#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 -1.67 -2.13 0.24 -1.26 -5.05 118.33 108.46 2jzq n VAL 2 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.14 2jzq n VAL 2 Cb 0.00 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.30 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 -0.02 4.05 0.41 -1.34 -0.87 -1.26 -4.82 114.94 111.09 2jzq s ASN 3 Ca 0.00 -0.26 0.03 0.00 -1.57 0.00 0.00 52.86 51.07 2jzq s ASN 3 Cb 0.00 -2.56 -0.03 0.00 -0.02 0.00 0.00 41.25 38.64 2jzq s ASN 3 CO 0.00 -3.80 0.09 0.00 -2.57 0.00 0.00 177.10 170.81 2jzq s GLN 4 N 8.46 1.93 -0.55 -0.60 0.00 -1.26 -4.92 119.66 122.73 2jzq s GLN 4 Ca 0.87 -2.17 -0.21 0.00 -0.00 0.00 0.00 55.36 53.85 2jzq s GLN 4 Cb -0.10 -0.85 0.06 0.00 0.00 0.00 0.00 33.01 32.11 2jzq s GLN 4 CO 0.08 -0.39 0.79 -1.01 0.00 0.00 0.00 175.29 174.76 2jzq s HIS 5 N -3.15 2.90 -0.12 9.60 3.76 -1.26 -3.39 115.29 123.64 2jzq s HIS 5 Ca 0.23 -0.37 -0.06 0.00 -0.15 0.00 0.00 55.06 54.72 2jzq s HIS 5 Cb 0.04 -3.87 -0.04 0.00 1.11 0.00 0.00 32.58 29.82 2jzq s HIS 5 CO 0.13 -1.25 0.10 -1.17 -0.85 0.00 0.00 174.74 171.70 2jzq s LEU 6 N 3.31 4.14 0.31 0.89 2.96 0.80 -4.73 118.68 126.36 2jzq s LEU 6 Ca 0.22 0.36 0.05 0.00 -0.22 0.00 0.00 54.13 54.53 2jzq s LEU 6 Cb -0.17 -2.00 -0.06 0.00 0.50 0.00 0.00 46.19 44.46 2jzq s LEU 6 CO 0.14 0.38 0.01 0.00 -1.32 0.00 0.00 176.35 175.56 2jzq n GLY 8 N -0.65 -0.46 0.05 0.00 0.00 -1.26 0.27 105.19 103.14 2jzq n GLY 8 Ca -0.04 0.32 -0.02 0.00 0.00 0.00 0.00 46.02 46.29 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 -0.10 0.40 1.61 0.02 -2.00 -1.02 113.55 112.45 2jzq h SER 9 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2jzq h SER 9 Cb 0.37 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.94 2jzq h SER 9 CO -0.31 -0.07 0.00 0.47 -1.14 0.00 0.00 176.83 175.78 2jzq n ASP 10 N -2.37 0.06 -0.03 3.07 8.00 0.70 -2.31 116.55 123.67 2jzq n ASP 10 Ca -0.02 0.52 -0.14 0.00 0.71 0.00 0.00 54.79 55.87 2jzq n ASP 10 Cb 0.05 -0.53 -0.10 0.00 -0.02 0.00 0.00 41.12 40.52 2jzq n ASP 10 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2jzq h LEU 11 N 0.00 0.17 -1.10 0.64 5.85 0.42 0.19 115.31 121.48 2jzq h LEU 11 Ca 0.00 -0.61 -0.09 0.00 0.84 0.00 0.00 57.88 58.02 2jzq h LEU 11 Cb 0.20 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2jzq h LEU 11 CO 0.00 0.75 -0.42 -0.37 -0.34 0.00 0.00 178.44 178.05 2jzq h VAL 12 N -0.41 1.31 0.56 1.05 -1.51 -0.78 0.37 116.25 116.85 2jzq h VAL 12 Ca -0.00 -1.48 -0.03 0.00 -1.23 0.00 0.00 66.70 63.96 2jzq h VAL 12 Cb 0.73 1.77 0.01 0.00 -2.13 0.00 0.00 31.29 31.66 2jzq h VAL 12 CO 0.02 0.43 -0.27 -0.33 -1.23 0.00 0.00 177.57 176.19 2jzq h GLU 13 N 0.04 -0.73 -0.46 5.19 4.39 -1.44 2.96 114.58 124.54 2jzq h GLU 13 Ca 0.00 0.05 0.09 0.00 0.34 0.00 0.00 59.36 59.84 2jzq h GLU 13 Cb 0.77 0.17 -0.08 0.00 -0.10 0.00 0.00 28.75 29.51 2jzq h GLU 13 CO 0.06 -0.48 -0.04 0.00 -1.16 0.00 0.00 179.01 177.38 2jzq h ALA 14 N -1.18 0.38 -0.50 3.43 0.00 -0.52 0.58 119.26 121.46 2jzq h ALA 14 Ca -0.08 0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2jzq h ALA 14 Cb 0.59 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2jzq h ALA 14 CO 0.13 -0.41 0.16 -0.07 