 135.00 135.02 2drn s PRO 9 Ca 0.69 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.77 2drn s PRO 9 Cb -0.21 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.62 2drn s PRO 9 CO 0.30 -2.99 0.00 0.41 0.04 0.00 0.00 177.00 174.76 2drn n GLY 10 N -1.76 1.48 0.09 0.56 0.00 -1.26 -4.88 105.19 99.42 2drn n GLY 10 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.22 2drn n GLY 10 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2drn n LEU 11 N 0.00 0.40 -0.02 0.99 7.94 -1.26 -2.98 117.00 122.08 2drn n LEU 11 Ca 0.00 0.63 -0.00 0.00 -1.11 0.00 0.00 56.01 55.53 2drn n LEU 11 Cb 0.00 -0.61 -0.00 0.00 0.53 0.00 0.00 43.42 43.34 2drn n LEU 11 CO 0.00 -0.58 0.00 0.74 -1.11 0.00 0.00 177.39 176.45 2drn h THR 12 N 0.00 0.00 -1.01 1.96 2.02 -1.93 -2.69 112.91 111.26 2drn h THR 12 Ca 0.00 -0.36 0.29 0.00 0.77 0.00 0.00 66.41 67.10 2drn h THR 12 Cb 0.20 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.56 2drn h THR 12 CO 0.00 0.00 0.71 -0.08 0.37 0.00 0.00 175.52 176.52 2drn h GLU 13 N -0.37 0.07 0.13 6.66 4.81 -1.98 0.95 114.58 124.86 2drn h GLU 13 Ca -0.00 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2drn h GLU 13 Cb 0.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2drn h GLU 13 CO 0.00 0.04 -0.06 -0.07 -0.73 0.00 0.00 179.01 178.19 2drn h LEU 14 N 0.07 -0.15 0.63 1.64 4.07 -1.65 -2.21 115.31 117.70 2drn h LEU 14 Ca 0.49 -0.40 -0.03 0.00 0.08 0.00 0.00 57.88 58.02 2drn h LEU 14 Cb 1.84 0.04 0.01 0.00 1.08 0.00 0.00 40.66 43.62 2drn h LEU 14 CO -0.05 0.43 -0.30 -0.07 -1.08 0.00 0.00 178.44 177.38 2drn h LEU 15 N -0.85 -0.71 -1.34 1.67 4.07 -0.94 -2.97 115.31 114.25 2drn h LEU 15 Ca -0.02 0.02 0.22 0.00 0.08 0.00 0.00 57.88 58.19 2drn h LEU 15 Cb 0.54 0.18 -0.09 0.00 1.08 0.00 0.00 40.66 42.38 2drn h LEU 15 CO 0.03 -0.36 0.63 -0.61 -1.08 0.00 0.00 178.44 177.05 2drn h GLN 16 N -1.13 0.47 -0.78 1.13 -0.00 -1.03 0.25 115.11 114.03 2drn h GLN 16 Ca -0.09 -0.03 0.08 0.00 -0.00 0.00 0.00 58.65 58.62 2drn h GLN 16 Cb 0.64 -0.11 -0.07 0.00 0.00 0.00 0.00 27.48 27.95 2drn h GLN 16 CO 0.14 0.31 0.44 0.78 0.00 0.00 0.00 178.83 180.51 2drn h GLY 17 N 0.49 1.18 1.12 2.39 0.00 -1.32 -0.36 103.07 106.58 2drn h GLY 17 Ca 0.54 -0.30 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 2drn h GLY 17 CO -0.27 0.15 0.34 -1.82 0.00 0.00 0.00 176.54 174.94 2drn h TYR 18 N 0.77 1.13 -0.32 5.60 3.20 -0.35 -2.07 116.97 124.93 2drn h TYR 18 Ca 0.36 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 62.15 2drn h TYR 18 Cb 0.29 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 2drn h TYR 18 CO -0.07 0.84 0.12 1.15 -1.64 0.00 0.00 178.16 178.56 2drn h THR 19 N 1.10 1.13 0.00 1.81 2.02 -0.75 0.23 112.91 118.45 2drn h THR 19 Ca 0.26 -0.41 -0.05 0.00 0.77 0.00 0.00 66.41 66.98 2drn h THR 19 Cb 0.16 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 2drn h THR 19 CO -0.03 0.16 -0.22 0.58 0.37 0.00 0.00 175.52 176.38 2drn h VAL 20 N 0.44 0.43 0.04 3.16 2.07 -0.66 -2.95 116.25 118.79 2drn h VAL 20 Ca 0.11 -1.34 -0.34 0.00 0.82 0.00 0.00 66.70 65.95 2drn h VAL 20 Cb 0.11 2.