#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f8p s PRO 2 N 0.00 3.68 0.29 -0.72 0.04 -1.26 -4.83 135.00 132.21 1f8p s PRO 2 Ca 0.00 -1.45 0.00 0.00 0.04 0.00 0.00 61.00 59.59 1f8p s PRO 2 Cb 0.00 -5.30 0.00 0.00 0.04 0.00 0.00 34.50 29.24 1f8p s PRO 2 CO 0.00 -2.12 0.00 0.45 0.04 0.00 0.00 177.00 175.37 1f8p n SER 3 N 8.24 -4.22 -3.95 6.66 2.88 -1.26 -4.76 113.62 117.21 1f8p n SER 3 Ca 0.34 0.66 -0.30 0.00 -1.33 0.00 0.00 58.87 58.24 1f8p n SER 3 Cb 0.49 -2.50 -0.12 0.00 -0.75 0.00 0.00 64.21 61.34 1f8p n SER 3 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1f8p s LYS 4 N -3.24 2.39 0.02 -1.46 1.02 -1.26 -4.95 119.74 112.27 1f8p s LYS 4 Ca 0.00 -3.05 -0.22 0.00 0.02 0.00 0.00 55.97 52.72 1f8p s LYS 4 Cb 0.00 -3.46 -0.16 0.00 -0.52 0.00 0.00 37.83 33.69 1f8p s LYS 4 CO 0.00 -1.22 1.35 -1.00 -0.92 0.00 0.00 175.35 173.56 1f8p h PRO 5 N 5.94 0.23 0.00 -1.68 0.13 -2.02 -3.47 132.00 131.13 1f8p h PRO 5 Ca 0.06 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1f8p h PRO 5 Cb 0.82 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1f8p h PRO 5 CO 0.72 0.62 0.00 -3.47 -0.23 0.00 0.00 178.00 175.64 1f8p n ASP 6 N -4.68 0.00 -0.50 1.44 -0.08 -1.26 -4.82 116.55 106.65 1f8p n ASP 6 Ca -0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.21 1f8p n ASP 6 Cb 0.30 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.76 1f8p n ASP 6 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1f8p n ASN 7 N 3.86 -2.38 0.42 1.67 2.85 -1.26 -4.98 115.26 115.45 1f8p n ASN 7 Ca 0.00 0.07 -0.17 0.00 -0.11 0.00 0.00 54.58 54.38 1f8p n ASN 7 Cb 0.00 -0.89 -0.08 0.00 1.24 0.00 0.00 39.78 40.05 1f8p n ASN 7 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1f8p h PRO 8 N 0.22 -1.05 0.00 1.20 0.13 -2.05 -3.49 132.00 126.95 1f8p h PRO 8 Ca 0.00 0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1f8p h PRO 8 Cb 0.00 0.24 0.00 0.00 0.13 0.00 0.00 31.00 31.37 1f8p h PRO 8 CO 0.00 -0.70 0.00 0.41 -0.23 0.00 0.00 178.00 177.48 1f8p n GLY 9 N -1.01 4.42 2.80 1.56 0.00 -1.26 -5.10 105.19 106.60 1f8p n GLY 9 Ca -0.14 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 44.70 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 -3.49 0.54 0.00 1.61 2.56 -1.26 -4.95 118.70 113.71 1f8p s GLU 10 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.97 54.45 1f8p s GLU 10 Cb 0.00 -0.61 0.00 0.00 2.00 0.00 0.00 34.13 35.52 1f8p s GLU 10 CO 0.00 -1.13 0.00 -3.47 -0.56 0.00 0.00 175.26 170.10 1f8p n ASP 11 N 4.67 0.00 -4.06 -1.70 -0.08 -1.26 -5.05 116.55 109.08 1f8p n ASP 11 Ca 0.06 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 53.00 1f8p n ASP 11 Cb 0.47 0.03 -0.08 0.00 2.34 0.00 0.00 41.12 43.87 1f8p n ASP 11 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1f8p s ALA 12 N -1.63 3.99 0.34 -1.67 0.00 -1.26 -5.08 121.76 116.45 1f8p s ALA 12 Ca 0.00 -3.70 -0.28 0.00 0.00 0.00 0.00 51.96 47.98 1f8p s ALA 12 Cb 0.00 -2.65 -0.10 0.00 0.00 0.00 0.00 23.12 20.37 1f8p s ALA 12 CO 0.00 -2.13 1.27 -1.25 0.00 0.00 0.00 175.76 173.65 1f8p s PRO 13 N -1.05 4.33 0.00 0.00 0.04 -1.26 -2.36 135.00 134.70 1f8p s PRO 13 Ca 0.24 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.42 1f8p s