#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oks s SER 3 N 0.00 5.58 0.32 0.00 1.04 -1.26 -4.52 113.70 114.86 1oks s SER 3 Ca 0.00 1.83 0.02 0.00 0.48 0.00 0.00 55.95 58.28 1oks s SER 3 Cb 0.00 -2.53 0.58 0.00 0.10 0.00 0.00 66.02 64.17 1oks s SER 3 CO 0.00 -1.31 1.94 0.03 0.98 0.00 0.00 173.24 174.88 1oks h ARG 4 N 0.20 0.93 -0.38 4.02 3.08 -1.99 -1.87 114.38 118.37 1oks h ARG 4 Ca -0.46 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 59.38 1oks h ARG 4 Cb 1.22 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 31.06 1oks h ARG 4 CO 0.57 0.61 -0.37 1.03 -1.07 0.00 0.00 179.97 180.74 1oks h SER 5 N 0.95 0.95 -0.42 7.04 0.87 -1.99 -0.35 113.55 120.60 1oks h SER 5 Ca 0.35 -0.42 -0.08 0.00 -1.23 0.00 0.00 61.79 60.41 1oks h SER 5 Cb 0.17 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1oks h SER 5 CO -0.12 1.21 -0.04 0.58 -0.53 0.00 0.00 176.83 177.93 1oks h VAL 6 N 0.74 1.27 -0.36 2.23 2.07 -1.86 -1.49 116.25 118.84 1oks h VAL 6 Ca 0.06 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.46 1oks h VAL 6 Cb 0.95 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 1oks h VAL 6 CO 0.09 0.37 0.14 0.40 0.02 0.00 0.00 177.57 178.59 1oks h ILE 7 N 0.60 1.19 -0.45 4.57 2.04 -1.24 -1.22 117.51 123.00 1oks h ILE 7 Ca 0.11 -0.60 0.06 0.00 1.00 0.00 0.00 64.86 65.43 1oks h ILE 7 Cb 0.55 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 1oks h ILE 7 CO 0.03 0.21 0.17 -0.09 0.00 0.00 0.00 178.15 178.47 1oks h ARG 8 N 0.44 0.34 -0.79 2.37 2.43 -0.91 -1.49 114.38 116.77 1oks h ARG 8 Ca 0.12 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1oks h ARG 8 Cb 0.20 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 1oks h ARG 8 CO -0.01 0.23 0.38 0.77 -1.51 0.00 0.00 179.97 179.83 1oks h SER 9 N 0.35 1.03 -0.75 -3.80 0.02 -0.97 0.18 113.55 109.61 1oks h SER 9 Ca 0.21 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1oks h SER 9 Cb 0.20 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1oks h SER 9 CO -0.21 0.87 0.36 0.40 -1.14 0.00 0.00 176.83 177.12 1oks h ILE 10 N 1.11 1.24 -0.04 3.27 2.04 -0.74 0.12 117.51 124.51 1oks h ILE 10 Ca 0.27 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 1oks h ILE 10 Cb 0.11 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1oks h ILE 10 CO -0.04 0.29 -0.01 0.40 0.00 0.00 0.00 178.15 178.79 1oks h ILE 11 N 1.06 1.30 -0.94 -0.67 2.04 -1.01 -2.76 117.51 116.54 1oks h ILE 11 Ca 0.26 -0.94 -0.00 0.00 1.00 0.00 0.00 64.86 65.18 1oks h ILE 11 Cb 0.12 1.85 -0.05 0.00 -0.74 0.00 0.00 36.82 38.01 1oks h ILE 11 CO -0.03 0.25 0.58 0.50 0.00 0.00 0.00 178.15 179.45 1oks h LYS 12 N -0.28 1.27 0.00 2.37 3.64 -0.78 -2.66 116.57 120.12 1oks h LYS 12 Ca 0.01 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1oks h LYS 12 Cb 0.41 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1oks h LYS 12 CO 0.00 0.87 -0.01 -1.13 -2.27 0.00 0.00 179.45 176.92 1oks n SER 13 N -4.36 0.09 -4.74 4.20 3.41 0.01 -4.89 113.62 107.33 1oks n SER 13 Ca 0.11 0.49 -0.29 0.00 -0.26 0.00 0.00 58.87 58.92 1oks n SER 13 Cb 0.05 -0.51 0.15 0.00 -0.26 0.00 0.00 64.21 63.64 1oks n SER 13 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1oks s SER 14 N -3.14 3.16 -0.22 4.04 1.04 -1.01 -4.97 113.70 112.61 1oks s SER 14 Ca 0.14 1.02 0.15 0.00 0.48 0.00 0.00 55.95 57.74 1oks s SER 14 Cb 0.18 -1.63 0.82 0.00 0.10 0.00 0.00 66.02 65.49 1oks s SER 14 CO 0.54 -2.77 1.74 0.54 0.98 0.00 0.00 173.24 174.27 1oks n ARG 15 N -3.92 4.78 -1.48 4.02 1.74 -1.26 -4.98 116.66 