#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 -1.56 -2.13 0.24 -1.26 -5.05 118.33 108.57 2jzq n VAL 2 Ca 0.00 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.08 2jzq n VAL 2 Cb 0.00 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.32 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 4.07 0.31 -1.34 0.01 -1.26 -4.84 114.94 111.72 2jzq s ASN 3 Ca 0.00 0.45 0.03 0.00 -0.71 0.00 0.00 52.86 52.63 2jzq s ASN 3 Cb 0.00 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 39.09 2jzq s ASN 3 CO 0.00 -3.52 0.14 0.00 -1.51 0.00 0.00 177.10 172.21 2jzq s GLN 4 N 8.68 1.61 -0.40 -0.60 -2.07 -1.26 -4.96 119.66 120.67 2jzq s GLN 4 Ca 0.95 -1.92 -0.21 0.00 -1.82 0.00 0.00 55.36 52.36 2jzq s GLN 4 Cb -0.15 -0.23 0.01 0.00 -1.09 0.00 0.00 33.01 31.56 2jzq s GLN 4 CO 0.15 -0.41 0.67 -1.01 -1.32 0.00 0.00 175.29 173.37 2jzq s HIS 5 N -3.56 3.10 -0.11 9.60 3.76 -1.26 -3.39 115.29 123.42 2jzq s HIS 5 Ca 0.35 0.21 0.03 0.00 -0.15 0.00 0.00 55.06 55.50 2jzq s HIS 5 Cb 0.05 -3.31 -0.00 0.00 1.11 0.00 0.00 32.58 30.43 2jzq s HIS 5 CO 0.16 -0.77 -0.20 -1.17 -0.85 0.00 0.00 174.74 171.92 2jzq s LEU 6 N 2.87 2.29 0.42 0.89 2.96 0.99 -4.83 118.68 124.26 2jzq s LEU 6 Ca 0.25 -0.49 0.07 0.00 -0.22 0.00 0.00 54.13 53.74 2jzq s LEU 6 Cb -0.14 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 2jzq s LEU 6 CO 0.17 0.15 0.25 0.00 -1.32 0.00 0.00 176.35 175.61 2jzq n GLY 8 N -1.36 -0.64 0.06 0.00 0.00 -1.26 0.28 105.19 102.27 2jzq n GLY 8 Ca 0.00 0.48 -0.02 0.00 0.00 0.00 0.00 46.02 46.48 2jzq n GLY 8 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2jzq h SER 9 N 0.00 -0.12 0.43 1.61 0.02 -2.00 -0.70 113.55 112.79 2jzq h SER 9 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2jzq h SER 9 Cb 0.69 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2jzq h SER 9 CO -0.46 -0.08 0.00 0.47 -1.14 0.00 0.00 176.83 175.62 2jzq n ASP 10 N -2.41 0.22 -0.02 3.07 9.92 0.37 -2.07 116.55 125.63 2jzq n ASP 10 Ca -0.02 0.57 -0.13 0.00 -0.53 0.00 0.00 54.79 54.68 2jzq n ASP 10 Cb 0.06 -0.61 -0.09 0.00 -0.64 0.00 0.00 41.12 39.83 2jzq n ASP 10 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 2jzq h LEU 11 N 0.00 0.09 -1.56 0.64 5.85 0.44 0.53 115.31 121.30 2jzq h LEU 11 Ca 0.00 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.19 2jzq h LEU 11 Cb 0.22 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2jzq h LEU 11 CO 0.00 0.56 -0.16 -0.37 -0.34 0.00 0.00 178.44 178.12 2jzq h VAL 12 N -0.37 1.15 0.37 1.05 -1.51 -0.55 0.67 116.25 117.05 2jzq h VAL 12 Ca 0.01 -0.67 -0.02 0.00 -1.23 0.00 0.00 66.70 64.79 2jzq h VAL 12 Cb 0.53 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 30.99 2jzq h VAL 12 CO 0.01 0.20 -0.18 -0.08 -1.23 0.00 0.00 177.57 176.29 2jzq h GLU 13 N 0.07 -0.48 -0.29 5.19 4.81 -1.32 3.00 114.58 125.56 2jzq h GLU 13 Ca 0.01 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.33 2jzq h GLU 13 Cb 0.34 0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.78 2jzq h GLU 13 CO 0.02 -0.17 -0.02 0.00 -0.73 0.00 0.00 179.01 178.11 2jzq h ALA 14 N -0.62 0.24 -0.75 2.92 0.00 -0.58 0.35 119.26 120.82 2jzq h ALA 14 Ca -0.05 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2jzq h ALA 14 Cb 