#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 6.36 0.56 1.61 0.01 -1.26 -5.05 113.70 115.93 2knv s SER 2 Ca 0.00 -0.27 -0.10 0.00 1.31 0.00 0.00 55.95 56.89 2knv s SER 2 Cb 0.00 -2.36 -0.04 0.00 0.21 0.00 0.00 66.02 63.83 2knv s SER 2 CO 0.00 -0.90 0.94 -2.16 0.41 0.00 0.00 173.24 171.53 2knv s PRO 3 N 3.14 3.63 0.19 12.44 0.04 -1.26 -4.94 135.00 148.23 2knv s PRO 3 Ca 0.26 0.59 0.16 0.00 0.04 0.00 0.00 61.00 62.05 2knv s PRO 3 Cb -0.13 -2.19 0.77 0.00 0.04 0.00 0.00 34.50 32.98 2knv s PRO 3 CO 0.20 -0.40 1.48 -2.30 0.04 0.00 0.00 177.00 176.02 2knv n PRO 4 N -2.40 0.10 0.21 0.56 -0.02 -1.26 -1.22 135.00 130.97 2knv n PRO 4 Ca 0.04 0.51 0.10 0.00 -2.02 0.00 0.00 63.50 62.14 2knv n PRO 4 Cb 0.54 -1.77 0.28 0.00 -0.02 0.00 0.00 33.50 32.53 2knv n PRO 4 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2knv h GLU 5 N 0.00 0.00 -6.69 -0.52 4.39 -2.02 -3.45 114.58 106.30 2knv h GLU 5 Ca 0.00 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 59.19 2knv h GLU 5 Cb 0.11 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 2knv h GLU 5 CO 0.00 0.17 0.41 0.00 -1.16 0.00 0.00 179.01 178.43 2knv s ALA 6 N -3.32 3.34 -0.04 3.43 0.00 -0.36 -5.00 121.76 119.81 2knv s ALA 6 Ca 0.04 0.71 -0.30 0.00 0.00 0.00 0.00 51.96 52.41 2knv s ALA 6 Cb 0.07 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.87 2knv s ALA 6 CO 0.66 -0.03 1.15 0.34 0.00 0.00 0.00 175.76 177.88 2knv s ASP 7 N -0.53 7.12 0.56 0.00 -1.08 -1.26 -4.92 116.67 116.56 2knv s ASP 7 Ca 0.45 1.79 0.37 0.00 -0.52 0.00 0.00 52.55 54.64 2knv s ASP 7 Cb -0.27 -2.56 1.83 0.00 -1.46 0.00 0.00 42.92 40.45 2knv s ASP 7 CO 0.34 -0.51 2.12 1.55 0.52 0.00 0.00 175.17 179.18 2knv h PRO 8 N 7.23 0.00 0.00 4.34 0.13 -1.95 -1.16 132.00 140.59 2knv h PRO 8 Ca -0.35 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.52 2knv h PRO 8 Cb 1.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 2knv h PRO 8 CO 0.85 0.00 -1.73 0.54 -0.23 0.00 0.00 178.00 177.43 2knv n ARG 9 N -2.93 0.64 0.05 0.86 1.74 -1.26 -3.44 116.66 112.32 2knv n ARG 9 Ca -0.01 0.20 -0.04 0.00 -0.77 0.00 0.00 57.85 57.23 2knv n ARG 9 Cb 0.16 -1.74 -0.09 0.00 -1.02 0.00 0.00 32.46 29.77 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 0.00 0.00 -0.28 0.55 5.85 -1.84 -3.27 115.31 116.32 2knv h LEU 10 Ca -0.28 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.38 2knv h LEU 10 Cb 1.86 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.89 2knv h LEU 10 CO 0.06 0.82 -0.30 -0.29 -0.34 0.00 0.00 178.44 178.38 2knv h ILE 11 N 0.00 0.55 0.00 4.05 2.10 -1.38 -3.10 117.51 119.72 2knv h ILE 11 Ca -0.11 -1.62 0.00 0.00 1.08 0.00 0.00 64.86 64.21 2knv h ILE 11 Cb 1.71 2.15 0.00 0.00 -1.09 0.00 0.00 