#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k0b s SER 2 N 0.00 6.84 0.90 1.61 0.01 -1.26 -5.01 113.70 116.79 2k0b s SER 2 Ca 0.00 2.25 -0.11 0.00 1.31 0.00 0.00 55.95 59.40 2k0b s SER 2 Cb 0.00 -2.58 0.13 0.00 0.21 0.00 0.00 66.02 63.79 2k0b s SER 2 CO 0.00 -0.67 1.09 -2.84 0.41 0.00 0.00 173.24 171.23 2k0b s PRO 3 N 1.58 1.18 0.00 12.44 0.02 -1.26 -4.78 135.00 144.18 2k0b s PRO 3 Ca 0.65 1.00 0.00 0.00 0.02 0.00 0.00 61.00 62.67 2k0b s PRO 3 Cb -0.35 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.38 2k0b s PRO 3 CO 0.29 -2.34 1.16 -2.30 -0.33 0.00 0.00 177.00 173.48 2k0b n PRO 4 N -3.98 0.65 0.00 5.54 -0.02 -1.26 -2.58 135.00 133.35 2k0b n PRO 4 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 2k0b n PRO 4 Cb 0.54 -1.17 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 2k0b n PRO 4 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2k0b n GLU 5 N 1.45 1.62 -1.21 -0.52 -0.58 -1.26 -4.73 120.64 115.41 2k0b n GLU 5 Ca 0.00 -1.08 -0.01 0.00 -0.42 0.00 0.00 57.16 55.66 2k0b n GLU 5 Cb 0.33 -0.90 0.01 0.00 -0.57 0.00 0.00 31.44 30.30 2k0b n GLU 5 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k0b n ALA 6 N -0.30 -1.06 -2.55 0.62 0.00 -1.07 -4.84 120.51 111.31 2k0b n ALA 6 Ca 0.00 -0.13 -0.35 0.00 0.00 0.00 0.00 53.44 52.96 2k0b n ALA 6 Cb 0.24 -0.43 -0.06 0.00 0.00 0.00 0.00 19.45 19.21 2k0b n ALA 6 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2k0b s ASP 7 N -0.16 6.67 0.62 0.00 2.15 -1.19 -4.73 116.67 120.03 2k0b s ASP 7 Ca 0.01 0.83 0.21 0.00 0.43 0.00 0.00 52.55 54.02 2k0b s ASP 7 Cb 0.04 -2.19 0.80 0.00 -0.30 0.00 0.00 42.92 41.27 2k0b s ASP 7 CO -0.01 0.19 1.34 -0.65 -0.17 0.00 0.00 175.17 175.86 2k0b h PRO 8 N 3.82 0.00 0.06 4.34 0.11 -1.96 1.02 132.00 139.39 2k0b h PRO 8 Ca -0.49 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.37 2k0b h PRO 8 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2k0b h PRO 8 CO 0.66 0.00 -1.34 0.00 -0.21 0.00 0.00 178.00 177.11 2k0b h ARG 9 N 0.00 0.13 0.00 1.05 3.08 -2.00 -3.39 114.38 113.25 2k0b h ARG 9 Ca 0.31 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2k0b h ARG 9 Cb 2.35 0.08 0.00 0.00 0.08 0.00 0.00 29.97 32.49 2k0b h ARG 9 CO -0.00 1.11 -1.15 1.28 -1.07 0.00 0.00 179.97 180.13 2k0b n LEU 10 N -4.11 0.80 0.22 3.04 4.77 0.26 -2.88 117.00 119.10 2k0b n LEU 10 Ca -0.28 -0.38 0.08 0.00 -0.03 0.00 0.00 56.01 55.41 2k0b n LEU 10 Cb 0.81 -0.01 0.48 0.00 -2.33 0.00 0.00 43.42 42.37 2k0b n LEU 10 CO 0.32 0.19 0.80 -0.29 -1.33 0.00 0.00 177.39 177.09 2k0b h ILE 11 N 0.00 0.75 0.04 -0.08 2.10 0.72 0.67 117.51 121.71 2k0b h ILE 11 Ca 0.00 -1.10 -0.37 0.00 1.08 0.00 0.00 64.86 64.47 2k0b h ILE 11 Cb 0.59 1.68 -0.05 0.00 -1.09 0.00 0.00 36.82 37.96 2k0b h ILE 11 