#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f8p h PRO 2 N 0.00 -0.15 -5.70 -0.72 0.13 -2.09 -3.48 132.00 119.99 1f8p h PRO 2 Ca 0.00 0.01 -0.61 0.00 -0.87 0.00 0.00 66.00 64.53 1f8p h PRO 2 Cb 0.00 0.03 -0.10 0.00 0.13 0.00 0.00 31.00 31.07 1f8p h PRO 2 CO 0.00 -0.10 -0.49 -1.54 -0.23 0.00 0.00 178.00 175.64 1f8p s SER 3 N -3.71 4.29 0.57 1.44 1.04 -1.26 -5.11 113.70 110.96 1f8p s SER 3 Ca -0.02 -1.29 -0.18 0.00 0.48 0.00 0.00 55.95 54.94 1f8p s SER 3 Cb 0.00 -0.11 -0.12 0.00 0.10 0.00 0.00 66.02 65.90 1f8p s SER 3 CO 0.07 -0.68 0.11 0.29 0.98 0.00 0.00 173.24 174.01 1f8p n LYS 4 N -1.27 0.19 -2.37 4.02 4.01 -1.26 -4.85 118.16 116.63 1f8p n LYS 4 Ca -0.06 0.08 -0.43 0.00 -0.51 0.00 0.00 58.31 57.39 1f8p n LYS 4 Cb 0.66 -1.30 -0.02 0.00 -0.51 0.00 0.00 35.03 33.85 1f8p n LYS 4 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1f8p s PRO 5 N -1.57 4.19 0.38 1.97 0.04 -1.26 -4.99 135.00 133.77 1f8p s PRO 5 Ca 0.61 1.68 -0.24 0.00 0.04 0.00 0.00 61.00 63.09 1f8p s PRO 5 Cb -0.45 -3.80 -0.10 0.00 0.04 0.00 0.00 34.50 30.19 1f8p s PRO 5 CO 0.62 -0.76 1.00 -0.51 0.04 0.00 0.00 177.00 177.39 1f8p s ASP 6 N 2.22 6.95 -0.00 6.66 1.01 -1.26 -5.05 116.67 127.20 1f8p s ASP 6 Ca 0.57 1.93 -0.09 0.00 0.71 0.00 0.00 52.55 55.66 1f8p s ASP 6 Cb -0.23 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.08 1f8p s ASP 6 CO 0.17 -0.35 0.31 0.21 0.21 0.00 0.00 175.17 175.72 1f8p s ASN 7 N -1.67 6.59 -0.02 0.27 3.84 -1.26 -5.06 114.94 117.63 1f8p s ASN 7 Ca 0.56 0.69 -0.30 0.00 0.21 0.00 0.00 52.86 54.02 1f8p s ASN 7 Cb -0.19 -2.14 -0.04 0.00 -0.55 0.00 0.00 41.25 38.32 1f8p s ASN 7 CO 0.24 0.28 1.23 -2.16 -2.79 0.00 0.00 177.10 173.91 1f8p s PRO 8 N -1.49 4.36 0.00 0.43 0.04 -1.26 -4.16 135.00 132.92 1f8p s PRO 8 Ca 0.25 1.74 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1f8p s PRO 8 Cb -0.14 -3.51 0.00 0.00 0.04 0.00 0.00 34.50 30.89 1f8p s PRO 8 CO 0.14 -0.42 0.00 0.41 0.04 0.00 0.00 177.00 177.17 1f8p n GLY 9 N 3.37 1.68 3.07 0.56 0.00 -1.26 -5.02 105.19 107.59 1f8p n GLY 9 Ca 0.11 -0.36 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 1f8p n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1f8p s GLU 10 N 0.00 1.96 0.00 1.61 2.12 -1.26 -5.00 118.70 118.13 1f8p s GLU 10 Ca 0.00 -1.59 0.00 0.00 0.36 0.00 0.00 54.97 53.74 1f8p s GLU 10 Cb 0.00 -3.13 0.00 0.00 0.26 0.00 0.00 34.13 31.26 1f8p s GLU 10 CO 0.00 -0.77 0.35 -0.25 -0.54 0.00 0.00 175.26 174.04 1f8p n ASP 11 N 4.41 0.00 -4.26 -1.70 9.92 -1.26 -4.77 116.55 118.90 1f8p n ASP 11 Ca -0.06 0.50 -0.20 0.00 -0.53 0.00 0.00 54.79 54.50 1f8p n ASP 11 Cb 0.42 -0.28 -0.12 0.00 -0.64 0.00 0.00 41.12 40.50 1f8p n ASP 11 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1f8p s ALA 12 N -3.05 1.61 0.36 2.24 0.00 -1.26 -5.00 121.76 116.66 1f8p s ALA 12 Ca 0.00 -1.26 -0.26 0.00 0.00 0.00 0.00 51.96 50.44 1f8p s ALA 12 Cb 0.00 -0.15 -0.09 0.00 0.00 0.00 0.00 23.12 22.88 1f8p s ALA 12 CO 0.00 0.21 1.11 -1.25 0.00 0.00 0.00 175.76 175.82 1f8p s PRO 13 N -2.31 4.29 0.00 0.00 0.04 -1.26 -2.55 135.00 133.20 1f8p s PRO 13 Ca 0.07 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.83 1f8p s PRO 13 Cb -0.07 