36.82 39.59 2knv h ILE 11 CO 0.09 0.29 0.00 -0.62 -1.08 0.00 0.00 178.15 176.83 2knv n GLU 12 N -3.22 0.18 0.24 2.19 -0.58 -1.22 -3.14 120.64 115.08 2knv n GLU 12 Ca 0.02 0.18 0.07 0.00 -0.42 0.00 0.00 57.16 57.01 2knv n GLU 12 Cb 0.60 -1.72 0.61 0.00 -0.57 0.00 0.00 31.44 30.37 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 0.03 -0.05 1.62 0.02 -1.62 0.21 113.55 113.75 2knv h SER 13 Ca 0.00 -0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 2knv h SER 13 Cb 0.62 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2knv h SER 13 CO 0.00 0.04 -0.12 -0.07 -1.14 0.00 0.00 176.83 175.54 2knv h LEU 14 N 0.03 0.20 -1.30 5.07 4.07 -1.76 -3.01 115.31 118.60 2knv h LEU 14 Ca 0.01 -0.57 -0.06 0.00 0.08 0.00 0.00 57.88 57.34 2knv h LEU 14 Cb 0.03 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.70 2knv h LEU 14 CO 0.00 0.73 -0.17 0.28 -1.08 0.00 0.00 178.44 178.20 2knv h SER 15 N -0.33 0.25 -0.62 -0.43 0.02 -1.54 -2.63 113.55 108.28 2knv h SER 15 Ca 0.00 -0.06 0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2knv h SER 15 Cb 0.70 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 63.13 2knv h SER 15 CO 0.03 0.44 0.38 -0.61 -1.14 0.00 0.00 176.83 175.92 2knv h GLN 16 N 0.24 0.71 -0.66 3.45 5.75 -0.57 0.32 115.11 124.36 2knv h GLN 16 Ca 0.05 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.42 2knv h GLN 16 Cb 0.45 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.81 2knv h GLN 16 CO 0.03 0.47 0.09 0.52 -2.65 0.00 0.00 178.83 177.29 2knv h MET 17 N 0.74 1.10 -0.49 1.69 2.86 -1.34 0.31 114.93 119.79 2knv h MET 17 Ca 0.25 -0.30 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 2knv h MET 17 Cb 0.03 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 2knv h MET 17 CO -0.11 1.01 0.16 1.25 1.06 0.00 0.00 176.91 180.29 2knv h LEU 18 N 1.02 0.71 -1.11 1.22 5.85 -1.06 0.31 115.31 122.25 2knv h LEU 18 Ca 0.20 -0.20 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 2knv h LEU 18 Cb 0.46 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2knv h LEU 18 CO 0.02 0.72 -0.34 -1.28 -0.34 0.00 0.00 178.44 177.21 2knv h SER 19 N 0.66 0.18 0.39 1.25 0.87 -0.16 -2.45 113.55 114.28 2knv h SER 19 Ca 0.16 -0.06 -0.08 0.00 -1.23 0.00 0.00 61.79 60.58 2knv h SER 19 Cb 0.26 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2knv h SER 19 CO -0.01 0.52 -0.37 -0.03 -0.53 0.00 0.00 176.83 176.41 2knv h MET 20 N 0.15 0.00 0.00 2.24 1.85 -0.43 -3.46 114.93 115.28 2knv h MET 20 Ca 0.02 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 2knv h MET 20 Cb 0.69 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.72 2knv h MET 20 CO 0.05 0.37 0.00 0.41 -0.40 0.00 0.00 176.91 177.35 2knv n GLY 21 N -0.43 1.67 3.38 