#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 -1.72 -2.13 0.24 -1.26 -5.06 118.33 108.40 2jzq n VAL 2 Ca 0.00 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.05 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 -0.13 4.43 0.37 -1.34 -0.87 -1.26 -4.81 114.94 111.33 2jzq s ASN 3 Ca 0.00 0.19 0.04 0.00 -1.57 0.00 0.00 52.86 51.51 2jzq s ASN 3 Cb 0.00 -2.54 -0.04 0.00 -0.02 0.00 0.00 41.25 38.66 2jzq s ASN 3 CO 0.00 -3.24 0.11 0.00 -2.57 0.00 0.00 177.10 171.40 2jzq s GLN 4 N 8.15 1.80 -0.46 -0.60 -2.07 -1.26 -4.94 119.66 120.28 2jzq s GLN 4 Ca 0.86 -2.06 -0.20 0.00 -1.82 0.00 0.00 55.36 52.14 2jzq s GLN 4 Cb -0.13 -0.62 0.03 0.00 -1.09 0.00 0.00 33.01 31.20 2jzq s GLN 4 CO 0.12 -0.39 0.62 -1.01 -1.32 0.00 0.00 175.29 173.31 2jzq s HIS 5 N -3.30 3.06 -0.17 9.60 3.76 -1.26 -3.36 115.29 123.62 2jzq s HIS 5 Ca 0.29 -0.23 -0.03 0.00 -0.15 0.00 0.00 55.06 54.94 2jzq s HIS 5 Cb 0.05 -3.37 -0.02 0.00 1.11 0.00 0.00 32.58 30.35 2jzq s HIS 5 CO 0.15 -0.91 -0.07 -1.17 -0.85 0.00 0.00 174.74 171.88 2jzq s LEU 6 N 2.72 2.95 0.39 0.89 2.96 0.90 -4.79 118.68 124.69 2jzq s LEU 6 Ca 0.19 -0.29 0.08 0.00 -0.22 0.00 0.00 54.13 53.89 2jzq s LEU 6 Cb -0.16 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 2jzq s LEU 6 CO 0.16 0.10 0.30 0.00 -1.32 0.00 0.00 176.35 175.59 2jzq n GLY 8 N -1.41 -0.66 0.01 0.00 0.00 -1.26 0.29 105.19 102.16 2jzq n GLY 8 Ca 0.01 0.49 -0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 -0.02 0.45 1.61 0.02 -2.00 -0.09 113.55 113.51 2jzq h SER 9 Ca 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2jzq h SER 9 Cb 0.72 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2jzq h SER 9 CO -0.47 -0.02 0.00 0.47 -1.14 0.00 0.00 176.83 175.67 2jzq n ASP 10 N -2.07 0.52 -0.01 3.07 9.92 0.37 -2.05 116.55 126.31 2jzq n ASP 10 Ca -0.00 0.67 -0.13 0.00 -0.53 0.00 0.00 54.79 54.80 2jzq n ASP 10 Cb 0.01 -0.76 -0.09 0.00 -0.64 0.00 0.00 41.12 39.64 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 0.04 -1.60 0.64 5.85 0.49 0.21 115.31 120.93 2jzq h LEU 11 Ca 0.00 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 2jzq h LEU 11 Cb 0.22 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2jzq h LEU 11 CO 0.00 0.39 -0.21 -0.37 -0.34 0.00 0.00 178.44 177.91 2jzq h VAL 12 N -0.32 1.05 0.53 1.05 -1.51 -0.42 0.62 116.25 117.25 2jzq h VAL 12 Ca 0.01 -0.75 -0.03 0.00 -1.23 0.00 0.00 66.70 64.69 2jzq h VAL 12 Cb 0.38 1.42 0.01 0.00 -2.13 0.00 0.00 31.29 30.96 2jzq h VAL 12 CO 0.00 0.21 -0.25 -0.33 -1.23 0.00 0.00 177.57 175.97 2jzq h GLU 13 N 0.00 -0.69 -0.44 5.19 5.08 -1.26 2.79 114.58 125.25 2jzq h GLU 13 Ca -0.00 0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.49 2jzq h GLU 13 Cb 0.40 0.16 -0.07 0.00 0.50 0.00 0.00 28.75 29.74 2jzq h GLU 13 CO 0.03 -0.45 0.00 0.00 -1.00 0.00 0.00 179.01 177.59 2jzq h ALA 14 N -1.16 0.42 -0.73 3.43 0.00 -0.36 0.86 119.26 121.71 2jzq h ALA 14 Ca -0.07 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2jzq h ALA 14 Cb 0.55 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2jzq h ALA 14 CO 0.12 -0.39 0.30 -0.07 0.00 0.00 0.00 179.25 179.21 2jzq h LEU 15 N 0.12 1.01 -2.61 0.00 3.38 0.28 0.44 