#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ohn h TYR 2 N 0.00 0.93 -1.29 5.58 -0.00 -1.99 -3.46 116.97 116.74 1ohn h TYR 2 Ca 0.00 -0.68 0.15 0.00 0.00 0.00 0.00 58.73 58.21 1ohn h TYR 2 Cb 0.00 -0.04 -0.28 0.00 0.00 0.00 0.00 36.73 36.41 1ohn h TYR 2 CO 0.00 1.56 0.47 -0.47 -0.00 0.00 0.00 178.16 179.71 1ohn s TYR 3 N -2.58 -0.43 0.58 0.10 5.04 -1.26 -5.09 117.35 113.70 1ohn s TYR 3 Ca -0.10 0.84 -0.08 0.00 -2.44 0.00 0.00 57.07 55.29 1ohn s TYR 3 Cb 0.04 0.26 -0.02 0.00 0.35 0.00 0.00 41.96 42.59 1ohn s TYR 3 CO 0.93 -0.21 0.93 0.20 -1.34 0.00 0.00 175.55 176.06 1ohn s GLY 4 N 1.43 1.59 0.45 8.97 0.00 -0.22 -4.91 107.32 114.64 1ohn s GLY 4 Ca -0.08 -0.40 0.19 0.00 0.00 0.00 0.00 44.72 44.43 1ohn s GLY 4 CO -0.14 -0.14 1.97 3.43 0.00 0.00 0.00 173.10 178.22 1ohn h ASN 5 N -0.17 0.00 -1.56 1.64 4.21 -1.86 -1.89 115.58 115.95 1ohn h ASN 5 Ca -0.45 0.00 -0.65 0.00 1.21 0.00 0.00 56.30 56.40 1ohn h ASN 5 Cb 1.22 0.00 -0.36 0.00 -1.12 0.00 0.00 38.32 38.06 1ohn h ASN 5 CO 0.62 0.21 -0.01 0.61 -1.29 0.00 0.00 177.43 177.57 1ohn n GLY 6 N -0.72 5.88 4.65 2.83 0.00 -1.26 -4.95 105.19 111.62 1ohn n GLY 6 Ca -0.02 -2.63 0.00 0.00 0.00 0.00 0.00 46.02 43.37 1ohn n GLY 6 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ohn n VAL 7 N -0.56 0.00 -0.71 1.61 0.31 -0.71 -4.21 118.33 114.06 1ohn n VAL 7 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.79 1ohn n VAL 7 Cb 0.55 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 1ohn n VAL 7 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1ohn n HIS 8 N 0.00 0.00 -4.72 3.52 8.25 -1.26 -1.05 115.22 119.96 1ohn n HIS 8 Ca 0.00 -0.03 -0.33 0.00 -0.26 0.00 0.00 57.72 57.10 1ohn n HIS 8 Cb 0.00 -0.00 -0.12 0.00 1.12 0.00 0.00 29.99 30.99 1ohn n HIS 8 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ohn n GLY 10 N 2.44 -0.12 0.00 0.00 0.00 -1.26 -2.49 105.19 103.77 1ohn n GLY 10 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1ohn n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ohn n LYS 11 N -2.24 2.50 0.00 1.61 5.02 -1.26 -4.98 118.16 118.81 1ohn n LYS 11 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1ohn n LYS 11 Cb 0.00 -0.74 0.00 0.00 -0.02 0.00 0.00 35.03 34.27 1ohn n LYS 11 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1ohn n HIS 12 N -0.93 0.00 -3.60 2.13 1.44 -1.26 -5.12 115.22 107.89 1ohn n HIS 12 Ca 0.00 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.31 1ohn n HIS 12 Cb 0.00 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.02 1ohn n HIS 12 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1ohn s SER 13 N -0.81 5.63 0.00 4.39 0.01 -1.26 -4.98 113.70 116.68 1ohn s SER 13 Ca 0.00 -1.71 -0.03 0.00 1.31 0.00 0.00 55.95 55.52 1ohn s SER 13 Cb 0.00 -1.98 -0.15 0.00 0.21 0.00 0.00 66.02 64.10 1ohn s SER 13 CO 0.00 -0.60 2.55 0.00 0.41 0.00 0.00 173.24 175.60 1ohn n THR 15 N 2.28 -0.68 -3.06 0.00 -2.24 -0.98 -4.75 114.28 104.84 1ohn n THR 15 Ca 0.23 -3.70 -0.18 0.00 -2.27 0.00 0.00 64.05 58.13 1ohn n THR 15 Cb 0.63 -1.76 -0.03 0.00 -2.10 0.00 0.00 70.33 67.07 1ohn n THR 15 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1ohn n VAL 16 N 2.63 0.00 0.00 2.28 0.31 -0.02 -2.76 118.33 120.77 1ohn n VAL 16 Ca 0.28 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1ohn n VAL 16 Cb 0.46 -0.21 0.00 0.00 -0.91 0.00 0.00 33.84 33.18 1ohn n VAL 16 