#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ba4 s ALA 2 N 0.00 0.18 0.00 2.12 0.00 -1.26 -5.00 121.76 117.80 1ba4 s ALA 2 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.10 1ba4 s ALA 2 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1ba4 s ALA 2 CO 0.00 -0.05 0.00 -1.91 0.00 0.00 0.00 175.76 173.80 1ba4 n GLU 3 N 3.80 0.00 -3.20 0.00 2.13 -1.26 -5.03 120.64 117.08 1ba4 n GLU 3 Ca -0.23 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.55 1ba4 n GLU 3 Cb 0.53 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.22 1ba4 n GLU 3 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1ba4 s PHE 4 N 0.09 -1.33 -0.87 4.31 0.08 -1.26 -4.94 117.98 114.04 1ba4 s PHE 4 Ca 0.00 -0.14 0.00 0.00 0.12 0.00 0.00 56.93 56.91 1ba4 s PHE 4 Cb 0.00 0.13 0.00 0.00 -0.57 0.00 0.00 43.02 42.58 1ba4 s PHE 4 CO 0.00 -1.14 0.00 -2.13 -0.10 0.00 0.00 175.22 171.85 1ba4 n ARG 5 N 4.17 -1.80 0.00 0.44 3.00 -1.26 -4.80 116.66 116.40 1ba4 n ARG 5 Ca 0.12 0.49 0.00 0.00 -0.00 0.00 0.00 57.85 58.46 1ba4 n ARG 5 Cb 0.54 -4.86 0.00 0.00 0.00 0.00 0.00 32.46 28.14 1ba4 n ARG 5 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 1ba4 n HIS 6 N -2.36 0.00 0.40 -0.14 -0.00 -1.26 -3.53 115.22 108.32 1ba4 n HIS 6 Ca -0.10 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.08 1ba4 n HIS 6 Cb 0.44 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.31 1ba4 n HIS 6 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 1ba4 n ASP 7 N 0.00 3.00 -0.75 0.26 5.68 -1.26 -0.98 116.55 122.51 1ba4 n ASP 7 Ca 0.00 -1.76 -0.04 0.00 -0.50 0.00 0.00 54.79 52.49 1ba4 n ASP 7 Cb 0.00 -0.56 -0.04 0.00 -1.14 0.00 0.00 41.12 39.38 1ba4 n ASP 7 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1ba4 n SER 8 N 0.94 -0.54 0.00 -1.12 3.41 -1.26 -4.72 113.62 110.32 1ba4 n SER 8 Ca 0.00 -1.42 0.00 0.00 -0.26 0.00 0.00 58.87 57.19 1ba4 n SER 8 Cb 0.40 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1ba4 n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ba4 n GLY 9 N 0.00 0.00 0.00 5.00 0.00 -1.03 -4.50 105.19 104.67 1ba4 n GLY 9 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1ba4 n GLY 9 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1ba4 n TYR 10 N 0.00 0.00 0.00 1.61 4.19 -0.15 -4.85 117.16 117.96 1ba4 n TYR 10 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1ba4 n TYR 10 Cb 0.00 0.00 0.00 0.00 0.49 0.00 0.00 39.34 39.83 1ba4 n TYR 10 CO 0.00 0.00 0.00 -1.91 0.91 0.00 0.00 176.86 175.86 1ba4 n GLU 11 N 0.00 0.00 -1.13 2.98 0.00 -1.26 -5.03 120.64 116.20 1ba4 n GLU 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1ba4 n GLU 11 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1ba4 n GLU 11 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 1ba4 n VAL 12 N -1.35 0.00 -1.66 6.31 0.24 -1.26 -4.94 118.33 115.67 1ba4 n VAL 12 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1ba4 n VAL 12 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1ba4 n VAL 12 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1ba4 n HIS 13 N 0.00 0.00 -3.66 6.34 8.25 -1.26 -5.07 115.22 119.82 1ba4 n HIS 13 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 1ba4 n HIS 13 Cb 0.00 0.07 -0.08 0.00 1.12 0.00 0.00 29.99 31.10 1ba4 n HIS 13 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1ba4 s HIS 14 N 0.00 -0.90 -0.56 4.41 3.76 -1.26 -5.03 115.29 115.72 1ba4 s HIS 14 Ca 0.00 1.80 0.11 0.00 -0.15 0.00 0.00 55.06 56.82 1ba4 s HIS 14 Cb 0.00 0.49 