0.00 0.00 0.00 179.25 179.05 2jzq h LEU 15 N 0.07 0.72 -2.41 0.00 3.38 -0.22 0.31 115.31 117.16 2jzq h LEU 15 Ca 0.23 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2jzq h LEU 15 Cb 0.34 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2jzq h LEU 15 CO -0.42 0.74 0.18 0.22 0.09 0.00 0.00 178.44 179.25 2jzq h TYR 16 N 0.67 0.00 0.00 1.13 3.20 0.80 0.32 116.97 123.10 2jzq h TYR 16 Ca 0.16 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2jzq h TYR 16 Cb 0.27 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.54 2jzq h TYR 16 CO 0.01 0.00 -0.14 -0.07 -1.64 0.00 0.00 178.16 176.32 2jzq h LEU 17 N 0.00 0.00 -1.91 2.82 4.07 0.23 -1.76 115.31 118.76 2jzq h LEU 17 Ca 0.02 0.00 0.34 0.00 0.08 0.00 0.00 57.88 58.32 2jzq h LEU 17 Cb 0.39 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.08 2jzq h LEU 17 CO -0.00 0.23 0.84 -0.37 -1.08 0.00 0.00 178.44 178.07 2jzq h VAL 18 N -0.33 0.41 0.00 1.22 -1.51 -0.21 -3.04 116.25 112.79 2jzq h VAL 18 Ca 0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 65.45 2jzq h VAL 18 Cb 0.14 0.36 0.00 0.00 -2.13 0.00 0.00 31.29 29.66 2jzq h VAL 18 CO 0.00 0.01 0.00 0.00 -1.23 0.00 0.00 177.57 176.35 2jzq n GLY 20 N 1.99 0.08 0.00 0.00 0.00 -0.66 -2.23 105.19 104.37 2jzq n GLY 20 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.72 0.00 0.00 1.61 -0.58 -1.26 -4.97 120.64 113.72 2jzq n GLU 21 Ca -0.04 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.81 2jzq n GLU 21 Cb 0.27 0.00 0.70 0.00 -0.57 0.00 0.00 31.44 31.84 2jzq n GLU 21 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2jzq n ARG 22 N 0.00 0.77 -2.72 3.49 1.74 -0.95 -4.90 116.66 114.08 2jzq n ARG 22 Ca 0.00 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.05 2jzq n ARG 22 Cb 0.00 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 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 0.52 -1.14 2.01 -0.13 0.00 -1.26 -3.79 105.19 101.40 2jzq n GLY 23 Ca 0.18 0.65 -0.16 0.00 0.00 0.00 0.00 46.02 46.68 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 -1.08 -3.72 -3.02 1.61 -1.74 -1.26 -2.35 117.46 105.89 2jzq n PHE 24 Ca 0.04 -0.59 0.00 0.00 -0.56 0.00 0.00 57.45 56.34 2jzq n PHE 24 Cb 0.45 -0.60 0.00 0.00 1.52 0.00 0.00 39.48 40.85 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 -3.43 -0.83 -3.32 2.97 -1.74 -1.26 -4.69 117.46 105.15 2jzq n PHE 25 Ca 0.09 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.89 2jzq n PHE 25 Cb 0.32 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.25 2jzq n PHE 25 CO 0.00 0.00 0.00 -0.47 -0.56 0.00 0.00 176.76 175.73 2jzq s TYR 26 N -7.90 -0.94 0.00 2.97 5.04 -1.26 -4.92 117.35 110.35 2jzq s TYR 26 Ca 0.00 0.60 0.00 0.00 -2.44 0.00 0.00 57.07 55.23 2jzq s TYR 26 Cb 0.00 -0.05 0.00 0.00 0.35 0.00 0.00 41.96 42.26 2jzq s TYR 26 CO 0.00 -0.86 0.00 -2.37 -1.34 0.00 0.00 175.55 170.98 2jzq n THR 27 N 5.36 0.00 0.00 4.34 5.66 -1.26 -4.97 114.28 123.41 2jzq n THR 27 Ca -0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.99 2jzq n THR 27 Cb 0.50 -1.78 0.00 0.00 -1.55 0.00 0.00 70.33 67.49 2jzq n THR 27 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2jzq n ASP 28 N -1.97 0.00 -0.13 1.09 2.03 0.45 -3.86 116.55 