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.67 1f8p s PRO 13 CO 0.04 -0.08 0.00 0.00 0.04 0.00 0.00 177.00 177.00 1f8p n ALA 14 N 0.39 0.00 -0.47 8.56 0.00 -1.26 -4.36 120.51 123.37 1f8p n ALA 14 Ca 0.03 0.00 0.39 0.00 0.00 0.00 0.00 53.44 53.86 1f8p n ALA 14 Cb 0.47 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.63 1f8p n ALA 14 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1f8p h GLU 15 N 0.00 0.07 -0.41 0.00 4.81 -2.00 0.20 114.58 117.26 1f8p h GLU 15 Ca 0.00 -0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1f8p h GLU 15 Cb 0.00 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.31 1f8p h GLU 15 CO 0.00 0.05 0.06 0.22 -0.73 0.00 0.00 179.01 178.60 1f8p h ASP 16 N 0.07 -0.05 -0.72 1.04 3.58 -1.69 0.46 116.42 119.11 1f8p h ASP 16 Ca 0.75 0.08 0.05 0.00 0.42 0.00 0.00 57.03 58.33 1f8p h ASP 16 Cb 2.69 0.12 -0.04 0.00 1.72 0.00 0.00 39.33 43.81 1f8p h ASP 16 CO -0.16 0.01 0.48 0.17 -2.88 0.00 0.00 179.24 176.85 1f8p h LEU 17 N 0.18 0.69 -1.94 2.28 8.10 -0.90 0.14 115.31 123.86 1f8p h LEU 17 Ca 0.20 -0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.19 1f8p h LEU 17 Cb 0.26 -0.15 0.00 0.00 -0.44 0.00 0.00 40.66 40.33 1f8p h LEU 17 CO -0.28 0.46 0.00 0.00 -4.11 0.00 0.00 178.44 174.50 1f8p h ALA 18 N 1.60 1.00 -0.09 0.17 0.00 -0.86 -2.36 119.26 118.71 1f8p h ALA 18 Ca 0.30 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.12 1f8p h ALA 18 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1f8p h ALA 18 CO -0.10 0.00 -0.32 -0.09 0.00 0.00 0.00 179.25 178.75 1f8p h ARG 19 N 0.00 0.38 0.00 0.00 2.43 0.26 -3.13 114.38 114.32 1f8p h ARG 19 Ca 0.00 -0.28 -0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1f8p h ARG 19 Cb 0.29 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1f8p h ARG 19 CO 0.00 0.91 -0.02 1.88 -1.51 0.00 0.00 179.97 181.23 1f8p h TYR 20 N -0.08 0.00 -0.65 2.20 0.05 -1.19 -2.61 116.97 114.69 1f8p h TYR 20 Ca -0.01 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.68 1f8p h TYR 20 Cb 0.95 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.66 1f8p h TYR 20 CO 0.12 0.02 0.08 -0.92 -1.05 0.00 0.00 178.16 176.41 1f8p h TYR 21 N 0.00 1.17 -0.09 4.88 5.03 -1.44 -1.03 116.97 125.49 1f8p h TYR 21 Ca -0.00 -0.17 0.03 0.00 2.58 0.00 0.00 58.73 61.16 1f8p h TYR 21 Cb 0.38 -0.32 -0.03 0.00 1.55 0.00 0.00 36.73 38.32 1f8p h TYR 21 CO 0.00 0.99 -0.07 0.66 -1.32 0.00 0.00 178.16 178.43 1f8p h SER 22 N 1.01 -0.21 -0.52 -2.11 4.64 -1.54 0.49 113.55 115.31 1f8p h SER 22 Ca 0.19 0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.51 1f8p h SER 22 Cb 0.48 0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.65 1f8p h SER 22 CO 0.02 -0.09 0.17 0.00 -0.87 0.00 0.00 176.83 176.05 1f8p h ALA 23 N 1.01 1.23 -0.65 5.18 0.00 -1.64 -0.85 119.26 123.53 1f8p h ALA 23 Ca 0.06 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1f8p h ALA 23 Cb 0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1f8p h ALA 23 CO -0.14 0.54 0.22 -0.07 0.00 0.00 0.00 179.25 179.80 1f8p h LEU 24 N 0.83 0.91 0.49 0.00 3.38 -0.14 -2.45 115.31 118.33 1f8p h LEU 24 Ca 0.19 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1f8p h LEU 24 Cb 0.26 