#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ncq s ASN 30 N 0.00 6.33 0.21 4.38 0.02 -1.26 -4.98 114.94 119.64 1ncq s ASN 30 Ca 0.00 0.39 0.23 0.00 -1.02 0.00 0.00 52.86 52.46 1ncq s ASN 30 Cb 0.00 -2.19 0.22 0.00 0.02 0.00 0.00 41.25 39.30 1ncq s ASN 30 CO 0.00 -0.02 1.27 1.88 0.02 0.00 0.00 177.10 180.25 1ncq h TYR 31 N 7.36 0.00 -3.21 2.20 0.05 -1.99 -3.47 116.97 117.92 1ncq h TYR 31 Ca -0.37 0.00 -0.64 0.00 0.05 0.00 0.00 58.73 57.77 1ncq h TYR 31 Cb 1.16 0.00 -0.14 0.00 1.01 0.00 0.00 36.73 38.76 1ncq h TYR 31 CO 0.67 0.00 -0.72 0.71 -1.05 0.00 0.00 178.16 177.77 1ncq s TYR 32 N -3.25 2.69 0.24 4.88 2.02 -1.26 -5.04 117.35 117.63 1ncq s TYR 32 Ca 0.04 -0.19 -0.02 0.00 -0.37 0.00 0.00 57.07 56.53 1ncq s TYR 32 Cb 0.10 -1.35 0.28 0.00 -0.40 0.00 0.00 41.96 40.60 1ncq s TYR 32 CO 0.74 0.48 1.68 -0.22 -1.57 0.00 0.00 175.55 176.66 1ncq h LYS 33 N 3.15 0.68 -6.52 -0.62 3.64 -2.01 -3.45 116.57 111.44 1ncq h LYS 33 Ca -0.48 -0.25 -0.53 0.00 -1.27 0.00 0.00 60.65 58.12 1ncq h LYS 33 Cb 1.19 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 1ncq h LYS 33 CO 0.54 0.83 -0.00 -0.51 -2.27 0.00 0.00 179.45 178.03 1ncq s ASP 34 N -6.75 6.80 0.26 4.20 1.11 -1.26 -4.99 116.67 116.03 1ncq s ASP 34 Ca -0.09 1.15 -0.01 0.00 0.18 0.00 0.00 52.55 53.79 1ncq s ASP 34 Cb 0.14 -2.32 0.33 0.00 1.07 0.00 0.00 42.92 42.14 1ncq s ASP 34 CO 0.82 -0.05 1.73 0.00 1.18 0.00 0.00 175.17 178.85 1ncq h ALA 35 N 2.86 1.07 -0.19 5.23 0.00 -2.00 -2.88 119.26 123.35 1ncq h ALA 35 Ca -0.48 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 54.19 1ncq h ALA 35 Cb 1.18 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1ncq h ALA 35 CO 0.66 0.57 0.18 0.00 0.00 0.00 0.00 179.25 180.67 1ncq h ALA 36 N 1.24 1.93 -0.00 0.00 0.00 -1.98 -1.89 119.26 118.56 1ncq h ALA 36 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ncq h ALA 36 Cb 0.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1ncq h ALA 36 CO 0.03 -0.28 -0.08 -1.13 0.00 0.00 0.00 179.25 177.79 1ncq n SER 37 N -4.02 0.12 -4.78 0.00 3.41 -1.09 -4.87 113.62 102.39 1ncq n SER 37 Ca 0.02 0.18 -0.30 0.00 -0.26 0.00 0.00 58.87 58.50 1ncq n SER 37 Cb 0.31 -0.32 0.09 0.00 -0.26 0.00 0.00 64.21 64.04 1ncq n SER 37 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1ncq s THR 38 N -2.87 3.21 0.75 6.66 -4.23 -0.71 -4.98 115.64 113.47 1ncq s THR 38 Ca 0.18 0.39 -0.13 0.00 -1.18 0.00 0.00 61.69 60.95 1ncq s THR 38 Cb 0.19 -3.02 0.17 0.00 1.34 0.00 0.00 72.50 71.18 1ncq s THR 38 CO 0.54 -0.51 0.99 -1.54 -0.54 0.00 0.00 174.62 173.55 1ncq n SER 39 N -3.50 -0.08 -4.48 3.99 3.41 -1.26 -4.99 