114.16 2jzq n ASP 28 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2jzq n ASP 28 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2jzq n ASP 28 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2jzq n PRO 29 N 0.00 0.91 0.00 -0.67 -0.04 -1.26 -4.57 135.00 129.37 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 -1.12 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 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 -0.36 0.00 0.00 0.52 -2.24 -1.26 -5.14 114.28 105.80 2jzq n THR 30 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2jzq n THR 30 Cb 0.06 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 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 -0.20 -1.89 3.48 3.38 0.00 -1.26 -5.12 105.19 103.58 2jzq n GLY 31 Ca 0.00 0.81 -0.46 0.00 0.00 0.00 0.00 46.02 46.37 2jzq n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jzq n GLY 32 N 0.00 -1.14 2.85 -0.02 0.00 -1.26 -3.45 105.19 102.17 2jzq n GLY 32 Ca 0.00 0.29 -0.02 0.00 0.00 0.00 0.00 46.02 46.29 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 1.66 -2.93 0.18 -0.02 0.00 -1.26 -4.69 105.19 98.13 2jzq n GLY 33 Ca 0.14 0.70 0.12 0.00 0.00 0.00 0.00 46.02 46.98 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 3.87 0.00 0.00 1.61 0.13 -1.76 -3.12 132.00 132.73 2jzq h PRO 34 Ca -0.17 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.77 2jzq h PRO 34 Cb 0.59 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.59 2jzq h PRO 34 CO 0.03 0.00 -0.24 -2.13 -0.23 0.00 0.00 178.00 175.43 2jzq n ARG 35 N -2.36 0.79 0.02 0.86 3.00 -1.25 -0.41 116.66 117.32 2jzq n ARG 35 Ca -0.02 -1.51 0.19 0.00 -0.00 0.00 0.00 57.85 56.51 2jzq n ARG 35 Cb 0.04 -0.49 0.43 0.00 0.00 0.00 0.00 32.46 32.44 2jzq n ARG 35 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.63 177.70 2jzq h ARG 36 N 2.37 0.00 -0.95 -0.14 -0.00 -1.83 0.93 114.38 114.76 2jzq h ARG 36 Ca -0.24 0.00 0.27 0.00 -0.00 0.00 0.00 59.98 60.00 2jzq h ARG 36 Cb 1.19 0.00 -0.14 0.00 -0.00 0.00 0.00 29.97 31.02 2jzq h ARG 36 CO 0.01 0.00 0.46 0.78 -0.00 0.00 0.00 179.97 181.22 2jzq h GLY 37 N 0.00 1.76 0.00 0.08 0.00 -1.93 2.42 103.07 105.40 2jzq h GLY 37 Ca 0.28 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2jzq h GLY 37 CO -0.00 -0.37 -0.62 1.39 0.00 0.00 0.00 176.54 176.93 2jzq n ILE 38 N -5.06 1.29 -0.26 2.60 5.41 0.32 -3.21 119.36 120.45 2jzq n ILE 38 Ca 0.26 0.22 0.22 0.00 1.00 0.00 0.00 62.75 64.46 2jzq n ILE 38 Cb 0.80 -2.28 0.55 0.00 -0.71 0.00 0.00 39.64 38.00 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 -0.89 0.61 0.00 1.39 2.07 -1.07 0.38 116.25 118.73 2jzq h VAL 39 Ca 0.00 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2jzq h VAL 39 Cb 0.62 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2jzq h VAL 39 CO 0.00 0.06 -1.01 1.21 0.02 0.00 0.00 177.57 177.85 2jzq n GLU 40 N -4.49 0.53 0.00 1.57 2.13 0.81 -3.53 120.64 117.67 2jzq n GLU 40 Ca 0.21 0.09 0.00 0.00 0.66 0.00 0.00 57.16 58.11 2jzq n GLU 40 Cb 0.80 -1.77 0.00 0.00 0.27 0.00 0.00 31.44 30.74 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 -2.50 0.00 -0.47 5.31 7.27 0.11 -2.46 117.38 124.63 2jzq n GLN 41 Ca 0.00 0.00 0.40 0.00 0.07 