CO 0.00 0.26 -2.28 -0.62 -1.08 0.00 0.00 178.15 174.42 2k0b n GLU 12 N -3.60 0.69 -0.07 2.19 1.02 -1.26 -3.97 120.64 115.64 2k0b n GLU 12 Ca -0.01 0.17 -0.12 0.00 -0.02 0.00 0.00 57.16 57.18 2k0b n GLU 12 Cb 0.40 -1.59 -0.14 0.00 -0.02 0.00 0.00 31.44 30.08 2k0b n GLU 12 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2k0b n SER 13 N -3.25 0.86 -0.12 1.62 7.64 -1.14 -3.80 113.62 115.44 2k0b n SER 13 Ca -0.38 0.12 -0.26 0.00 1.01 0.00 0.00 58.87 59.36 2k0b n SER 13 Cb 1.03 0.22 -0.11 0.00 -1.01 0.00 0.00 64.21 64.34 2k0b n SER 13 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2k0b n LEU 14 N -3.01 2.00 0.16 -3.43 0.00 0.16 -4.31 117.00 108.57 2k0b n LEU 14 Ca -0.31 0.34 0.05 0.00 0.00 0.00 0.00 56.01 56.10 2k0b n LEU 14 Cb 1.09 -0.90 0.52 0.00 0.00 0.00 0.00 43.42 44.12 2k0b n LEU 14 CO 0.41 0.49 1.03 -1.28 0.00 0.00 0.00 177.39 178.03 2k0b h SER 15 N -0.90 0.16 0.02 1.96 0.87 -0.08 -1.42 113.55 114.16 2k0b h SER 15 Ca -0.54 -0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.04 2k0b h SER 15 Cb 1.52 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 63.40 2k0b h SER 15 CO -0.30 0.19 -0.30 -0.61 -0.53 0.00 0.00 176.83 175.28 2k0b h GLN 16 N 0.18 -0.44 -0.42 2.24 -0.00 -1.69 0.36 115.11 115.34 2k0b h GLN 16 Ca 0.04 0.03 -0.15 0.00 -0.00 0.00 0.00 58.65 58.57 2k0b h GLN 16 Cb 0.11 0.10 -0.01 0.00 0.00 0.00 0.00 27.48 27.68 2k0b h GLN 16 CO 0.00 -0.30 -0.33 0.52 0.00 0.00 0.00 178.83 178.73 2k0b h MET 17 N -0.46 0.96 -0.17 1.69 2.86 -1.64 -1.43 114.93 116.74 2k0b h MET 17 Ca 0.06 -0.47 -0.06 0.00 -2.06 0.00 0.00 59.70 57.17 2k0b h MET 17 Cb 0.54 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 2k0b h MET 17 CO -0.24 1.14 -0.15 -0.07 1.06 0.00 0.00 176.91 178.64 2k0b h LEU 18 N 0.80 0.27 0.13 1.22 -0.00 -0.92 0.55 115.31 117.37 2k0b h LEU 18 Ca 0.08 -0.06 -0.33 0.00 -0.00 0.00 0.00 57.88 57.57 2k0b h LEU 18 Cb 0.92 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 41.50 2k0b h LEU 18 CO 0.09 0.45 -1.70 0.77 -0.00 0.00 0.00 178.44 178.05 2k0b h SER 19 N 0.27 0.44 0.75 -0.43 4.64 -0.90 -3.36 113.55 114.96 2k0b h SER 19 Ca 0.05 -0.69 -0.05 0.00 -0.47 0.00 0.00 61.79 60.63 2k0b h SER 19 Cb 0.43 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 2k0b h SER 19 CO 0.03 1.59 -0.25 -0.03 -0.87 0.00 0.00 176.83 177.30 2k0b h MET 20 N 0.08 0.00 0.00 4.77 1.85 -1.18 -3.46 114.93 116.98 2k0b h MET 20 Ca -0.31 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.78 2k0b h MET 20 Cb 2.05 0.00 0.00 0.00 0.43 0.00 0.00 31.60 34.08 2k0b h MET 20 CO 0.15 0.25 0.00 0.41 -0.40 0.00 0.00 176.91 177.32 2k0b n GLY 21 N -0.04 1.55 2.40 1.39 0.00 -0.89 -5.08 105.19 104.51 2k0b n GLY 21 Ca -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2k0b