#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 6.37 0.59 1.61 0.01 -1.26 -5.08 113.70 115.94 2k0b s SER 2 Ca 0.00 1.27 0.00 0.00 1.31 0.00 0.00 55.95 58.53 2k0b s SER 2 Cb 0.00 -2.39 0.05 0.00 0.21 0.00 0.00 66.02 63.89 2k0b s SER 2 CO 0.00 -0.65 0.83 -2.16 0.41 0.00 0.00 173.24 171.67 2k0b s PRO 3 N -4.59 2.40 0.88 12.44 0.04 -1.26 -5.08 135.00 139.83 2k0b s PRO 3 Ca 0.53 -0.77 -0.11 0.00 0.04 0.00 0.00 61.00 60.69 2k0b s PRO 3 Cb -0.10 -2.44 0.12 0.00 0.04 0.00 0.00 34.50 32.12 2k0b s PRO 3 CO 0.43 -0.86 1.15 -2.14 0.04 0.00 0.00 177.00 175.62 2k0b s PRO 4 N -4.86 1.28 -0.90 0.56 0.02 -1.26 -4.86 135.00 124.98 2k0b s PRO 4 Ca 0.59 1.55 -0.25 0.00 0.02 0.00 0.00 61.00 62.91 2k0b s PRO 4 Cb -0.10 -1.76 0.02 0.00 0.02 0.00 0.00 34.50 32.69 2k0b s PRO 4 CO 0.40 -2.44 1.55 -2.00 -0.33 0.00 0.00 177.00 174.18 2k0b s GLU 5 N -4.58 3.21 -0.94 5.54 2.12 -1.26 -3.88 118.70 118.92 2k0b s GLU 5 Ca 0.67 -0.60 -0.06 0.00 0.36 0.00 0.00 54.97 55.34 2k0b s GLU 5 Cb -0.23 -4.95 -0.03 0.00 0.26 0.00 0.00 34.13 29.18 2k0b s GLU 5 CO 0.56 -2.48 0.79 0.00 -0.54 0.00 0.00 175.26 173.60 2k0b n ALA 6 N 10.36 -2.53 -2.60 6.30 0.00 -1.26 -4.99 120.51 125.78 2k0b n ALA 6 Ca 0.27 -0.01 -0.32 0.00 0.00 0.00 0.00 53.44 53.37 2k0b n ALA 6 Cb 0.50 -3.54 -0.05 0.00 0.00 0.00 0.00 19.45 16.35 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 -3.23 6.54 0.22 0.00 -1.08 -1.25 -4.69 116.67 113.18 2k0b s ASP 7 Ca 0.26 0.69 0.06 0.00 -0.52 0.00 0.00 52.55 53.04 2k0b s ASP 7 Cb -0.05 -2.13 0.34 0.00 -1.46 0.00 0.00 42.92 39.62 2k0b s ASP 7 CO 0.78 0.04 1.00 -2.65 0.52 0.00 0.00 175.17 174.85 2k0b n PRO 8 N 0.12 0.05 -0.03 4.34 -0.02 -1.26 0.18 135.00 138.38 2k0b n PRO 8 Ca -0.02 0.44 -0.13 0.00 -2.02 0.00 0.00 63.50 61.76 2k0b n PRO 8 Cb 0.52 -2.04 -0.10 0.00 -0.02 0.00 0.00 33.50 31.86 2k0b n PRO 8 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k0b h ARG 9 N 0.00 0.10 0.00 -0.52 2.47 -1.98 -3.16 114.38 111.30 2k0b h ARG 9 Ca 0.00 -0.07 -0.40 0.00 -1.26 0.00 0.00 59.98 58.25 2k0b h ARG 9 Cb 0.78 0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 29.04 2k0b h ARG 9 CO 0.00 0.65 -2.48 1.28 0.56 0.00 0.00 179.97 179.98 2k0b n LEU 10 N -4.72 2.86 0.30 3.04 4.77 0.13 -2.50 117.00 120.89 2k0b n LEU 10 Ca -0.08 -0.08 0.18 0.00 -0.03 0.00 0.00 56.01 55.99 2k0b n LEU 10 Cb 0.33 -0.90 0.94 0.00 -2.33 0.00 0.00 43.42 41.47 2k0b n LEU 10 CO 0.36 0.90 1.09 -0.29 -1.33 0.00 0.00 177.39 178.11 2k0b h ILE 11 N -0.12 0.25 0.00 -0.08 2.10 -0.70 0.69 117.51 119.66 2k0b h ILE 11 Ca -0.59 -0.23 -0.01 0.00 1.08 0.00 0.00 64.86 65.10 2k0b h ILE 11 Cb 1.86 1.18 -0.00 0.00 -1.09 0.00 0.00 