#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 -2.27 1.97 3.14 -1.26 -4.58 118.33 115.33 2jzq n VAL 2 Ca 0.00 0.00 -0.34 0.00 -2.96 0.00 0.00 64.34 61.04 2jzq n VAL 2 Cb 0.00 -0.15 -0.04 0.00 -1.06 0.00 0.00 33.84 32.59 2jzq n VAL 2 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 2jzq s ASN 3 N -0.57 5.72 0.34 6.55 -0.87 -1.26 -4.72 114.94 120.13 2jzq s ASN 3 Ca 0.00 -0.80 0.04 0.00 -1.57 0.00 0.00 52.86 50.53 2jzq s ASN 3 Cb 0.00 -2.56 -0.04 0.00 -0.02 0.00 0.00 41.25 38.63 2jzq s ASN 3 CO 0.00 -2.19 0.14 0.00 -2.57 0.00 0.00 177.10 172.48 2jzq s GLN 4 N 6.19 1.71 -0.37 -0.60 -2.07 -1.26 -4.96 119.66 118.30 2jzq s GLN 4 Ca 0.58 -2.00 -0.18 0.00 -1.82 0.00 0.00 55.36 51.95 2jzq s GLN 4 Cb -0.05 -0.36 0.00 0.00 -1.09 0.00 0.00 33.01 31.51 2jzq s GLN 4 CO 0.00 -0.43 0.49 -1.01 -1.32 0.00 0.00 175.29 173.02 2jzq s HIS 5 N -3.43 3.17 -0.06 9.60 3.76 -1.26 -3.34 115.29 123.73 2jzq s HIS 5 Ca 0.32 0.02 0.05 0.00 -0.15 0.00 0.00 55.06 55.30 2jzq s HIS 5 Cb 0.05 -2.93 -0.02 0.00 1.11 0.00 0.00 32.58 30.79 2jzq s HIS 5 CO 0.16 -0.59 -0.21 -1.17 -0.85 0.00 0.00 174.74 172.08 2jzq s LEU 6 N 2.34 2.29 -0.11 0.89 2.96 0.81 -4.85 118.68 123.01 2jzq s LEU 6 Ca 0.17 -0.42 -0.02 0.00 -0.22 0.00 0.00 54.13 53.64 2jzq s LEU 6 Cb -0.16 -1.44 0.04 0.00 0.50 0.00 0.00 46.19 45.13 2jzq s LEU 6 CO 0.14 0.26 0.01 0.00 -1.32 0.00 0.00 176.35 175.44 2jzq n GLY 8 N 5.12 0.49 0.05 0.00 0.00 -1.26 -2.47 105.19 107.12 2jzq n GLY 8 Ca -0.08 0.03 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 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 1.04 -0.13 0.29 1.61 7.64 -1.26 0.24 113.62 123.04 2jzq n SER 9 Ca 0.00 0.93 0.18 0.00 1.01 0.00 0.00 58.87 60.99 2jzq n SER 9 Cb 0.00 -0.38 0.81 0.00 -1.01 0.00 0.00 64.21 63.63 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 -0.08 6.43 3.32 -1.86 -2.45 116.42 121.78 2jzq h ASP 10 Ca 0.02 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 2jzq h ASP 10 Cb 0.05 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 2jzq h ASP 10 CO -0.12 0.00 0.02 0.25 -1.72 0.00 0.00 179.24 177.67 2jzq h LEU 11 N 0.00 0.13 -1.50 1.55 5.85 0.29 0.31 115.31 121.94 2jzq h LEU 11 Ca -0.00 -0.24 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 2jzq h LEU 11 Cb 0.40 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2jzq h LEU 11 CO 0.00 0.33 -0.25 -0.37 -0.34 0.00 0.00 178.44 177.81 2jzq h VAL 12 N -0.08 0.98 0.15 1.05 -1.51 0.14 0.55 116.25 117.52 2jzq h VAL 12 Ca 0.03 -0.94 -0.01 0.00 -1.23 0.00 0.00 66.70 64.55 2jzq h VAL 12 Cb 0.26 1.54 0.00 0.00 -2.13 0.00 0.00 31.29 30.95 2jzq h VAL 12 CO 0.00 0.25 -0.07 -0.08 -1.23 0.00 0.00 177.57 176.44 2jzq h GLU 13 N 0.00 -0.19 -0.25 5.19 4.81 -1.04 2.54 114.58 125.64 2jzq h GLU 13 Ca -0.00 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.27 2jzq h GLU 13 Cb 0.52 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 2jzq h GLU 13 CO 0.03 0.26 0.08 0.00 -0.73 0.00 0.00 179.01 178.65 2jzq h ALA 14 N -0.13 0.27 -0.67 2.92 0.00 -0.15 0.34 119.26 121.85 2jzq h ALA 14 Ca -0.02 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2jzq h ALA 