1.39 0.00 -0.77 -5.09 105.19 105.34 2knv n GLY 21 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2knv n GLY 21 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2knv s PHE 22 N -2.00 2.98 0.03 1.61 0.40 0.03 -5.02 117.98 116.01 2knv s PHE 22 Ca 0.00 -0.68 -0.18 0.00 -0.60 0.00 0.00 56.93 55.47 2knv s PHE 22 Cb 0.00 -2.06 0.03 0.00 0.51 0.00 0.00 43.02 41.50 2knv s PHE 22 CO 0.00 -0.36 0.40 -1.12 0.70 0.00 0.00 175.22 174.84 2knv s SER 23 N 1.12 -0.28 0.20 1.36 0.01 -1.26 -3.56 113.70 111.29 2knv s SER 23 Ca 0.02 0.04 0.06 0.00 1.31 0.00 0.00 55.95 57.38 2knv s SER 23 Cb -0.15 0.41 -0.04 0.00 0.21 0.00 0.00 66.02 66.45 2knv s SER 23 CO 0.00 -0.62 0.15 1.51 0.41 0.00 0.00 173.24 174.69 2knv s ASP 24 N -1.85 5.46 -0.08 2.44 1.47 -1.26 -4.97 116.67 117.89 2knv s ASP 24 Ca -0.07 -0.20 0.09 0.00 1.18 0.00 0.00 52.55 53.55 2knv s ASP 24 Cb -0.01 -1.39 -0.13 0.00 -0.34 0.00 0.00 42.92 41.04 2knv s ASP 24 CO -0.01 0.03 0.07 -0.62 0.68 0.00 0.00 175.17 175.32 2knv n GLU 25 N -0.67 2.05 -0.21 2.11 4.71 -1.26 -4.54 120.64 122.82 2knv n GLU 25 Ca -0.08 -0.02 0.10 0.00 -0.01 0.00 0.00 57.16 57.14 2knv n GLU 25 Cb 0.56 -1.25 0.21 0.00 -1.01 0.00 0.00 31.44 29.95 2knv n GLU 25 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2knv n GLY 26 N 2.31 1.97 2.21 0.62 0.00 -1.26 -4.96 105.19 106.08 2knv n GLY 26 Ca -0.13 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 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 1.21 0.35 0.11 -0.02 0.00 -1.26 -4.97 105.19 100.61 2knv n GLY 27 Ca 0.17 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.53 0.39 -0.16 1.61 4.27 -1.26 -4.22 117.44 114.55 2knv n TRP 28 Ca -0.02 0.11 -0.10 0.00 -3.89 0.00 0.00 57.50 53.61 2knv n TRP 28 Cb 0.53 -1.06 0.03 0.00 -1.36 0.00 0.00 31.31 29.45 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 0.98 -1.12 5.67 5.85 -1.93 -1.90 115.31 122.88 2knv h LEU 29 Ca -0.49 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 57.89 2knv h LEU 29 Cb 2.06 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.83 2knv h LEU 29 CO 0.01 1.12 0.00 1.07 -0.34 0.00 0.00 178.44 180.30 2knv n THR 30 N -4.13 1.03 -0.06 1.05 5.66 -1.26 -2.12 114.28 114.45 2knv n THR 30 Ca 0.01 0.57 -0.20 0.00 -3.05 0.00 0.00 64.05 61.38 2knv n THR 30 Cb 0.42 -1.54 -0.13 0.00 -1.55 0.00 0.00 70.33 67.53 2knv n THR 30 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2knv n ARG 31 N -2.20 0.71 0.12 1.09 5.12 -0.77 -4.28 116.66 116.43 2knv n ARG 31 Ca -0.00 0.23 0.04 0.00 -1.93 0.00 0.00 57.85 56.19 2knv n ARG 31 Cb 0.09 -1.63 0.47 0.00 -1.16 0.00 0.00 32.46 30.23 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 -0.02 0.25 -0.18 0.55 5.85 -0.85 -0.08 115.31 120.84 