36.82 38.77 2k0b h ILE 11 CO -0.13 0.03 -0.76 -0.62 -1.08 0.00 0.00 178.15 175.60 2k0b n GLU 12 N -3.38 0.49 0.08 2.19 4.71 -1.19 -4.16 120.64 119.37 2k0b n GLU 12 Ca -0.02 0.40 0.01 0.00 -0.01 0.00 0.00 57.16 57.53 2k0b n GLU 12 Cb 0.16 -1.59 -0.04 0.00 -1.01 0.00 0.00 31.44 28.96 2k0b n GLU 12 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 2k0b h SER 13 N -1.00 0.00 0.08 1.62 0.02 -1.41 -2.56 113.55 110.30 2k0b h SER 13 Ca -0.02 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.56 2k0b h SER 13 Cb 0.74 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.25 2k0b h SER 13 CO -0.01 0.57 -2.10 -0.11 -1.14 0.00 0.00 176.83 174.04 2k0b n LEU 14 N -3.05 2.68 0.19 5.07 0.00 0.92 -3.84 117.00 118.98 2k0b n LEU 14 Ca -0.05 0.13 0.14 0.00 0.00 0.00 0.00 56.01 56.24 2k0b n LEU 14 Cb 0.80 -1.05 0.62 0.00 0.00 0.00 0.00 43.42 43.79 2k0b n LEU 14 CO 0.42 0.84 0.92 -1.28 0.00 0.00 0.00 177.39 178.30 2k0b h SER 15 N -0.02 0.00 -0.59 1.96 0.87 0.01 -0.57 113.55 115.20 2k0b h SER 15 Ca -0.47 0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.17 2k0b h SER 15 Cb 1.96 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.85 2k0b h SER 15 CO 0.02 0.00 0.26 -0.61 -0.53 0.00 0.00 176.83 175.97 2k0b h GLN 16 N 0.00 0.47 0.00 2.24 -0.00 -1.56 -2.92 115.11 113.34 2k0b h GLN 16 Ca 0.00 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.65 58.61 2k0b h GLN 16 Cb 0.34 -0.11 -0.00 0.00 0.00 0.00 0.00 27.48 27.71 2k0b h GLN 16 CO 0.00 0.31 -2.00 0.00 0.00 0.00 0.00 178.83 177.14 2k0b n MET 17 N -4.93 0.66 0.01 1.69 0.00 -0.91 -3.82 117.12 109.82 2k0b n MET 17 Ca 0.08 -0.19 -0.11 0.00 0.00 0.00 0.00 57.70 57.47 2k0b n MET 17 Cb 0.22 -1.52 -0.06 0.00 0.00 0.00 0.00 33.22 31.86 2k0b n MET 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 2k0b h LEU 18 N 0.00 0.08 -2.54 3.17 5.85 -0.96 -2.00 115.31 118.91 2k0b h LEU 18 Ca -0.02 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2k0b h LEU 18 Cb 1.04 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.05 2k0b h LEU 18 CO 0.00 0.06 0.00 -1.54 -0.34 0.00 0.00 178.44 176.62 2k0b n SER 19 N -5.04 3.70 -0.01 1.25 3.41 -1.12 -4.22 113.62 111.59 2k0b n SER 19 Ca -0.06 -2.00 -0.05 0.00 -0.26 0.00 0.00 58.87 56.50 2k0b n SER 19 Cb 0.03 -0.44 -0.12 0.00 -0.26 0.00 0.00 64.21 63.42 2k0b n SER 19 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 2k0b n MET 20 N 1.54 0.63 0.00 4.33 0.00 -1.09 -4.97 117.12 117.57 2k0b n MET 20 Ca 0.23 0.23 0.00 0.00 -0.00 0.00 0.00 57.70 58.16 2k0b n MET 20 Cb 0.59 -1.76 0.00 0.00 0.00 0.00 0.00 33.22 32.05 2k0b n MET 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2k0b n GLY 21 N 