#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jzq n VAL 2 N 0.00 0.00 -2.20 -2.13 0.24 -1.26 -4.96 118.33 108.02 2jzq n VAL 2 Ca 0.00 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.92 2jzq n VAL 2 Cb 0.00 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.34 2jzq n VAL 2 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2jzq s ASN 3 N -0.18 5.56 0.28 -1.34 0.02 -1.26 -4.65 114.94 113.36 2jzq s ASN 3 Ca 0.00 -0.03 0.02 0.00 -1.02 0.00 0.00 52.86 51.83 2jzq s ASN 3 Cb 0.00 -2.54 -0.05 0.00 0.02 0.00 0.00 41.25 38.67 2jzq s ASN 3 CO 0.00 -2.22 0.09 0.00 0.02 0.00 0.00 177.10 174.98 2jzq s GLN 4 N 6.60 1.49 -0.37 -0.60 0.00 -1.26 -4.96 119.66 120.56 2jzq s GLN 4 Ca 0.57 -1.81 -0.19 0.00 -0.00 0.00 0.00 55.36 53.93 2jzq s GLN 4 Cb -0.10 -0.45 0.00 0.00 0.00 0.00 0.00 33.01 32.46 2jzq s GLN 4 CO 0.16 -0.26 0.54 -1.01 0.00 0.00 0.00 175.29 174.72 2jzq s HIS 5 N -3.61 3.16 0.02 9.60 3.76 -1.26 -3.36 115.29 123.60 2jzq s HIS 5 Ca 0.37 0.11 0.05 0.00 -0.15 0.00 0.00 55.06 55.45 2jzq s HIS 5 Cb 0.08 -3.01 -0.03 0.00 1.11 0.00 0.00 32.58 30.72 2jzq s HIS 5 CO 0.14 -0.62 -0.14 -0.51 -0.85 0.00 0.00 174.74 172.77 2jzq s LEU 6 N 2.47 2.82 -0.17 0.89 1.02 0.80 -4.84 118.68 121.67 2jzq s LEU 6 Ca 0.19 -0.31 -0.04 0.00 0.02 0.00 0.00 54.13 53.99 2jzq s LEU 6 Cb -0.15 -1.63 0.08 0.00 0.02 0.00 0.00 46.19 44.50 2jzq s LEU 6 CO 0.14 0.27 0.19 0.00 0.02 0.00 0.00 176.35 176.98 2jzq n GLY 8 N 5.32 0.49 0.09 0.00 0.00 -1.26 -2.54 105.19 107.29 2jzq n GLY 8 Ca -0.06 0.06 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2jzq n GLY 8 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jzq n SER 9 N 1.17 -0.23 0.27 1.61 7.64 -1.26 0.24 113.62 123.06 2jzq n SER 9 Ca 0.00 1.04 0.17 0.00 1.01 0.00 0.00 58.87 61.09 2jzq n SER 9 Cb 0.00 -0.37 0.76 0.00 -1.01 0.00 0.00 64.21 63.59 2jzq n SER 9 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2jzq h ASP 10 N 0.00 0.00 -0.10 6.43 3.32 -1.87 -2.49 116.42 121.71 2jzq h ASP 10 Ca 0.04 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 2jzq h ASP 10 Cb 0.09 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 2jzq h ASP 10 CO -0.21 0.00 0.01 0.25 -1.72 0.00 0.00 179.24 177.58 2jzq h LEU 11 N 0.00 0.16 -1.47 1.55 5.85 0.31 0.24 115.31 121.95 2jzq h LEU 11 Ca 0.00 -0.27 -0.05 0.00 0.84 0.00 0.00 57.88 58.40 2jzq h LEU 11 Cb 0.38 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2jzq h LEU 11 CO 0.00 0.39 -0.24 -0.37 -0.34 0.00 0.00 178.44 177.88 2jzq h VAL 12 N -0.07 0.79 0.33 1.05 -1.51 0.86 0.30 116.25 118.00 2jzq h VAL 12 Ca 0.03 -0.96 -0.02 0.00 -1.23 0.00 0.00 66.70 64.53 2jzq h VAL 12 Cb 0.30 