#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2knv s SER 2 N 0.00 7.00 0.76 1.61 1.04 -1.26 -5.03 113.70 117.82 2knv s SER 2 Ca 0.00 1.83 -0.12 0.00 0.48 0.00 0.00 55.95 58.15 2knv s SER 2 Cb 0.00 -2.55 0.05 0.00 0.10 0.00 0.00 66.02 63.61 2knv s SER 2 CO 0.00 -0.64 1.13 -2.16 0.98 0.00 0.00 173.24 172.55 2knv s PRO 3 N 2.50 2.43 0.53 4.02 0.04 -1.26 -4.92 135.00 138.33 2knv s PRO 3 Ca 0.57 0.36 0.29 0.00 0.04 0.00 0.00 61.00 62.26 2knv s PRO 3 Cb -0.25 -1.98 1.58 0.00 0.04 0.00 0.00 34.50 33.88 2knv s PRO 3 CO 0.21 -1.32 1.87 -1.35 0.04 0.00 0.00 177.00 176.45 2knv h PRO 4 N -0.86 0.00 0.00 0.56 0.11 -2.04 0.15 132.00 129.92 2knv h PRO 4 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2knv h PRO 4 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2knv h PRO 4 CO 0.64 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.36 2knv h GLU 5 N 0.00 0.00 -6.41 1.05 4.39 -2.02 -3.43 114.58 108.16 2knv h GLU 5 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 2knv h GLU 5 Cb 0.34 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.96 2knv h GLU 5 CO 0.00 0.00 0.29 0.00 -1.16 0.00 0.00 179.01 178.14 2knv s ALA 6 N -3.58 3.25 0.08 3.43 0.00 0.04 -5.00 121.76 119.98 2knv s ALA 6 Ca 0.02 0.46 -0.31 0.00 0.00 0.00 0.00 51.96 52.13 2knv s ALA 6 Cb 0.09 -3.20 -0.08 0.00 0.00 0.00 0.00 23.12 19.92 2knv s ALA 6 CO 0.53 -0.07 1.54 0.34 0.00 0.00 0.00 175.76 178.10 2knv s ASP 7 N 0.36 6.69 0.63 0.00 -1.08 -1.26 -4.89 116.67 117.12 2knv s ASP 7 Ca 0.46 2.40 0.41 0.00 -0.52 0.00 0.00 52.55 55.30 2knv s ASP 7 Cb -0.21 -2.57 2.12 0.00 -1.46 0.00 0.00 42.92 40.79 2knv s ASP 7 CO 0.27 -0.81 2.26 1.55 0.52 0.00 0.00 175.17 178.97 2knv h PRO 8 N 7.73 0.00 0.13 4.34 0.13 -1.94 -2.23 132.00 140.16 2knv h PRO 8 Ca -0.41 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.38 2knv h PRO 8 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2knv h PRO 8 CO 0.91 0.00 -1.80 0.00 -0.23 0.00 0.00 178.00 176.89 2knv h ARG 9 N 0.00 0.27 -0.60 0.86 3.08 -1.99 -3.21 114.38 112.79 2knv h ARG 9 Ca -0.00 -0.46 -0.05 0.00 0.07 0.00 0.00 59.98 59.54 2knv h ARG 9 Cb 0.14 0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 2knv h ARG 9 CO 0.00 1.22 0.19 -0.07 -1.07 0.00 0.00 179.97 180.24 2knv h LEU 10 N -0.07 0.84 -0.63 3.04 3.38 -1.88 -2.15 115.31 117.85 2knv h LEU 10 Ca -0.38 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.40 2knv h LEU 10 Cb 1.95 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 42.47 2knv h LEU 10 CO 0.08 0.80 -0.21 -0.29 0.09 0.00 0.00 178.44 178.90 2knv h ILE 11 N 0.88 0.43 0.00 1.22 2.10 -1.57 -2.94 117.51 117.63 2knv h ILE 11 Ca 0.20 -1.28 0.00 0.00 1.08 0.00 0.00 64.86 64.85 2knv h ILE 11 Cb 0.26 1.95 0.00 0.00 -1.09 0.00 0.00 36.82 37.94 2knv