#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 3.87 0.26 1.61 0.01 -1.26 -5.02 113.70 113.17 2k0b s SER 2 Ca 0.00 -1.18 -0.30 0.00 1.31 0.00 0.00 55.95 55.79 2k0b s SER 2 Cb 0.00 -1.20 -0.09 0.00 0.21 0.00 0.00 66.02 64.94 2k0b s SER 2 CO 0.00 -0.23 1.29 -2.84 0.41 0.00 0.00 173.24 171.87 2k0b s PRO 3 N 1.38 4.41 0.00 12.44 0.02 -1.26 -4.86 135.00 147.12 2k0b s PRO 3 Ca -0.06 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.05 2k0b s PRO 3 Cb -0.19 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.19 2k0b s PRO 3 CO -0.06 -0.17 0.35 -2.30 -0.33 0.00 0.00 177.00 174.49 2k0b n PRO 4 N 1.75 0.55 -0.29 5.54 -0.02 -1.26 -1.11 135.00 140.17 2k0b n PRO 4 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 2k0b n PRO 4 Cb 0.43 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 32.71 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 0.02 0.07 -2.63 -0.52 1.02 -1.26 -4.81 120.64 112.53 2k0b n GLU 5 Ca 0.00 -0.84 -0.05 0.00 -0.02 0.00 0.00 57.16 56.25 2k0b n GLU 5 Cb 0.10 -0.53 0.10 0.00 -0.02 0.00 0.00 31.44 31.10 2k0b n GLU 5 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k0b n ALA 6 N -0.04 1.22 -1.52 0.62 0.00 -0.26 -4.85 120.51 115.68 2k0b n ALA 6 Ca 0.00 -1.06 -0.32 0.00 0.00 0.00 0.00 53.44 52.06 2k0b n ALA 6 Cb 0.61 -0.93 0.04 0.00 0.00 0.00 0.00 19.45 19.18 2k0b n ALA 6 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k0b s ASP 7 N -1.02 5.21 0.15 0.00 1.11 -0.78 -4.28 116.67 117.05 2k0b s ASP 7 Ca 0.15 1.90 0.09 0.00 0.18 0.00 0.00 52.55 54.88 2k0b s ASP 7 Cb 0.36 -2.54 0.51 0.00 1.07 0.00 0.00 42.92 42.32 2k0b s ASP 7 CO -0.09 -1.56 1.26 -0.81 1.18 0.00 0.00 175.17 175.14 2k0b n PRO 8 N -2.54 0.06 -0.06 8.23 -0.04 -1.26 0.78 135.00 140.17 2k0b n PRO 8 Ca 0.10 0.54 -0.22 0.00 -0.04 0.00 0.00 63.50 63.88 2k0b n PRO 8 Cb 0.52 -1.75 -0.13 0.00 -0.04 0.00 0.00 33.50 32.11 2k0b n PRO 8 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k0b n ARG 9 N -1.82 0.68 0.10 0.54 1.74 -1.26 -4.26 116.66 112.38 2k0b n ARG 9 Ca -0.01 0.30 0.08 0.00 -0.77 0.00 0.00 57.85 57.45 2k0b n ARG 9 Cb 0.06 -1.65 -0.00 0.00 -1.02 0.00 0.00 32.46 29.85 2k0b n ARG 9 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2k0b h LEU 10 N -0.27 0.00 -1.12 0.55 3.38 -1.19 0.16 115.31 116.82 2k0b h LEU 10 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2k0b h LEU 10 Cb 1.