PRO 13 Cb -0.10 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.41 1f8p s PRO 13 CO -0.11 -0.18 0.00 0.00 0.04 0.00 0.00 177.00 176.76 1f8p n ALA 14 N 0.73 0.00 -0.30 8.56 0.00 -1.26 -4.49 120.51 123.76 1f8p n ALA 14 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.57 1f8p n ALA 14 Cb 0.43 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.15 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 0.18 -0.82 0.00 4.57 -2.01 0.12 114.58 116.61 1f8p h GLU 15 Ca 0.00 -0.01 0.11 0.00 -1.18 0.00 0.00 59.36 58.28 1f8p h GLU 15 Cb 0.00 -0.04 -0.08 0.00 -0.16 0.00 0.00 28.75 28.47 1f8p h GLU 15 CO 0.00 0.12 0.45 0.22 -1.18 0.00 0.00 179.01 178.62 1f8p h ASP 16 N 0.18 0.60 -0.87 1.04 3.58 -1.69 0.21 116.42 119.47 1f8p h ASP 16 Ca 0.54 0.06 0.13 0.00 0.42 0.00 0.00 57.03 58.19 1f8p h ASP 16 Cb 1.09 -0.05 -0.09 0.00 1.72 0.00 0.00 39.33 42.00 1f8p h ASP 16 CO -0.67 0.32 0.48 -0.07 -2.88 0.00 0.00 179.24 176.42 1f8p h LEU 17 N 0.72 0.64 -0.88 2.28 3.38 -1.06 0.16 115.31 120.54 1f8p h LEU 17 Ca 0.41 0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.57 1f8p h LEU 17 Cb 0.46 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 41.09 1f8p h LEU 17 CO -0.29 0.30 0.51 0.00 0.09 0.00 0.00 178.44 179.05 1f8p h ALA 18 N 1.54 1.29 0.53 1.53 0.00 -0.44 0.70 119.26 124.40 1f8p h ALA 18 Ca 0.46 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 1f8p h ALA 18 Cb 0.58 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.25 1f8p h ALA 18 CO -0.32 0.08 -0.26 -0.09 0.00 0.00 0.00 179.25 178.67 1f8p h ARG 19 N 0.80 -0.69 -0.74 0.00 9.65 -0.61 -2.19 114.38 120.61 1f8p h ARG 19 Ca 0.44 0.05 0.18 0.00 -1.10 0.00 0.00 59.98 59.55 1f8p h ARG 19 Cb 0.47 0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 29.16 1f8p h ARG 19 CO -0.28 -0.38 0.51 -0.92 2.80 0.00 0.00 179.97 181.70 1f8p h TYR 20 N -0.96 0.26 -0.98 2.20 3.20 -0.84 -2.11 116.97 117.74 1f8p h TYR 20 Ca -0.07 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.82 1f8p h TYR 20 Cb 0.62 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 1f8p h TYR 20 CO 0.00 0.09 0.65 -0.92 -1.64 0.00 0.00 178.16 176.34 1f8p h TYR 21 N 0.21 1.22 -0.05 -3.82 3.20 0.11 0.15 116.97 117.99 1f8p h TYR 21 Ca 0.36 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.26 1f8p h TYR 21 Cb 1.12 -0.41 -0.00 0.00 1.54 0.00 0.00 36.73 38.97 1f8p h TYR 21 CO -0.00 0.75 0.02 1.03 -1.64 0.00 0.00 178.16 178.32 1f8p h SER 22 N 1.30 0.03 -0.01 -2.11 0.87 -1.22 0.61 113.55 113.02 1f8p h SER 22 Ca 0.37 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.93 1f8p h SER 22 Cb -0.10 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1f8p h SER 22 CO -0.09 0.03 0.00 0.00 -0.53 0.00 0.00 176.83 176.24 1f8p h ALA 23 N 1.02 0.01 -0.90 6.23 0.00 -1.37 -2.07 119.26 122.18 1f8p h ALA 23 Ca 0.02 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 54.96 1f8p h ALA 23 Cb 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 1f8p h ALA 23 CO -0.01 -0.38 0.58 1.25 0.00 0.00 0.00 179.25 180.69 1f8p h LEU 24 N -0.19 0.71 0.03 0.00 5.85 -0.60 -2.06 115.31 119.06 1f8p h LEU 24 Ca 0.00 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 1f8p h LEU 24 Cb 0.21 