0.53 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 2jzq h ALA 14 CO 0.08 -0.43 0.33 -0.07 0.00 0.00 0.00 179.25 179.17 2jzq h LEU 15 N 0.06 1.01 -2.72 0.00 3.38 0.38 0.31 115.31 117.73 2jzq h LEU 15 Ca 0.14 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jzq h LEU 15 Cb 0.19 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2jzq h LEU 15 CO -0.25 0.89 0.08 0.22 0.09 0.00 0.00 178.44 179.47 2jzq h TYR 16 N 1.07 0.00 0.00 1.13 3.20 0.76 0.16 116.97 123.29 2jzq h TYR 16 Ca 0.25 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.12 2jzq h TYR 16 Cb 0.17 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.44 2jzq h TYR 16 CO 0.01 0.00 -0.17 1.28 -1.64 0.00 0.00 178.16 177.65 2jzq n LEU 17 N -3.10 0.60 -0.41 2.82 4.32 0.10 -1.80 117.00 119.53 2jzq n LEU 17 Ca -0.03 0.38 0.40 0.00 -0.02 0.00 0.00 56.01 56.74 2jzq n LEU 17 Cb 0.15 -0.62 0.77 0.00 -1.62 0.00 0.00 43.42 42.09 2jzq n LEU 17 CO 0.19 -0.49 1.36 -0.37 -1.22 0.00 0.00 177.39 176.86 2jzq h VAL 18 N -0.33 0.31 0.00 4.08 -1.51 -0.36 -2.88 116.25 115.56 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 0.17 0.31 0.00 0.00 -2.13 0.00 0.00 31.29 29.64 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 1.82 0.55 0.00 0.00 0.00 -0.74 -2.15 105.19 104.67 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 1.18 0.00 0.00 0.00 173.32 174.50 2jzq n GLU 21 N 0.00 -0.09 0.00 1.61 1.02 -1.26 -4.77 120.64 117.14 2jzq n GLU 21 Ca 0.00 -0.05 0.13 0.00 -0.02 0.00 0.00 57.16 57.22 2jzq n GLU 21 Cb 0.00 -0.54 0.68 0.00 -0.02 0.00 0.00 31.44 31.56 2jzq n GLU 21 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2jzq n ARG 22 N -0.00 0.50 -2.08 3.49 3.00 -0.92 -4.94 116.66 115.71 2jzq n ARG 22 Ca 0.00 0.03 -0.02 0.00 -0.01 0.00 0.00 57.85 57.85 2jzq n ARG 22 Cb 0.23 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.19 2jzq n ARG 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2jzq n GLY 23 N 0.81 -2.20 2.94 -0.13 0.00 -1.26 -4.19 105.19 101.16 2jzq n GLY 23 Ca 0.14 0.30 -0.21 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.06 -3.76 -3.27 1.61 -1.74 -1.26 -2.19 117.46 106.80 2jzq n PHE 24 Ca 0.03 -1.01 -0.02 0.00 -0.56 0.00 0.00 57.45 55.89 2jzq n PHE 24 Cb 0.11 -0.73 0.01 0.00 1.52 0.00 0.00 39.48 40.39 2jzq n PHE 24 CO 0.00 0.00 0.00 1.97 -0.56 0.00 0.00 176.76 178.17 2jzq n PHE 25 N -3.18 -1.28 -3.47 2.97 1.16 -1.26 -4.76 117.46 107.64 2jzq n PHE 25 Ca 0.13 -0.48 -0.21 0.00 -1.87 0.00 0.00 57.45 55.01 2jzq n PHE 25 Cb 0.44 0.24 -0.12 0.00 -1.61 0.00 0.00 39.48 38.43 2jzq n PHE 25 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 2jzq s TYR 26 N -6.80 -0.16 0.29 2.97 5.04 -1.26 -4.89 117.35 112.53 2jzq s TYR 26 Ca 0.05 -0.31 -0.05 0.00 -2.44 0.00 0.00 57.07 54.32 2jzq s TYR 26 Cb -0.01 -0.58 0.07 0.00 0.35 0.00 0.00 41.96 41.78 2jzq s TYR 26 CO 0.03 -0.81 0.37 -2.37 -1.34 0.00 0.00 175.55 171.43 2jzq n THR 27 N 5.29 0.00 0.00 4.34 5.66 -1.26 -5.07 114.28 123.24 2jzq n THR 27 Ca -0.04 -0.26 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 2jzq n THR 27 Cb 0.46 -1.78 0.00 0.00 -1.55 0.00 0.00 70.33 67.46 2jzq n THR 27 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 2jzq n ASP 28 N -3.27 0.00 0.00 1.09 5.68 -1.26 -4.48 116.55 114.30 2jzq n ASP 28 Ca 0.05 0.00 0.05 0.00 -0.50 0.00 0.00 54.79 54.39 2jzq n ASP 28 Cb 0.16 0.00 0.31 0.00 -1.14 0.00 0.00 41.12 40.45 2jzq n ASP 28 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 2jzq n PRO 29 N 0.00 0.85 0.00 0.11 -0.04 -1.26 -4.62 135.00 130.04 2jzq n PRO 29 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2jzq n PRO 29 Cb 0.00 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 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 -0.69 0.00 0.00 0.52 -2.24 -1.26 -5.07 114.28 105.53 2jzq n THR 30 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 2jzq n THR 30 Cb 0.04 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 2jzq n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jzq n GLY 31 N 0.48 -1.40 3.60 3.38 0.00 -1.26 -4.99 105.19 105.00 2jzq n GLY 31 Ca 0.00 0.53 -0.43 0.00 0.00 0.00 0.00 46.02 46.12 2jzq n GLY 31 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jzq s GLY 32 N 0.00 1.47 -1.23 -0.02 0.00 -1.26 -3.96 107.32 102.31 2jzq s GLY 32 Ca 0.00 -0.45 -0.19 0.00 0.00 0.00 0.00 44.72 44.08 2jzq s GLY 32 CO 0.00 2.19 0.65 0.61 0.00 0.00 0.00 173.10 176.55 2jzq n GLY 33 N 4.53 -0.76 0.15 0.20 0.00 -1.26 -4.86 105.19 103.19 2jzq n GLY 33 Ca 0.09 0.35 -0.17 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.07 0.43 -1.01 1.61 0.13 -1.93 -2.99 132.00 126.17 2jzq h PRO 34 Ca -0.67 -0.44 -0.44 0.00 -0.87 0.00 0.00 66.00 63.58 2jzq h PRO 34 Cb 1.38 0.12 -0.25 0.00 0.13 0.00 0.00 31.00 32.37 2jzq h PRO 34 CO 0.53 1.10 0.56 2.89 -0.23 0.00 0.00 178.00 182.85 2jzq n ARG 35 N -4.21 2.06 0.33 0.86 1.85 -1.26 -4.47 116.66 111.82 2jzq n ARG 35 Ca -0.10 -2.49 0.07 0.00 -1.00 0.00 0.00 57.85 54.33 2jzq n ARG 35 Cb 0.67 -1.98 0.39 0.00 -1.05 0.00 0.00 32.46 30.49 2jzq n ARG 35 CO 0.00 0.00 0.00 0.07 -0.01 0.00 0.00 177.63 177.69 2jzq h ARG 36 N 0.90 0.00 -0.85 2.89 -0.00 -1.88 0.17 114.38 115.62 2jzq h ARG 36 Ca 0.52 0.00 0.22 0.00 -0.00 0.00 0.00 59.98 60.72 2jzq h ARG 36 Cb 2.40 0.00 -0.13 0.00 -0.00 0.00 0.00 29.97 32.24 2jzq h ARG 36 CO 0.95 0.00 0.22 0.78 -0.00 0.00 0.00 179.97 181.92 2jzq h GLY 37 N 0.00 1.28 0.00 0.08 0.00 -1.88 2.01 103.07 104.56 2jzq h GLY 37 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2jzq h GLY 37 CO -0.00 -0.32 -0.61 1.39 0.00 0.00 0.00 176.54 176.99 2jzq n ILE 38 N -5.21 1.27 -0.31 2.60 5.41 0.53 -3.19 119.36 120.46 2jzq n ILE 38 Ca 0.20 0.23 0.25 0.00 1.00 0.00 0.00 62.75 64.42 2jzq n ILE 38 Cb 0.63 -2.27 0.57 0.00 -0.71 0.00 0.00 39.64 37.85 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 -0.88 0.51 0.00 1.39 2.07 -1.24 0.38 116.25 118.49 2jzq h VAL 39 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 2jzq h VAL 39 Cb 0.61 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2jzq h VAL 39 CO 0.00 0.05 -1.13 1.21 0.02 0.00 0.00 177.57 177.73 2jzq n GLU 40 N -4.52 0.43 0.00 1.57 2.13 0.68 -3.80 120.64 117.12 2jzq n GLU 40 Ca 0.25 0.01 0.00 0.00 0.66 0.00 0.00 57.16 58.08 2jzq n GLU 40 Cb 0.94 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 31.00 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 -2.22 0.00 -0.50 5.31 7.27 0.13 -2.95 117.38 124.43 2jzq n GLN 41 Ca 0.01 0.00 0.41 