#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 0.00 -3.99 5.64 0.05 -2.04 -3.46 116.97 113.18 1ohn h TYR 2 Ca 0.00 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.55 1ohn h TYR 2 Cb 0.00 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 37.67 1ohn h TYR 2 CO 0.00 0.01 -0.15 -0.47 -1.05 0.00 0.00 178.16 176.50 1ohn s TYR 3 N -3.93 0.92 -0.31 4.88 5.04 -1.26 -5.12 117.35 117.57 1ohn s TYR 3 Ca -0.02 -1.20 0.03 0.00 -2.44 0.00 0.00 57.07 53.44 1ohn s TYR 3 Cb 0.11 0.02 -0.00 0.00 0.35 0.00 0.00 41.96 42.44 1ohn s TYR 3 CO 0.49 -1.16 0.40 0.41 -1.34 0.00 0.00 175.55 174.35 1ohn n GLY 4 N -0.54 -0.29 0.00 8.97 0.00 -1.26 -4.86 105.19 107.21 1ohn n GLY 4 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.38 0.00 -1.36 1.61 2.85 -1.26 -3.54 115.26 113.18 1ohn n ASN 5 Ca 0.01 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.60 1ohn n ASN 5 Cb 0.07 0.00 0.32 0.00 1.24 0.00 0.00 39.78 41.41 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 4.55 2.43 0.25 8.20 0.00 -1.26 -4.55 105.19 114.81 1ohn n GLY 6 Ca 0.00 -0.80 0.14 0.00 0.00 0.00 0.00 46.02 45.36 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 4.35 0.24 -4.08 1.61 3.04 -1.92 -3.48 116.25 116.01 1ohn h VAL 7 Ca 0.00 -0.82 -0.46 0.00 -1.01 0.00 0.00 66.70 64.41 1ohn h VAL 7 Cb 0.99 1.66 0.14 0.00 -2.01 0.00 0.00 31.29 32.08 1ohn h VAL 7 CO 0.00 0.10 0.25 -1.00 -1.01 0.00 0.00 177.57 175.91 1ohn s HIS 8 N -3.62 2.34 0.05 3.17 3.76 -1.26 -4.97 115.29 114.76 1ohn s HIS 8 Ca 0.01 0.92 0.00 0.00 -0.15 0.00 0.00 55.06 55.84 1ohn s HIS 8 Cb 0.09 -3.33 0.00 0.00 1.11 0.00 0.00 32.58 30.45 1ohn s HIS 8 CO 0.59 -2.59 0.00 0.00 -0.85 0.00 0.00 174.74 171.89 1ohn n GLY 10 N -0.82 -0.60 2.47 0.00 0.00 -1.26 -4.97 105.19 100.00 1ohn n GLY 10 Ca 0.00 0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 1ohn n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ohn n LYS 11 N 0.00 3.27 -0.14 1.61 4.81 -1.26 -4.77 118.16 121.67 1ohn n LYS 11 Ca 0.00 -2.20 0.00 0.00 -0.87 0.00 0.00 58.31 55.24 1ohn n LYS 11 Cb 0.00 -2.88 0.00 0.00 0.02 0.00 0.00 35.03 32.17 1ohn n LYS 11 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 1ohn n HIS 12 N 4.36 0.00 -1.65 5.64 1.44 -1.26 -4.85 115.22 118.90 1ohn n HIS 12 Ca 0.68 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.99 1ohn n HIS 12 Cb 0.26 -0.84 -0.01 0.00 0.12 0.00 0.00 29.99 29.52 1ohn n HIS 12 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1ohn n SER 13 N 0.00 6.89 -4.80 4.39 7.64 -1.26 -4.99 113.62 121.49 1ohn n SER 13 Ca 0.00 -2.80 -0.35 0.00 1.01 0.00 0.00 58.87 56.73 1ohn n SER 13 Cb 0.00 -1.55 -0.06 0.00 -1.01 0.00 0.00 64.21 61.59 1ohn n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ohn s THR 15 N -1.90 0.00 0.01 0.00 -1.32 -1.26 -4.99 115.64 106.18 1ohn s THR 15 Ca 0.58 -1.07 -0.11 0.00 -1.21 0.00 0.00 61.69 59.87 1ohn s THR 15 Cb -0.14 -2.60 0.01 0.00 -1.51 0.00 0.00 72.50 68.25 1ohn s THR 15 CO 0.19 0.00 0.22 -0.69 -2.21 0.00 0.00 174.62 172.13 1ohn s VAL 16 N -2.87 0.08 -1.09 5.08 1.01 -1.26 -4.77 120.40 116.58 1ohn s VAL 16 Ca 0.16 -0.65 -0.18 0.00 0.00 0.00 0.00 61.98 61.30 1ohn s VAL 16 Cb -0.05 -0.63 -0.06 0.00 0.00 0.00 0.00 36.38 35.64 1ohn s VAL 16 CO 0.11 -0.36 2.06 -0.67 0.00 0.00 0.00 175.10 176.24 1ohn n ASP 17 N 1.18 3.16 -0.77 3.32 2.03 -1.23 -4.52 116.55 119.71 1ohn n ASP 17 Ca -0.21 -2.76 0.00 0.00 0.52 0.00 0.00 54.79 52.34 1ohn n ASP 17 Cb 0.57 -1.38 -0.00 0.00 -0.72 0.00 0.00 41.12 39.59 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 6.95 0.00 -0.13 -0.67 4.27 -1.26 -4.99 117.44 121.61 1ohn n TRP 18 Ca 0.51 -0.16 0.26 0.00 -3.89 0.00 0.00 57.50 54.22 1ohn n TRP 18 Cb 0.40 0.05 0.72 0.00 -1.36 0.00 0.00 31.31 31.12 1ohn n TRP 18 CO 0.00 0.00 0.00 0.78 -2.29 0.00 0.00 177.69 176.18 1ohn h GLY 19 N 0.22 0.00 1.29 -1.67 0.00 -2.01 0.88 103.07 101.79 1ohn h GLY 19 Ca -0.11 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 1ohn h GLY 19 CO -0.01 0.00 -0.25 -0.84 0.00 0.00 0.00 176.54 175.44 1ohn h THR 20 N 0.00 1.27 -0.47 4.70 2.02 -1.99 -2.47 112.91 115.97 1ohn h THR 20 Ca 0.38 -1.38 -0.05 0.00 0.77 0.00 0.00 66.41 66.13 1ohn h THR 20 Cb 1.53 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 69.15 1ohn h THR 20 CO -0.00 0.46 0.08 0.00 0.37 0.00 0.00 175.52 176.43 1ohn h ALA 21 N 1.02 1.26 -0.81 6.16 0.00 -1.25 -1.55 119.26 124.10 1ohn h ALA 21 Ca 0.09 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.86 1ohn h ALA 21 Cb 0.78 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 1ohn h ALA 21 CO 0.06 0.51 0.48 0.82 0.00 0.00 0.00 179.25 181.12 1ohn h ILE 22 N 0.69 1.00 0.21 0.00 2.04 -1.32 0.02 117.51 120.15 1ohn h ILE 22 Ca 0.15 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 1ohn h ILE 22 Cb 0.31 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.45 1ohn h ILE 22 CO 0.00 0.16 -0.11 1.23 0.00 0.00 0.00 178.15 179.43 1ohn h GLY 23 N 0.87 -0.31 0.47 5.37 0.00 -0.90 -1.06 103.07 107.50 1ohn h GLY 23 Ca 0.36 0.12 0.07 0.00 0.00 0.00 0.00 47.33 47.88 1ohn h GLY 23 CO -0.19 -0.12 0.09 -0.57 0.00 0.00 0.00 176.54 175.75 1ohn h ASN 24 N -0.30 0.01 -0.24 0.19 -0.73 -1.03 -0.77 115.58 112.72 1ohn h ASN 24 Ca -0.02 0.07 0.05 0.00 1.87 0.00 0.00 56.30 58.27 1ohn h ASN 24 Cb 0.24 0.10 -0.05 0.00 0.27 0.00 0.00 38.32 38.88 1ohn h ASN 24 CO 0.04 0.04 -0.10 0.40 -0.37 0.00 0.00 177.43 177.44 1ohn h ILE 25 N 0.22 0.67 -0.36 2.57 2.04 -0.91 -1.77 117.51 119.98 1ohn h ILE 25 Ca 0.21 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.07 1ohn h ILE 25 Cb 0.26 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1ohn h ILE 25 CO -0.27 0.00 0.23 1.23 0.00 0.00 0.00 178.15 179.34 1ohn h GLY 26 N -0.06 0.52 0.89 5.37 0.00 -0.87 -0.55 103.07 108.37 1ohn h GLY 26 Ca 0.12 -0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.29 1ohn h GLY 26 CO -0.28 0.20 0.62 3.43 0.00 0.00 0.00 176.54 180.51 1ohn h ASN 27 N 0.48 1.05 0.01 0.19 2.35 -0.98 -0.44 115.58 118.23 1ohn h ASN 27 Ca 0.13 -0.01 -0.20 0.00 -0.55 0.00 0.00 56.30 55.67 1ohn h ASN 27 Cb -0.03 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.10 1ohn h ASN 27 CO -0.03 0.72 -0.74 -1.13 -1.65 0.00 0.00 177.43 174.61 1ohn h ASN 28 N 1.22 0.75 -0.39 5.81 -0.73 -1.07 -0.48 115.58 120.69 1ohn h ASN 28 Ca 0.38 -0.48 0.05 0.00 1.87 0.00 0.00 56.30 58.11 1ohn h ASN 28 Cb -0.01 -0.22 -0.04 0.00 0.27 0.00 0.00 38.32 38.31 1ohn h ASN 28 CO -0.12 1.26 0.13 0.00 -0.37 0.00 0.00 177.43 178.33 1ohn h ALA 29 N 0.73 0.45 0.00 1.57 0.00 -0.91 -2.16 119.26 118.93 1ohn h ALA 29 Ca -0.04 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1ohn h ALA 29 Cb 1.34 