1.51 1.55 1.80 -5.12 0.00 -1.19 -5.07 105.19 98.67 2k0b n GLY 21 Ca -0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.15 0.23 -2.40 1.61 3.72 -0.77 -5.09 117.46 114.60 2k0b n PHE 22 Ca 0.00 -1.21 0.00 0.00 -0.05 0.00 0.00 57.45 56.19 2k0b n PHE 22 Cb 0.00 -0.18 0.00 0.00 -0.94 0.00 0.00 39.48 38.36 2k0b n PHE 22 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2k0b n SER 23 N -1.32 0.00 -4.25 4.37 3.41 -1.26 -4.76 113.62 109.81 2k0b n SER 23 Ca -0.08 -0.34 -0.35 0.00 -0.26 0.00 0.00 58.87 57.84 2k0b n SER 23 Cb 0.31 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.13 2k0b n SER 23 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2k0b s ASP 24 N 0.99 4.61 0.42 4.04 1.47 -1.26 -4.84 116.67 122.10 2k0b s ASP 24 Ca 0.00 -0.80 0.18 0.00 1.18 0.00 0.00 52.55 53.11 2k0b s ASP 24 Cb 0.00 -1.74 1.10 0.00 -0.34 0.00 0.00 42.92 41.94 2k0b s ASP 24 CO 0.00 -0.15 1.85 -0.08 0.68 0.00 0.00 175.17 177.47 2k0b h GLU 25 N 8.09 0.38 0.00 2.11 4.81 -1.91 -3.37 114.58 124.68 2k0b h GLU 25 Ca -0.32 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 2k0b h GLU 25 Cb 1.12 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.41 2k0b h GLU 25 CO 0.58 0.25 0.00 0.41 -0.73 0.00 0.00 179.01 179.52 2k0b n GLY 26 N -1.52 0.02 0.59 1.92 0.00 -1.26 -5.03 105.19 99.91 2k0b n GLY 26 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 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 3.08 -0.31 0.02 -0.02 0.00 -1.26 -5.01 105.19 101.70 2k0b n GLY 27 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 0.00 0.00 0.08 1.61 4.27 -1.26 -4.57 117.44 117.57 2k0b n TRP 28 Ca -0.05 0.00 0.21 0.00 -3.89 0.00 0.00 57.50 53.76 2k0b n TRP 28 Cb 0.33 -0.06 0.74 0.00 -1.36 0.00 0.00 31.31 30.95 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 0.11 0.00 0.00 5.67 5.85 -1.92 0.83 115.31 125.85 2k0b h LEU 29 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2k0b h LEU 29 Cb 0.51 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 2k0b h LEU 29 CO 0.00 0.00 -0.36 0.71 -0.34 0.00 0.00 178.44 178.45 2k0b h THR 30 N 0.00 0.57 -0.32 1.05 1.35 -2.00 -3.35 112.91 110.22 2k0b h THR 30 Ca 0.20 -1.52 0.07 0.00 -0.55 0.00 0.00 66.41 64.61 2k0b h THR 30 Cb 1.14 1.18 -0.07 0.00 -1.73 0.00 0.00 68.15 68.66 2k0b h THR 30 CO -0.00 0.19 -0.19 0.03 -0.25 0.00 0.00 175.52 175.30 2k0b h ARG 31 N -1.00 -0.14 0.13 4.72 2.47 -1.34 -0.14 114.38 119.08 2k0b h ARG 31 Ca -0.06 0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.68 2k0b h ARG 31 Cb 0.60 0.03 -0.05 0.00 -1.65 0.00 0.00 29.97 28.90 2k0b h ARG 31 CO -0.04 -0.10 -0.51 1.25 0.56 0.00 0.00 179.97 181.13 2k0b h LEU 32 N -0.15 -1.54 -0.43 3.04 7.12 0.38 -1.75 115.31 121.98 2k0b h LEU 32 Ca 0.17 0.16 -0.02 0.00 0.13 0.00 0.00 57.88 58.32 2k0b h LEU 32 Cb 0.40 0.57 -0.02 0.00 -0.53 0.00 0.00 40.66 41.08 2k0b h LEU 32 CO -0.41 -0.55 0.19 -0.07 -0.13 0.00 0.00 178.44 177.47 2k0b h LEU 33 N -0.74 0.58 -0.67 2.25 4.07 -1.67 -2.43 115.31 116.70 2k0b h LEU 33 Ca -0.01 -0.15 0.14 0.00 0.08 0.00 0.00 57.88 57.94 2k0b h LEU 33 Cb 0.74 -0.15 -0.11 0.00 1.08 0.00 0.00 40.66 42.23 2k0b h LEU 33 CO -0.27 0.57 0.08 -0.61 -1.08 0.00 0.00 178.44 177.13 2k0b h GLN 34 N 0.55 0.19 0.00 1.13 5.75 -0.73 0.74 115.11 122.73 2k0b h GLN 34 Ca 0.14 -0.01 -0.08 0.00 -0.15 0.00 0.00 58.65 58.55 2k0b h GLN 34 Cb 0.16 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 2k0b h GLN 34 CO -0.01 0.12 -0.46 1.15 -2.65 0.00 0.00 178.83 176.97 2k0b h THR 35 N 0.19 0.65 -0.97 2.39 2.02 -1.25 -3.34 112.91 112.60 2k0b h THR 35 Ca 0.36 -1.93 -0.66 0.00 0.77 0.00 0.00 66.41 64.95 2k0b h THR 35 Cb 0.60 2.30 -0.31 0.00 -1.74 0.00 0.00 68.15 69.00 2k0b h THR 35 CO -0.51 0.37 0.66 0.29 0.37 0.00 0.00 175.52 176.70 2k0b n LYS 36 N -3.17 2.79 -2.37 6.66 5.02 -0.54 -4.88 118.16 121.67 2k0b n LYS 36 Ca 0.02 -3.39 -0.11 0.00 -2.02 0.00 0.00 58.31 52.81 2k0b n LYS 36 Cb 0.70 -2.28 -0.01 0.00 -0.02 0.00 0.00 35.03 33.41 2k0b n LYS 36 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2k0b n ASN 37 N -0.90 -3.53 -2.17 4.39 0.23 -1.11 -2.79 115.26 109.38 2k0b n ASN 37 Ca 0.60 0.23 -0.01 0.00 -0.53 0.00 0.00 54.58 54.88 2k0b n ASN 37 Cb 0.72 -3.04 0.00 0.00 -2.08 0.00 0.00 39.78 35.38 2k0b n ASN 37 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 2k0b n TYR 38 N -3.18 -1.34 -4.81 -2.53 4.01 0.25 -5.02 117.16 104.53 2k0b n TYR 38 Ca -0.13 0.51 -0.33 0.00 -0.16 0.00 0.00 57.90 57.80 2k0b n TYR 38 Cb 0.58 -2.64 -0.15 0.00 -0.31 0.00 0.00 39.34 36.83 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 -2.33 3.95 0.14 7.72 2.15 -1.12 -4.95 116.67 122.23 2k0b s ASP 39 Ca 0.02 -0.34 0.23 0.00 0.43 0.00 0.00 52.55 52.88 2k0b s ASP 39 Cb -0.00 -1.58 0.07 0.00 -0.30 0.00 0.00 42.92 41.10 2k0b s ASP 39 CO 0.33 0.17 1.07 2.30 -0.17 0.00 0.00 175.17 178.87 2k0b n ILE 40 N 3.50 0.45 -0.03 4.11 -0.00 -1.26 -2.83 119.36 123.30 2k0b n ILE 40 Ca -0.18 -0.43 0.01 0.00 -0.00 0.00 0.00 62.75 62.15 2k0b n ILE 40 Cb 0.53 -0.18 0.33 0.00 -0.00 0.00 0.00 39.64 40.32 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 4.21 0.64 0.12 3.28 0.00 -1.98 -0.41 103.07 108.92 2k0b h GLY 41 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2k0b h GLY 41 CO 0.00 0.30 -1.48 0.00 0.00 0.00 0.00 176.54 175.36 2k0b n ALA 42 N -2.47 3.58 -0.03 3.60 0.00 -1.25 -3.91 120.51 120.02 2k0b n ALA 42 Ca 0.03 -0.52 -0.15 0.00 0.00 0.00 0.00 53.44 52.80 2k0b n ALA 42 Cb 0.16 -0.