h ILE 11 CO -0.01 0.21 0.00 -0.62 -1.08 0.00 0.00 178.15 176.65 2knv n GLU 12 N -3.24 0.17 0.26 2.19 -0.58 -0.82 -2.93 120.64 115.69 2knv n GLU 12 Ca 0.02 0.24 0.08 0.00 -0.42 0.00 0.00 57.16 57.08 2knv n GLU 12 Cb 0.51 -1.74 0.64 0.00 -0.57 0.00 0.00 31.44 30.28 2knv n GLU 12 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 2knv h SER 13 N 0.00 0.00 -0.05 1.62 0.02 -1.39 0.15 113.55 113.91 2knv h SER 13 Ca 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 2knv h SER 13 Cb 0.54 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2knv h SER 13 CO 0.00 0.05 -0.21 -0.07 -1.14 0.00 0.00 176.83 175.47 2knv h LEU 14 N 0.00 0.27 -1.04 5.07 3.38 -1.74 -2.97 115.31 118.27 2knv h LEU 14 Ca -0.00 -0.64 -0.03 0.00 0.09 0.00 0.00 57.88 57.29 2knv h LEU 14 Cb 0.10 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2knv h LEU 14 CO 0.01 0.87 0.27 0.28 0.09 0.00 0.00 178.44 179.96 2knv h SER 15 N -0.31 0.88 -0.94 -0.43 0.02 -1.54 -2.43 113.55 108.78 2knv h SER 15 Ca -0.01 -0.11 0.03 0.00 -0.84 0.00 0.00 61.79 60.86 2knv h SER 15 Cb 0.85 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 63.11 2knv h SER 15 CO 0.04 0.78 0.62 -0.61 -1.14 0.00 0.00 176.83 176.51 2knv h GLN 16 N 0.94 1.17 -0.59 3.45 5.75 -0.73 0.11 115.11 125.22 2knv h GLN 16 Ca 0.22 -0.07 -0.09 0.00 -0.15 0.00 0.00 58.65 58.56 2knv h GLN 16 Cb 0.17 -0.26 -0.02 0.00 1.07 0.00 0.00 27.48 28.43 2knv h GLN 16 CO -0.02 0.77 0.02 0.52 -2.65 0.00 0.00 178.83 177.47 2knv h MET 17 N 1.20 1.03 -0.55 1.69 2.86 -1.28 -2.07 114.93 117.82 2knv h MET 17 Ca 0.37 -0.32 -0.08 0.00 -2.06 0.00 0.00 59.70 57.61 2knv h MET 17 Cb -0.02 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 2knv h MET 17 CO -0.11 1.00 0.03 1.25 1.06 0.00 0.00 176.91 180.14 2knv h LEU 18 N 0.92 0.92 -0.75 1.22 5.85 -1.02 -1.91 115.31 120.55 2knv h LEU 18 Ca 0.17 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.60 2knv h LEU 18 Cb 0.53 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.31 2knv h LEU 18 CO 0.03 0.99 0.00 -1.20 -0.34 0.00 0.00 178.44 177.92 2knv n SER 19 N -4.29 0.63 -0.34 1.25 7.64 0.32 -1.40 113.62 117.43 2knv n SER 19 Ca 0.02 0.67 0.13 0.00 1.01 0.00 0.00 58.87 60.70 2knv n SER 19 Cb 0.31 -0.80 0.43 0.00 -1.01 0.00 0.00 64.21 63.14 2knv n SER 19 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 2knv n MET 20 N -2.21 1.15 -0.51 1.43 0.00 -0.80 -4.92 117.12 111.27 2knv n MET 20 Ca 0.02 -0.68 0.00 0.00 -0.00 0.00 0.00 57.70 57.04 2knv n MET 20 Cb 0.20 -1.49 0.00 0.00 0.00 0.00 0.00 33.22 31.94 2knv n MET 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2knv n GLY 21 N 1.28 0.71 3.41 -5.12 0.00 -0.50 -5.06 105.19 99.92 2knv n GLY 21 Ca 0.15 -0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 2knv n GLY 21 