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.04 2jzq h VAL 12 CO 0.00 0.23 -0.16 -0.08 -1.23 0.00 0.00 177.57 176.34 2jzq h GLU 13 N 0.00 -0.43 -0.42 5.19 4.81 -1.09 2.84 114.58 125.49 2jzq h GLU 13 Ca -0.00 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.34 2jzq h GLU 13 Cb 0.56 0.10 -0.07 0.00 0.63 0.00 0.00 28.75 29.97 2jzq h GLU 13 CO 0.03 -0.16 -0.03 0.00 -0.73 0.00 0.00 179.01 178.12 2jzq h ALA 14 N -0.83 0.37 -0.61 2.92 0.00 -0.39 0.86 119.26 121.56 2jzq h ALA 14 Ca -0.05 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2jzq h ALA 14 Cb 0.46 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2jzq h ALA 14 CO 0.07 -0.41 0.17 -0.07 0.00 0.00 0.00 179.25 179.02 2jzq h LEU 15 N 0.08 0.92 -2.55 0.00 3.38 -0.41 0.40 115.31 117.13 2jzq h LEU 15 Ca 0.21 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jzq h LEU 15 Cb 0.31 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2jzq h LEU 15 CO -0.37 0.90 0.01 0.22 0.09 0.00 0.00 178.44 179.29 2jzq h TYR 16 N 0.89 0.00 0.00 1.13 3.20 0.77 0.38 116.97 123.35 2jzq h TYR 16 Ca 0.20 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.07 2jzq h TYR 16 Cb 0.32 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.59 2jzq h TYR 16 CO 0.02 0.00 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.34 2jzq h LEU 17 N 0.00 0.00 -2.00 2.82 4.07 0.25 -1.64 115.31 118.82 2jzq h LEU 17 Ca 0.00 0.00 0.18 0.00 0.08 0.00 0.00 57.88 58.14 2jzq h LEU 17 Cb 0.03 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.75 2jzq h LEU 17 CO -0.00 0.39 0.48 -0.37 -1.08 0.00 0.00 178.44 177.86 2jzq h VAL 18 N -0.65 0.58 0.00 1.22 -1.51 -0.06 -3.15 116.25 112.68 2jzq h VAL 18 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2jzq h VAL 18 Cb 0.13 0.65 0.00 0.00 -2.13 0.00 0.00 31.29 29.95 2jzq h VAL 18 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.34 2jzq n GLY 20 N 1.81 0.47 0.00 0.00 0.00 -0.61 -2.03 105.19 104.83 2jzq n GLY 20 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2jzq n GLY 20 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jzq n GLU 21 N 0.00 -0.20 0.00 1.61 2.13 -1.26 -4.72 120.64 118.20 2jzq n GLU 21 Ca 0.00 -0.20 0.13 0.00 0.66 0.00 0.00 57.16 57.75 2jzq n GLU 21 Cb 0.00 -0.68 0.57 0.00 0.27 0.00 0.00 31.44 31.60 2jzq n GLU 21 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2jzq n ARG 22 N -0.03 0.04 -2.22 5.31 1.74 -0.86 -4.97 116.66 115.67 2jzq n ARG 22 Ca 0.00 0.05 -0.01 0.00 -0.77 0.00 0.00 57.85 57.12 2jzq n ARG 22 Cb 0.14 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.07 2jzq n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jzq n GLY 23 N 1.15 -3.90 2.65 -0.13 0.00 -1.26 -4.31 