#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ohn s TYR 2 N 0.00 2.59 0.19 5.64 2.02 -1.26 -4.97 117.35 121.57 1ohn s TYR 2 Ca 0.00 1.44 0.00 0.00 -0.37 0.00 0.00 57.07 58.14 1ohn s TYR 2 Cb 0.00 -3.06 0.00 0.00 -0.40 0.00 0.00 41.96 38.50 1ohn s TYR 2 CO 0.00 -1.88 0.00 0.98 -1.57 0.00 0.00 175.55 173.08 1ohn n TYR 3 N -3.56 -3.24 0.00 2.71 9.36 -1.26 -5.13 117.16 116.03 1ohn n TYR 3 Ca 0.08 0.67 0.00 0.00 3.32 0.00 0.00 57.90 61.97 1ohn n TYR 3 Cb 0.54 1.92 0.00 0.00 -0.63 0.00 0.00 39.34 41.17 1ohn n TYR 3 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ohn n GLY 4 N -1.43 0.01 4.33 2.98 0.00 -1.26 -5.03 105.19 104.78 1ohn n GLY 4 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.63 1ohn n GLY 4 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ohn n ASN 5 N 0.00 0.00 -0.33 1.61 2.85 -1.26 -2.30 115.26 115.83 1ohn n ASN 5 Ca 0.00 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.51 1ohn n ASN 5 Cb 0.00 0.00 0.05 0.00 1.24 0.00 0.00 39.78 41.07 1ohn n ASN 5 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ohn n GLY 6 N 0.00 0.41 0.29 8.20 0.00 -1.26 -4.72 105.19 108.11 1ohn n GLY 6 Ca 0.00 -0.22 0.18 0.00 0.00 0.00 0.00 46.02 45.98 1ohn n GLY 6 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1ohn h VAL 7 N 1.38 0.12 -4.16 1.61 3.04 -1.87 -3.47 116.25 112.91 1ohn h VAL 7 Ca 0.00 -0.42 -0.48 0.00 -1.01 0.00 0.00 66.70 64.79 1ohn h VAL 7 Cb 0.41 1.37 0.13 0.00 -2.01 0.00 0.00 31.29 31.19 1ohn h VAL 7 CO 0.00 0.03 0.28 -1.00 -1.01 0.00 0.00 177.57 175.88 1ohn s HIS 8 N -3.88 2.51 1.03 3.17 3.76 -1.26 -4.93 115.29 115.69 1ohn s HIS 8 Ca -0.01 1.20 -0.14 0.00 -0.15 0.00 0.00 55.06 55.96 1ohn s HIS 8 Cb 0.11 -3.16 0.12 0.00 1.11 0.00 0.00 32.58 30.76 1ohn s HIS 8 CO 0.52 -2.17 0.53 0.00 -0.85 0.00 0.00 174.74 172.77 1ohn n GLY 10 N 1.34 3.23 2.94 0.00 0.00 -1.26 -3.68 105.19 107.76 1ohn n GLY 10 Ca 0.05 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1ohn n GLY 10 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ohn n LYS 11 N -0.46 0.00 0.00 1.61 2.85 -1.26 -4.70 118.16 116.21 1ohn n LYS 11 Ca 0.05 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.31 1ohn n LYS 11 Cb 0.43 -2.52 0.00 0.00 -0.65 0.00 0.00 35.03 32.30 1ohn n LYS 11 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1ohn n HIS 12 N -0.36 0.00 0.03 5.58 8.25 -1.26 -5.07 115.22 122.39 1ohn n HIS 12 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ohn n HIS 12 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1ohn n HIS 12 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1ohn n SER 13 N 0.00 1.18 0.09 0.41 7.64 -1.26 -4.65 113.62 117.03 1ohn n SER 13 Ca 0.00 -1.14 -0.02 0.00 1.01 0.00 0.00 58.87 58.72 1ohn n SER 13 Cb 0.00 -0.00 0.22 0.00 -1.01 0.00 0.00 64.21 63.41 1ohn n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ohn n THR 15 N -4.02 0.93 0.00 0.00 -1.04 -1.24 -4.42 114.28 104.49 1ohn n THR 15 Ca -0.02 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.49 1ohn n THR 15 Cb 0.49 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.73 1ohn n THR 15 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1ohn n VAL 16 N -1.47 0.00 0.26 12.58 0.31 -1.26 -4.78 118.33 123.96 1ohn n VAL 16 Ca 0.10 0.00 0.17 0.00 -0.01 0.00 0.00 64.34 64.60 1ohn n VAL 16 Cb 0.46 0.00 0.90 0.00 -0.91 0.00 0.00 33.84 34.29 1ohn n VAL 16 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1ohn h ASP 17 N 0.00 0.00 