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1ohn n ASP 17 N -1.51 0.00 -0.22 4.52 2.03 -0.59 -0.87 116.55 119.91 1ohn n ASP 17 Ca 0.05 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.46 1ohn n ASP 17 Cb 0.37 -0.43 0.50 0.00 -0.72 0.00 0.00 41.12 40.85 1ohn n ASP 17 CO 0.00 0.00 0.00 -2.67 -1.92 0.00 0.00 177.20 172.61 1ohn n TRP 18 N -0.62 0.08 -0.19 -0.67 2.14 -1.15 -4.72 117.44 112.31 1ohn n TRP 18 Ca 0.00 -0.04 0.22 0.00 2.07 0.00 0.00 57.50 59.76 1ohn n TRP 18 Cb 0.00 0.00 0.61 0.00 -0.81 0.00 0.00 31.31 31.11 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 5.23 0.46 1.27 -1.67 0.00 -1.80 -1.61 103.07 104.95 1ohn h GLY 19 Ca 0.00 -0.10 -0.23 0.00 0.00 0.00 0.00 47.33 47.00 1ohn h GLY 19 CO 0.00 -0.00 -0.85 -0.84 0.00 0.00 0.00 176.54 174.85 1ohn h THR 20 N 0.21 1.30 -0.51 4.70 2.02 -1.91 0.62 112.91 119.35 1ohn h THR 20 Ca 0.42 -2.09 -0.01 0.00 0.77 0.00 0.00 66.41 65.50 1ohn h THR 20 Cb 1.33 2.12 -0.02 0.00 -1.74 0.00 0.00 68.15 69.83 1ohn h THR 20 CO -0.09 0.65 0.27 0.00 0.37 0.00 0.00 175.52 176.72 1ohn h ALA 21 N 0.58 0.65 -0.56 6.16 0.00 -1.68 -1.46 119.26 122.95 1ohn h ALA 21 Ca -0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1ohn h ALA 21 Cb 1.47 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1ohn h ALA 21 CO 0.17 0.18 0.22 0.82 0.00 0.00 0.00 179.25 180.63 1ohn h ILE 22 N 0.67 1.21 0.13 0.00 1.08 -1.46 -1.59 117.51 117.55 1ohn h ILE 22 Ca 0.18 -0.66 0.00 0.00 -0.39 0.00 0.00 64.86 63.99 1ohn h ILE 22 Cb 0.07 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.35 1ohn h ILE 22 CO -0.03 0.26 -0.11 1.23 -0.69 0.00 0.00 178.15 178.81 1ohn h GLY 23 N 0.94 -0.25 0.86 5.37 0.00 -0.60 0.62 103.07 110.01 1ohn h GLY 23 Ca 0.19 0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.66 1ohn h GLY 23 CO -0.02 -0.12 0.00 -0.57 0.00 0.00 0.00 176.54 175.84 1ohn h ASN 24 N -0.26 -0.03 0.39 0.19 -0.73 -1.05 -0.53 115.58 113.55 1ohn h ASN 24 Ca -0.00 0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.18 1ohn h ASN 24 Cb 0.24 0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.84 1ohn h ASN 24 CO -0.02 -0.00 -0.35 0.40 -0.37 0.00 0.00 177.43 177.09 1ohn h ILE 25 N 0.04 0.27 -0.44 2.57 2.04 -1.27 -2.81 117.51 117.91 1ohn h ILE 25 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 1ohn h ILE 25 Cb 0.05 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1ohn h ILE 25 CO -0.08 0.00 0.28 1.23 0.00 0.00 0.00 178.15 179.59 1ohn h GLY 26 N -0.76 0.62 0.83 5.37 0.00 -0.77 0.03 103.07 108.40 1ohn h GLY 26 Ca -0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 1ohn h GLY 26 CO -0.04 0.23 -0.39 -0.57 0.00 0.00 0.00 176.54 175.77 1ohn h ASN 27 N 0.59 -0.99 1.05 0.19 -0.73 -1.11 -1.48 115.58 113.11 1ohn h ASN 27 Ca 0.16 0.06 -0.07 0.00 1.87 0.00 0.00 56.30 58.32 1ohn h ASN 27 Cb -0.05 0.29 -0.01 0.00 0.27 0.00 0.00 38.32 38.82 1ohn h ASN 27 CO -0.03 -0.60 -0.34 0.78 -0.37 0.00 0.00 177.43 176.86 1ohn h ASN 28 N -0.96 0.00 0.02 1.15 4.21 -1.50 -1.13 115.58 117.38 1ohn h ASN 28 Ca -0.08 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.43 1ohn h ASN 28 Cb 0.78 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.98 1ohn h ASN 28 CO 0.07 0.34 -0.01 0.00 -1.29 0.00 0.00 177.43 176.54 1ohn h ALA 29 N 1.66 -0.03 0.00 -0.83 0.00 -0.95 -2.44 119.26 116.67 1ohn h ALA 29 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1ohn h ALA 29 Cb 0.96 