105.19 99.39 2jzq n GLY 23 Ca 0.07 0.38 -0.18 0.00 0.00 0.00 0.00 46.02 46.29 2jzq n GLY 23 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2jzq n PHE 24 N 0.58 -3.48 -3.83 1.61 -1.74 -1.26 -2.30 117.46 107.04 2jzq n PHE 24 Ca -0.06 -1.03 -0.06 0.00 -0.56 0.00 0.00 57.45 55.73 2jzq n PHE 24 Cb 0.10 -0.59 -0.00 0.00 1.52 0.00 0.00 39.48 40.51 2jzq n PHE 24 CO 0.00 0.00 0.00 -0.59 -0.56 0.00 0.00 176.76 175.61 2jzq s PHE 25 N -2.46 -0.06 -0.19 2.97 -0.12 -1.26 -4.73 117.98 112.14 2jzq s PHE 25 Ca 0.48 -0.43 -0.03 0.00 -0.05 0.00 0.00 56.93 56.90 2jzq s PHE 25 Cb -0.02 0.73 -0.01 0.00 -0.63 0.00 0.00 43.02 43.09 2jzq s PHE 25 CO 0.33 -1.22 -0.07 -0.47 -0.05 0.00 0.00 175.22 173.75 2jzq s TYR 26 N -3.11 2.93 0.77 3.49 5.04 -1.26 -4.80 117.35 120.41 2jzq s TYR 26 Ca 0.14 -0.82 -0.12 0.00 -2.44 0.00 0.00 57.07 53.83 2jzq s TYR 26 Cb -0.04 -2.02 0.05 0.00 0.35 0.00 0.00 41.96 40.30 2jzq s TYR 26 CO 0.07 -0.42 1.12 -0.08 -1.34 0.00 0.00 175.55 174.89 2jzq s THR 27 N 1.10 2.94 -0.79 4.34 -1.32 -1.26 -4.16 115.64 116.49 2jzq s THR 27 Ca 0.01 0.31 -0.16 0.00 -1.21 0.00 0.00 61.69 60.64 2jzq s THR 27 Cb -0.15 -3.21 0.02 0.00 -1.51 0.00 0.00 72.50 67.66 2jzq s THR 27 CO -0.01 -0.40 0.48 0.47 -2.21 0.00 0.00 174.62 172.96 2jzq n ASP 28 N -3.26 -3.29 -4.33 8.08 9.92 -1.22 -3.27 116.55 119.18 2jzq n ASP 28 Ca 0.07 -0.89 -0.40 0.00 -0.53 0.00 0.00 54.79 53.04 2jzq n ASP 28 Cb 0.58 -1.19 -0.01 0.00 -0.64 0.00 0.00 41.12 39.86 2jzq n ASP 28 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2jzq n PRO 29 N -3.24 2.74 0.00 -0.24 -0.04 -1.26 -4.00 135.00 128.96 2jzq n PRO 29 Ca -0.15 -2.90 0.00 0.00 -0.04 0.00 0.00 63.50 60.41 2jzq n PRO 29 Cb 0.46 -3.45 0.00 0.00 -0.04 0.00 0.00 33.50 30.47 2jzq n PRO 29 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2jzq n THR 30 N 6.32 0.00 -3.63 0.52 -2.24 -1.26 -5.08 114.28 108.91 2jzq n THR 30 Ca 0.49 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 62.24 2jzq n THR 30 Cb 0.44 -0.51 -0.04 0.00 -2.10 0.00 0.00 70.33 68.12 2jzq n THR 30 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jzq s GLY 31 N -2.06 -0.05 -0.41 3.38 0.00 -1.26 -4.99 107.32 101.93 2jzq s GLY 31 Ca 0.00 2.44 -0.13 0.00 0.00 0.00 0.00 44.72 47.04 2jzq s GLY 31 CO 0.00 0.96 0.54 0.61 0.00 0.00 0.00 173.10 175.21 2jzq n GLY 32 N 0.39 -1.24 2.99 0.20 0.00 -1.26 -4.38 105.19 101.90 2jzq n GLY 32 Ca -0.01 1.03 -0.06 0.00 0.00 0.00 0.00 46.02 46.99 2jzq n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jzq n GLY 33 N -0.48 -1.24 0.15 -0.02 0.00 -1.26 -4.88 105.19 97.46 2jzq n GLY 33 Ca 0.09 0.89 -0.00 0.00 0.00 0.00 0.00 46.02 47.00 2jzq