0.00 0.00 57.00 57.47 2jzq n GLN 41 Cb 0.52 -0.12 0.67 0.00 2.41 0.00 0.00 30.24 33.72 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 -0.90 0.71 0.00 0.00 3.86 -0.31 -3.43 115.15 115.08 2jzq h HIS 44 Ca -0.02 -0.49 0.00 0.00 -1.16 0.00 0.00 60.37 58.71 2jzq h HIS 44 Cb 0.53 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.96 2jzq h HIS 44 CO 0.10 1.36 0.00 0.45 0.86 0.00 0.00 177.93 180.70 2jzq n SER 45 N -4.01 0.00 -3.70 2.45 2.88 0.93 -5.02 113.62 107.15 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 0.88 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.32 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 3.65 0.01 0.36 2.46 1.09 -1.22 -4.20 121.20 123.34 2jzq s ILE 46 Ca 0.00 -0.65 -0.11 0.00 -1.10 0.00 0.00 60.65 58.79 2jzq s ILE 46 Cb 0.00 -1.58 0.03 0.00 -1.06 0.00 0.00 42.46 39.85 2jzq s ILE 46 CO 0.00 -0.04 0.66 0.00 -0.10 0.00 0.00 174.94 175.47 2jzq s SER 48 N -3.12 1.79 0.36 0.00 0.01 -1.26 -4.13 113.70 107.36 2jzq s SER 48 Ca 0.21 -0.85 0.22 0.00 1.31 0.00 0.00 55.95 56.84 2jzq s SER 48 Cb -0.03 -0.03 1.30 0.00 0.21 0.00 0.00 66.02 67.47 2jzq s SER 48 CO 0.14 -0.22 1.48 0.18 0.41 0.00 0.00 173.24 175.23 2jzq n LEU 49 N 0.39 0.30 -0.35 2.44 7.99 -1.26 0.26 117.00 126.77 2jzq n LEU 49 Ca -0.14 1.50 0.09 0.00 -0.01 0.00 0.00 56.01 57.44 2jzq n LEU 49 Cb 0.58 -0.73 0.26 0.00 -0.11 0.00 0.00 43.42 43.41 2jzq n LEU 49 CO 0.28 -1.67 1.20 0.10 -1.51 0.00 0.00 177.39 175.79 2jzq h TYR 50 N 0.00 1.05 0.23 -1.77 -0.00 -1.98 1.68 116.97 116.19 2jzq h TYR 50 Ca 0.81 0.03 -0.01 0.00 0.00 0.00 0.00 58.73 59.56 2jzq h TYR 50 Cb 2.25 -0.32 0.00 0.00 0.00 0.00 0.00 36.73 38.66 2jzq h TYR 50 CO -0.01 0.34 -0.11 1.96 -0.00 0.00 0.00 178.16 180.34 2jzq h GLN 51 N 0.86 -0.30 -0.02 0.10 4.20 0.32 -2.86 115.11 117.41 2jzq h GLN 51 Ca 0.51 0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.25 2jzq h GLN 51 Cb 0.62 0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.47 2jzq h GLN 51 CO -0.31 0.03 0.28 -0.07 -0.67 0.00 0.00 178.83 178.08 2jzq h LEU 52 N -0.96 0.00 -1.43 1.46 4.07 -0.59 1.01 115.31 118.86 2jzq h LEU 52 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2jzq h LEU 52 Cb 0.47 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.21 2jzq h LEU 52 CO 0.05 0.00 0.00 -0.08 -1.08 0.00 0.00 178.44 177.33 2jzq h GLU 53 N 0.00 0.00 0.00 1.13 4.81 0.27 -2.03 114.58 118.76 2jzq h GLU 53 Ca 0.01 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.07 2jzq h GLU 53 Cb 0.57 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 2jzq h GLU 53 CO -0.00 0.00 -1.34 -2.95 -0.73 0.00 0.00 179.01 173.99 2jzq h ASN 54 N 0.00 0.00 0.06 1.04 7.08 0.10 -3.26 115.58 120.60 2jzq h ASN 54 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2jzq h ASN 54 Cb 0.43 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.67 2jzq h ASN 54 CO 0.00 0.60 -0.00 -1.22 -2.08 0.00 0.00 177.43 174.73 2jzq n TYR 55 N -2.94 0.00 -2.61 4.14 4.01 -0.78 -4.80 117.16 114.18 2jzq n TYR 55 Ca -0.09 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.42 2jzq n TYR 55 Cb 0.84 -0.03 0.09 0.00 -0.31 0.00 0.00 39.34 39.93 2jzq n TYR 55 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40