#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 7.29 0.39 1.61 0.15 -1.26 -5.02 113.70 116.86 2k0b s SER 2 Ca 0.00 1.56 -0.27 0.00 0.70 0.00 0.00 55.95 57.94 2k0b s SER 2 Cb 0.00 -2.53 -0.09 0.00 -1.71 0.00 0.00 66.02 61.68 2k0b s SER 2 CO 0.00 -0.22 1.35 -2.16 1.20 0.00 0.00 173.24 173.41 2k0b s PRO 3 N 0.90 4.02 0.00 5.44 0.04 -1.26 -4.79 135.00 139.35 2k0b s PRO 3 Ca 0.48 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.79 2k0b s PRO 3 Cb -0.20 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.50 2k0b s PRO 3 CO 0.26 -0.49 0.89 -2.30 0.04 0.00 0.00 177.00 175.41 2k0b n PRO 4 N 0.26 0.64 -0.11 0.56 -0.02 -1.26 -1.69 135.00 133.38 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 0.42 -1.18 0.00 0.00 -0.02 0.00 0.00 33.50 32.73 2k0b n PRO 4 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2k0b n GLU 5 N 1.07 0.10 -0.50 -0.52 2.13 -1.26 -4.79 120.64 116.86 2k0b n GLU 5 Ca 0.00 -0.65 -0.02 0.00 0.66 0.00 0.00 57.16 57.15 2k0b n GLU 5 Cb 0.32 -0.52 -0.02 0.00 0.27 0.00 0.00 31.44 31.49 2k0b n GLU 5 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k0b n ALA 6 N -0.03 0.34 -1.89 4.31 0.00 -0.88 -4.74 120.51 117.62 2k0b n ALA 6 Ca 0.00 -0.15 -0.36 0.00 0.00 0.00 0.00 53.44 52.93 2k0b n ALA 6 Cb 0.54 -0.19 -0.06 0.00 0.00 0.00 0.00 19.45 19.73 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 -0.22 7.16 0.60 0.00 2.15 -0.68 -4.61 116.67 121.07 2k0b s ASP 7 Ca 0.00 1.68 0.30 0.00 0.43 0.00 0.00 52.55 54.96 2k0b s ASP 7 Cb 0.00 -2.52 1.14 0.00 -0.30 0.00 0.00 42.92 41.24 2k0b s ASP 7 CO 0.00 -0.11 1.46 -0.65 -0.17 0.00 0.00 175.17 175.70 2k0b h PRO 8 N 2.93 0.00 0.08 4.34 0.11 -1.95 0.79 132.00 138.30 2k0b h PRO 8 Ca -0.47 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.27 2k0b h PRO 8 Cb 1.19 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2k0b h PRO 8 CO 0.64 0.00 -2.10 0.54 -0.21 0.00 0.00 178.00 176.88 2k0b n ARG 9 N -3.44 0.72 0.01 1.05 3.00 -1.26 -4.35 116.66 112.40 2k0b n ARG 9 Ca 0.23 0.23 0.11 0.00 -0.01 0.00 0.00 57.85 58.41 2k0b n ARG 9 Cb 1.42 -1.67 -0.07 0.00 0.00 0.00 0.00 32.46 32.14 2k0b n ARG 9 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2k0b n LEU 10 N -3.36 0.52 0.25 0.55 4.77 0.70 -1.85 117.00 118.58 2k0b n LEU 10 Ca -0.34 -0.10 0.16 0.00 -0.03 0.00 0.00 56.01 55.70 2k0b n LEU 10 Cb 1.04 -0.04 0.56 0.00 -2.33 0.00 0.00 43.42 42.65 2k0b n LEU 10 CO 0.39 0.06 0.95 -0.29 -1.33 0.00 0.00 177.39 177.17 2k0b h ILE 11 N 0.00 0.00 0.00 -0.08 2.10 0.18 0.88 117.51 120.59 2k0b h ILE 11 Ca 0.00 -0.60 -0.30 0.00 1.08 0.00 0.00 64.86 65.04 2k0b h ILE 11 Cb 0.78 1.58 -0.05 0.00 -1.09 0.00 0.00 36.82 38.05 2k0b h ILE 11 CO 0.00 0.00 -1.73 -0.62 -1.08 0.00 0.00 178.15 174.72 2k0b n GLU 12 N -3.03 0.57 -0.05 2.19 1.02 -1.24 -4.20 120.64 115.89 2k0b n GLU 12 Ca 0.01 0.43 -0.08 0.00 -0.02 0.00 0.00 57.16 57.50 2k0b n GLU 12 Cb 0.35 -1.63 -0.15 