115.31 117.92 2jzq h LEU 15 Ca 0.22 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2jzq h LEU 15 Cb 0.32 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2jzq h LEU 15 CO -0.36 0.90 -0.01 0.22 0.09 0.00 0.00 178.44 179.27 2jzq h TYR 16 N 1.05 0.00 0.00 1.13 5.03 0.82 0.46 116.97 125.46 2jzq h TYR 16 Ca 0.25 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.56 2jzq h TYR 16 Cb 0.20 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.48 2jzq h TYR 16 CO 0.02 0.01 -0.26 1.25 -1.32 0.00 0.00 178.16 177.86 2jzq h LEU 17 N 0.00 0.00 -1.64 2.82 5.85 0.32 -1.80 115.31 120.86 2jzq h LEU 17 Ca -0.00 0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.87 2jzq h LEU 17 Cb 0.10 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 2jzq h LEU 17 CO 0.00 0.55 0.48 -0.37 -0.34 0.00 0.00 178.44 178.77 2jzq h VAL 18 N -0.84 0.79 0.00 1.05 -1.51 -0.01 -3.14 116.25 112.59 2jzq h VAL 18 Ca 0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 2jzq h VAL 18 Cb 0.26 0.40 0.00 0.00 -2.13 0.00 0.00 31.29 29.82 2jzq h VAL 18 CO 0.00 0.07 -0.16 0.00 -1.23 0.00 0.00 177.57 176.25 2jzq n GLY 20 N 1.76 0.64 0.00 0.00 0.00 -0.68 -1.71 105.19 105.21 2jzq n GLY 20 Ca -0.02 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.04 0.05 1.61 -0.58 -1.26 -4.70 120.64 115.80 2jzq n GLU 21 Ca 0.00 -0.21 0.10 0.00 -0.42 0.00 0.00 57.16 56.63 2jzq n GLU 21 Cb 0.00 -0.67 0.43 0.00 -0.57 0.00 0.00 31.44 30.62 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 -0.07 0.09 -1.73 3.49 1.74 -0.69 -4.95 116.66 114.54 2jzq n ARG 22 Ca 0.00 0.26 -0.01 0.00 -0.77 0.00 0.00 57.85 57.33 2jzq n ARG 22 Cb 0.11 -1.65 -0.01 0.00 -1.02 0.00 0.00 32.46 29.89 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 0.40 -3.36 2.74 -0.13 0.00 -1.26 -4.45 105.19 99.12 2jzq n GLY 23 Ca 0.04 0.03 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 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 0.30 -2.94 -3.82 1.61 -1.74 -1.26 -1.75 117.46 107.86 2jzq n PHE 24 Ca -0.07 -1.30 -0.06 0.00 -0.56 0.00 0.00 57.45 55.47 2jzq n PHE 24 Cb 0.10 -0.48 -0.00 0.00 1.52 0.00 0.00 39.48 40.62 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 -1.97 -0.08 -0.20 2.97 -0.12 -1.26 -4.75 117.98 112.57 2jzq s PHE 25 Ca 0.46 -0.38 -0.03 0.00 -0.05 0.00 0.00 56.93 56.92 2jzq s PHE 25 Cb -0.03 0.72 -0.01 0.00 -0.63 0.00 0.00 43.02 43.07 2jzq s PHE 25 CO 0.30 -1.17 -0.06 -0.47 -0.05 0.00 0.00 175.22 173.77 2jzq s TYR 26 N -3.22 2.94 0.77 3.49 5.04 -1.26 -4.84 117.35 120.27 2jzq s TYR 26 Ca 0.13 -0.85 -0.12 0.00 -2.44 0.00 0.00 57.07 53.80 2jzq s TYR 26 Cb -0.04 -2.05 0.05 0.00 0.35 0.00 0.00 41.96 40.27 2jzq s TYR 26 CO 0.07 -0.46 1.11 -0.08 -1.34 0.00 0.00 175.55 174.85 2jzq s THR 27 N 1.20 3.00 -0.83 4.34 -1.32 -1.26 -4.15 115.64 116.63 2jzq s THR 27 Ca 0.02 0.33 -0.20 0.00 -1.21 0.00 0.00 61.69 60.63 2jzq s THR 27 Cb -0.14 -3.21 0.03 0.00 -1.51 0.00 0.00 72.50 67.66 2jzq s THR 27 CO -0.02 -0.43 0.49 0.47 -2.21 0.00 0.00 174.62 172.93 2jzq n ASP 28 N -3.27 -3.19 -3.94 8.08 8.00 -1.26 -4.22 116.55 116.74 2jzq n ASP 28 Ca 0.07 -0.92 -0.42 0.00 0.71 0.00 0.00 54.79 54.23 2jzq n ASP 28 Cb 0.58 -1.18 0.00 0.00 -0.02 0.00 0.00 41.12 40.49 2jzq n ASP 28 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2jzq n PRO 29 N -3.54 2.97 0.00 -0.24 -0.04 -1.26 -4.11 135.00 128.78 2jzq n PRO 29 Ca -0.13 -2.81 0.00 0.00 -0.04 0.00 0.00 63.50 60.53 2jzq n PRO 29 Cb 0.45 -3.32 0.00 0.00 -0.04 0.00 0.00 33.50 30.58 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 5.34 0.00 -2.17 0.52 -2.24 -1.26 -5.14 114.28 109.32 2jzq n THR 30 Ca 0.51 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 62.01 2jzq n THR 30 Cb 0.41 0.00 0.17 0.00 -2.10 0.00 0.00 70.33 68.81 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 -1.75 1.79 0.34 3.38 0.00 -1.26 -5.02 107.32 104.81 2jzq s GLY 31 Ca 0.00 -1.50 -0.27 0.00 0.00 0.00 0.00 44.72 42.95 2jzq s GLY 31 CO 0.00 -0.75 1.12 -0.32 0.00 0.00 0.00 173.10 173.15 2jzq s GLY 32 N -4.90 2.93 -1.47 0.20 0.00 -1.26 -3.37 107.32 99.46 2jzq s GLY 32 Ca 0.73 0.89 -0.05 0.00 0.00 0.00 0.00 44.72 46.30 2jzq s GLY 32 CO 0.51 1.44 0.20 0.61 0.00 0.00 0.00 173.10 175.85 2jzq n GLY 33 N 0.82 -0.25 0.18 0.20 0.00 -1.26 -4.81 105.19 100.07 2jzq n GLY 33 Ca 0.02 0.20 -0.20 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.91 0.64 -1.05 1.61 0.13 -1.77 -2.96 132.00 126.69 2jzq h PRO 34 Ca -0.66 -0.75 -0.51 0.00 -0.87 0.00 0.00 66.00 63.21 2jzq h PRO 34 Cb 1.39 0.23 -0.27 0.00 0.13 0.00 0.00 31.00 32.48 2jzq h PRO 34 CO 0.66 1.32 0.66 2.89 -0.23 0.00 0.00 178.00 183.30 2jzq n ARG 35 N -3.81 2.26 0.16 0.86 1.85 -1.26 -4.66 116.66 112.05 2jzq n ARG 35 Ca -0.11 -2.75 0.11 0.00 -1.00 0.00 0.00 57.85 54.10 2jzq n ARG 35 Cb 0.92 -2.08 0.26 0.00 -1.05 0.00 0.00 32.46 30.51 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 1.28 0.00 -0.87 2.89 0.11 -1.88 0.37 114.38 116.28 2jzq h ARG 36 Ca 0.55 0.00 0.23 0.00 0.10 0.00 0.00 59.98 60.86 2jzq h ARG 36 Cb 1.92 0.00 -0.14 0.00 1.11 0.00 0.00 29.97 32.87 2jzq h ARG 36 CO 1.15 0.00 0.24 0.78 0.10 0.00 0.00 179.97 182.24 2jzq h GLY 37 N 0.00 1.34 0.00 0.08 0.00 -1.89 2.15 103.07 104.76 2jzq h GLY 37 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2jzq h GLY 37 CO -0.00 -0.35 -0.67 1.39 0.00 0.00 0.00 176.54 176.91 2jzq n ILE 38 N -5.21 1.43 -0.27 2.60 5.41 0.12 -3.19 119.36 120.26 2jzq n ILE 38 Ca 0.21 0.20 0.21 0.00 1.00 0.00 0.00 62.75 64.36 2jzq n ILE 38 Cb 0.66 -2.37 0.52 0.00 -0.71 0.00 0.00 39.64 37.75 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 -0.99 0.63 0.00 1.39 2.07 -1.23 0.11 116.25 118.23 2jzq h VAL 39 Ca 0.00 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 2jzq h VAL 39 Cb 0.67 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2jzq h VAL 39 CO 0.00 0.07 -1.23 -0.62 0.02 0.00 0.00 177.57 175.81 2jzq n GLU 40 N -4.52 0.62 0.00 1.57 1.02 0.72 -3.72 120.64 116.33 2jzq n GLU 40 Ca 0.21 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 2jzq n GLU 40 Cb 0.77 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 2jzq n GLU 40 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 2jzq n GLN 41 N -2.61 0.00 -0.31 3.49 -0.06 0.28 -2.35 117.38 115.81 2jzq n GLN 41 Ca -0.02 0.00 0.28 0.00 -2.00 0.00 0.00 57.00 55.27 2jzq n GLN 41 Cb 0.58 -0.10 0.52 0.00 -4.06 0.00 0.00 30.24 27.18 