n GLY 21 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2k0b n PHE 22 N -0.14 -0.80 -1.28 1.61 3.01 0.19 -5.03 117.46 115.01 2k0b n PHE 22 Ca 0.00 -1.48 0.00 0.00 1.01 0.00 0.00 57.45 56.98 2k0b n PHE 22 Cb 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.19 2k0b n PHE 22 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2k0b n SER 23 N -1.85 0.22 -4.17 4.37 7.64 -1.26 -4.35 113.62 114.23 2k0b n SER 23 Ca -0.02 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.56 2k0b n SER 23 Cb 0.40 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.43 2k0b n SER 23 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2k0b s ASP 24 N 1.62 2.65 -0.72 6.43 -4.77 -1.26 -4.91 116.67 115.70 2k0b s ASP 24 Ca 0.00 -0.46 0.04 0.00 -3.30 0.00 0.00 52.55 48.83 2k0b s ASP 24 Cb 0.00 -1.05 0.28 0.00 -1.09 0.00 0.00 42.92 41.05 2k0b s ASP 24 CO 0.00 0.15 0.95 1.21 0.70 0.00 0.00 175.17 178.18 2k0b n GLU 25 N 3.42 3.11 0.00 2.11 2.13 -1.26 -4.60 120.64 125.55 2k0b n GLU 25 Ca -0.19 -4.69 0.00 0.00 0.66 0.00 0.00 57.16 52.94 2k0b n GLU 25 Cb 0.53 -2.31 0.00 0.00 0.27 0.00 0.00 31.44 29.93 2k0b n GLU 25 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k0b n GLY 26 N 0.72 -0.65 2.27 8.31 0.00 -1.26 -4.77 105.19 109.80 2k0b n GLY 26 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.32 2k0b n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k0b n GLY 27 N 0.00 0.60 0.00 -0.02 0.00 -1.26 -4.89 105.19 99.62 2k0b n GLY 27 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 2k0b n GLY 27 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2k0b n TRP 28 N -2.74 0.02 0.21 1.61 4.27 -1.26 -3.89 117.44 115.66 2k0b n TRP 28 Ca 0.00 0.01 0.18 0.00 -3.89 0.00 0.00 57.50 53.79 2k0b n TRP 28 Cb 0.01 -0.51 0.84 0.00 -1.36 0.00 0.00 31.31 30.29 2k0b n TRP 28 CO 0.00 0.00 0.00 1.25 -2.29 0.00 0.00 177.69 176.65 2k0b h LEU 29 N 0.00 0.00 0.02 5.67 5.85 -1.92 0.98 115.31 125.91 2k0b h LEU 29 Ca 0.00 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.37 2k0b h LEU 29 Cb 0.50 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.48 2k0b h LEU 29 CO 0.00 0.00 -1.94 0.35 -0.34 0.00 0.00 178.44 176.51 2k0b n THR 30 N -3.64 1.57 0.32 1.05 -2.24 -1.25 -4.11 114.28 105.98 2k0b n THR 30 Ca 0.02 -0.30 -0.19 0.00 -2.27 0.00 0.00 64.05 61.31 2k0b n THR 30 Cb 0.36 -1.88 -0.10 0.00 -2.10 0.00 0.00 70.33 66.62 2k0b n THR 30 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2k0b h ARG 31 N -0.74 -1.01 0.58 -0.78 2.47 -1.34 -1.37 114.38 112.20 2k0b h ARG 31 Ca -0.51 0.07 -0.02 0.00 -1.26 0.00 0.00 59.98 58.26 2k0b h ARG 31 Cb 1.58 0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 30.12 2k0b h ARG 31 CO -0.23 -0.67 -0.48 1.25 0.56 0.00 0.00 179.97 180.40 2k0b h LEU 32 N -1.05 -1.29 -0.52 3.04 7.12 0.69 -2.68 115.31 120.62 2k0b h LEU 32 Ca -0.07 0.09 0.04 0.00 0.13 0.00 0.00 57.88 58.08 2k0b h LEU 32 Cb 0.89 0.41 -0.04 0.00 -0.53 0.00 0.00 40.66 41.39 2k0b h LEU 32 CO -0.03 -0.67 0.27 -0.07 -0.13 0.00 0.00 178.44 177.81 2k0b h LEU 33 N -1.04 0.39 -0.59 2.25 4.07 -1.65 -1.76 115.31 116.98 2k0b h LEU 33 Ca -0.08 0.03 0.12 0.00 0.08 0.00 0.00 57.88 58.03 2k0b h LEU 33 Cb 0.87 -0.05 -0.10 0.00 1.08 0.00 0.00 40.66 42.47 2k0b h LEU 33 CO -0.01 0.27 -0.01 -0.61 -1.08 0.00 0.00 178.44 177.00 2k0b h GLN 34 N 0.52 0.10 -0.21 1.13 5.75 -1.17 0.83 115.11 122.06 2k0b h GLN 34 Ca 0.23 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.68 2k0b h GLN 34 Cb 0.13 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 2k0b h GLN 34 CO -0.15 0.07 -0.04 1.15 -2.65 0.00 0.00 178.83 177.21 2k0b h THR 35 N 0.11 1.28 -0.09 2.39 2.02 -1.11 -3.08 112.91 114.43 2k0b h THR 35 Ca 0.30 -1.00 -0.06 0.00 0.77 0.00 0.00 66.41 66.43 2k0b h THR 35 Cb 0.48 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 2k0b h THR 35 CO -0.51 0.31 0.07 0.29 0.37 0.00 0.00 175.52 176.05 2k0b n LYS 36 N -4.63 1.14 -4.31 6.66 4.01 -0.70 -4.80 118.16 115.53 2k0b n LYS 36 Ca -0.04 -0.28 -0.31 0.00 -0.51 0.00 0.00 58.31 57.17 2k0b n LYS 36 Cb 0.27 -1.11 -0.10 0.00 -0.51 0.00 0.00 35.03 33.58 2k0b n LYS 36 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 2k0b n ASN 37 N 1.02 0.89 -2.96 4.39 6.94 -1.02 -2.41 115.26 122.10 2k0b n ASN 37 Ca 0.05 -1.27 -0.03 0.00 -0.02 0.00 0.00 54.58 53.32 2k0b n ASN 37 Cb 0.54 -1.65 0.01 0.00 -2.36 0.00 0.00 39.78 36.32 2k0b n ASN 37 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2k0b n TYR 38 N -4.58 -2.63 -5.25 -2.53 4.01 0.28 -5.01 117.16 101.46 2k0b n TYR 38 Ca -0.33 0.99 -0.31 0.00 -0.16 0.00 0.00 57.90 58.10 2k0b n TYR 38 Cb 0.70 -3.91 -0.16 0.00 -0.31 0.00 0.00 39.34 35.65 2k0b n TYR 38 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2k0b s ASP 39 N -3.01 2.97 0.00 7.72 2.15 -1.01 -4.85 116.67 120.63 2k0b s ASP 39 Ca 0.09 -0.47 0.25 0.00 0.43 0.00 0.00 52.55 52.84 2k0b s ASP 39 Cb -0.01 -0.54 0.45 0.00 -0.30 0.00 0.00 42.92 42.51 2k0b s ASP 39 CO 0.68 0.28 1.38 2.30 -0.17 0.00 0.00 175.17 179.64 2k0b n ILE 40 N 2.68 0.00 -0.26 4.11 -0.00 -1.26 -3.39 119.36 121.24 2k0b n ILE 40 Ca -0.17 -0.01 -0.01 0.00 -0.00 0.00 0.00 62.75 62.57 2k0b n ILE 40 Cb 0.52 0.32 0.18 0.00 -0.00 0.00 0.00 39.64 40.66 2k0b n ILE 40 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 2k0b h GLY 41 N 5.00 1.17 0.05 3.28 0.00 -1.96 -0.89 103.07 109.71 2k0b h GLY 41 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2k0b h GLY 41 CO 0.00 0.47 -1.50 0.00 0.00 0.00 0.00 176.54 175.51 2k0b n ALA 42 N -2.42 3.68 0.03 3.60 0.00 -1.26 -4.27 