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.78 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 2.43 0.44 0.00 0.00 0.00 -1.25 -2.85 119.26 118.03 2k0b h ALA 43 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2k0b h ALA 43 Cb 0.78 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2k0b h ALA 43 CO 0.00 0.69 0.00 -0.07 0.00 0.00 0.00 179.25 179.87 2k0b h LEU 44 N 0.54 0.00 -0.76 0.00 4.07 -1.27 -2.85 115.31 115.04 2k0b h LEU 44 Ca -0.02 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.82 2k0b h LEU 44 Cb 1.28 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.01 2k0b h LEU 44 CO 0.14 0.00 -0.40 -0.78 -1.08 0.00 0.00 178.44 176.32 2k0b h ASP 45 N 0.00 0.48 0.12 -0.43 1.82 -1.62 -0.83 116.42 115.96 2k0b h ASP 45 Ca 0.00 -0.21 0.00 0.00 -0.39 0.00 0.00 57.03 56.43 2k0b h ASP 45 Cb 0.77 -0.14 0.00 0.00 0.68 0.00 0.00 39.33 40.64 2k0b h ASP 45 CO 0.00 0.84 -0.48 0.35 -1.61 0.00 0.00 179.24 178.34 2k0b n THR 46 N -4.03 0.00 -0.10 2.25 -2.24 -1.09 -4.33 114.28 104.74 2k0b n THR 46 Ca -0.02 -0.16 -0.10 0.00 -2.27 0.00 0.00 64.05 61.51 2k0b n THR 46 Cb 0.50 0.84 -0.16 0.00 -2.10 0.00 0.00 70.33 69.41 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 -0.57 1.38 0.00 2.28 -5.35 -1.12 -4.65 119.36 111.34 2k0b n ILE 47 Ca 0.09 -0.85 0.00 0.00 -0.27 0.00 0.00 62.75 61.73 2k0b n ILE 47 Cb 0.40 -0.49 0.00 0.00 -1.74 0.00 0.00 39.64 37.81 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 -2.75 0.00 -0.08 6.28 3.00 -1.19 -4.92 117.38 117.71 2k0b n GLN 48 Ca -0.33 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.66 2k0b n GLN 48 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 30.24 31.39 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 -2.13 -2.31 -3.18 1.08 4.01 -0.32 -5.01 117.16 109.29 2k0b n TYR 49 Ca 0.00 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.52 2k0b n TYR 49 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 38.97 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 -1.79 -0.67 -2.59 7.72 7.64 -1.26 -4.30 113.62 118.36 2k0b n SER 50 Ca 0.00 -2.65 -0.13 0.00 1.01 0.00 0.00 58.87 57.09 2k0b n SER 50 Cb 0.00 -0.17 0.06 0.00 -1.01 0.00 0.00 64.21 63.09 2k0b n SER 50 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2k0b n LYS 51 N 2.08 -4.84 -0.70 1.43 3.00 -1.26 -4.95 118.16 112.92 2k0b n LYS 51 Ca 0.23 0.56 0.00 0.00 -0.00 0.00 0.00 58.31 59.10 2k0b n LYS 51 Cb 0.52 -4.75 0.00 0.00 0.00 0.00 0.00 35.03 30.80 2k0b n LYS 51 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12