#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 6.15 0.46 1.61 1.04 -1.26 -5.07 113.70 116.63 2knv s SER 2 Ca 0.00 -0.86 -0.22 0.00 0.48 0.00 0.00 55.95 55.35 2knv s SER 2 Cb 0.00 -2.19 -0.08 0.00 0.10 0.00 0.00 66.02 63.85 2knv s SER 2 CO 0.00 -0.52 1.10 -2.16 0.98 0.00 0.00 173.24 172.64 2knv s PRO 3 N 1.86 3.82 0.32 4.02 0.04 -1.26 -4.93 135.00 138.87 2knv s PRO 3 Ca 0.08 1.60 0.24 0.00 0.04 0.00 0.00 61.00 62.95 2knv s PRO 3 Cb -0.19 -2.33 1.16 0.00 0.04 0.00 0.00 34.50 33.19 2knv s PRO 3 CO 0.11 -0.45 1.72 -1.35 0.04 0.00 0.00 177.00 177.06 2knv h PRO 4 N 1.96 0.00 -0.00 0.56 0.11 -2.04 -1.11 132.00 131.47 2knv h PRO 4 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2knv h PRO 4 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2knv h PRO 4 CO 0.60 0.00 -0.06 0.39 -0.21 0.00 0.00 178.00 178.72 2knv n GLU 5 N -2.31 0.94 -2.99 1.05 -0.58 -1.26 -4.78 120.64 110.72 2knv n GLU 5 Ca -0.00 -0.31 -0.41 0.00 -0.42 0.00 0.00 57.16 56.02 2knv n GLU 5 Cb 0.11 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.44 2knv n GLU 5 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2knv s ALA 6 N -2.27 3.55 0.11 0.62 0.00 -0.42 -5.01 121.76 118.34 2knv s ALA 6 Ca 0.35 -0.13 -0.31 0.00 0.00 0.00 0.00 51.96 51.87 2knv s ALA 6 Cb 0.21 -3.12 -0.10 0.00 0.00 0.00 0.00 23.12 20.10 2knv s ALA 6 CO 0.42 -0.65 1.78 0.34 0.00 0.00 0.00 175.76 177.65 2knv s ASP 7 N 1.21 6.47 0.58 0.00 -1.08 -1.26 -4.87 116.67 117.72 2knv s ASP 7 Ca 0.33 2.69 0.39 0.00 -0.52 0.00 0.00 52.55 55.44 2knv s ASP 7 Cb -0.16 -2.57 2.01 0.00 -1.46 0.00 0.00 42.92 40.75 2knv s ASP 7 CO 0.11 -0.97 2.18 1.55 0.52 0.00 0.00 175.17 178.55 2knv h PRO 8 N 8.52 0.00 0.02 4.34 0.13 -1.94 -2.01 132.00 141.05 2knv h PRO 8 Ca -0.45 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.34 2knv h PRO 8 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 2knv h PRO 8 CO 0.94 0.00 -2.02 0.54 -0.23 0.00 0.00 178.00 177.24 2knv n ARG 9 N -2.92 0.67 0.02 0.86 1.74 -1.26 -3.83 116.66 111.94 2knv n ARG 9 Ca -0.02 0.19 -0.03 0.00 -0.77 0.00 0.00 57.85 57.23 2knv n ARG 9 Cb 0.11 -1.68 0.22 0.00 -1.02 0.00 0.00 32.46 30.09 2knv n ARG 9 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2knv h LEU 10 N 0.01 0.46 -0.34 0.55 5.85 -1.77 -1.71 115.31 118.36 2knv h LEU 10 Ca -0.41 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.16 2knv h LEU 10 Cb 2.07 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.98 2knv h LEU 10 CO 0.05 0.70 0.00 0.00 -0.34 0.00 0.00 178.44 178.85 2knv n ILE 11 N -4.13 0.70 0.35 4.05 3.06 -0.85 -2.68 119.36 119.87 2knv n ILE 11 Ca -0.00 -0.03 0.14 0.00 -2.50 0.00 0.00 62.75 60.36 2knv n ILE 11 Cb 0.39 -0.86 0.55 0.00 0.54 0.00 0.00 39.64 