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2knv s PHE 22 N -2.00 3.01 0.21 1.61 5.36 -0.79 -5.03 117.98 120.36 2knv s PHE 22 Ca 0.00 -0.57 -0.07 0.00 -0.96 0.00 0.00 56.93 55.34 2knv s PHE 22 Cb 0.00 -2.09 -0.02 0.00 -0.34 0.00 0.00 43.02 40.57 2knv s PHE 22 CO 0.00 -0.31 0.29 -1.54 -1.46 0.00 0.00 175.22 172.20 2knv s SER 23 N 1.11 0.04 0.22 6.13 1.04 -1.26 -3.60 113.70 117.38 2knv s SER 23 Ca 0.02 -1.14 0.11 0.00 0.48 0.00 0.00 55.95 55.43 2knv s SER 23 Cb -0.14 0.47 -0.05 0.00 0.10 0.00 0.00 66.02 66.40 2knv s SER 23 CO 0.01 -0.97 -0.22 1.51 0.98 0.00 0.00 173.24 174.55 2knv s ASP 24 N -3.08 3.38 -0.25 7.02 1.47 -1.26 -4.94 116.67 119.02 2knv s ASP 24 Ca 0.29 -0.92 -0.12 0.00 1.18 0.00 0.00 52.55 52.99 2knv s ASP 24 Cb 0.03 -0.25 -0.11 0.00 -0.34 0.00 0.00 42.92 42.25 2knv s ASP 24 CO 0.09 0.07 -0.31 -1.84 0.68 0.00 0.00 175.17 173.86 2knv n GLU 25 N -0.02 0.52 -0.05 2.11 -0.00 -1.26 -4.48 120.64 117.46 2knv n GLU 25 Ca -0.10 0.22 0.11 0.00 -0.00 0.00 0.00 57.16 57.40 2knv n GLU 25 Cb 0.57 -1.38 0.44 0.00 -0.00 0.00 0.00 31.44 31.08 2knv n GLU 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2knv n GLY 26 N 1.50 0.10 1.61 -1.84 0.00 -1.26 -4.92 105.19 100.37 2knv n GLY 26 Ca -0.48 -0.40 -0.04 0.00 0.00 0.00 0.00 46.02 45.10 2knv n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2knv n GLY 27 N 1.12 0.39 0.07 -0.02 0.00 -1.26 -4.99 105.19 100.50 2knv n GLY 27 Ca 0.17 -0.40 0.01 0.00 0.00 0.00 0.00 46.02 45.79 2knv n GLY 27 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2knv n TRP 28 N -2.02 0.35 -0.14 1.61 4.27 -1.26 -4.17 117.44 116.08 2knv n TRP 28 Ca -0.04 0.12 -0.12 0.00 -3.89 0.00 0.00 57.50 53.56 2knv n TRP 28 Cb 0.53 -0.87 -0.01 0.00 -1.36 0.00 0.00 31.31 29.60 2knv n TRP 28 CO 0.00 0.00 0.00 1.25 -2.29 0.00 0.00 177.69 176.65 2knv h LEU 29 N 0.00 1.02 -2.10 5.67 5.85 -1.94 0.18 115.31 124.00 2knv h LEU 29 Ca -0.23 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.06 2knv h LEU 29 Cb 1.59 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 42.34 2knv h LEU 29 CO 0.02 1.22 -0.06 0.00 -0.34 0.00 0.00 178.44 179.29 2knv h THR 30 N 0.82 0.28 0.01 1.05 1.03 -2.00 -2.46 112.91 111.65 2knv h THR 30 Ca 0.09 -0.38 -0.34 0.00 -0.01 0.00 0.00 66.41 65.77 2knv h THR 30 Cb 0.87 1.29 -0.06 0.00 -1.07 0.00 0.00 68.15 69.19 2knv h THR 30 CO 0.08 0.06 -2.05 0.54 -0.01 0.00 0.00 175.52 174.13 2knv n ARG 31 N -3.37 0.67 -0.36 0.00 5.12 -0.95 -4.22 116.66 113.55 2knv n ARG 31 Ca -0.02 0.17 -0.02 0.00 -1.93 0.00 0.00 57.85 56.05 2knv n ARG 31 Cb 0.21 -1.66 0.10 0.00 -1.16 0.00 0.00 32.46 29.95 2knv n ARG 31 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2knv h LEU 32 N 0.01 1.10 0.00 0.55 5.85 -0.19 -0.80 115.31 121.82 2knv h LEU 32 Ca -0.42 