120.51 119.88 2k0b n ALA 42 Ca 0.09 -0.54 -0.13 0.00 0.00 0.00 0.00 53.44 52.86 2k0b n ALA 42 Cb 0.06 -0.78 -0.09 0.00 0.00 0.00 0.00 19.45 18.65 2k0b n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k0b h ALA 43 N 2.46 -0.11 -0.04 0.00 0.00 -1.44 -3.00 119.26 117.13 2k0b h ALA 43 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.72 2k0b h ALA 43 Cb 0.77 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2k0b h ALA 43 CO 0.00 -0.35 0.03 -0.07 0.00 0.00 0.00 179.25 178.86 2k0b h LEU 44 N -0.53 0.00 -1.22 0.00 4.07 -1.39 -1.72 115.31 114.52 2k0b h LEU 44 Ca -0.01 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.88 2k0b h LEU 44 Cb 0.45 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.17 2k0b h LEU 44 CO 0.02 0.00 -0.16 -0.78 -1.08 0.00 0.00 178.44 176.44 2k0b h ASP 45 N 0.00 0.33 0.11 -0.43 3.58 -1.67 -1.43 116.42 116.91 2k0b h ASP 45 Ca 0.02 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2k0b h ASP 45 Cb 0.09 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2k0b h ASP 45 CO -0.00 0.52 -0.46 0.35 -2.88 0.00 0.00 179.24 176.77 2k0b n THR 46 N -4.22 0.00 -0.06 2.25 -2.24 -0.65 -2.21 114.28 107.16 2k0b n THR 46 Ca -0.00 -0.17 -0.03 0.00 -2.27 0.00 0.00 64.05 61.58 2k0b n THR 46 Cb 0.31 0.86 -0.12 0.00 -2.10 0.00 0.00 70.33 69.28 2k0b n THR 46 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2k0b n ILE 47 N -0.51 0.77 0.00 2.28 -5.35 -1.19 -4.59 119.36 110.76 2k0b n ILE 47 Ca 0.09 -0.57 0.00 0.00 -0.27 0.00 0.00 62.75 62.00 2k0b n ILE 47 Cb 0.40 -0.41 0.00 0.00 -1.74 0.00 0.00 39.64 37.89 2k0b n ILE 47 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2k0b n GLN 48 N -2.43 0.00 -1.40 6.28 3.00 -1.20 -4.89 117.38 116.74 2k0b n GLN 48 Ca -0.19 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.44 2k0b n GLN 48 Cb 0.85 -0.01 -0.04 0.00 0.00 0.00 0.00 30.24 31.04 2k0b n GLN 48 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2k0b n TYR 49 N -2.38 2.13 1.79 1.08 4.01 -0.54 -4.30 117.16 118.94 2k0b n TYR 49 Ca 0.00 -2.82 0.15 0.00 -0.16 0.00 0.00 57.90 55.07 2k0b n TYR 49 Cb 0.00 -2.24 0.80 0.00 -0.31 0.00 0.00 39.34 37.59 2k0b n TYR 49 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2k0b n SER 50 N 3.03 0.44 -3.15 7.72 7.64 -0.94 -3.60 113.62 124.76 2k0b n SER 50 Ca 0.71 -1.06 -0.20 0.00 1.01 0.00 0.00 58.87 59.33 2k0b n SER 50 Cb 0.33 -0.02 -0.04 0.00 -1.01 0.00 0.00 64.21 63.47 2k0b n SER 50 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2k0b n LYS 51 N -0.69 0.86 0.00 1.43 0.00 -1.26 -5.09 118.16 113.40 2k0b n LYS 51 Ca 0.21 -3.17 0.07 0.00 -0.00 0.00 0.00 58.31 55.42 2k0b n LYS 51 Cb 0.20 -1.46 0.41 0.00 -0.00 0.00 0.00 35.03 34.18 2k0b n LYS 51 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98