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 1ohn h ALA 29 CO 0.14 -0.26 -0.08 0.00 0.00 0.00 0.00 179.25 179.04 1ohn h ALA 30 N 1.26 1.12 0.27 0.00 0.00 -0.96 -1.35 119.26 119.61 1ohn h ALA 30 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ohn h ALA 30 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ohn h ALA 30 CO -0.19 0.10 -0.13 0.00 0.00 0.00 0.00 179.25 179.03 1ohn h ALA 31 N 1.92 -0.61 0.00 0.00 0.00 -0.43 -3.46 119.26 116.68 1ohn h ALA 31 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ohn h ALA 31 Cb 0.39 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ohn h ALA 31 CO 0.01 -0.58 0.00 0.09 0.00 0.00 0.00 179.25 178.77 1ohn n ASN 32 N -3.69 0.00 -2.58 0.00 3.02 -1.07 -5.00 115.26 105.93 1ohn n ASN 32 Ca -0.05 -0.97 -0.16 0.00 -0.03 0.00 0.00 54.58 53.38 1ohn n ASN 32 Cb 0.14 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.33 1ohn n ASN 32 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1ohn n TRP 33 N 0.00 2.07 0.29 3.10 8.01 -0.78 -4.95 117.44 125.17 1ohn n TRP 33 Ca 0.00 -2.91 0.14 0.00 -1.31 0.00 0.00 57.50 53.42 1ohn n TRP 33 Cb 0.24 -0.26 0.85 0.00 -2.01 0.00 0.00 31.31 30.13 1ohn n TRP 33 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1ohn h ALA 34 N 2.82 1.46 0.00 6.99 0.00 -1.57 -0.64 119.26 128.32 1ohn h ALA 34 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ohn h ALA 34 Cb 1.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ohn h ALA 34 CO 0.64 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.94 1ohn h THR 35 N 0.00 0.00 -0.70 0.00 1.03 -1.92 -3.48 112.91 107.83 1ohn h THR 35 Ca -0.00 -0.32 0.09 0.00 -0.01 0.00 0.00 66.41 66.16 1ohn h THR 35 Cb 0.11 1.19 -0.02 0.00 -1.07 0.00 0.00 68.15 68.36 1ohn h THR 35 CO 0.01 0.00 -0.12 0.61 -0.01 0.00 0.00 175.52 176.01 1ohn n GLY 36 N -0.20 -1.45 2.48 2.99 0.00 -0.25 -4.98 105.19 103.78 1ohn n GLY 36 Ca 0.01 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.78 0.89 3.30 -0.02 0.00 -1.26 -4.98 105.19 101.34 1ohn n GLY 37 Ca 0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.51 0.11 0.33 1.61 2.47 -1.26 -5.14 114.94 110.55 1ohn s ASN 38 Ca 0.00 -1.04 0.00 0.00 0.42 0.00 0.00 52.86 52.24 1ohn s ASN 38 Cb 0.00 0.41 0.00 0.00 -1.45 0.00 0.00 41.25 40.21 1ohn s ASN 38 CO 0.00 -0.87 0.00 0.00 -3.72 0.00 0.00 177.10 172.51 1ohn n ALA 39 N -0.21 -3.29 -3.09 1.71 0.00 -1.26 -4.76 120.51 109.61 1ohn n ALA 39 Ca -0.05 0.46 -0.36 0.00 0.00 0.00 0.00 53.44 53.49 1ohn n ALA 39 Cb 0.63 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.89 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 -3.92 5.21 0.37 0.00 0.00 -1.26 -4.93 105.19 100.67 1ohn n GLY 40 Ca -0.00 -2.71 0.12 0.00 0.00 0.00 0.00 46.02 43.44 1ohn n GLY 40 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1ohn h TRP 41 N 4.69 0.60 0.00 1.61 0.09 -1.95 -3.24 115.95 117.75 1ohn h TRP 41 Ca 0.23 0.02 -0.06 0.00 0.09 0.00 0.00 58.89 59.17 1ohn h TRP 41 Cb 0.59 -0.19 -0.10 0.00 0.08 0.00 0.00 29.16 29.53 1ohn h TRP 41 CO 0.94 0.25 -0.45 0.27 0.09 0.00 0.00 178.44 179.55 1ohn n ASN 42 N -4.50 0.06 -0.26 0.11 0.23 -1.26 -4.89 115.26 104.76 1ohn n ASN 42 Ca 0.14 -1.74 0.15 0.00 -0.53 0.00 0.00 54.58 52.60 1ohn n ASN 42 Cb 0.44 -0.10 0.72 0.00 -2.08 0.00 0.00 39.78 38.76 1ohn n ASN 42 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62