113.62 106.71 1ncq n SER 39 Ca 0.07 -1.33 -0.41 0.00 -0.26 0.00 0.00 58.87 56.95 1ncq n SER 39 Cb 0.55 -0.77 0.02 0.00 -0.26 0.00 0.00 64.21 63.75 1ncq n SER 39 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ncq n SER 40 N -3.71 -0.55 0.09 4.04 7.64 -1.26 -4.93 113.62 114.94 1ncq n SER 40 Ca 0.12 0.89 0.03 0.00 1.01 0.00 0.00 58.87 60.92 1ncq n SER 40 Cb 0.44 -1.17 0.43 0.00 -1.01 0.00 0.00 64.21 62.89 1ncq n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ncq h ALA 41 N 0.78 1.62 0.00 -0.43 0.00 -2.03 -3.49 119.26 115.70 1ncq h ALA 41 Ca -0.42 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1ncq h ALA 41 Cb 1.39 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1ncq h ALA 41 CO 0.51 0.29 0.00 0.41 0.00 0.00 0.00 179.25 180.46 1ncq n GLY 42 N -1.14 -0.26 3.61 0.00 0.00 -1.26 -4.94 105.19 101.20 1ncq n GLY 42 Ca 0.00 -1.46 -0.63 0.00 0.00 0.00 0.00 46.02 43.94 1ncq n GLY 42 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1ncq n GLN 43 N 0.44 0.34 -0.31 1.61 7.27 -1.26 -4.84 117.38 120.63 1ncq n GLN 43 Ca 0.00 0.12 0.14 0.00 0.07 0.00 0.00 57.00 57.33 1ncq n GLN 43 Cb 0.00 -1.71 0.32 0.00 2.41 0.00 0.00 30.24 31.27 1ncq n GLN 43 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1ncq h SER 44 N 6.95 0.33 -6.21 1.69 0.87 -2.05 -3.45 113.55 111.67 1ncq h SER 44 Ca -0.36 0.16 -0.45 0.00 -1.23 0.00 0.00 61.79 59.92 1ncq h SER 44 Cb 1.37 0.14 0.01 0.00 -0.44 0.00 0.00 62.40 63.48 1ncq h SER 44 CO 1.00 -0.03 -0.80 -0.11 -0.53 0.00 0.00 176.83 176.37 1ncq n LEU 45 N -5.06 -2.80 0.00 2.23 7.94 -1.26 -4.89 117.00 113.16 1ncq n LEU 45 Ca 0.23 -0.81 0.00 0.00 -1.11 0.00 0.00 56.01 54.32 1ncq n LEU 45 Cb 0.69 -2.59 0.00 0.00 0.53 0.00 0.00 43.42 42.05 1ncq n LEU 45 CO 0.12 0.44 0.00 -1.20 -1.11 0.00 0.00 177.39 175.64 1ncq n SER 46 N -2.95 0.00 -2.67 1.96 7.64 -1.26 -5.11 113.62 111.23 1ncq n SER 46 Ca -0.14 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.74 1ncq n SER 46 Cb 0.61 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 1ncq n SER 46 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1ncq n MET 47 N -1.56 -3.33 -3.51 1.43 2.81 -1.26 -5.05 117.12 106.65 1ncq n MET 47 Ca 0.00 2.69 -0.29 0.00 -1.81 0.00 0.00 57.70 58.29 1ncq n MET 47 Cb 0.00 -5.22 -0.13 0.00 -0.71 0.00 0.00 33.22 27.16 1ncq n MET 47 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1ncq s ASP 48 N -1.60 3.17 0.53 7.83 3.68 -1.26 -5.00 116.67 124.03 1ncq s ASP 48 Ca 0.01 -2.07 0.31 0.00 2.13 0.00 0.00 52.55 52.94 1ncq s ASP 48 Cb -0.00 -0.47 1.40 0.00 -1.45 0.00 0.00 42.92 42.40 1ncq s ASP 48 CO 0.75 -0.33 2.01 1.55 