115.55 1oks n ARG 15 Ca 0.06 -3.14 -0.32 0.00 -0.77 0.00 0.00 57.85 53.68 1oks n ARG 15 Cb 0.59 -2.23 0.07 0.00 -1.02 0.00 0.00 32.46 29.87 1oks n ARG 15 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1oks s LEU 16 N -2.65 3.21 0.46 0.55 1.43 -1.26 -4.97 118.68 115.46 1oks s LEU 16 Ca 0.55 1.97 -0.25 0.00 -1.03 0.00 0.00 54.13 55.37 1oks s LEU 16 Cb 0.41 -4.54 -0.08 0.00 0.03 0.00 0.00 46.19 42.00 1oks s LEU 16 CO 0.17 -1.92 1.34 -0.62 0.23 0.00 0.00 176.35 175.56 1oks n GLU 17 N -2.97 1.98 -0.32 1.70 -0.58 -1.26 -4.73 120.64 114.46 1oks n GLU 17 Ca 0.10 0.71 0.03 0.00 -0.42 0.00 0.00 57.16 57.58 1oks n GLU 17 Cb 0.52 -2.50 0.22 0.00 -0.57 0.00 0.00 31.44 29.11 1oks n GLU 17 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1oks h GLU 18 N 2.00 1.05 0.00 3.49 4.39 -1.99 -0.19 114.58 123.34 1oks h GLU 18 Ca -0.49 -0.06 -0.08 0.00 0.34 0.00 0.00 59.36 59.06 1oks h GLU 18 Cb 1.29 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 29.69 1oks h GLU 18 CO 0.59 0.69 -0.38 0.38 -1.16 0.00 0.00 179.01 179.14 1oks h ASP 19 N 1.08 0.00 0.59 1.42 2.03 -1.99 -1.04 116.42 118.51 1oks h ASP 19 Ca 0.39 0.00 -0.21 0.00 -0.73 0.00 0.00 57.03 56.49 1oks h ASP 19 Cb 0.16 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.65 1oks h ASP 19 CO -0.15 0.38 -0.92 0.03 -1.03 0.00 0.00 179.24 177.56 1oks h ARG 20 N 0.00 0.21 -0.55 4.15 3.08 -1.52 -1.47 114.38 118.28 1oks h ARG 20 Ca -0.00 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 59.80 1oks h ARG 20 Cb 0.76 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.86 1oks h ARG 20 CO 0.05 0.99 0.34 0.87 -1.07 0.00 0.00 179.97 181.15 1oks h LYS 21 N 0.11 0.75 -0.35 0.04 1.57 -0.66 -2.22 116.57 115.81 1oks h LYS 21 Ca -0.05 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.55 1oks h LYS 21 Cb 1.57 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.71 1oks h LYS 21 CO 0.14 0.54 -0.24 0.00 -0.57 0.00 0.00 179.45 179.32 1oks h ARG 22 N 0.75 0.69 -0.14 3.15 3.08 -1.06 -2.61 114.38 118.23 1oks h ARG 22 Ca 0.20 -0.28 0.04 0.00 0.07 0.00 0.00 59.98 60.01 1oks h ARG 22 Cb -0.02 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 1oks h ARG 22 CO -0.04 0.87 -0.13 -0.92 -1.07 0.00 0.00 179.97 178.69 1oks h TYR 23 N 0.60 -0.32 0.00 3.04 3.20 -1.10 -1.60 116.97 120.80 1oks h TYR 23 Ca 0.08 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.97 1oks h TYR 23 Cb 0.73 0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.16 1oks h TYR 23 CO 0.03 -0.19 0.00 1.28 -1.64 0.00 0.00 178.16 177.65 1oks n LEU 24 N -5.27 0.38 0.00 2.82 4.77 -0.85 -1.98 117.00 116.87 1oks n LEU 24 Ca -0.03 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 1oks n LEU 24 Cb 0.19 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1oks n LEU 24 CO 0.22 0.07 0.00 0.35 -1.33 0.00 0.00 177.39 176.70 1oks n THR 26 N 1.39 0.00 -0.08 -5.08 -2.24 -0.60 -1.16 114.28 106.50 1oks n THR 26 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1oks n THR 26 Cb 0.05 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.24 1oks n THR 26 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1oks h LEU 27 N 0.00 0.36 -1.00 3.22 3.38 -1.68 -2.89 115.31 116.69 1oks h LEU 27 Ca 0.00 -0.20 0.06 0.00 0.09 0.00 0.00 57.88 57.83 1oks h LEU 27 Cb 0.00 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 1oks h LEU 27 CO 0.00 0.46 0.65 0.25 0.09 0.00 0.00 178.44 179.89 1oks h LEU 28 N 0.24 1.06 -2.08 1.67 5.85 -1.42 -1.33 115.31 119.29 1oks h LEU 28 Ca 0.08 