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.27 2knv h LEU 32 Cb 2.10 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.85 2knv h LEU 32 CO 0.05 0.80 0.00 0.18 -0.34 0.00 0.00 178.44 179.12 2knv n LEU 33 N -4.42 0.00 0.01 2.25 4.77 -1.02 -1.40 117.00 117.19 2knv n LEU 33 Ca 0.11 0.38 -0.14 0.00 -0.03 0.00 0.00 56.01 56.33 2knv n LEU 33 Cb 0.01 -0.38 -0.14 0.00 -2.33 0.00 0.00 43.42 40.59 2knv n LEU 33 CO 0.37 -0.14 -0.55 1.56 -1.33 0.00 0.00 177.39 177.30 2knv h GLN 34 N 0.00 0.13 -0.00 3.23 1.08 -1.32 -2.30 115.11 115.93 2knv h GLN 34 Ca 0.00 -0.22 0.00 0.00 -1.45 0.00 0.00 58.65 56.98 2knv h GLN 34 Cb 0.24 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2knv h GLN 34 CO 0.00 0.85 -0.93 0.25 -0.95 0.00 0.00 178.83 178.05 2knv n THR 35 N -3.27 0.00 -0.32 -0.54 -2.24 -1.08 -4.25 114.28 102.58 2knv n THR 35 Ca -0.21 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2knv n THR 35 Cb 1.04 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 70.20 2knv n THR 35 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2knv n LYS 36 N -1.46 1.74 -0.81 -0.78 5.02 -0.49 -5.12 118.16 116.25 2knv n LYS 36 Ca 0.04 -1.09 0.10 0.00 -2.02 0.00 0.00 58.31 55.35 2knv n LYS 36 Cb 0.33 -0.84 -0.04 0.00 -0.02 0.00 0.00 35.03 34.46 2knv n LYS 36 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2knv n ASN 37 N -0.30 -4.81 -1.42 4.39 5.15 -0.87 -4.25 115.26 113.15 2knv n ASN 37 Ca 0.00 0.63 -0.03 0.00 -0.60 0.00 0.00 54.58 54.58 2knv n ASN 37 Cb 0.30 -2.67 0.01 0.00 -0.53 0.00 0.00 39.78 36.89 2knv n ASN 37 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2knv n TYR 38 N -3.49 0.31 -2.67 1.20 4.02 -1.20 -4.45 117.16 110.89 2knv n TYR 38 Ca -0.03 -1.00 -0.42 0.00 -0.01 0.00 0.00 57.90 56.44 2knv n TYR 38 Cb 0.38 -0.50 -0.03 0.00 -0.02 0.00 0.00 39.34 39.17 2knv n TYR 38 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2knv s ASP 39 N 1.33 6.43 0.26 7.72 -1.08 -1.26 -4.89 116.67 125.18 2knv s ASP 39 Ca 0.06 -0.01 -0.05 0.00 -0.52 0.00 0.00 52.55 52.04 2knv s ASP 39 Cb 0.05 -2.51 0.32 0.00 -1.46 0.00 0.00 42.92 39.31 2knv s ASP 39 CO 0.00 -1.37 1.92 0.40 0.52 0.00 0.00 175.17 176.65 2knv h ILE 40 N 6.12 1.21 0.49 4.11 2.04 -1.96 -1.24 117.51 128.29 2knv h ILE 40 Ca -0.25 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.14 2knv h ILE 40 Cb 1.06 -0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2knv h ILE 40 CO 1.14 0.24 -0.24 1.23 0.00 0.00 0.00 178.15 180.52 2knv h GLY 41 N 1.30 -0.69 1.25 5.37 0.00 -2.00 -2.03 103.07 106.26 2knv h GLY 41 Ca 0.38 0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.97 2knv h GLY 41 CO -0.10 -0.25 0.51 0.00 0.00 0.00 0.00 176.54 176.69 2knv h ALA 42 N -0.36 1.46 0.01 3.60 0.00 -1.93 -0.42 119.26 121.62 2knv h ALA 