2knv h LEU 32 Ca -0.49 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.20 2knv h LEU 32 Cb 1.95 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.92 2knv h LEU 32 CO -0.01 0.26 0.00 0.18 -0.34 0.00 0.00 178.44 178.54 2knv n LEU 33 N -4.42 0.20 -0.07 2.25 4.77 -1.01 -0.65 117.00 118.08 2knv n LEU 33 Ca -0.00 0.54 -0.20 0.00 -0.03 0.00 0.00 56.01 56.33 2knv n LEU 33 Cb 0.15 -0.51 -0.13 0.00 -2.33 0.00 0.00 43.42 40.60 2knv n LEU 33 CO 0.36 -0.30 -1.09 0.00 -1.33 0.00 0.00 177.39 175.02 2knv n GLN 34 N -1.71 0.70 0.09 3.23 1.13 -0.09 -3.17 117.38 117.55 2knv n GLN 34 Ca 0.04 0.21 -0.13 0.00 -1.94 0.00 0.00 57.00 55.17 2knv n GLN 34 Cb 0.21 -1.61 -0.11 0.00 0.11 0.00 0.00 30.24 28.84 2knv n GLN 34 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 2knv h THR 35 N 0.00 1.53 -0.25 5.09 1.35 -1.24 -3.30 112.91 116.09 2knv h THR 35 Ca -0.51 -3.01 0.00 0.00 -0.55 0.00 0.00 66.41 62.34 2knv h THR 35 Cb 1.95 2.82 0.00 0.00 -1.73 0.00 0.00 68.15 71.19 2knv h THR 35 CO -0.01 0.88 0.00 0.29 -0.25 0.00 0.00 175.52 176.42 2knv n LYS 36 N -3.54 2.83 -0.66 4.72 5.02 0.18 -5.09 118.16 121.61 2knv n LYS 36 Ca -0.06 -2.73 0.09 0.00 -2.02 0.00 0.00 58.31 53.58 2knv n LYS 36 Cb 0.97 -1.76 -0.02 0.00 -0.02 0.00 0.00 35.03 34.19 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 -0.45 -4.90 -1.60 4.39 2.85 -1.19 -4.16 115.26 110.19 2knv n ASN 37 Ca 0.20 0.71 -0.06 0.00 -0.11 0.00 0.00 54.58 55.32 2knv n ASN 37 Cb 0.82 -1.99 0.19 0.00 1.24 0.00 0.00 39.78 40.04 2knv n ASN 37 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 2knv n TYR 38 N -2.54 1.67 -2.52 1.20 4.01 -1.23 -4.39 117.16 113.37 2knv n TYR 38 Ca 0.00 -0.93 -0.41 0.00 -0.16 0.00 0.00 57.90 56.40 2knv n TYR 38 Cb 0.30 -0.54 -0.03 0.00 -0.31 0.00 0.00 39.34 38.76 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 -0.48 6.17 0.28 7.72 2.15 -1.26 -4.87 116.67 126.38 2knv s ASP 39 Ca 0.36 -0.24 0.01 0.00 0.43 0.00 0.00 52.55 53.10 2knv s ASP 39 Cb 0.29 -2.56 0.54 0.00 -0.30 0.00 0.00 42.92 40.90 2knv s ASP 39 CO 0.09 -1.79 1.83 0.40 -0.17 0.00 0.00 175.17 175.52 2knv h ILE 40 N 6.13 0.90 0.10 4.11 2.04 -1.94 -1.42 117.51 127.43 2knv h ILE 40 Ca -0.27 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.27 2knv h ILE 40 Cb 1.06 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 2knv h ILE 40 CO 1.25 0.17 -0.12 1.23 0.00 0.00 0.00 178.15 180.68 2knv h GLY 41 N 0.95 -0.24 1.01 5.37 0.00 -1.99 0.40 103.07 108.57 2knv h GLY 41 Ca 0.49 0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.92 2knv h GLY 41 CO -0.27 -0.13 0.22 0.00 0.00 0.00 0.00 176.54 176.36 2knv h ALA 42 N 0.61 0.82 -0.19 3.60 0.00 -1.84 -1.22 119.26 121.03 2knv h ALA 42 