0.02 4.52 3.58 -1.96 -2.99 116.42 119.59 1ohn h ASP 17 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1ohn h ASP 17 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1ohn h ASP 17 CO 0.00 0.00 0.00 -2.67 -2.88 0.00 0.00 179.24 173.69 1ohn n TRP 18 N -2.68 0.00 -0.17 0.28 2.14 -1.26 -4.54 117.44 111.21 1ohn n TRP 18 Ca -0.02 0.00 0.14 0.00 2.07 0.00 0.00 57.50 59.69 1ohn n TRP 18 Cb 0.08 -0.02 0.47 0.00 -0.81 0.00 0.00 31.31 31.04 1ohn n TRP 18 CO 0.00 0.00 0.00 0.78 2.07 0.00 0.00 177.69 180.54 1ohn h GLY 19 N 2.46 0.78 1.44 -1.67 0.00 -1.74 -0.24 103.07 104.11 1ohn h GLY 19 Ca 0.00 -0.20 -0.16 0.00 0.00 0.00 0.00 47.33 46.97 1ohn h GLY 19 CO 0.00 0.08 -0.53 -0.91 0.00 0.00 0.00 176.54 175.18 1ohn h THR 20 N 0.48 1.31 -0.17 4.70 1.35 -1.91 -0.31 112.91 118.36 1ohn h THR 20 Ca 0.36 -1.76 -0.02 0.00 -0.55 0.00 0.00 66.41 64.45 1ohn h THR 20 Cb 0.74 1.73 -0.01 0.00 -1.73 0.00 0.00 68.15 68.88 1ohn h THR 20 CO -0.12 0.55 0.05 0.00 -0.25 0.00 0.00 175.52 175.74 1ohn h ALA 21 N 0.96 0.23 -0.96 6.62 0.00 -1.42 -1.35 119.26 123.34 1ohn h ALA 21 Ca 0.01 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.82 1ohn h ALA 21 Cb 1.07 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 1ohn h ALA 21 CO 0.10 -0.14 0.63 0.82 0.00 0.00 0.00 179.25 180.66 1ohn h ILE 22 N 0.09 1.15 -0.33 0.00 1.08 -1.38 -0.53 117.51 117.61 1ohn h ILE 22 Ca 0.06 -0.41 -0.03 0.00 -0.39 0.00 0.00 64.86 64.08 1ohn h ILE 22 Cb 0.25 -0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 33.84 1ohn h ILE 22 CO -0.00 0.22 0.07 1.23 -0.69 0.00 0.00 178.15 178.98 1ohn h GLY 23 N 1.19 0.57 0.95 5.37 0.00 -0.90 -0.39 103.07 109.86 1ohn h GLY 23 Ca 0.38 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 1ohn h GLY 23 CO -0.12 0.34 0.14 -0.57 0.00 0.00 0.00 176.54 176.33 1ohn h ASN 24 N 0.38 0.34 -0.15 0.19 -1.24 -0.94 -0.56 115.58 113.58 1ohn h ASN 24 Ca 0.10 -0.10 0.05 0.00 0.71 0.00 0.00 56.30 57.06 1ohn h ASN 24 Cb 0.31 -0.09 -0.05 0.00 0.73 0.00 0.00 38.32 39.22 1ohn h ASN 24 CO 0.00 0.34 -0.19 0.40 -1.29 0.00 0.00 177.43 176.69 1ohn h ILE 25 N 0.31 0.52 -0.82 2.57 2.04 -1.06 -2.13 117.51 118.94 1ohn h ILE 25 Ca 0.09 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.97 1ohn h ILE 25 Cb 0.08 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 1ohn h ILE 25 CO -0.01 0.00 0.54 1.23 0.00 0.00 0.00 178.15 179.90 1ohn h GLY 26 N -0.23 1.17 0.92 5.37 0.00 -0.86 0.86 103.07 110.31 1ohn h GLY 26 Ca 0.10 -0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.04 1ohn h GLY 26 CO -0.28 0.38 0.31 -0.57 0.00 0.00 0.00 176.54 176.38 1ohn h ASN 27 N 1.07 0.51 0.76 0.19 -0.73 -0.98 -1.48 115.58 114.91 1ohn h ASN 27 Ca 0.31 -0.00 -0.19 0.00 1.87 0.00 0.00 56.30 58.30 1ohn h ASN 27 Cb -0.06 -0.11 -0.02 0.00 0.27 0.00 0.00 38.32 38.40 1ohn h ASN 27 CO -0.09 0.36 -0.87 0.78 -0.37 0.00 0.00 177.43 177.25 1ohn h ASN 28 N 0.62 0.09 -0.48 1.15 2.35 -1.00 -1.68 115.58 116.63 1ohn h ASN 28 Ca 0.19 -0.08 0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1ohn h ASN 28 Cb -0.01 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.29 1ohn h ASN 28 CO -0.07 0.91 0.25 0.00 -1.65 0.00 0.00 177.43 176.87 1ohn h ALA 29 N 1.08 0.61 0.00 -0.83 0.00 -0.76 -0.63 119.26 118.73 1ohn h ALA 29 Ca -0.02 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1ohn h ALA 29 Cb 1.51 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1ohn h ALA 29 CO 0.12 -0.08 -0.30 0.00 0.00 