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.57 2k0b h LEU 10 CO -0.06 0.19 0.00 -0.29 0.09 0.00 0.00 178.44 178.37 2k0b h ILE 11 N 0.00 0.00 0.00 1.22 2.10 0.14 0.82 117.51 121.78 2k0b h ILE 11 Ca -0.04 -0.34 0.00 0.00 1.08 0.00 0.00 64.86 65.56 2k0b h ILE 11 Cb 1.19 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 38.11 2k0b h ILE 11 CO 0.02 0.00 -0.38 -0.62 -1.08 0.00 0.00 178.15 176.09 2k0b n GLU 12 N -2.63 0.25 0.10 2.19 -0.58 -1.16 -4.21 120.64 114.60 2k0b n GLU 12 Ca 0.01 0.25 -0.01 0.00 -0.42 0.00 0.00 57.16 56.99 2k0b n GLU 12 Cb 0.25 -1.10 -0.03 0.00 -0.57 0.00 0.00 31.44 29.99 2k0b n GLU 12 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 2k0b h SER 13 N -0.51 0.00 0.00 1.62 0.02 -0.71 -2.96 113.55 111.02 2k0b h SER 13 Ca 0.00 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.60 2k0b h SER 13 Cb 0.38 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.87 2k0b h SER 13 CO 0.00 0.66 -1.94 -0.11 -1.14 0.00 0.00 176.83 174.30 2k0b n LEU 14 N -3.21 1.97 0.26 5.07 -0.00 0.04 -4.33 117.00 116.81 2k0b n LEU 14 Ca -0.01 0.36 0.11 0.00 -0.00 0.00 0.00 56.01 56.47 2k0b n LEU 14 Cb 0.81 -0.90 0.71 0.00 -0.00 0.00 0.00 43.42 44.04 2k0b n LEU 14 CO 0.43 0.46 1.01 -1.28 -0.00 0.00 0.00 177.39 178.00 2k0b h SER 15 N -0.93 0.00 -0.49 1.96 0.87 0.37 0.29 113.55 115.63 2k0b h SER 15 Ca -0.53 0.00 0.10 0.00 -1.23 0.00 0.00 61.79 60.13 2k0b h SER 15 Cb 1.50 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.37 2k0b h SER 15 CO -0.30 0.09 -0.06 -0.61 -0.53 0.00 0.00 176.83 175.43 2k0b h GLN 16 N 0.00 0.06 0.00 2.24 -0.00 -1.70 -0.69 115.11 115.02 2k0b h GLN 16 Ca -0.00 -0.00 -0.36 0.00 -0.00 0.00 0.00 58.65 58.29 2k0b h GLN 16 Cb 0.20 -0.01 -0.06 0.00 0.00 0.00 0.00 27.48 27.60 2k0b h GLN 16 CO 0.01 0.04 -2.27 0.00 0.00 0.00 0.00 178.83 176.61 2k0b n MET 17 N -5.29 0.68 0.12 1.69 0.00 -0.92 -3.45 117.12 109.95 2k0b n MET 17 Ca 0.05 0.07 0.02 0.00 0.00 0.00 0.00 57.70 57.84 2k0b n MET 17 Cb 0.26 -1.57 0.39 0.00 0.00 0.00 0.00 33.22 32.30 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 0.21 -0.45 3.17 5.85 -0.37 0.11 115.31 123.83 2k0b h LEU 18 Ca -0.50 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.17 2k0b h LEU 18 Cb 2.16 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 43.14 2k0b h LEU 18 CO 0.03 0.38 -0.70 -1.20 -0.34 0.00 0.00 178.44 176.60 2k0b n SER 19 N -4.27 1.40 -0.04 1.25 7.64 -0.27 -4.28 113.62 115.05 2k0b n SER 19 Ca -0.01 -1.16 -0.11 0.00 1.01 0.00 0.00 58.87 58.60 2k0b n SER 19 Cb 0.27 0.68 -0.14 0.00 -1.01 0.00 0.00 64.21 64.01 2k0b n SER 19 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 2k0b n MET 20 N -0.83 0.66 0.00 1.43 0.00 -0.98 -4.99 117.12 112.42 2k0b n MET 20 Ca 0.07 0.22 0.00 0.00 -0.00 0.00 0.00 57.70 57.99 2k0b n MET 20 Cb 0.39 -1.72 0.00 0.00 0.00 0.00 0.00 33.22 31.89 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 1.68 1.85 3.53 -5.12 0.00 -0.68 -5.07 105.19 