0.13 0.00 0.00 175.17 179.28 1ncq h PRO 49 N 7.25 0.00 -0.92 4.34 0.13 -2.02 -3.32 132.00 137.45 1ncq h PRO 49 Ca 0.00 0.00 0.26 0.00 -0.87 0.00 0.00 66.00 65.40 1ncq h PRO 49 Cb 0.97 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.06 1ncq h PRO 49 CO 0.32 0.08 0.66 0.66 -0.23 0.00 0.00 178.00 179.49 1ncq h SER 50 N 0.00 0.02 0.54 1.44 4.64 -1.95 0.18 113.55 118.43 1ncq h SER 50 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ncq h SER 50 Cb 0.47 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1ncq h SER 50 CO 0.01 0.01 0.00 2.29 -0.87 0.00 0.00 176.83 178.27 1ncq n LYS 51 N -4.28 0.14 -0.05 4.77 2.85 -1.25 -0.25 118.16 120.09 1ncq n LYS 51 Ca 0.19 0.42 -0.06 0.00 -1.05 0.00 0.00 58.31 57.82 1ncq n LYS 51 Cb 0.97 -1.79 -0.05 0.00 -0.65 0.00 0.00 35.03 33.51 1ncq n LYS 51 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1ncq n PHE 52 N -2.06 0.00 0.05 5.58 3.01 0.46 -4.41 117.46 120.09 1ncq n PHE 52 Ca 0.02 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.37 1ncq n PHE 52 Cb 0.18 -0.40 -0.13 0.00 -0.01 0.00 0.00 39.48 39.12 1ncq n PHE 52 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 1ncq h THR 53 N 0.00 1.37 -1.74 4.37 1.35 -0.98 -3.40 112.91 113.89 1ncq h THR 53 Ca -0.23 -3.08 -0.48 0.00 -0.55 0.00 0.00 66.41 62.07 1ncq h THR 53 Cb 1.41 2.74 -0.41 0.00 -1.73 0.00 0.00 68.15 70.17 1ncq h THR 53 CO -0.02 0.83 -1.04 -0.62 -0.25 0.00 0.00 175.52 174.42 1ncq n GLU 54 N -3.33 1.75 -0.85 4.72 1.02 0.65 -4.94 120.64 119.67 1ncq n GLU 54 Ca -0.08 -3.77 -0.09 0.00 -0.02 0.00 0.00 57.16 53.20 1ncq n GLU 54 Cb 1.00 -1.75 -0.09 0.00 -0.02 0.00 0.00 31.44 30.58 1ncq n GLU 54 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1ncq n PRO 55 N -0.00 1.65 -3.79 3.49 -0.04 -1.22 -4.80 135.00 130.29 1ncq n PRO 55 Ca 0.24 -0.76 -0.30 0.00 -0.04 0.00 0.00 63.50 62.63 1ncq n PRO 55 Cb 0.65 -1.62 -0.04 0.00 -0.04 0.00 0.00 33.50 32.45 1ncq n PRO 55 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ncq s VAL 56 N 0.21 5.27 0.03 0.52 -7.23 -1.26 -5.03 120.40 112.91 1ncq s VAL 56 Ca 0.40 -0.24 -0.22 0.00 -1.81 0.00 0.00 61.98 60.11 1ncq s VAL 56 Cb 0.20 -3.65 -0.15 0.00 0.56 0.00 0.00 36.38 33.34 1ncq s VAL 56 CO -0.02 0.04 1.37 0.50 -0.31 0.00 0.00 175.10 176.68 1ncq h LYS 57 N 2.75 0.24 -4.86 4.82 3.64 -2.05 -3.41 116.57 117.69 1ncq h LYS 57 Ca -0.46 -0.11 -0.65 0.00 -1.27 0.00 0.00 60.65 58.16 1ncq h LYS 57 Cb 1.17 -0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.81 1ncq h LYS 57 CO 0.73 0.60 -0.50 -0.51 -2.27 0.00 0.00 179.45 177.49 1ncq s ASP 58 N -5.90 6.04 0.13 4.20 1.01 -1.26 -5.04 116.67 