0.00 0.07 0.00 0.00 57.00 57.48 2jzq n GLN 41 Cb 0.49 0.00 0.69 0.00 2.41 0.00 0.00 30.24 33.83 2jzq n GLN 41 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2jzq h HIS 44 N -0.79 0.00 0.00 0.00 3.86 -0.39 -3.41 115.15 114.42 2jzq h HIS 44 Ca -0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2jzq h HIS 44 Cb 0.52 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.99 2jzq h HIS 44 CO 0.02 1.02 0.00 0.45 0.86 0.00 0.00 177.93 180.27 2jzq n SER 45 N -4.56 0.00 -3.93 2.45 2.88 0.73 -4.99 113.62 106.19 2jzq n SER 45 Ca -0.17 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.28 2jzq n SER 45 Cb 0.49 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.88 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 3.44 0.07 0.06 2.46 1.09 -1.23 -4.12 121.20 122.98 2jzq s ILE 46 Ca 0.00 -1.32 -0.01 0.00 -1.10 0.00 0.00 60.65 58.23 2jzq s ILE 46 Cb 0.00 -1.76 0.00 0.00 -1.06 0.00 0.00 42.46 39.64 2jzq s ILE 46 CO 0.00 -0.32 0.09 0.00 -0.10 0.00 0.00 174.94 174.61 2jzq s SER 48 N -1.39 0.04 0.38 0.00 0.01 -1.26 -4.23 113.70 107.25 2jzq s SER 48 Ca 0.05 -0.41 0.24 0.00 1.31 0.00 0.00 55.95 57.14 2jzq s SER 48 Cb -0.00 0.31 1.36 0.00 0.21 0.00 0.00 66.02 67.89 2jzq s SER 48 CO 0.04 -0.60 1.52 0.18 0.41 0.00 0.00 173.24 174.78 2jzq n LEU 49 N 0.50 0.29 -0.05 2.44 4.32 -1.26 0.15 117.00 123.39 2jzq n LEU 49 Ca -0.18 1.51 -0.10 0.00 -0.02 0.00 0.00 56.01 57.22 2jzq n LEU 49 Cb 0.60 -0.74 -0.04 0.00 -1.62 0.00 0.00 43.42 41.62 2jzq n LEU 49 CO 0.22 -1.68 0.90 0.10 -1.22 0.00 0.00 177.39 175.71 2jzq h TYR 50 N 0.00 0.27 -0.54 -1.77 -0.00 -1.97 2.11 116.97 115.07 2jzq h TYR 50 Ca 0.83 -0.01 -0.12 0.00 0.00 0.00 0.00 58.73 59.44 2jzq h TYR 50 Cb 2.39 -0.09 -0.02 0.00 0.00 0.00 0.00 36.73 39.01 2jzq h TYR 50 CO -0.01 0.26 -0.12 0.37 -0.00 0.00 0.00 178.16 178.66 2jzq h GLN 51 N 0.20 1.04 0.00 0.10 4.15 0.98 -1.96 115.11 119.63 2jzq h GLN 51 Ca 0.07 -0.40 0.00 0.00 0.77 0.00 0.00 58.65 59.09 2jzq h GLN 51 Cb 0.08 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.71 2jzq h GLN 51 CO -0.01 1.09 0.00 -0.07 -1.93 0.00 0.00 178.83 177.91 2jzq h LEU 52 N 0.92 0.00 -2.02 -2.39 4.07 -0.42 -2.77 115.31 112.71 2jzq h LEU 52 Ca 0.14 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.08 2jzq h LEU 52 Cb 0.70 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.44 2jzq h LEU 52 CO 0.05 0.00 -0.09 -0.08 -1.08 0.00 0.00 178.44 177.24 2jzq h GLU 53 N 0.00 0.00 0.00 1.13 4.57 0.43 0.45 114.58 121.16 2jzq h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2jzq h GLU 53 Cb 0.72 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 2jzq h GLU 53 CO 0.00 0.09 -0.55 0.09 -1.18 0.00 0.00 179.01 177.46 2jzq n ASN 54 N -3.92 0.53 -0.30 1.04 3.02 -1.04 -3.48 115.26 111.11 2jzq n ASN 54 Ca -0.02 -0.22 0.14 0.00 -0.03 0.00 0.00 54.58 54.45 2jzq n ASN 54 Cb 0.18 0.28 0.58 0.00 -0.61 0.00 0.00 39.78 40.21 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 -1.59 0.00 -1.60 3.10 4.01 0.14 -4.86 117.16 116.36 2jzq n TYR 55 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 2jzq n TYR 55 Cb 0.35 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.32 2jzq n TYR 55 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40