0.63 0.00 1.11 0.00 0.00 32.58 34.81 1ba4 s HIS 14 CO 0.00 -0.47 1.35 0.94 -0.85 0.00 0.00 174.74 175.71 1ba4 n GLN 15 N 4.45 0.07 0.02 1.40 7.27 -1.26 -1.33 117.38 128.01 1ba4 n GLN 15 Ca -0.20 0.57 -0.13 0.00 0.07 0.00 0.00 57.00 57.31 1ba4 n GLN 15 Cb 0.56 -1.75 -0.09 0.00 2.41 0.00 0.00 30.24 31.37 1ba4 n GLN 15 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 1ba4 h LYS 16 N 0.00 -0.08 -0.52 3.69 1.63 -2.00 -2.17 116.57 117.12 1ba4 h LYS 16 Ca 0.00 0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.82 1ba4 h LYS 16 Cb 0.02 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.64 1ba4 h LYS 16 CO 0.00 0.35 0.35 -0.07 -3.45 0.00 0.00 179.45 176.63 1ba4 h LEU 17 N -0.54 0.56 0.66 5.20 3.38 -1.63 -1.52 115.31 121.42 1ba4 h LEU 17 Ca -0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1ba4 h LEU 17 Cb 0.47 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1ba4 h LEU 17 CO 0.01 0.40 -0.36 0.58 0.09 0.00 0.00 178.44 179.16 1ba4 h VAL 18 N 0.66 0.27 -0.58 1.22 2.07 -1.29 0.86 116.25 119.46 1ba4 h VAL 18 Ca 0.20 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.84 1ba4 h VAL 18 Cb 0.01 0.27 -0.11 0.00 -1.52 0.00 0.00 31.29 29.94 1ba4 h VAL 18 CO -0.05 0.00 -0.12 -0.26 0.02 0.00 0.00 177.57 177.16 1ba4 h PHE 19 N -0.94 -0.26 -0.02 1.57 -1.00 -0.77 -0.30 116.94 115.23 1ba4 h PHE 19 Ca -0.09 0.05 0.03 0.00 2.81 0.00 0.00 57.97 60.78 1ba4 h PHE 19 Cb 0.75 0.20 -0.04 0.00 3.61 0.00 0.00 35.95 40.47 1ba4 h PHE 19 CO -0.06 -0.23 -0.22 0.35 -1.61 0.00 0.00 178.31 176.53 1ba4 h PHE 20 N 0.02 -0.59 -0.67 -0.55 3.57 -1.01 -2.23 116.94 115.49 1ba4 h PHE 20 Ca 0.28 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.93 1ba4 h PHE 20 Cb 0.44 0.27 -0.09 0.00 2.79 0.00 0.00 35.95 39.35 1ba4 h PHE 20 CO -0.45 -0.31 0.18 0.00 -2.23 0.00 0.00 178.31 175.49 1ba4 h ALA 21 N 0.54 0.84 0.06 2.41 0.00 0.84 -1.15 119.26 122.80 1ba4 h ALA 21 Ca 0.07 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1ba4 h ALA 21 Cb 0.43 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1ba4 h ALA 21 CO -0.22 -0.29 -0.11 0.93 0.00 0.00 0.00 179.25 179.57 1ba4 h GLU 22 N 0.30 -0.21 -0.42 0.00 3.07 -0.75 0.92 114.58 117.50 1ba4 h GLU 22 Ca 0.36 0.01 0.08 0.00 -0.50 0.00 0.00 59.36 59.32 1ba4 h GLU 22 Cb 0.55 0.05 -0.09 0.00 -0.84 0.00 0.00 28.75 28.42 1ba4 h GLU 22 CO -0.43 -0.14 -0.31 0.22 -1.40 0.00 0.00 179.01 176.95 1ba4 h ASP 23 N -0.22 -1.03 -0.03 1.42 3.58 -0.74 -1.49 116.42 117.91 1ba4 h ASP 23 Ca 0.02 0.19 0.03 0.00 0.42 0.00 0.00 57.03 57.70 1ba4 h ASP 23 Cb 0.23 0.50 -0.05 0.00 1.72 0.00 0.00 39.33 41.73 1ba4 h ASP 23 CO -0.06 -0.31 -0.24 0.58 -2.88 0.00 0.00 179.24 176.32 1ba4 h VAL 24 N -0.22 0.43 -0.56 2.25 2.07 -0.91 -0.32 116.25 118.99 1ba4 h VAL 24 Ca 0.18 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.82 1ba4 h VAL 24 Cb 0.53 0.43 -0.11 0.00 -1.52 0.00 0.00 31.29 30.62 1ba4 h VAL 24 CO -0.55 0.00 -0.20 1.23 0.02 0.00 0.00 177.57 178.07 1ba4 h GLY 25 N -0.36 0.25 0.84 2.17 0.00 0.06 0.32 103.07 106.34 1ba4 h GLY 25 Ca 0.07 0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.62 1ba4 h GLY 25 CO -0.24 -0.22 -0.40 1.76 0.00 0.00 0.00 176.54 177.43 1ba4 h SER 26 N -0.07 -0.96 0.00 0.19 0.02 -0.89 -1.03 113.55 110.82 1ba4 h SER 26 Ca 0.26 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 1ba4 h SER 26 Cb 0.47 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.26 1ba4 h SER 26 CO -0.61 -0.62 0.00 0.59 -1.14 0.00 0.00 176.83 