101.37 2k0b n GLY 21 Ca -0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 2k0b n GLY 21 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k0b s PHE 22 N -2.00 2.51 0.00 1.61 0.08 0.29 -5.05 117.98 115.42 2k0b s PHE 22 Ca 0.00 -0.27 0.00 0.00 0.12 0.00 0.00 56.93 56.78 2k0b s PHE 22 Cb 0.00 -1.19 0.00 0.00 -0.57 0.00 0.00 43.02 41.26 2k0b s PHE 22 CO 0.00 0.56 0.00 0.43 -0.10 0.00 0.00 175.22 176.11 2k0b n SER 23 N -0.13 0.00 -4.60 1.36 7.64 -1.26 -4.08 113.62 112.55 2k0b n SER 23 Ca -0.10 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.36 2k0b n SER 23 Cb 0.57 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.72 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 1.00 6.62 -0.76 6.43 -4.77 -1.26 -4.85 116.67 119.08 2k0b s ASP 24 Ca 0.00 0.49 -0.07 0.00 -3.30 0.00 0.00 52.55 49.67 2k0b s ASP 24 Cb 0.00 -2.43 -0.08 0.00 -1.09 0.00 0.00 42.92 39.32 2k0b s ASP 24 CO 0.00 -0.77 3.06 -0.62 0.70 0.00 0.00 175.17 177.54 2k0b n GLU 25 N 6.53 2.99 0.00 2.11 -0.58 -1.26 -3.79 120.64 126.65 2k0b n GLU 25 Ca 0.05 -2.03 0.00 0.00 -0.42 0.00 0.00 57.16 54.76 2k0b n GLU 25 Cb 0.48 -2.35 0.00 0.00 -0.57 0.00 0.00 31.44 29.00 2k0b n GLU 25 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k0b n GLY 26 N 2.31 0.87 0.00 0.62 0.00 -1.26 -4.80 105.19 102.94 2k0b n GLY 26 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.59 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 1.18 0.16 -0.02 0.00 -1.25 -5.00 105.19 100.25 2k0b n GLY 27 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 2k0b n GLY 27 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2k0b h TRP 28 N 0.00 0.00 -1.00 1.61 5.08 -1.87 -3.36 115.95 116.41 2k0b h TRP 28 Ca 0.00 0.00 0.25 0.00 1.08 0.00 0.00 58.89 60.22 2k0b h TRP 28 Cb 0.00 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 26.09 2k0b h TRP 28 CO 0.00 0.23 0.66 1.25 -1.28 0.00 0.00 178.44 179.30 2k0b h LEU 29 N 0.00 0.35 -0.24 0.11 5.85 -1.90 1.55 115.31 121.03 2k0b h LEU 29 Ca -0.02 0.05 -0.19 0.00 0.84 0.00 0.00 57.88 58.56 2k0b h LEU 29 Cb 1.19 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 2k0b h LEU 29 CO 0.03 0.10 -0.89 0.00 -0.34 0.00 0.00 178.44 177.34 2k0b h THR 30 N 0.32 1.62 0.00 1.05 1.03 -2.00 -3.35 112.91 111.59 2k0b h THR 30 Ca 0.53 -2.99 -0.13 0.00 -0.01 0.00 0.00 66.41 63.81 2k0b h THR 30 Cb 1.48 2.62 -0.02 0.00 -1.07 0.00 0.00 68.15 71.17 2k0b h THR 30 CO -0.20 0.86 -1.05 0.54 -0.01 0.00 0.00 175.52 175.66 2k0b n ARG 31 N -3.50 0.51 -0.27 0.00 1.74 0.20 -3.94 116.66 111.40 2k0b n ARG 31 Ca -0.01 0.48 -0.12 0.00 -0.77 0.00 0.00 57.85 57.43 2k0b n ARG 31 Cb 0.84 -1.66 -0.10 0.00 -1.02 0.00 0.00 