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.83 2drn h VAL 20 CO -0.01 0.21 -1.88 -0.62 0.02 0.00 0.00 177.57 175.30 2drn n GLU 21 N -3.22 0.64 -0.02 1.57 1.02 -0.68 -2.61 120.64 117.34 2drn n GLU 21 Ca 0.02 0.37 0.13 0.00 -0.02 0.00 0.00 57.16 57.66 2drn n GLU 21 Cb 0.53 -1.66 0.56 0.00 -0.02 0.00 0.00 31.44 30.86 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 -0.55 0.87 0.04 2.62 2.07 -0.67 0.87 116.25 121.50 2drn h VAL 22 Ca -0.47 -0.09 -0.32 0.00 0.82 0.00 0.00 66.70 66.65 2drn h VAL 22 Cb 1.66 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.98 2drn h VAL 22 CO -0.15 0.05 -1.82 0.18 0.02 0.00 0.00 177.57 175.85 2drn n LEU 23 N -4.46 1.49 -0.07 2.57 4.32 -1.11 -3.14 117.00 116.61 2drn n LEU 23 Ca 0.08 0.34 -0.06 0.00 -0.02 0.00 0.00 56.01 56.35 2drn n LEU 23 Cb 0.39 -0.28 -0.04 0.00 -1.62 0.00 0.00 43.42 41.87 2drn n LEU 23 CO 0.35 0.55 -0.08 -0.09 -1.22 0.00 0.00 177.39 176.90 2drn h ARG 24 N 0.03 0.00 -0.04 3.23 1.12 -1.13 -3.35 114.38 114.23 2drn h ARG 24 Ca -0.34 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.51 2drn h ARG 24 Cb 2.02 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 31.98 2drn h ARG 24 CO 0.08 0.29 -0.09 0.37 -3.11 0.00 0.00 179.97 177.51 2drn h GLN 25 N -1.00 0.06 -6.05 0.20 -0.00 0.53 -3.47 115.11 105.38 2drn h GLN 25 Ca -0.04 -0.01 -0.39 0.00 -0.00 0.00 0.00 58.65 58.21 2drn h GLN 25 Cb 0.46 -0.01 0.11 0.00 0.00 0.00 0.00 27.48 28.04 2drn h GLN 25 CO -0.02 0.15 -0.92 0.94 0.00 0.00 0.00 178.83 178.98 2drn n GLN 26 N -4.40 -1.56 -2.13 1.69 7.27 -1.18 -4.92 117.38 112.15 2drn n GLN 26 Ca -0.02 0.55 -0.34 0.00 0.07 0.00 0.00 57.00 57.26 2drn n GLN 26 Cb 0.19 -4.54 0.01 0.00 2.41 0.00 0.00 30.24 28.31 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 -5.62 3.24 0.17 3.69 0.04 -1.26 -4.96 135.00 130.30 2drn s PRO 27 Ca 0.46 1.49 -0.05 0.00 0.04 0.00 0.00 61.00 62.94 2drn s PRO 27 Cb -0.14 -2.00 0.05 0.00 0.04 0.00 0.00 34.50 32.45 2drn s PRO 27 CO 0.83 -0.91 1.46 -1.00 0.04 0.00 0.00 177.00 177.42 2drn h PRO 28 N 0.84 0.59 -4.61 0.56 0.13 -1.99 -3.41 132.00 124.11 2drn h PRO 28 Ca -0.49 -0.40 -0.62 0.00 -0.87 0.00 0.00 66.00 63.62 2drn h PRO 28 Cb 1.25 0.06 -0.37 0.00 0.13 0.00 0.00 31.00 32.07 2drn h PRO 28 CO 0.56 1.02 -0.81 -0.51 -0.23 0.00 0.00 178.00 178.03 2drn s ASP 29 N -6.95 3.30 -0.03 1.44 1.11 -1.26 -5.01 116.67 109.27 2drn s ASP 29 Ca -0.08 -0.83 -0.25 0.00 0.18 0.00 0.00 52.55 51.57 2drn s ASP 29 Cb 0.11 -1.24 -0.20 0.00 1.07 0.00 0.00 42.92 42.66 2drn s ASP 29 CO 0.85 -0.13 1.22 0.25 1.18 0.00 0.00 175.17 178.55 2drn h LEU 30 N 7.98 0.07 -0.12 1.23 6.46 -1.98 -0.98 115.31 127.96 2drn h LEU 30 Ca -0.30 -0.55 0.03 0.00 -0.12 0.00 0.00 57.88 56.94 2drn h LEU 30 Cb 1.10 -0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 40.96 2drn h LEU 30 CO 0.49 0.60 -0.50 0.58 -0.62 0.00 0.00 178.44 178.99 2drn h VAL 31 N -0.47 0.00 -0.99 1.05 2.07 -1.99 0.99 116.25 116.92 2drn h VAL 31 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2drn h VAL 31 Cb 0.59 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.30 2drn h VAL 31 CO 0.01 0.00 0.65 -0.78 0.02 0.00 0.00 177.57 177.47 2drn h ASP 32 N -0.54 1.11 -0.14 0.57 3.58 -1.99 -1.41 116.42 117.60 2drn h ASP 32 Ca 0.03 -0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.46 2drn h ASP 32 Cb 0.62 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 2drn h ASP 32 CO -0.40 0.79 0.08 0.15 -2.88 0.00 0.00 179.24 176.98 2drn h PHE 33 N 1.30 0.18 -0.63 0.28 3.57 0.28 0.26 116.94 122.19 2drn h PHE 33 Ca 0.37 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.92 2drn h PHE 33 Cb -0.09 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 38.54 2drn h PHE 33 CO -0.00 0.17 0.35 0.00 -2.23 0.00 0.00 178.31 176.60 2drn h ALA 34 N 1.00 0.83 0.00 