14 Cb 0.53 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2jzq h ALA 14 CO 0.03 -0.33 0.21 -0.07 0.00 0.00 0.00 179.25 179.09 2jzq h LEU 15 N 0.19 0.95 -2.65 0.00 3.38 0.11 0.22 115.31 117.52 2jzq h LEU 15 Ca 0.11 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2jzq h LEU 15 Cb 0.08 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 2jzq h LEU 15 CO -0.11 0.89 -0.00 0.22 0.09 0.00 0.00 178.44 179.52 2jzq h TYR 16 N 0.99 0.00 0.00 1.13 3.20 0.62 0.16 116.97 123.06 2jzq h TYR 16 Ca 0.22 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.09 2jzq h TYR 16 Cb 0.28 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.55 2jzq h TYR 16 CO 0.02 0.00 -0.25 -0.07 -1.64 0.00 0.00 178.16 176.22 2jzq h LEU 17 N 0.00 0.00 -1.77 2.82 4.07 0.23 -0.62 115.31 120.04 2jzq h LEU 17 Ca -0.00 0.00 0.31 0.00 0.08 0.00 0.00 57.88 58.27 2jzq h LEU 17 Cb 0.11 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.79 2jzq h LEU 17 CO 0.00 0.45 0.76 -0.37 -1.08 0.00 0.00 178.44 178.20 2jzq h VAL 18 N -0.64 0.47 0.00 1.22 -1.51 -0.53 -3.09 116.25 112.17 2jzq h VAL 18 Ca 0.00 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.42 2jzq h VAL 18 Cb 0.25 0.32 0.00 0.00 -2.13 0.00 0.00 31.29 29.73 2jzq h VAL 18 CO 0.00 0.03 0.00 0.00 -1.23 0.00 0.00 177.57 176.37 2jzq n GLY 20 N 1.99 -0.22 0.00 0.00 0.00 -0.24 -2.46 105.19 104.26 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 -1.92 0.00 0.00 1.61 1.02 -1.26 -4.95 120.64 115.14 2jzq n GLU 21 Ca -0.02 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.21 2jzq n GLU 21 Cb 0.31 0.00 0.45 0.00 -0.02 0.00 0.00 31.44 32.18 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 0.29 -2.42 3.49 1.74 -1.03 -4.93 116.66 113.81 2jzq n ARG 22 Ca 0.00 0.11 -0.01 0.00 -0.77 0.00 0.00 57.85 57.18 2jzq n ARG 22 Cb 0.00 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 29.94 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 0.18 -4.09 3.98 -0.13 0.00 -1.26 -4.12 105.19 99.75 2jzq n GLY 23 Ca 0.09 0.43 -0.25 0.00 0.00 0.00 0.00 46.02 46.29 2jzq n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jzq s PHE 24 N -1.16 1.54 0.06 1.61 -0.71 -1.26 -2.52 117.98 115.54 2jzq s PHE 24 Ca -0.03 -0.12 -0.26 0.00 -1.04 0.00 0.00 56.93 55.47 2jzq s PHE 24 Cb 0.00 -3.32 0.09 0.00 -1.21 0.00 0.00 43.02 38.58 2jzq s PHE 24 CO 0.60 -2.01 0.75 -0.59 -1.34 0.00 0.00 175.22 172.63 2jzq s PHE 25 N -3.37 -0.46 -0.36 3.49 -0.71 -1.26 -4.81 117.98 110.50 2jzq s PHE 25 Ca 0.69 0.37 -0.20 0.00 -1.04 0.00 0.00 56.93 56.74 2jzq s PHE 25 Cb -0.05 0.53 0.00 0.00 -1.21 0.00 0.00 43.02 42.30 2jzq s PHE 25 CO 0.47 -0.68 0.64 -0.47 -1.34 0.00 0.00 175.22 173.84 2jzq s TYR 26 N -3.13 3.14 0.00 3.49 6.14 -1.26 -4.78 117.35 120.95 2jzq s TYR 26 Ca 0.01 0.32 0.00 0.00 0.64 0.00 0.00 57.07 58.05 2jzq s TYR 26 Cb -0.01 -3.15 0.00 0.00 0.42 0.00 0.00 41.96 39.22 2jzq s TYR 26 CO -0.09 -0.64 0.00 -2.37 0.64 0.00 0.00 175.55 173.09 2jzq n THR 27 N 5.61 0.00 -3.71 4.34 5.66 -1.26 -4.46 114.28 120.45 2jzq n THR 27 Ca -0.01 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.73 2jzq n THR 27 Cb 0.49 -1.82 0.01 