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1f8p h LEU 24 CO -0.01 0.84 -0.23 -0.09 0.09 0.00 0.00 178.44 179.04 1f8p h ARG 25 N 0.95 -0.63 -0.82 1.13 2.43 0.13 0.36 114.38 117.93 1f8p h ARG 25 Ca 0.22 0.04 0.18 0.00 -0.81 0.00 0.00 59.98 59.61 1f8p h ARG 25 Cb 0.25 0.14 -0.11 0.00 -0.42 0.00 0.00 29.97 29.83 1f8p h ARG 25 CO -0.01 -0.39 0.30 1.25 -1.51 0.00 0.00 179.97 179.61 1f8p h HIS 26 N -0.71 0.49 0.00 2.20 2.76 -0.96 0.87 115.15 119.79 1f8p h HIS 26 Ca -0.07 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.14 1f8p h HIS 26 Cb 0.53 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.40 1f8p h HIS 26 CO -0.03 -0.04 0.00 0.66 -1.30 0.00 0.00 177.93 177.22 1f8p n TYR 27 N -5.08 0.00 -0.52 5.26 4.01 -0.95 -1.69 117.16 118.19 1f8p n TYR 27 Ca 0.18 0.00 0.44 0.00 -0.16 0.00 0.00 57.90 58.35 1f8p n TYR 27 Cb 0.54 -0.26 0.76 0.00 -0.31 0.00 0.00 39.34 40.07 1f8p n TYR 27 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1f8p h ILE 28 N 0.00 0.18 0.38 -0.72 2.04 -0.10 0.71 117.51 120.01 1f8p h ILE 28 Ca 0.00 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 1f8p h ILE 28 Cb 0.00 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1f8p h ILE 28 CO 0.00 0.01 -0.18 -1.13 0.00 0.00 0.00 178.15 176.84 1f8p h ASN 29 N 0.03 -0.44 -0.04 1.72 -0.73 0.75 -2.15 115.58 114.72 1f8p h ASN 29 Ca 0.79 -0.06 -0.12 0.00 1.87 0.00 0.00 56.30 58.78 1f8p h ASN 29 Cb 3.00 0.11 0.01 0.00 0.27 0.00 0.00 38.32 41.71 1f8p h ASN 29 CO -0.09 -0.21 -0.45 0.17 -0.37 0.00 0.00 177.43 176.48 1f8p h LEU 30 N -0.64 0.46 -0.91 0.34 8.10 0.10 -1.86 115.31 120.90 1f8p h LEU 30 Ca -0.05 -0.71 0.24 0.00 0.11 0.00 0.00 57.88 57.47 1f8p h LEU 30 Cb 0.47 -0.14 -0.13 0.00 -0.44 0.00 0.00 40.66 40.42 1f8p h LEU 30 CO 0.09 1.10 0.38 0.40 -4.11 0.00 0.00 178.44 176.30 1f8p h ILE 31 N -0.14 0.39 0.03 0.15 5.03 -0.11 -0.52 117.51 122.34 1f8p h ILE 31 Ca -0.04 -0.11 -0.00 0.00 -0.12 0.00 0.00 64.86 64.58 1f8p h ILE 31 Cb 1.14 0.03 0.00 0.00 -3.03 0.00 0.00 36.82 34.96 1f8p h ILE 31 CO 0.09 0.06 -0.01 0.71 -0.68 0.00 0.00 178.15 178.32 1f8p h THR 32 N 0.33 1.41 -0.89 -0.27 1.35 -1.39 -0.58 112.91 112.87 1f8p h THR 32 Ca 0.59 -1.67 0.28 0.00 -0.55 0.00 0.00 66.41 65.07 1f8p h THR 32 Cb 1.19 2.48 -0.16 0.00 -1.73 0.00 0.00 68.15 69.93 1f8p h THR 32 CO -0.58 0.41 0.15 -1.14 -0.25 0.00 0.00 175.52 174.11 1f8p n ARG 33 N -4.76 -0.07 0.04 4.72 3.00 -0.26 0.65 116.66 119.99 1f8p n ARG 33 Ca -0.09 1.30 -0.19 0.00 -0.00 0.00 0.00 57.85 58.87 1f8p n ARG 33 Cb 0.34 -2.15 -0.14 0.00 0.00 0.00 0.00 32.46 30.52 1f8p n ARG 33 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 1f8p h GLN 34 N 0.00 0.31 0.00 -0.14 4.15 -1.46 -3.45 115.11 114.52 1f8p h GLN 34 Ca 0.60 -0.49 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1f8p h GLN 34 Cb 1.38 0.18 0.00 0.00 0.21 0.00 0.00 27.48 29.24 1f8p h GLN 34 CO -0.79 1.22 0.00 0.54 -1.93 0.00 0.00 178.83 177.86 1f8p n ARG 35 N -4.15 0.00 0.00 1.69 3.00 0.21 -5.12 116.66 112.29 1f8p n ARG 35 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.71 1f8p n ARG 35 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.25 1f8p n ARG 35 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.63 178.61