0.00 -0.02 0.00 0.00 31.44 30.00 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 -4.37 0.47 -0.05 1.62 7.64 -0.77 -3.54 113.62 114.61 2k0b n SER 13 Ca -0.39 0.22 -0.20 0.00 1.01 0.00 0.00 58.87 59.51 2k0b n SER 13 Cb 0.73 0.46 -0.13 0.00 -1.01 0.00 0.00 64.21 64.26 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 -2.89 2.73 0.23 -3.43 0.00 0.49 -3.76 117.00 110.36 2k0b n LEU 14 Ca -0.23 0.09 0.09 0.00 0.00 0.00 0.00 56.01 55.95 2k0b n LEU 14 Cb 1.08 -1.03 0.54 0.00 0.00 0.00 0.00 43.42 44.01 2k0b n LEU 14 CO 0.44 0.86 0.85 -1.28 0.00 0.00 0.00 177.39 178.26 2k0b h SER 15 N -0.02 0.00 0.79 1.96 0.87 0.45 -1.02 113.55 116.57 2k0b h SER 15 Ca -0.49 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 59.95 2k0b h SER 15 Cb 1.95 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.89 2k0b h SER 15 CO -0.00 0.23 -0.58 0.06 -0.53 0.00 0.00 176.83 176.01 2k0b h GLN 16 N 0.00 0.00 -0.51 2.24 -0.00 -1.72 -1.13 115.11 113.99 2k0b h GLN 16 Ca -0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 58.65 58.58 2k0b h GLN 16 Cb 0.55 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.01 2k0b h GLN 16 CO 0.03 0.58 0.06 0.52 -0.00 0.00 0.00 178.83 180.02 2k0b h MET 17 N 0.00 0.86 -0.25 0.06 2.86 -1.30 0.16 114.93 117.32 2k0b h MET 17 Ca -0.01 -0.24 -0.10 0.00 -2.06 0.00 0.00 59.70 57.29 2k0b h MET 17 Cb 1.13 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.68 2k0b h MET 17 CO 0.08 0.86 -0.26 -0.07 1.06 0.00 0.00 176.91 178.58 2k0b h LEU 18 N 0.74 0.49 0.09 1.22 -0.00 -1.03 0.34 115.31 117.16 2k0b h LEU 18 Ca 0.15 -0.17 -0.30 0.00 -0.00 0.00 0.00 57.88 57.57 2k0b h LEU 18 Cb 0.43 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 40.94 2k0b h LEU 18 CO 0.01 0.74 -1.52 0.77 -0.00 0.00 0.00 178.44 178.44 2k0b h SER 19 N 0.43 0.31 1.40 -0.43 4.64 -0.94 -3.33 113.55 115.63 2k0b h SER 19 Ca 0.06 -0.45 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 2k0b h SER 19 Cb 0.68 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 2k0b h SER 19 CO 0.05 1.38 0.00 0.24 -0.87 0.00 0.00 176.83 177.63 2k0b h MET 20 N 0.05 0.00 -0.10 4.77 2.86 -0.74 -3.47 114.93 118.31 2k0b h MET 20 Ca -0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.41 2k0b h MET 20 Cb 1.99 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.65 2k0b h MET 20 CO 0.15 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.53 2k0b n GLY 21 N 1.09 0.77 2.84 8.32 0.00 -1.07 -5.08 105.19 112.06 2k0b n GLY 21 Ca 0.05 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.12 0.51 0.00 1.61 3.72 0.12 -5.05 117.46 118.25 2k0b n PHE 22 Ca 0.00 -2.09 0.00 0.00 -0.05 0.00 0.00 57.45 55.31 2k0b n PHE 22 Cb 0.03 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.44 2k0b n PHE 22 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2k0b n SER 23 N -1.45 2.06 -4.18 4.37 7.64 -1.26 -4.24 113.62 116.56 2k0b n SER 23 Ca -0.11 