40.26 2knv n ILE 11 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 2knv h GLU 12 N 0.00 0.00 -0.42 9.51 4.39 -1.41 -2.91 114.58 123.74 2knv h GLU 12 Ca 0.00 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.75 2knv h GLU 12 Cb 0.55 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 2knv h GLU 12 CO 0.00 0.00 0.28 0.77 -1.16 0.00 0.00 179.01 178.90 2knv h SER 13 N 0.00 0.31 -0.01 1.42 0.02 -1.59 0.49 113.55 114.19 2knv h SER 13 Ca 0.00 -0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 2knv h SER 13 Cb 0.49 -0.07 0.01 0.00 0.14 0.00 0.00 62.40 62.97 2knv h SER 13 CO 0.00 0.21 -0.51 -0.07 -1.14 0.00 0.00 176.83 175.32 2knv h LEU 14 N 0.36 0.46 -0.83 5.07 4.07 -1.75 -3.11 115.31 119.58 2knv h LEU 14 Ca 0.18 -0.75 -0.08 0.00 0.08 0.00 0.00 57.88 57.30 2knv h LEU 14 Cb 0.27 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.85 2knv h LEU 14 CO -0.04 1.16 -0.04 0.77 -1.08 0.00 0.00 178.44 179.21 2knv h SER 15 N -0.18 0.81 -0.47 -0.43 4.64 -1.48 -2.67 113.55 113.77 2knv h SER 15 Ca -0.06 -0.22 0.04 0.00 -0.47 0.00 0.00 61.79 61.08 2knv h SER 15 Cb 1.23 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 63.06 2knv h SER 15 CO 0.10 0.90 0.23 -0.61 -0.87 0.00 0.00 176.83 176.58 2knv h GLN 16 N 0.77 0.44 -0.52 4.77 5.75 -0.11 0.28 115.11 126.49 2knv h GLN 16 Ca 0.14 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.57 2knv h GLN 16 Cb 0.52 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.95 2knv h GLN 16 CO 0.03 0.29 0.16 0.52 -2.65 0.00 0.00 178.83 177.18 2knv h MET 17 N 0.45 0.81 0.03 1.69 2.86 -1.45 -0.61 114.93 118.71 2knv h MET 17 Ca 0.21 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2knv h MET 17 Cb 0.13 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.67 2knv h MET 17 CO -0.15 0.75 -0.01 1.25 1.06 0.00 0.00 176.91 179.80 2knv h LEU 18 N 0.71 -0.03 -1.92 1.22 5.85 -1.06 0.83 115.31 120.91 2knv h LEU 18 Ca 0.17 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2knv h LEU 18 Cb 0.28 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 2knv h LEU 18 CO -0.00 0.08 -0.12 0.28 -0.34 0.00 0.00 178.44 178.33 2knv h SER 19 N -0.14 0.00 1.44 1.25 0.02 -0.36 -0.52 113.55 115.24 2knv h SER 19 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2knv h SER 19 Cb 0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2knv h SER 19 CO 0.01 0.12 0.00 -0.03 -1.14 0.00 0.00 176.83 175.79 2knv h MET 20 N 0.00 0.00 0.00 3.45 1.85 -0.65 -3.47 114.93 116.12 2knv h MET 20 Ca -0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 2knv h MET 20 Cb 0.31 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.34 2knv h MET 20 CO 0.02 0.00 0.00 0.41 -0.40 0.00 0.00 176.91 176.94 2knv n GLY 21 N 0.87 1.04 