0.00 -1.55 0.00 0.00 70.33 67.45 2jzq n THR 27 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2jzq n ASP 28 N -1.66 -3.48 -3.94 1.09 8.00 -1.26 -4.57 116.55 110.72 2jzq n ASP 28 Ca 0.00 -0.86 -0.41 0.00 0.71 0.00 0.00 54.79 54.22 2jzq n ASP 28 Cb 0.00 -1.22 -0.02 0.00 -0.02 0.00 0.00 41.12 39.85 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 -2.94 2.43 0.00 -0.24 -0.04 -1.26 -4.24 135.00 128.70 2jzq n PRO 29 Ca -0.19 -2.51 0.00 0.00 -0.04 0.00 0.00 63.50 60.77 2jzq n PRO 29 Cb 0.50 -3.27 0.00 0.00 -0.04 0.00 0.00 33.50 30.69 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 5.84 0.00 0.00 0.52 -2.24 -1.26 -5.17 114.28 111.97 2jzq n THR 30 Ca 0.50 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.28 2jzq n THR 30 Cb 0.41 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 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 1.68 2.55 2.62 3.38 0.00 -1.26 -5.04 105.19 109.12 2jzq n GLY 31 Ca 0.00 -1.28 -0.00 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.32 -0.96 4.01 -0.02 0.00 -1.26 -3.69 105.19 101.95 2jzq n GLY 32 Ca 0.00 0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.54 -0.82 0.12 -0.02 0.00 -1.26 -4.85 105.19 96.81 2jzq n GLY 33 Ca -0.00 0.35 -0.16 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.46 0.29 -0.77 1.61 0.13 -1.83 -2.99 132.00 125.98 2jzq h PRO 34 Ca -0.70 -0.31 -0.09 0.00 -0.87 0.00 0.00 66.00 64.02 2jzq h PRO 34 Cb 1.40 0.09 -0.06 0.00 0.13 0.00 0.00 31.00 32.56 2jzq h PRO 34 CO 0.52 1.01 0.12 0.54 -0.23 0.00 0.00 178.00 179.96 2jzq n ARG 35 N -4.36 3.37 -0.25 0.86 1.74 -1.26 -4.58 116.66 112.17 2jzq n ARG 35 Ca -0.10 -2.27 0.30 0.00 -0.77 0.00 0.00 57.85 55.01 2jzq n ARG 35 Cb 0.59 -2.01 0.46 0.00 -1.02 0.00 0.00 32.46 30.47 2jzq n ARG 35 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2jzq n ARG 36 N 0.17 0.01 -0.31 5.56 -4.01 -1.13 0.15 116.66 117.10 2jzq n ARG 36 Ca 0.26 1.01 0.15 0.00 -1.04 0.00 0.00 57.85 58.23 2jzq n ARG 36 Cb 1.05 -2.50 0.33 0.00 -3.04 0.00 0.00 32.46 28.30 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 1.58 0.00 2.89 0.00 -1.87 2.21 103.07 107.88 2jzq h GLY 37 Ca 0.52 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.70 2jzq h GLY 37 CO -0.01 -0.32 -0.67 1.39 0.00 0.00 0.00 176.54 176.93 2jzq n ILE 38 N -5.08 1.34 -0.08 2.60 5.41 0.39 -3.43 119.36 120.50 2jzq n ILE 38 Ca 0.23 0.21 0.22 0.00 1.00 0.00 0.00 62.75 64.41 2jzq n ILE 38 Cb 0.71 -2.30 0.67 0.00 -0.71 0.00 0.00 39.64 38.01 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 -0.92 0.68 0.00 1.39 2.07 -1.07 0.11 116.25 118.52 2jzq h VAL 39 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2jzq h VAL 39 Cb 0.67 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2jzq h VAL 39 CO 0.00 0.01 -1.19 1.21 0.02 0.00 0.00 177.57 177.62 2jzq n GLU 40 N -4.36 0.41 0.00 1.57 2.13 0.74 -3.86 120.64 117.27 2jzq n GLU 40 Ca 0.13 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.94 2jzq n GLU 40 Cb 0.71 -1.63 0.00 0.00 0.27 0.00 0.00 31.44 30.79 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 -2.15 0.00 -0.53 5.31 -0.06 0.33 -3.13 117.38 117.15 2jzq