n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jzq h PRO 34 N 1.25 0.00 -0.02 1.61 0.13 -1.76 -2.98 132.00 130.22 2jzq h PRO 34 Ca -0.03 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.07 2jzq h PRO 34 Cb 1.02 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.11 2jzq h PRO 34 CO 0.25 0.58 -0.55 2.89 -0.23 0.00 0.00 178.00 180.93 2jzq n ARG 35 N -3.77 1.53 -0.09 0.86 1.85 -1.20 -3.40 116.66 112.43 2jzq n ARG 35 Ca -0.01 -3.24 0.21 0.00 -1.00 0.00 0.00 57.85 53.82 2jzq n ARG 35 Cb 0.59 -1.52 0.33 0.00 -1.05 0.00 0.00 32.46 30.81 2jzq n ARG 35 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2jzq n ARG 36 N -0.98 0.02 -0.29 2.89 -4.01 -1.13 0.25 116.66 113.39 2jzq n ARG 36 Ca 0.19 0.97 0.05 0.00 -1.04 0.00 0.00 57.85 58.02 2jzq n ARG 36 Cb 0.73 -2.45 0.20 0.00 -3.04 0.00 0.00 32.46 27.89 2jzq n ARG 36 CO 0.00 0.00 0.00 0.78 -3.04 0.00 0.00 177.63 175.37 2jzq h GLY 37 N 0.00 1.33 0.00 2.89 0.00 -1.88 2.39 103.07 107.80 2jzq h GLY 37 Ca 0.37 -0.29 -0.31 0.00 0.00 0.00 0.00 47.33 47.11 2jzq h GLY 37 CO -0.00 0.05 -1.71 1.39 0.00 0.00 0.00 176.54 176.27 2jzq n ILE 38 N -4.80 1.53 0.25 2.60 -0.00 0.68 -3.01 119.36 116.61 2jzq n ILE 38 Ca 0.15 -0.15 0.08 0.00 -0.00 0.00 0.00 62.75 62.83 2jzq n ILE 38 Cb 0.35 -2.00 0.62 0.00 -0.00 0.00 0.00 39.64 38.61 2jzq n ILE 38 CO 0.00 0.00 0.00 0.58 -0.00 0.00 0.00 176.55 177.13 2jzq h VAL 39 N -1.00 1.00 0.00 1.39 2.07 -0.55 0.11 116.25 119.27 2jzq h VAL 39 Ca -0.46 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2jzq h VAL 39 Cb 1.39 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 2jzq h VAL 39 CO -0.28 0.05 -0.71 1.21 0.02 0.00 0.00 177.57 177.86 2jzq n GLU 40 N -4.43 0.16 0.00 1.57 2.13 0.80 -3.70 120.64 117.17 2jzq n GLU 40 Ca -0.03 0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.81 2jzq n GLU 40 Cb 0.13 -1.58 0.00 0.00 0.27 0.00 0.00 31.44 30.27 2jzq n GLU 40 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 2jzq n GLN 41 N -1.79 0.00 -0.54 5.31 -0.06 0.31 -3.06 117.38 117.56 2jzq n GLN 41 Ca 0.04 0.00 0.45 0.00 -2.00 0.00 0.00 57.00 55.48 2jzq n GLN 41 Cb 0.39 0.00 0.68 0.00 -4.06 0.00 0.00 30.24 27.26 2jzq n GLN 41 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2jzq h HIS 44 N -1.03 0.44 0.00 0.00 3.86 -0.38 -3.42 115.15 114.62 2jzq h HIS 44 Ca -0.04 -0.32 0.00 0.00 -1.16 0.00 0.00 60.37 58.85 2jzq h HIS 44 Cb 0.40 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.85 2jzq h HIS 44 CO 0.03 1.27 0.00 0.45 0.86 0.00 0.00 177.93 180.54 2jzq n SER 45 N -4.20 0.00 -3.91 2.45 2.88 0.72 -5.03 113.62 106.53 2jzq n SER 45 Ca -0.14 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.31 2jzq n SER 45 Cb 