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2knv h ALA 42 Cb 0.26 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2knv h ALA 42 CO -0.05 0.46 0.12 0.00 0.00 0.00 0.00 179.25 179.79 2knv h ALA 43 N 1.08 0.25 -0.18 0.00 0.00 -1.03 -0.80 119.26 118.57 2knv h ALA 43 Ca 0.20 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 2knv h ALA 43 Cb 0.25 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2knv h ALA 43 CO -0.01 -0.26 -0.19 1.25 0.00 0.00 0.00 179.25 180.04 2knv h LEU 44 N 0.25 0.31 -0.63 0.00 5.85 -0.80 -2.69 115.31 117.60 2knv h LEU 44 Ca 0.07 -0.08 -0.14 0.00 0.84 0.00 0.00 57.88 58.56 2knv h LEU 44 Cb -0.00 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2knv h LEU 44 CO -0.01 0.51 -0.50 -0.78 -0.34 0.00 0.00 178.44 177.32 2knv h ASP 45 N 0.29 0.53 -0.23 1.25 1.82 -0.77 -2.65 116.42 116.67 2knv h ASP 45 Ca 0.05 -0.26 0.03 0.00 -0.39 0.00 0.00 57.03 56.46 2knv h ASP 45 Cb 0.51 -0.15 -0.01 0.00 0.68 0.00 0.00 39.33 40.35 2knv h ASP 45 CO 0.03 0.94 0.16 0.74 -1.61 0.00 0.00 179.24 179.50 2knv h THR 46 N 0.38 0.97 -0.07 2.25 2.02 -0.81 -0.91 112.91 116.75 2knv h THR 46 Ca 0.02 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.14 2knv h THR 46 Cb 1.01 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 2knv h THR 46 CO 0.09 0.03 0.00 2.30 0.37 0.00 0.00 175.52 178.31 2knv n ILE 47 N -4.50 0.07 0.00 3.11 -6.64 -1.15 -4.98 119.36 105.26 2knv n ILE 47 Ca 0.02 -0.53 0.00 0.00 -1.77 0.00 0.00 62.75 60.46 2knv n ILE 47 Cb 0.19 1.40 0.00 0.00 -1.44 0.00 0.00 39.64 39.79 2knv n ILE 47 CO 0.00 0.00 0.00 1.67 -1.77 0.00 0.00 176.55 176.45 2knv n GLN 48 N 1.28 0.00 -1.54 6.28 0.00 -0.35 -4.86 117.38 118.19 2knv n GLN 48 Ca 0.14 0.00 -0.24 0.00 -0.00 0.00 0.00 57.00 56.89 2knv n GLN 48 Cb 0.56 0.00 -0.08 0.00 0.00 0.00 0.00 30.24 30.72 2knv n GLN 48 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2knv n TYR 49 N 0.00 1.05 -0.07 3.69 4.01 -1.26 -4.66 117.16 119.92 2knv n TYR 49 Ca 0.00 0.07 -0.14 0.00 -0.16 0.00 0.00 57.90 57.67 2knv n TYR 49 Cb 0.00 -2.34 -0.06 0.00 -0.31 0.00 0.00 39.34 36.63 2knv n TYR 49 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2knv n SER 50 N 15.46 1.82 0.17 7.72 3.41 -1.26 -4.77 113.62 136.16 2knv n SER 50 Ca 0.48 0.08 -0.11 0.00 -0.26 0.00 0.00 58.87 59.06 2knv n SER 50 Cb 0.40 -0.36 -0.06 0.00 -0.26 0.00 0.00 64.21 63.93 2knv n SER 50 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2knv h LYS 51 N -0.32 -0.47 0.00 4.33 1.57 -1.99 -3.53 116.57 116.16 2knv h LYS 51 Ca -0.36 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2knv h LYS 51 Cb 1.40 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.82 2knv h LYS 51 CO -0.16 -0.17 0.00 0.72 -0.57 0.00 0.00 179.45 179.27