3.48 1.39 0.00 -0.20 -5.07 105.19 106.69 2knv n GLY 21 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 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 3.11 -0.29 1.61 2.19 0.24 -5.01 117.98 117.84 2knv s PHE 22 Ca 0.00 -0.32 -0.14 0.00 0.33 0.00 0.00 56.93 56.80 2knv s PHE 22 Cb 0.00 -2.24 0.10 0.00 -1.31 0.00 0.00 43.02 39.57 2knv s PHE 22 CO 0.00 -0.30 0.70 -1.12 1.83 0.00 0.00 175.22 176.34 2knv s SER 23 N 1.53 -0.98 0.48 6.13 0.01 -1.26 -3.44 113.70 116.17 2knv s SER 23 Ca 0.06 1.47 0.08 0.00 1.31 0.00 0.00 55.95 58.87 2knv s SER 23 Cb -0.15 1.71 0.02 0.00 0.21 0.00 0.00 66.02 67.81 2knv s SER 23 CO 0.04 -0.22 0.52 1.51 0.41 0.00 0.00 173.24 175.50 2knv s ASP 24 N 2.08 5.11 -0.04 2.44 -4.77 -1.26 -5.06 116.67 115.17 2knv s ASP 24 Ca -0.08 -0.79 0.03 0.00 -3.30 0.00 0.00 52.55 48.41 2knv s ASP 24 Cb -0.07 -0.20 -0.05 0.00 -1.09 0.00 0.00 42.92 41.51 2knv s ASP 24 CO -0.19 -0.92 0.01 -1.84 0.70 0.00 0.00 175.17 172.93 2knv n GLU 25 N -1.82 3.14 0.16 2.11 -0.00 -1.26 -4.65 120.64 118.32 2knv n GLU 25 Ca 0.06 -0.00 0.13 0.00 -0.00 0.00 0.00 57.16 57.35 2knv n GLU 25 Cb 0.62 -1.11 0.39 0.00 -0.00 0.00 0.00 31.44 31.34 2knv n GLU 25 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 2knv h GLY 26 N 0.79 0.00 -0.05 -1.84 0.00 -2.06 -3.47 103.07 96.44 2knv h GLY 26 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2knv h GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2knv n GLY 27 N 0.91 1.36 0.09 4.60 0.00 -1.26 -5.00 105.19 105.90 2knv n GLY 27 Ca 0.04 -0.31 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.92 0.87 0.02 1.61 4.27 -1.26 -3.78 117.44 117.26 2knv n TRP 28 Ca 0.00 0.29 -0.09 0.00 -3.89 0.00 0.00 57.50 53.81 2knv n TRP 28 Cb 0.18 -1.15 0.07 0.00 -1.36 0.00 0.00 31.31 29.05 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 0.01 0.54 -1.38 5.67 5.85 -1.94 0.50 115.31 124.57 2knv h LEU 29 Ca -0.35 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.07 2knv h LEU 29 Cb 2.05 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.92 2knv h LEU 29 CO 0.07 0.99 0.00 0.00 -0.34 0.00 0.00 178.44 179.16 2knv h THR 30 N 0.37 0.00 0.05 1.05 1.03 -1.97 -2.34 112.91 111.09 2knv h THR 30 Ca 0.00 -0.33 -0.36 0.00 -0.01 0.00 0.00 66.41 65.71 2knv h THR 30 Cb 1.10 1.22 -0.04 0.00 -1.07 0.00 0.00 68.15 69.35 2knv h THR 30 CO 0.10 0.00 -2.12 0.54 -0.01 0.00 0.00 175.52 174.03 2knv n ARG 31 N -2.76 0.70 -0.36 0.00 5.12 -0.93 -4.25 116.66 114.18 2knv n ARG 31 Ca 0.01 0.20 0.01 0.00 -1.93 0.00 0.00 57.85 56.14 2knv n ARG 31 Cb 0.24 -1.65 0.17 0.00 -1.16 0.00 0.00 32.46 30.06 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 0.03 1.05 -0.02 0.55 5.85 -0.50 -0.17 115.31 122.10 2knv h LEU 32 Ca -0.45 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2knv h LEU 32 Cb 2.02 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.82 2knv h LEU 32 CO 0.03 0.70 0.00 0.18 -0.34 0.00 0.00 178.44 179.01 2knv n LEU 33 N -4.46 0.01 -0.10 2.25 4.77 -0.92 -0.44 117.00 118.11 2knv n LEU 33 Ca 0.14 0.50 -0.16 0.00 -0.03 0.00 0.00 56.01 56.46 2knv n LEU 33 Cb 0.13 -0.50 -0.07 0.00 -2.33 0.00 0.00 43.42 40.66 2knv n LEU 33 CO 0.34 -0.31 -0.72 0.00 -1.33 0.00 0.00 177.39 175.37 2knv n GLN 34 N -1.51 0.53 0.08 3.23 1.13 -0.11 -2.90 117.38 117.83 2knv n GLN 34 Ca 0.03 0.41 -0.12 0.00 -1.94 0.00 0.00 57.00 55.38 2knv n GLN 34 Cb 0.14 -1.61 -0.06 0.00 0.11 0.00 0.00 30.24 28.82 2knv n GLN 34 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 2knv h THR 35 N -1.00 1.47 -0.29 5.09 2.02 -1.42 -3.19 112.91 115.59 2knv h THR 35 Ca -0.26 -2.71 0.00 0.00 0.77 0.00 0.00 66.41 64.21 2knv h THR 35 Cb 1.09 2.59 0.00 0.00 -1.74 0.00 0.00 68.15 70.09 2knv h THR 35 CO -0.16 0.79 0.00 0.29 0.37 0.00 0.00 175.52 176.82 2knv n LYS 36 N -3.64 2.21 -0.48 6.66 4.01 0.42 -5.06 118.16 122.27 2knv n LYS 36 Ca -0.06 -1.82 0.06 0.00 -0.51 0.00 0.00 58.31 55.98 2knv n LYS 36 Cb 0.88 -1.47 -0.03 0.00 -0.51 0.00 0.00 35.03 33.90 2knv n LYS 36 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2knv n ASN 37 N 1.05 -2.72 -1.40 4.39 5.15 -1.21 -4.38 115.26 116.14 2knv n ASN 37 Ca 0.18 0.44 -0.03 0.00 -0.60 0.00 0.00 54.58 54.57 2knv n ASN 37 Cb 0.50 -1.63 0.01 0.00 -0.53 0.00 0.00 39.78 38.13 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 -2.90 0.27 -3.11 1.20 4.01 -1.14 -4.47 117.16 111.01 2knv n TYR 38 Ca -0.03 -0.96 -0.44 0.00 -0.16 0.00 0.00 57.90 56.31 2knv n TYR 38 Cb 0.23 -0.48 -0.05 0.00 -0.31 0.00 0.00 39.34 38.73 2knv n TYR 38 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2knv s ASP 39 N 1.34 6.19 0.23 7.72 -1.08 -1.26 -4.92 116.67 124.89 2knv s ASP 39 Ca 0.05 -1.29 -0.07 0.00 -0.52 0.00 0.00 52.55 50.72 2knv s ASP 39 Cb 0.04 -2.30 0.28 0.00 -1.46 0.00 0.00 42.92 39.48 2knv s ASP 39 CO 0.00 -1.07 1.84 0.40 0.52 0.00 0.00 175.17 176.87 2knv h ILE 40 N 5.91 1.04 -0.22 4.11 5.03 -1.95 -1.38 117.51 130.05 2knv h ILE 40 Ca -0.29 -0.31 0.02 0.00 -0.12 0.00 0.00 64.86 64.16 2knv h ILE 40 Cb 1.09 0.06 -0.02 0.00 -3.03 0.00 0.00 36.82 34.92 2knv h ILE 40 CO 1.07 0.16 0.09 1.23 -0.68 0.00 0.00 178.15 180.02 2knv h GLY 41 N 0.90 0.28 1.01 5.37 0.00 -1.99 -0.92 103.07 107.71 2knv h GLY 41 Ca 0.34 -0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.58 2knv h GLY 41 CO -0.16 0.04 0.29 0.00 0.00 0.00 0.00 176.54 176.71 2knv h ALA 42 N 1.13 0.87 -0.42 3.60 0.00 -1.88 -2.80 119.26 119.76 2knv h ALA 42 Ca 0.09 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2knv