0.77 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.17 2jzq n SER 45 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2jzq s ILE 46 N 3.67 0.04 0.36 2.46 1.09 -1.23 -4.35 121.20 123.24 2jzq s ILE 46 Ca 0.00 -1.24 -0.10 0.00 -1.10 0.00 0.00 60.65 58.22 2jzq s ILE 46 Cb 0.00 -1.83 0.03 0.00 -1.06 0.00 0.00 42.46 39.59 2jzq s ILE 46 CO 0.00 -0.20 0.63 0.00 -0.10 0.00 0.00 174.94 175.27 2jzq s SER 48 N -3.14 0.43 0.36 0.00 0.01 -1.26 -4.02 113.70 106.07 2jzq s SER 48 Ca 0.23 -1.14 0.20 0.00 1.31 0.00 0.00 55.95 56.54 2jzq s SER 48 Cb -0.03 0.26 1.30 0.00 0.21 0.00 0.00 66.02 67.76 2jzq s SER 48 CO 0.15 -0.68 1.52 0.18 0.41 0.00 0.00 173.24 174.82 2jzq n LEU 49 N -0.04 0.33 -0.24 2.44 4.32 -1.26 0.28 117.00 122.83 2jzq n LEU 49 Ca -0.08 1.59 -0.07 0.00 -0.02 0.00 0.00 56.01 57.43 2jzq n LEU 49 Cb 0.63 -0.78 0.04 0.00 -1.62 0.00 0.00 43.42 41.69 2jzq n LEU 49 CO 0.30 -1.78 1.00 0.10 -1.22 0.00 0.00 177.39 175.79 2jzq h TYR 50 N 0.00 1.01 -0.36 -1.77 -0.00 -1.97 2.16 116.97 116.05 2jzq h TYR 50 Ca 0.82 -0.08 -0.06 0.00 0.00 0.00 0.00 58.73 59.41 2jzq h TYR 50 Cb 2.17 -0.30 -0.01 0.00 0.00 0.00 0.00 36.73 38.58 2jzq h TYR 50 CO -0.01 0.80 0.00 0.37 -0.00 0.00 0.00 178.16 179.32 2jzq h GLN 51 N 0.93 0.63 0.00 0.10 5.75 0.37 -2.45 115.11 120.45 2jzq h GLN 51 Ca 0.22 -0.20 -0.06 0.00 -0.15 0.00 0.00 58.65 58.46 2jzq h GLN 51 Cb 0.22 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.71 2jzq h GLN 51 CO -0.02 0.74 -0.27 -0.07 -2.65 0.00 0.00 178.83 176.57 2jzq h LEU 52 N 0.45 0.00 -1.91 -2.39 4.07 -0.47 -2.82 115.31 112.23 2jzq h LEU 52 Ca 0.10 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.05 2jzq h LEU 52 Cb 0.46 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.20 2jzq h LEU 52 CO 0.02 0.27 -0.04 -0.08 -1.08 0.00 0.00 178.44 177.53 2jzq h GLU 53 N 0.00 0.00 -0.00 1.13 4.81 0.40 0.19 114.58 121.11 2jzq h GLU 53 Ca -0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2jzq h GLU 53 Cb 1.00 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.38 2jzq h GLU 53 CO 0.04 0.04 -0.45 0.09 -0.73 0.00 0.00 179.01 178.00 2jzq n ASN 54 N -4.49 0.61 -0.46 1.04 3.02 -1.07 -3.43 115.26 110.49 2jzq n ASN 54 Ca -0.03 -0.39 0.14 0.00 -0.03 0.00 0.00 54.58 54.27 2jzq n ASN 54 Cb 0.13 0.23 0.51 0.00 -0.61 0.00 0.00 39.78 40.04 2jzq n ASN 54 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2jzq n TYR 55 N -1.32 0.00 -1.55 3.10 4.01 0.64 -4.88 117.16 117.16 2jzq n TYR 55 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 2jzq n TYR 55 Cb 0.34 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 2jzq n TYR 55 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40