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1ohn h ALA 29 CO 0.04 -0.48 -0.18 0.00 0.00 0.00 0.00 179.25 178.63 1ohn h ALA 30 N 0.88 1.47 -0.31 0.00 0.00 -1.08 0.57 119.26 120.78 1ohn h ALA 30 Ca -0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1ohn h ALA 30 Cb 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ohn h ALA 30 CO 0.01 0.22 0.02 0.00 0.00 0.00 0.00 179.25 179.50 1ohn h ALA 31 N 1.82 0.42 0.00 0.00 0.00 -1.04 -3.46 119.26 117.00 1ohn h ALA 31 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ohn h ALA 31 Cb 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ohn h ALA 31 CO 0.02 0.15 0.00 0.27 0.00 0.00 0.00 179.25 179.69 1ohn n ASN 32 N -4.58 0.00 0.08 0.00 6.94 -0.93 -5.02 115.26 111.74 1ohn n ASN 32 Ca -0.02 0.00 -0.10 0.00 -0.02 0.00 0.00 54.58 54.44 1ohn n ASN 32 Cb 0.24 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.65 1ohn n ASN 32 CO 0.00 0.00 0.00 -0.25 -1.03 0.00 0.00 177.26 175.98 1ohn h TRP 33 N 0.00 0.42 0.00 -2.53 2.91 -0.96 -3.06 115.95 112.74 1ohn h TRP 33 Ca 0.00 -0.22 0.00 0.00 1.13 0.00 0.00 58.89 59.80 1ohn h TRP 33 Cb 0.00 -0.05 0.00 0.00 -0.51 0.00 0.00 29.16 28.60 1ohn h TRP 33 CO 0.00 1.03 0.00 0.00 -1.03 0.00 0.00 178.44 178.44 1ohn n ALA 34 N -2.49 1.44 -0.25 2.65 0.00 -0.14 -2.17 120.51 119.54 1ohn n ALA 34 Ca -0.05 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1ohn n ALA 34 Cb 0.80 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1ohn n ALA 34 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1ohn n THR 35 N -1.69 0.24 0.70 0.00 5.66 -1.23 -4.82 114.28 113.14 1ohn n THR 35 Ca 0.02 -0.49 0.13 0.00 -3.05 0.00 0.00 64.05 60.65 1ohn n THR 35 Cb 0.12 1.05 0.37 0.00 -1.55 0.00 0.00 70.33 70.32 1ohn n THR 35 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ohn n GLY 36 N -0.12 -1.56 0.00 1.09 0.00 -0.92 -5.00 105.19 98.68 1ohn n GLY 36 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 1.36 -0.03 3.75 -0.02 0.00 -1.26 -5.10 105.19 103.89 1ohn n GLY 37 Ca 0.05 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.61 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 0.00 4.34 0.00 1.61 2.47 -1.26 -4.54 114.94 117.56 1ohn s ASN 38 Ca 0.00 1.97 0.00 0.00 0.42 0.00 0.00 52.86 55.25 1ohn s ASN 38 Cb 0.00 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.26 1ohn s ASN 38 CO 0.00 -2.15 0.00 0.00 -3.72 0.00 0.00 177.10 171.23 1ohn n ALA 39 N -3.33 0.00 -0.42 1.71 0.00 -1.26 -4.95 120.51 112.27 1ohn n ALA 39 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1ohn n ALA 39 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1ohn n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ohn n GLY 40 N 0.00 -0.45 3.65 0.00 0.00 -1.26 -4.88 105.19 102.25 1ohn n GLY 40 Ca 0.00 -1.10 -0.45 0.00 0.00 0.00 0.00 46.02 44.47 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 0.00 1.99 -1.24 1.61 -0.00 -1.26 -5.00 117.44 113.54 1ohn n TRP 41 Ca 0.00 0.49 -0.35 0.00 -0.00 0.00 0.00 57.50 57.64 1ohn n TRP 41 Cb 0.00 -2.42 0.09 0.00 -0.00 0.00 0.00 31.31 28.98 1ohn n TRP 41 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 177.69 177.96 1ohn n ASN 42 N 2.00 -0.23 0.00 5.87 6.94 -1.26 -5.13 115.26 123.45 1ohn n ASN 42 Ca 0.12 0.60 0.00 0.00 -0.02 0.00 0.00 54.58 55.28 1ohn n ASN 42 Cb 0.31 -1.34 0.00 0.00 -2.36 0.00 0.00 39.78 36.39 1ohn n ASN 42 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52