42 Ca -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2knv h ALA 42 Cb 0.57 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2knv h ALA 42 CO 0.11 0.50 -0.02 0.00 0.00 0.00 0.00 179.25 179.84 2knv h ALA 43 N 1.53 -0.02 -0.17 0.00 0.00 -1.11 0.12 119.26 119.61 2knv h ALA 43 Ca 0.28 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.10 2knv h ALA 43 Cb -0.11 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2knv h ALA 43 CO -0.06 -0.52 -0.31 -0.07 0.00 0.00 0.00 179.25 178.29 2knv h LEU 44 N -0.03 0.34 -0.79 0.00 4.07 -1.01 -2.86 115.31 115.03 2knv h LEU 44 Ca 0.00 -0.12 -0.13 0.00 0.08 0.00 0.00 57.88 57.71 2knv h LEU 44 Cb 0.04 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.67 2knv h LEU 44 CO -0.01 0.64 -0.56 -0.78 -1.08 0.00 0.00 178.44 176.66 2knv h ASP 45 N 0.30 0.15 -0.24 -0.43 3.58 -0.69 -2.43 116.42 116.66 2knv h ASP 45 Ca 0.04 -0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.40 2knv h ASP 45 Cb 0.70 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 2knv h ASP 45 CO 0.05 0.68 0.12 0.74 -2.88 0.00 0.00 179.24 177.95 2knv h THR 46 N 0.11 1.11 -0.33 2.25 2.02 -0.52 -2.13 112.91 115.42 2knv h THR 46 Ca -0.00 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.85 2knv h THR 46 Cb 1.02 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 2knv h THR 46 CO 0.08 0.13 0.00 2.30 0.37 0.00 0.00 175.52 178.40 2knv n ILE 47 N -4.43 0.65 0.00 3.11 -5.35 -1.17 -4.98 119.36 107.19 2knv n ILE 47 Ca 0.01 -0.83 0.00 0.00 -0.27 0.00 0.00 62.75 61.67 2knv n ILE 47 Cb 0.12 0.79 0.00 0.00 -1.74 0.00 0.00 39.64 38.81 2knv n ILE 47 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2knv n GLN 48 N 0.93 0.00 -1.82 6.28 1.13 -0.80 -4.84 117.38 118.26 2knv n GLN 48 Ca 0.14 0.00 -0.25 0.00 -1.94 0.00 0.00 57.00 54.95 2knv n GLN 48 Cb 0.47 -0.37 -0.08 0.00 0.11 0.00 0.00 30.24 30.36 2knv n GLN 48 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2knv n TYR 49 N 0.00 2.03 0.05 1.08 4.01 -1.24 -4.52 117.16 118.57 2knv n TYR 49 Ca 0.00 -1.04 0.11 0.00 -0.16 0.00 0.00 57.90 56.81 2knv n TYR 49 Cb 0.00 -2.52 -0.17 0.00 -0.31 0.00 0.00 39.34 36.34 2knv n TYR 49 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2knv n SER 50 N 15.74 0.12 0.00 7.72 7.64 -1.26 -4.79 113.62 138.80 2knv n SER 50 Ca 0.44 -0.06 -0.01 0.00 1.01 0.00 0.00 58.87 60.25 2knv n SER 50 Cb 0.46 1.93 -0.00 0.00 -1.01 0.00 0.00 64.21 65.59 2knv n SER 50 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2knv n LYS 51 N -2.21 0.04 0.00 1.43 5.02 -1.26 -5.08 118.16 116.10 2knv n LYS 51 Ca -0.03 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2knv n LYS 51 Cb 0.55 -0.30 0.00 0.00 -0.02 0.00 0.00 35.03 35.26 2knv n LYS 51 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46