2.41 0.00 0.15 0.76 119.26 124.40 2drn h ALA 34 Ca 0.05 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2drn h ALA 34 Cb 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2drn h ALA 34 CO -0.01 0.03 -0.41 0.28 0.00 0.00 0.00 179.25 179.15 2drn h VAL 35 N 0.66 1.12 0.04 0.00 2.07 -0.91 -1.27 116.25 117.96 2drn h VAL 35 Ca 0.28 -1.47 -0.24 0.00 0.82 0.00 0.00 66.70 66.09 2drn h VAL 35 Cb 0.15 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 2drn h VAL 35 CO -0.17 0.40 -1.14 -0.08 0.02 0.00 0.00 177.57 176.60 2drn h GLU 36 N 0.00 0.08 0.06 1.57 4.81 0.11 -2.97 114.58 118.24 2drn h GLU 36 Ca -0.00 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2drn h GLU 36 Cb 0.80 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.23 2drn h GLU 36 CO 0.05 1.02 -0.03 -0.92 -0.73 0.00 0.00 179.01 178.41 2drn h TYR 37 N 0.02 -0.07 -0.84 0.92 3.20 0.69 -2.99 116.97 117.91 2drn h TYR 37 Ca -0.07 -0.00 0.17 0.00 3.14 0.00 0.00 58.73 61.97 2drn h TYR 37 Cb 1.85 0.02 -0.11 0.00 1.54 0.00 0.00 36.73 40.04 2drn h TYR 37 CO 0.02 -0.04 0.37 0.74 -1.64 0.00 0.00 178.16 177.61 2drn h PHE 38 N -0.57 0.63 -0.78 -3.82 0.04 -1.42 0.64 116.94 111.66 2drn h PHE 38 Ca -0.01 0.04 0.03 0.00 2.80 0.00 0.00 57.97 60.83 2drn h PHE 38 Cb 0.06 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 38.01 2drn h PHE 38 CO 0.01 0.06 0.50 1.15 -0.60 0.00 0.00 178.31 179.42 2drn h THR 39 N 0.48 1.11 -0.07 -1.55 2.02 -1.66 -0.81 112.91 112.44 2drn h THR 39 Ca 0.48 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 67.31 2drn h THR 39 Cb 0.79 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 2drn h THR 39 CO -0.44 0.18 -0.05 0.03 0.37 0.00 0.00 175.52 175.61 2drn h ARG 40 N 0.97 0.10 -0.02 6.66 3.08 -0.73 -1.64 114.38 122.80 2drn h ARG 40 Ca 0.31 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 60.21 2drn h ARG 40 Cb 0.02 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2drn h ARG 40 CO -0.11 0.16 -0.64 -0.07 -1.07 0.00 0.00 179.97 178.23 2drn h LEU 41 N 0.10 0.08 -1.20 3.04 3.38 -0.60 -2.89 115.31 117.22 2drn h LEU 41 Ca 0.02 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2drn h LEU 41 Cb 0.15 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2drn h LEU 41 CO 0.01 0.70 -0.30 -0.09 0.09 0.00 0.00 178.44 178.85 2drn h ARG 42 N 0.05 0.17 0.02 1.13 1.12 -0.71 -1.94 114.38 114.22 2drn h ARG 42 Ca -0.01 -0.06 -0.21 0.00 -1.11 0.00 0.00 59.98 58.59 2drn h ARG 42 Cb 1.14 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 31.07 2drn h ARG 42 CO 0.09 0.46 -0.95 0.93 -3.11 0.00 0.00 179.97 177.38 2drn h GLU 43 N 0.15 0.15 0.00 0.20 5.08 -1.39 -3.20 114.58 115.57 2drn h GLU 43 Ca 0.02 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 58.06 2drn h GLU 43 Cb 0.61 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 2drn h GLU 43 CO 0.04 0.99 -0.63 0.00 -1.00 0.00 0.00 179.01 178.41 2drn h ALA 44 N 0.94 0.84 -5.77 3.43 0.00 -1.29 -3.48 119.26 113.93 2drn h ALA 44 Ca -0.05 -0.58 -0.15 0.00 0.00 0.00 0.00 54.91 54.14 2drn h ALA 44 Cb 1.63 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.32 2drn h ALA 44 CO 0.14 0.79 -0.67 -2.13 0.00 0.00 0.00 179.25 177.39 2drn n ARG 45 N -3.62 -2.02 0.00 0.00 3.00 -0.76 -5.12 116.66 108.16 2drn n ARG 45 Ca -0.01 1.71 0.00 0.00 -0.00 0.00 0.00 57.85 59.56 2drn n ARG 45 Cb 0.66 -4.41 0.00 0.00 0.00 0.00 0.00 32.46 28.71 2drn n ARG 45 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50