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1oks h LEU 28 Cb 0.22 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1oks h LEU 28 CO -0.00 0.69 -0.08 0.44 -0.34 0.00 0.00 178.44 179.15 1oks h ASP 29 N 1.21 0.00 0.63 1.25 3.32 -1.78 -1.95 116.42 119.10 1oks h ASP 29 Ca 0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.47 1oks h ASP 29 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1oks h ASP 29 CO -0.16 0.08 -0.63 0.47 -1.72 0.00 0.00 179.24 177.28 1oks n ASP 30 N -3.83 0.59 -4.75 6.45 8.00 -0.54 -4.91 116.55 117.56 1oks n ASP 30 Ca -0.02 -0.10 -0.41 0.00 0.71 0.00 0.00 54.79 54.97 1oks n ASP 30 Cb 0.18 0.30 -0.04 0.00 -0.02 0.00 0.00 41.12 41.54 1oks n ASP 30 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1oks s ILE 31 N -3.10 3.32 -0.05 0.53 -1.09 -0.74 -5.05 121.20 115.03 1oks s ILE 31 Ca 0.08 1.26 0.01 0.00 -2.23 0.00 0.00 60.65 59.77 1oks s ILE 31 Cb 0.15 -3.80 0.02 0.00 -1.58 0.00 0.00 42.46 37.25 1oks s ILE 31 CO 0.72 0.27 -0.05 -0.54 -1.23 0.00 0.00 174.94 174.11 1oks s LYS 32 N -1.14 0.96 0.00 2.79 1.02 -1.26 -5.01 119.74 117.10 1oks s LYS 32 Ca 0.48 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.33 1oks s LYS 32 Cb -0.34 -0.95 0.00 0.00 -0.52 0.00 0.00 37.83 36.02 1oks s LYS 32 CO 0.42 -0.09 0.00 0.41 -0.92 0.00 0.00 175.35 175.17 1oks n GLY 33 N 4.13 2.37 0.19 -3.33 0.00 -1.26 -4.51 105.19 102.78 1oks n GLY 33 Ca -0.23 -1.78 -0.11 0.00 0.00 0.00 0.00 46.02 43.91 1oks n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oks h ALA 34 N 0.00 0.44 -0.41 4.61 0.00 -1.98 -0.75 119.26 121.16 1oks h ALA 34 Ca 0.00 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.70 1oks h ALA 34 Cb 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1oks h ALA 34 CO 0.00 0.19 0.22 -0.91 0.00 0.00 0.00 179.25 178.76 1oks h ASN 35 N 0.38 0.34 0.09 0.00 4.21 -1.98 -0.84 115.58 117.78 1oks h ASN 35 Ca 0.09 0.01 -0.11 0.00 1.21 0.00 0.00 56.30 57.50 1oks h ASN 35 Cb 0.44 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 37.58 1oks h ASN 35 CO 0.02 0.24 -0.38 0.44 -1.29 0.00 0.00 177.43 176.46 1oks h ASP 36 N 0.45 0.40 -0.58 5.81 3.32 -1.77 -2.00 116.42 122.05 1oks h ASP 36 Ca 0.17 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 1oks h ASP 36 Cb 0.05 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1oks h ASP 36 CO -0.10 0.75 0.09 -0.07 -1.72 0.00 0.00 179.24 178.18 1oks h LEU 37 N 0.33 0.96 -0.58 1.55 3.38 -0.86 -1.56 115.31 118.52 1oks h LEU 37 Ca 0.03 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.68 1oks h LEU 37 Cb 0.81 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1oks h LEU 37 CO 0.07 0.96 -0.03 0.00 0.09 0.00 0.00 178.44 179.53 1oks h ALA 38 N 1.15 0.79 -0.34 1.53 0.00 -0.88 -1.30 119.26 120.22 1oks h ALA 38 Ca 0.19 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1oks h ALA 38 Cb 0.42 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1oks h ALA 38 CO 0.01 0.65 -0.23 0.87 0.00 0.00 0.00 179.25 180.55 1oks h LYS 39 N 0.94 0.66 -0.21 0.00 1.57 -1.24 -1.13 116.57 117.15 1oks h LYS 39 Ca 0.16 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 1oks h LYS 39 Cb 0.59 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1oks h LYS 39 CO 0.04 0.84 0.04 0.35 -0.57 0.00 0.00 179.45 180.14 1oks h PHE 40 N 0.58 0.38 -0.78 -1.35 3.57 -1.08 -2.93 116.94 115.33 1oks h PHE 40 Ca 0.08 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1oks h PHE 40 Cb 0.71 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 1oks h PHE 40 CO 0.03 0.49 0.50 1.25 -2.23 0.00 