h ALA 42 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2knv h ALA 42 CO -0.09 0.47 0.27 0.00 0.00 0.00 0.00 179.25 179.90 2knv h ALA 43 N 1.13 0.53 -0.90 0.00 0.00 -0.83 -1.15 119.26 118.05 2knv h ALA 43 Ca 0.23 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.12 2knv h ALA 43 Cb 0.18 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2knv h ALA 43 CO -0.02 -0.02 0.59 -0.07 0.00 0.00 0.00 179.25 179.73 2knv h LEU 44 N 0.56 1.02 -0.65 0.00 4.07 -1.04 -1.81 115.31 117.46 2knv h LEU 44 Ca 0.16 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 58.07 2knv h LEU 44 Cb -0.06 -0.25 -0.00 0.00 1.08 0.00 0.00 40.66 41.43 2knv h LEU 44 CO -0.04 0.73 -0.10 -0.78 -1.08 0.00 0.00 178.44 177.18 2knv h ASP 45 N 1.20 0.00 -0.24 -0.43 3.58 -1.23 -3.06 116.42 116.25 2knv h ASP 45 Ca 0.33 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.74 2knv h ASP 45 Cb -0.12 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 2knv h ASP 45 CO -0.08 0.10 0.03 0.74 -2.88 0.00 0.00 179.24 177.15 2knv h THR 46 N 0.00 1.18 -0.29 2.25 2.02 -0.31 -2.78 112.91 114.98 2knv h THR 46 Ca -0.00 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.47 2knv h THR 46 Cb 0.85 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.16 2knv h THR 46 CO 0.01 0.24 0.00 2.30 0.37 0.00 0.00 175.52 178.45 2knv n ILE 47 N -4.30 1.98 0.00 3.11 -5.35 -1.19 -4.99 119.36 108.62 2knv n ILE 47 Ca 0.02 -1.65 0.00 0.00 -0.27 0.00 0.00 62.75 60.85 2knv n ILE 47 Cb 0.22 -0.07 0.00 0.00 -1.74 0.00 0.00 39.64 38.06 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 -0.23 0.00 -1.64 6.28 1.13 -1.05 -4.87 117.38 117.01 2knv n GLN 48 Ca 0.19 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.85 2knv n GLN 48 Cb 0.78 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 31.10 2knv n GLN 48 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 2knv s TYR 49 N 0.00 1.19 0.00 1.08 2.02 -1.25 -4.64 117.35 115.75 2knv s TYR 49 Ca 0.00 1.01 0.00 0.00 -0.37 0.00 0.00 57.07 57.71 2knv s TYR 49 Cb 0.00 -3.80 0.00 0.00 -0.40 0.00 0.00 41.96 37.76 2knv s TYR 49 CO 0.00 -3.24 0.00 0.43 -1.57 0.00 0.00 175.55 171.17 2knv n SER 50 N 13.51 2.41 -0.13 2.29 7.64 -1.26 -4.68 113.62 133.40 2knv n SER 50 Ca 0.32 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.91 2knv n SER 50 Cb 0.50 0.30 -0.10 0.00 -1.01 0.00 0.00 64.21 63.90 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 -1.10 0.56 0.00 1.43 5.02 -1.26 -5.09 118.16 117.72 2knv n LYS 51 Ca 0.00 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 2knv n LYS 51 Cb 0.18 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 2knv n LYS 51 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46