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1f8p h LEU 24 CO -0.00 0.37 -0.02 -0.09 -0.34 0.00 0.00 178.44 178.36 1f8p h ARG 25 N 0.76 -0.04 -0.98 1.25 2.43 0.60 0.34 114.38 118.73 1f8p h ARG 25 Ca 0.45 0.00 0.13 0.00 -0.81 0.00 0.00 59.98 59.75 1f8p h ARG 25 Cb 0.64 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.12 1f8p h ARG 25 CO -0.21 0.32 0.62 1.25 -1.51 0.00 0.00 179.97 180.44 1f8p h HIS 26 N -0.41 1.07 0.00 2.20 2.76 -0.68 0.39 115.15 120.47 1f8p h HIS 26 Ca -0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1f8p h HIS 26 Cb 0.38 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.01 1f8p h HIS 26 CO 0.05 0.40 0.00 0.66 -1.30 0.00 0.00 177.93 177.74 1f8p n TYR 27 N -4.62 0.00 -0.40 5.26 4.01 -1.05 -2.45 117.16 117.91 1f8p n TYR 27 Ca 0.19 0.00 0.34 0.00 -0.16 0.00 0.00 57.90 58.27 1f8p n TYR 27 Cb 0.40 -0.18 0.61 0.00 -0.31 0.00 0.00 39.34 39.85 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 0.15 0.40 -0.72 5.03 0.75 0.43 117.51 123.55 1f8p h ILE 28 Ca 0.00 -0.04 -0.01 0.00 -0.12 0.00 0.00 64.86 64.69 1f8p h ILE 28 Cb 0.00 0.01 -0.02 0.00 -3.03 0.00 0.00 36.82 33.79 1f8p h ILE 28 CO 0.00 0.02 -0.34 -1.13 -0.68 0.00 0.00 178.15 176.02 1f8p h ASN 29 N 0.12 -0.90 0.08 1.72 -1.24 -0.35 -0.39 115.58 114.62 1f8p h ASN 29 Ca 0.80 0.07 -0.26 0.00 0.71 0.00 0.00 56.30 57.62 1f8p h ASN 29 Cb 2.34 0.29 0.02 0.00 0.73 0.00 0.00 38.32 41.70 1f8p h ASN 29 CO -0.50 -0.49 -1.04 0.17 -1.29 0.00 0.00 177.43 174.27 1f8p h LEU 30 N -0.75 0.84 -0.58 0.34 8.10 0.01 -2.53 115.31 120.75 1f8p h LEU 30 Ca -0.03 -0.68 0.09 0.00 0.11 0.00 0.00 57.88 57.37 1f8p h LEU 30 Cb 0.65 -0.26 -0.07 0.00 -0.44 0.00 0.00 40.66 40.55 1f8p h LEU 30 CO -0.02 1.48 0.19 -0.29 -4.11 0.00 0.00 178.44 175.69 1f8p h ILE 31 N 0.36 0.75 -0.61 0.15 -0.00 -0.57 -0.54 117.51 117.05 1f8p h ILE 31 Ca -0.13 -0.12 -0.10 0.00 -0.00 0.00 0.00 64.86 64.52 1f8p h ILE 31 Cb 1.69 0.37 -0.02 0.00 -0.00 0.00 0.00 36.82 38.86 1f8p h ILE 31 CO 0.20 0.07 0.01 0.71 -0.00 0.00 0.00 178.15 179.13 1f8p h THR 32 N 0.36 1.27 -0.83 2.19 1.35 -1.10 0.22 112.91 116.37 1f8p h THR 32 Ca 0.29 -1.15 0.20 0.00 -0.55 0.00 0.00 66.41 65.20 1f8p h THR 32 Cb 0.37 0.79 -0.15 0.00 -1.73 0.00 0.00 68.15 67.43 1f8p h THR 32 CO -0.31 0.42 0.03 -0.09 -0.25 0.00 0.00 175.52 175.32 1f8p h ARG 33 N 0.98 0.09 0.00 4.72 2.43 -0.63 0.50 114.38 122.46 1f8p h ARG 33 Ca 0.17 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.27 1f8p h ARG 33 Cb 0.56 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1f8p h ARG 33 CO 0.03 0.06 -0.53 0.37 -1.51 0.00 0.00 179.97 178.39 1f8p h GLN 34 N 0.09 0.00 0.49 0.20 5.75 -1.48 -3.42 115.11 116.74 1f8p h GLN 34 Ca 0.47 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.96 1f8p h GLN 34 Cb 0.88 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.42 1f8p h GLN 34 CO -0.73 0.45 -0.41 -0.09 -2.65 0.00 0.00 178.83 175.40 1f8p h ARG 35 N -1.00 -0.85 -0.01 1.69 2.43 -0.17 -3.52 114.38 112.95 1f8p h ARG 35 Ca -0.10 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1f8p h ARG 35 Cb 0.71 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1f8p h ARG 35 CO -0.06 -0.56 0.00 0.66 -1.51 0.00 0.00 179.97 178.49