n GLN 41 Ca 0.01 0.00 0.43 0.00 -2.00 0.00 0.00 57.00 55.44 2jzq n GLN 41 Cb 0.48 0.00 0.74 0.00 -4.06 0.00 0.00 30.24 27.40 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 -0.97 0.17 0.00 0.00 3.86 -0.68 -3.42 115.15 114.10 2jzq h HIS 44 Ca -0.05 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.03 2jzq h HIS 44 Cb 0.54 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.01 2jzq h HIS 44 CO 0.02 1.26 0.00 0.45 0.86 0.00 0.00 177.93 180.52 2jzq n SER 45 N -4.37 0.00 -3.88 2.45 2.88 0.71 -5.03 113.62 106.38 2jzq n SER 45 Ca -0.18 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.26 2jzq n SER 45 Cb 0.65 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.06 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 2.89 0.04 0.00 2.46 1.09 -1.18 -4.14 121.20 122.37 2jzq s ILE 46 Ca 0.00 -1.16 0.00 0.00 -1.10 0.00 0.00 60.65 58.39 2jzq s ILE 46 Cb 0.00 -1.78 0.00 0.00 -1.06 0.00 0.00 42.46 39.62 2jzq s ILE 46 CO 0.00 -0.20 0.00 0.00 -0.10 0.00 0.00 174.94 174.64 2jzq s SER 48 N -0.23 -0.41 0.42 0.00 0.01 -1.26 -4.25 113.70 107.99 2jzq s SER 48 Ca 0.00 0.05 0.30 0.00 1.31 0.00 0.00 55.95 57.61 2jzq s SER 48 Cb 0.00 0.50 1.46 0.00 0.21 0.00 0.00 66.02 68.19 2jzq s SER 48 CO 0.00 -0.78 1.57 0.18 0.41 0.00 0.00 173.24 174.62 2jzq n LEU 49 N 0.18 0.25 -0.13 2.44 7.99 -1.26 0.21 117.00 126.68 2jzq n LEU 49 Ca -0.18 1.46 -0.07 0.00 -0.01 0.00 0.00 56.01 57.22 2jzq n LEU 49 Cb 0.62 -0.72 0.02 0.00 -0.11 0.00 0.00 43.42 43.23 2jzq n LEU 49 CO 0.18 -1.60 1.00 0.10 -1.51 0.00 0.00 177.39 175.56 2jzq h TYR 50 N 0.00 0.40 -0.19 -1.77 -0.00 -1.97 2.69 116.97 116.14 2jzq h TYR 50 Ca 0.88 0.02 -0.19 0.00 0.00 0.00 0.00 58.73 59.43 2jzq h TYR 50 Cb 2.71 -0.12 0.01 0.00 0.00 0.00 0.00 36.73 39.32 2jzq h TYR 50 CO -0.01 0.22 -0.64 0.37 -0.00 0.00 0.00 178.16 178.10 2jzq h GLN 51 N 0.44 0.77 0.00 0.10 4.15 0.22 -2.89 115.11 117.91 2jzq h GLN 51 Ca 0.17 -0.57 0.00 0.00 0.77 0.00 0.00 58.65 59.02 2jzq h GLN 51 Cb 0.05 0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.84 2jzq h GLN 51 CO -0.10 1.19 0.00 1.28 -1.93 0.00 0.00 178.83 179.27 2jzq n LEU 52 N -4.03 0.76 0.18 -2.39 4.32 0.43 -2.62 117.00 113.65 2jzq n LEU 52 Ca -0.06 0.61 0.05 0.00 -0.02 0.00 0.00 56.01 56.58 2jzq n LEU 52 Cb 0.67 -0.41 0.26 0.00 -1.62 0.00 0.00 43.42 42.32 2jzq n LEU 52 CO 0.51 -0.32 0.62 -0.08 -1.22 0.00 0.00 177.39 176.90 2jzq h GLU 53 N 0.00 0.00 0.00 3.23 4.81 0.49 -2.69 114.58 120.43 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 0.60 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.98 2jzq h GLU 53 CO 0.00 0.41 -0.57 0.09 -0.73 0.00 0.00 179.01 178.20 2jzq n ASN 54 N -3.43 0.55 -0.27 1.04 3.02 -1.08 -3.48 115.26 111.61 2jzq n ASN 54 Ca 0.00 -0.20 0.14 0.00 -0.03 0.00 0.00 54.58 54.50 2jzq n ASN 54 Cb 0.57 0.29 0.55 0.00 -0.61 0.00 0.00 39.78 40.59 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 -1.64 0.00 -2.17 3.10 4.01 -1.02 -4.86 117.16 114.57 2jzq n TYR 55 Ca 0.05 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.77 2jzq n TYR 55 Cb 0.36 -0.08 0.01 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