0.00 0.00 179.25 178.99 1ohn h ALA 30 N 1.24 1.48 0.10 0.00 0.00 -1.18 -1.11 119.26 119.79 1ohn h ALA 30 Ca 0.20 -0.27 -0.26 0.00 0.00 0.00 0.00 54.91 54.58 1ohn h ALA 30 Cb 0.08 -0.05 0.03 0.00 0.00 0.00 0.00 17.79 17.85 1ohn h ALA 30 CO -0.13 0.37 -1.08 0.00 0.00 0.00 0.00 179.25 178.42 1ohn h ALA 31 N 1.70 -0.00 0.00 0.00 0.00 -0.85 -3.41 119.26 116.70 1ohn h ALA 31 Ca -0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1ohn h ALA 31 Cb 0.54 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1ohn h ALA 31 CO 0.04 0.59 -0.00 -1.71 0.00 0.00 0.00 179.25 178.17 1ohn n ASN 32 N -3.91 0.00 -0.30 0.00 5.15 -0.28 -4.86 115.26 111.06 1ohn n ASN 32 Ca -0.13 -0.22 0.01 0.00 -0.60 0.00 0.00 54.58 53.64 1ohn n ASN 32 Cb 0.91 0.44 0.01 0.00 -0.53 0.00 0.00 39.78 40.61 1ohn n ASN 32 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 1ohn n TRP 33 N -0.44 0.00 0.00 1.20 8.01 -0.61 -4.91 117.44 120.69 1ohn n TRP 33 Ca 0.00 -0.11 0.00 0.00 -1.31 0.00 0.00 57.50 56.08 1ohn n TRP 33 Cb 0.00 -0.04 0.00 0.00 -2.01 0.00 0.00 31.31 29.26 1ohn n TRP 33 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1ohn n ALA 34 N -0.15 1.07 0.25 6.99 0.00 -0.52 -1.26 120.51 126.88 1ohn n ALA 34 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.59 1ohn n ALA 34 Cb 0.62 -0.98 0.68 0.00 0.00 0.00 0.00 19.45 19.77 1ohn n ALA 34 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1ohn h THR 35 N 0.00 0.00 0.00 0.00 1.35 -1.91 -3.44 112.91 108.91 1ohn h THR 35 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1ohn h THR 35 Cb 0.02 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 67.16 1ohn h THR 35 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1ohn n GLY 36 N -0.93 -0.25 2.54 5.82 0.00 -0.72 -4.93 105.19 106.72 1ohn n GLY 36 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1ohn n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ohn n GLY 37 N 0.00 0.53 2.60 -0.02 0.00 -0.39 -4.99 105.19 102.92 1ohn n GLY 37 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1ohn n GLY 37 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ohn s ASN 38 N -2.26 3.64 0.92 1.61 2.47 -1.26 -3.10 114.94 116.96 1ohn s ASN 38 Ca 0.00 -1.52 -0.11 0.00 0.42 0.00 0.00 52.86 51.65 1ohn s ASN 38 Cb 0.00 -0.53 0.15 0.00 -1.45 0.00 0.00 41.25 39.42 1ohn s ASN 38 CO 0.00 -0.41 1.12 0.00 -3.72 0.00 0.00 177.10 174.09 1ohn s ALA 39 N 1.80 1.34 0.00 1.71 0.00 -1.26 -5.08 121.76 120.27 1ohn s ALA 39 Ca 0.10 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1ohn s ALA 39 Cb -0.17 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1ohn s ALA 39 CO -0.29 -2.73 0.00 0.41 0.00 0.00 0.00 175.76 173.15 1ohn n GLY 40 N -0.00 -1.75 0.00 0.00 0.00 -1.18 -4.87 105.19 97.39 1ohn n GLY 40 Ca 0.10 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.01 1ohn n GLY 40 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1ohn n TRP 41 N 1.59 0.00 -1.40 1.61 -0.00 -1.26 -5.07 117.44 112.90 1ohn n TRP 41 Ca 0.00 0.00 0.16 0.00 -0.00 0.00 0.00 57.50 57.66 1ohn n TRP 41 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 31.31 31.22 1ohn n TRP 41 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1ohn n ASN 42 N 0.00 -7.43 0.00 5.87 4.13 -1.26 -5.10 115.26 111.47 1ohn n ASN 42 Ca 0.00 1.34 0.08 0.00 1.68 0.00 0.00 54.58 57.68 1ohn n ASN 42 Cb 0.00 -4.78 0.45 0.00 -1.54 0.00 0.00 39.78 33.91 1ohn n ASN 42 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83