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 -0.71 0.18 0.00 0.00 3.86 -0.30 -3.42 115.15 114.76 2jzq h HIS 44 Ca -0.03 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 59.05 2jzq h HIS 44 Cb 0.49 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.96 2jzq h HIS 44 CO 0.05 1.36 0.00 0.45 0.86 0.00 0.00 177.93 180.66 2jzq n SER 45 N -4.29 0.00 -3.61 2.45 2.88 0.88 -5.02 113.62 106.91 2jzq n SER 45 Ca -0.22 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.21 2jzq n SER 45 Cb 0.71 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.14 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 3.48 0.02 0.26 2.46 1.09 -1.21 -4.19 121.20 123.11 2jzq s ILE 46 Ca 0.00 -0.47 -0.20 0.00 -1.10 0.00 0.00 60.65 58.88 2jzq s ILE 46 Cb 0.00 -1.36 0.02 0.00 -1.06 0.00 0.00 42.46 40.06 2jzq s ILE 46 CO 0.00 -0.07 0.67 0.00 -0.10 0.00 0.00 174.94 175.44 2jzq s SER 48 N -2.92 3.79 0.48 0.00 0.15 -1.26 -4.26 113.70 109.69 2jzq s SER 48 Ca 0.12 -1.11 0.36 0.00 0.70 0.00 0.00 55.95 56.01 2jzq s SER 48 Cb -0.05 -0.38 1.51 0.00 -1.71 0.00 0.00 66.02 65.39 2jzq s SER 48 CO 0.05 -0.14 1.64 -0.07 1.20 0.00 0.00 173.24 175.92 2jzq h LEU 49 N 2.05 0.16 -1.28 3.45 3.38 -1.96 2.49 115.31 123.60 2jzq h LEU 49 Ca -0.42 0.08 0.08 0.00 0.09 0.00 0.00 57.88 57.71 2jzq h LEU 49 Cb 1.25 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 42.02 2jzq h LEU 49 CO 0.67 -0.10 0.53 0.10 0.09 0.00 0.00 178.44 179.73 2jzq h TYR 50 N 0.06 0.87 0.52 1.13 -0.00 -1.96 3.32 116.97 120.91 2jzq h TYR 50 Ca 0.81 0.02 -0.03 0.00 0.00 0.00 0.00 58.73 59.54 2jzq h TYR 50 Cb 2.82 -0.29 0.01 0.00 0.00 0.00 0.00 36.73 39.27 2jzq h TYR 50 CO -0.00 0.44 -0.25 1.96 -0.00 0.00 0.00 178.16 180.31 2jzq h GLN 51 N 0.85 -0.67 0.00 0.10 1.08 0.39 -2.84 115.11 114.02 2jzq h GLN 51 Ca 0.36 0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.61 2jzq h GLN 51 Cb 0.30 0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 2jzq h GLN 51 CO -0.13 -0.44 0.00 -0.07 -0.95 0.00 0.00 178.83 177.24 2jzq h LEU 52 N -1.18 0.00 -1.54 1.46 3.38 -1.06 0.17 115.31 116.54 2jzq h LEU 52 Ca -0.07 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 2jzq h LEU 52 Cb 0.54 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2jzq h LEU 52 CO 0.12 0.00 -0.17 -0.08 0.09 0.00 0.00 178.44 178.40 2jzq h GLU 53 N 0.00 0.00 0.00 1.13 4.22 0.64 -2.02 114.58 118.55 2jzq h GLU 53 Ca 0.00 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 59.29 2jzq h GLU 53 Cb 0.08 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2jzq h GLU 53 CO 0.00 0.17 -1.43 0.27 -2.18 0.00 0.00 179.01 175.84 2jzq n ASN 54 N -3.50 0.78 -0.06 1.04 0.23 0.58 -3.78 115.26 110.55 2jzq n ASN 54 Ca -0.01 0.34 0.09 0.00 -0.53 0.00 0.00 54.58 54.47 2jzq n ASN 54 Cb 0.33 0.32 0.53 0.00 -2.08 0.00 0.00 39.78 38.89 2jzq n ASN 54 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 2jzq n TYR 55 N -2.82 0.02 -0.77 -2.53 4.01 -0.78 -4.81 117.16 109.48 2jzq n TYR 55 Ca -0.09 -0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 2jzq n TYR 55 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.83 2jzq n TYR 55 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40