0.00 178.31 178.35 1oks h HIS 41 N 0.16 1.00 0.00 0.41 2.76 -1.11 0.14 115.15 118.50 1oks h HIS 41 Ca 0.07 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 1oks h HIS 41 Cb 0.32 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 28.94 1oks h HIS 41 CO 0.02 0.64 0.00 0.94 -1.30 0.00 0.00 177.93 178.23 1oks n GLN 42 N -4.52 0.02 0.00 5.26 7.27 -0.44 -1.20 117.38 123.77 1oks n GLN 42 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.15 1oks n GLN 42 Cb 0.03 -1.06 0.00 0.00 2.41 0.00 0.00 30.24 31.62 1oks n GLN 42 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1oks n LEU 44 N 0.55 0.00 -0.28 1.69 7.94 0.47 -2.72 117.00 124.66 1oks n LEU 44 Ca 0.00 0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.84 1oks n LEU 44 Cb 0.00 0.00 0.06 0.00 0.53 0.00 0.00 43.42 44.02 1oks n LEU 44 CO 0.00 0.00 1.01 0.58 -1.11 0.00 0.00 177.39 177.87 1oks h VAL 45 N 0.00 1.26 -0.34 1.96 2.07 -1.42 0.45 116.25 120.24 1oks h VAL 45 Ca 0.00 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 1oks h VAL 45 Cb 0.00 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1oks h VAL 45 CO 0.00 0.35 0.21 0.11 0.02 0.00 0.00 177.57 178.26 1oks h LYS 46 N 1.13 0.46 -0.20 1.57 1.57 -1.77 -2.89 116.57 116.44 1oks h LYS 46 Ca 0.25 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1oks h LYS 46 Cb 0.27 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1oks h LYS 46 CO -0.01 0.33 0.13 0.82 -0.57 0.00 0.00 179.45 180.15 1oks h ILE 47 N 0.45 1.05 0.00 1.86 2.04 -1.72 -1.88 117.51 119.31 1oks h ILE 47 Ca 0.12 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.89 1oks h ILE 47 Cb -0.01 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1oks h ILE 47 CO -0.02 0.05 0.00 -0.38 0.00 0.00 0.00 178.15 177.80 1oks n ILE 48 N -4.95 0.03 0.00 -0.67 2.08 0.10 -1.58 119.36 114.37 1oks n ILE 48 Ca -0.03 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.28 1oks n ILE 48 Cb 0.03 -0.17 0.00 0.00 -0.75 0.00 0.00 39.64 38.74 1oks n ILE 48 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1oks n LYS 50 N 0.55 0.00 -0.20 0.38 4.76 -0.71 -0.63 118.16 122.31 1oks n LYS 50 Ca 0.00 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.35 1oks n LYS 50 Cb 0.04 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.25 1oks n LYS 50 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1oks h HIS 51 N 0.00 0.99 -0.42 2.13 2.76 -1.55 -2.71 115.15 116.35 1oks h HIS 51 Ca 0.00 -0.13 -0.04 0.00 -2.20 0.00 0.00 60.37 58.00 1oks h HIS 51 Cb 0.00 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 28.67 1oks h HIS 51 CO 0.00 0.86 0.11 1.25 -1.30 0.00 0.00 177.93 178.85 1oks h HIS 52 N 0.83 0.63 0.00 5.26 -0.00 -1.12 -3.15 115.15 117.60 1oks h HIS 52 Ca 0.17 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.50 1oks h HIS 52 Cb 0.39 -0.19 0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1oks h HIS 52 CO 0.03 0.54 0.00 0.72 -0.00 0.00 0.00 177.93 179.22 1oks n HIS 53 N -4.32 0.00 -0.88 5.26 -0.00 -1.03 -4.73 115.22 109.52 1oks n HIS 53 Ca 0.03 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.42 1oks n HIS 53 Cb 0.19 -0.38 0.13 0.00 -0.00 0.00 0.00 29.99 29.93 1oks n HIS 53 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1oks n HIS 54 N -1.38 -0.43 0.00 4.41 8.25 -1.19 -5.10 115.22 119.79 1oks n HIS 54 Ca 0.10 0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.88 1oks n HIS 54 Cb 0.27 -1.90 0.00 0.00 1.12 0.00 0.00 29.99 29.48 1oks n HIS 54 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56