115.85 1ncq s ASP 58 Ca -0.15 -0.12 -0.34 0.00 0.71 0.00 0.00 52.55 52.65 1ncq s ASP 58 Cb 0.04 -2.13 -0.16 0.00 1.01 0.00 0.00 42.92 41.68 1ncq s ASP 58 CO 0.72 -0.10 1.19 -0.11 0.21 0.00 0.00 175.17 177.07 1ncq n LEU 59 N 5.08 1.33 -4.25 1.23 7.94 -1.26 -4.97 117.00 122.10 1ncq n LEU 59 Ca -0.13 1.14 -0.35 0.00 -1.11 0.00 0.00 56.01 55.55 1ncq n LEU 59 Cb 0.51 -1.17 -0.14 0.00 0.53 0.00 0.00 43.42 43.15 1ncq n LEU 59 CO 0.34 -1.34 -0.41 -0.04 -1.11 0.00 0.00 177.39 174.83 1ncq s MET 60 N -0.11 3.17 -0.06 1.96 -1.94 -1.26 -5.10 119.30 115.97 1ncq s MET 60 Ca 0.78 -0.75 -0.24 0.00 -1.71 0.00 0.00 55.69 53.77 1ncq s MET 60 Cb -0.92 -2.95 -0.04 0.00 2.01 0.00 0.00 34.83 32.93 1ncq s MET 60 CO 0.51 -0.26 0.71 -0.51 -0.01 0.00 0.00 175.02 175.46 1ncq s LEU 61 N 1.41 4.32 0.15 -0.03 1.02 -1.26 -5.01 118.68 119.29 1ncq s LEU 61 Ca 0.04 1.22 -0.32 0.00 0.02 0.00 0.00 54.13 55.08 1ncq s LEU 61 Cb -0.15 -3.11 -0.12 0.00 0.02 0.00 0.00 46.19 42.84 1ncq s LEU 61 CO -0.05 -0.11 1.74 1.17 0.02 0.00 0.00 176.35 179.11 1ncq n LYS 62 N 3.74 2.61 0.00 1.70 4.81 -1.26 -1.30 118.16 128.46 1ncq n LYS 62 Ca -0.01 0.94 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 1ncq n LYS 62 Cb 0.51 -2.79 0.00 0.00 0.02 0.00 0.00 35.03 32.77 1ncq n LYS 62 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ncq n GLY 63 N 3.95 2.64 3.82 3.14 0.00 -1.26 -5.05 105.19 112.43 1ncq n GLY 63 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1ncq n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ncq s ALA 64 N -2.72 3.36 -0.01 4.61 0.00 -0.42 -4.97 121.76 121.61 1ncq s ALA 64 Ca 0.00 0.18 -0.35 0.00 0.00 0.00 0.00 51.96 51.79 1ncq s ALA 64 Cb 0.00 -2.86 -0.14 0.00 0.00 0.00 0.00 23.12 20.12 1ncq s ALA 64 CO 0.00 0.31 1.68 -0.35 0.00 0.00 0.00 175.76 177.39 1ncq n PRO 65 N 0.44 1.85 -0.30 0.00 -0.04 -1.26 -4.80 135.00 130.88 1ncq n PRO 65 Ca -0.00 0.67 0.04 0.00 -0.04 0.00 0.00 63.50 64.17 1ncq n PRO 65 Cb 0.51 -2.44 0.19 0.00 -0.04 0.00 0.00 33.50 31.73 1ncq n PRO 65 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ncq h ALA 66 N 7.11 1.24 -3.68 0.55 0.00 -1.93 -3.33 119.26 119.23 1ncq h ALA 66 Ca -0.47 0.04 -0.67 0.00 0.00 0.00 0.00 54.91 53.81 1ncq h ALA 66 Cb 1.28 -0.13 -0.37 0.00 0.00 0.00 0.00 17.79 18.57 1ncq h ALA 66 CO 0.90 0.10 -0.73 -0.51 0.00 0.00 0.00 179.25 179.01 1ncq s LEU 67 N -10.27 4.18 0.00 0.00 1.43 -1.26 -5.08 118.68 107.68 1ncq s LEU 67 Ca -0.12 -1.72 0.28 0.00 -1.03 0.00 0.00 54.13 51.54 1ncq s LEU 67 Cb 0.20 -1.63 1.01 0.00 0.03 0.00 0.00 46.19 45.80 1ncq s LEU 67 CO 0.79 -0.31 1.72 -0.46 0.23 0.00 0.00 176.35 178.33