32.46 30.52 2k0b n ARG 31 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2k0b h LEU 32 N -1.00 -2.00 -0.54 0.55 7.12 0.17 -2.30 115.31 117.31 2k0b h LEU 32 Ca -0.20 0.28 -0.15 0.00 0.13 0.00 0.00 57.88 57.94 2k0b h LEU 32 Cb 0.96 0.85 -0.01 0.00 -0.53 0.00 0.00 40.66 41.94 2k0b h LEU 32 CO -0.12 -0.32 -0.49 -0.07 -0.13 0.00 0.00 178.44 177.31 2k0b h LEU 33 N -0.21 0.67 -0.58 2.25 4.07 -1.73 -3.32 115.31 116.46 2k0b h LEU 33 Ca 0.12 -0.33 0.10 0.00 0.08 0.00 0.00 57.88 57.84 2k0b h LEU 33 Cb 0.51 -0.19 -0.08 0.00 1.08 0.00 0.00 40.66 41.98 2k0b h LEU 33 CO -0.76 1.05 0.14 -0.61 -1.08 0.00 0.00 178.44 177.18 2k0b h GLN 34 N 0.48 0.27 0.00 1.13 5.75 -1.54 0.75 115.11 121.96 2k0b h GLN 34 Ca 0.02 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2k0b h GLN 34 Cb 1.03 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.52 2k0b h GLN 34 CO 0.10 0.18 0.00 0.25 -2.65 0.00 0.00 178.83 176.71 2k0b n THR 35 N -5.10 0.41 -1.69 2.39 -2.24 -1.16 -3.43 114.28 103.46 2k0b n THR 35 Ca 0.08 -0.04 -0.23 0.00 -2.27 0.00 0.00 64.05 61.59 2k0b n THR 35 Cb 0.29 -0.66 0.08 0.00 -2.10 0.00 0.00 70.33 67.95 2k0b n THR 35 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2k0b n LYS 36 N -1.83 2.94 -4.43 -0.78 5.02 -0.29 -4.92 118.16 113.86 2k0b n LYS 36 Ca 0.06 -3.69 -0.41 0.00 -2.02 0.00 0.00 58.31 52.25 2k0b n LYS 36 Cb 0.34 -2.18 -0.07 0.00 -0.02 0.00 0.00 35.03 33.11 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 -0.87 -2.18 -2.41 4.39 6.94 -1.09 -2.43 115.26 117.61 2k0b n ASN 37 Ca 0.47 -1.16 -0.04 0.00 -0.02 0.00 0.00 54.58 53.84 2k0b n ASN 37 Cb 0.90 -1.87 0.01 0.00 -2.36 0.00 0.00 39.78 36.46 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 -4.10 -2.21 -4.05 -2.53 4.01 0.24 -5.02 117.16 103.51 2k0b n TYR 38 Ca 0.11 0.88 -0.35 0.00 -0.16 0.00 0.00 57.90 58.38 2k0b n TYR 38 Cb 0.46 -3.20 -0.11 0.00 -0.31 0.00 0.00 39.34 36.18 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 -2.19 5.21 0.06 7.72 -1.08 -1.02 -4.81 116.67 120.56 2k0b s ASP 39 Ca 0.13 -0.08 0.24 0.00 -0.52 0.00 0.00 52.55 52.32 2k0b s ASP 39 Cb -0.04 -1.89 0.34 0.00 -1.46 0.00 0.00 42.92 39.87 2k0b s ASP 39 CO 0.50 0.11 1.29 2.30 0.52 0.00 0.00 175.17 179.89 2k0b n ILE 40 N 3.98 0.18 -0.33 4.11 -0.00 -1.26 -3.11 119.36 122.94 2k0b n ILE 40 Ca -0.17 -0.16 -0.03 0.00 -0.00 0.00 0.00 62.75 62.39 2k0b n ILE 40 Cb 0.52 0.09 0.09 0.00 -0.00 0.00 0.00 39.64 40.34 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 4.70 1.25 0.41 3.28 0.00 -1.99 0.55 103.07 111.28 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 -1.38 0.00 0.00 0.00 0.00 176.54 175.63 2k0b n ALA 42 N -2.35 3.10 -0.09 