175.05 1ba4 n ASN 27 N -5.37 0.00 -0.29 3.07 3.02 -0.17 -1.30 115.26 114.21 1ba4 n ASN 27 Ca -0.14 0.97 0.21 0.00 -0.03 0.00 0.00 54.58 55.59 1ba4 n ASN 27 Cb 0.45 -0.47 0.50 0.00 -0.61 0.00 0.00 39.78 39.65 1ba4 n ASN 27 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1ba4 h LYS 28 N 0.00 0.40 0.70 3.52 3.64 -0.55 -0.43 116.57 123.86 1ba4 h LYS 28 Ca 0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1ba4 h LYS 28 Cb 0.00 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1ba4 h LYS 28 CO 0.00 0.27 -0.47 0.78 -2.27 0.00 0.00 179.45 177.76 1ba4 h GLY 29 N 0.42 -1.24 0.71 5.01 0.00 -1.00 -0.08 103.07 106.88 1ba4 h GLY 29 Ca 0.54 0.52 0.05 0.00 0.00 0.00 0.00 47.33 48.44 1ba4 h GLY 29 CO -0.24 -0.42 0.29 0.00 0.00 0.00 0.00 176.54 176.18 1ba4 h ALA 30 N -0.96 0.73 -0.08 3.60 0.00 0.16 -1.84 119.26 120.88 1ba4 h ALA 30 Ca -0.09 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.88 1ba4 h ALA 30 Cb 0.90 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.54 1ba4 h ALA 30 CO 0.07 -0.04 -0.34 0.82 0.00 0.00 0.00 179.25 179.75 1ba4 h ILE 31 N 0.56 0.26 -0.42 0.00 2.04 -0.90 -0.15 117.51 118.91 1ba4 h ILE 31 Ca 0.25 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.17 1ba4 h ILE 31 Cb 0.15 0.26 -0.05 0.00 -0.74 0.00 0.00 36.82 36.44 1ba4 h ILE 31 CO -0.17 0.00 0.13 0.40 0.00 0.00 0.00 178.15 178.51 1ba4 h ILE 32 N -0.45 0.84 -0.37 -0.67 2.04 -0.67 -0.97 117.51 117.25 1ba4 h ILE 32 Ca 0.08 -0.10 0.08 0.00 1.00 0.00 0.00 64.86 65.92 1ba4 h ILE 32 Cb 0.57 0.54 -0.07 0.00 -0.74 0.00 0.00 36.82 37.12 1ba4 h ILE 32 CO -0.33 0.05 -0.11 1.23 0.00 0.00 0.00 178.15 179.00 1ba4 h GLY 33 N 0.28 0.25 0.89 5.37 0.00 -0.47 -0.05 103.07 109.33 1ba4 h GLY 33 Ca 0.20 0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.68 1ba4 h GLY 33 CO -0.22 -0.15 0.06 1.41 0.00 0.00 0.00 176.54 177.64 1ba4 h LEU 34 N -0.02 0.07 -0.30 3.11 3.38 -0.36 -1.25 115.31 119.93 1ba4 h LEU 34 Ca 0.18 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.22 1ba4 h LEU 34 Cb 0.29 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 1ba4 h LEU 34 CO -0.39 0.06 -0.08 0.24 0.09 0.00 0.00 178.44 178.36 1ba4 h MET 35 N 0.13 -0.00 -0.22 1.13 2.86 -0.49 -1.35 114.93 116.98 1ba4 h MET 35 Ca 0.06 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.75 1ba4 h MET 35 Cb 0.03 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.65 1ba4 h MET 35 CO -0.06 -0.00 -0.07 0.28 1.06 0.00 0.00 176.91 178.12 1ba4 h VAL 36 N -0.00 0.75 0.11 -2.22 2.07 -0.76 -2.73 116.25 113.46 1ba4 h VAL 36 Ca 0.14 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.68 1ba4 h VAL 36 Cb 0.22 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 1ba4 h VAL 36 CO -0.31 0.00 -0.30 1.23 0.02 0.00 0.00 177.57 178.21 1ba4 h GLY 37 N -0.02 -0.56 0.00 2.17 0.00 -0.63 -3.46 103.07 100.57 1ba4 h GLY 37 Ca 0.11 0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.80 1ba4 h GLY 37 CO -0.24 -0.24 0.00 0.61 0.00 0.00 0.00 176.54 176.67 1ba4 n GLY 38 N -1.41 2.38 0.62 4.60 0.00 -0.56 -4.51 105.19 106.31 1ba4 n GLY 38 Ca -0.06 -0.13 0.06 0.00 0.00 0.00 0.00 46.02 45.89 1ba4 n GLY 38 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ba4 n VAL 39 N 0.00 1.71 -0.79 1.61 0.31 -1.26 -5.05 118.33 114.86 1ba4 n VAL 39 Ca 0.00 -2.56 0.00 0.00 -0.01 0.00 0.00 64.34 61.77 1ba4 n VAL 39 Cb 0.00 -0.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 1ba4 n VAL 39 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03