3.60 0.00 -1.26 -4.16 120.51 119.35 2k0b n ALA 42 Ca 0.10 -0.43 -0.13 0.00 0.00 0.00 0.00 53.44 52.98 2k0b n ALA 42 Cb 0.02 -0.90 -0.05 0.00 0.00 0.00 0.00 19.45 18.52 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 2.26 0.39 0.00 0.00 0.00 -1.40 -3.11 119.26 117.39 2k0b h ALA 43 Ca 0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 2k0b h ALA 43 Cb 0.87 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2k0b h ALA 43 CO 0.00 0.40 -0.09 -0.07 0.00 0.00 0.00 179.25 179.49 2k0b h LEU 44 N 0.39 0.00 -1.05 0.00 4.07 -1.06 -2.53 115.31 115.13 2k0b h LEU 44 Ca 0.04 0.00 0.11 0.00 0.08 0.00 0.00 57.88 58.11 2k0b h LEU 44 Cb 0.86 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 42.52 2k0b h LEU 44 CO 0.07 0.09 0.63 -0.78 -1.08 0.00 0.00 178.44 177.37 2k0b h ASP 45 N 0.00 0.92 0.31 -0.43 3.58 -1.55 -1.97 116.42 117.28 2k0b h ASP 45 Ca -0.00 0.04 -0.15 0.00 0.42 0.00 0.00 57.03 57.34 2k0b h ASP 45 Cb 0.19 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 2k0b h ASP 45 CO 0.01 0.51 -1.83 0.35 -2.88 0.00 0.00 179.24 175.40 2k0b n THR 46 N -4.59 0.80 -0.85 2.25 -2.24 -1.00 -2.30 114.28 106.35 2k0b n THR 46 Ca 0.18 -0.66 -0.10 0.00 -2.27 0.00 0.00 64.05 61.20 2k0b n THR 46 Cb 0.33 -0.39 -0.06 0.00 -2.10 0.00 0.00 70.33 68.11 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 -2.63 2.63 -1.34 2.28 -5.35 -0.99 -4.64 119.36 109.32 2k0b n ILE 47 Ca -0.13 -1.33 0.00 0.00 -0.27 0.00 0.00 62.75 61.02 2k0b n ILE 47 Cb 0.81 -1.66 0.00 0.00 -1.74 0.00 0.00 39.64 37.05 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 1.59 0.00 -3.15 6.28 6.02 -1.25 -4.98 117.38 121.89 2k0b n GLN 48 Ca 0.25 0.20 -0.19 0.00 -0.01 0.00 0.00 57.00 57.24 2k0b n GLN 48 Cb 0.66 -3.23 -0.04 0.00 1.02 0.00 0.00 30.24 28.66 2k0b n GLN 48 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2k0b n TYR 49 N -3.27 -0.28 1.80 1.08 4.01 -0.76 -4.95 117.16 114.79 2k0b n TYR 49 Ca 0.00 -3.58 0.03 0.00 -0.16 0.00 0.00 57.90 54.19 2k0b n TYR 49 Cb 0.24 -0.23 0.12 0.00 -0.31 0.00 0.00 39.34 39.15 2k0b n TYR 49 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2k0b n SER 50 N 0.74 0.35 -0.88 7.72 2.88 -0.97 -2.45 113.62 121.01 2k0b n SER 50 Ca 0.22 -1.90 0.04 0.00 -1.33 0.00 0.00 58.87 55.89 2k0b n SER 50 Cb 0.61 -0.04 0.06 0.00 -0.75 0.00 0.00 64.21 64.09 2k0b n SER 50 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2k0b n LYS 51 N -0.35 0.41 0.00 -1.46 5.02 -1.26 -5.00 118.16 115.52 2k0b n LYS 51 Ca 0.04 -1.98 0.00 0.00 -2.02 0.00 0.00 58.31 54.35 2k0b n LYS 51 Cb 0.07 -0.60 0.00 0.00 -0.02 0.00 0.00 35.03 34.48 2k0b n LYS 51 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49