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.47 2k0b n SER 23 Cb 0.51 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.54 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 1.85 2.76 -0.93 6.43 1.47 -1.26 -4.83 116.67 122.15 2k0b s ASP 24 Ca 0.00 -0.48 -0.02 0.00 1.18 0.00 0.00 52.55 53.22 2k0b s ASP 24 Cb 0.00 -1.13 0.27 0.00 -0.34 0.00 0.00 42.92 41.73 2k0b s ASP 24 CO 0.00 0.15 2.09 1.21 0.68 0.00 0.00 175.17 179.30 2k0b n GLU 25 N 3.44 3.98 0.00 2.11 2.13 -1.26 -4.27 120.64 126.77 2k0b n GLU 25 Ca -0.19 -3.81 0.00 0.00 0.66 0.00 0.00 57.16 53.82 2k0b n GLU 25 Cb 0.53 -2.38 0.00 0.00 0.27 0.00 0.00 31.44 29.86 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 0.11 -0.76 1.00 8.31 0.00 -1.26 -4.84 105.19 107.75 2k0b n GLY 26 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 0.74 0.15 -0.02 0.00 -1.26 -4.94 105.19 99.86 2k0b n GLY 27 Ca 0.00 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.50 0.00 0.28 1.61 4.27 -1.26 -4.16 117.44 115.68 2k0b n TRP 28 Ca 0.00 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.74 2k0b n TRP 28 Cb 0.00 -0.18 0.84 0.00 -1.36 0.00 0.00 31.31 30.61 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 0.74 0.00 0.00 5.67 5.85 -1.92 0.83 115.31 126.48 2k0b h LEU 29 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2k0b h LEU 29 Cb 0.44 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.47 2k0b h LEU 29 CO 0.00 0.00 -0.79 0.35 -0.34 0.00 0.00 178.44 177.66 2k0b n THR 30 N -4.04 0.06 -0.06 1.05 -2.24 -1.26 -4.21 114.28 103.57 2k0b n THR 30 Ca -0.03 -0.08 -0.05 0.00 -2.27 0.00 0.00 64.05 61.62 2k0b n THR 30 Cb 0.10 0.42 -0.02 0.00 -2.10 0.00 0.00 70.33 68.73 2k0b n THR 30 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2k0b n ARG 31 N -1.65 0.39 0.00 -0.78 5.12 0.79 -4.22 116.66 116.32 2k0b n ARG 31 Ca 0.04 0.32 0.00 0.00 -1.93 0.00 0.00 57.85 56.28 2k0b n ARG 31 Cb 0.37 -1.38 0.00 0.00 -1.16 0.00 0.00 32.46 30.29 2k0b n ARG 31 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 2k0b n LEU 32 N -4.11 0.00 -0.08 0.55 -0.00 0.25 -2.53 117.00 111.07 2k0b n LEU 32 Ca -0.08 0.88 -0.06 0.00 -0.00 0.00 0.00 56.01 56.74 2k0b n LEU 32 Cb 0.31 -0.38 -0.00 0.00 -0.00 0.00 0.00 43.42 43.35 2k0b n LEU 32 CO 0.13 -0.38 0.80 -0.07 -0.00 0.00 0.00 177.39 177.87 2k0b h LEU 33 N 0.00 -0.29 -1.60 -1.96 4.07 -1.74 -2.50 115.31 111.29 2k0b h LEU 33 Ca 0.00 0.09 0.28 0.00 0.08 0.00 0.00 57.88 58.33 2k0b h LEU 33 Cb 0.00 0.19 -0.07 0.00 1.08 0.00 0.00 40.66 41.86 2k0b h LEU 33 CO 0.00 -0.10 0.70 -0.61 -1.08 0.00 0.00 178.44 177.35 2k0b h GLN 34 N -0.00 0.25 -0.02 1.13 5.75 -1.71 0.71 115.11 121.22 2k0b h GLN 34 Ca 0.15 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 2k0b h GLN 34 Cb 0.23 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.72 2k0b h GLN 34 CO -0.32 0.16 -0.27 2.41 -2.65 0.00 0.00 178.83 178.16 2k0b n THR 35 N -4.47 0.00 -2.09 2.39 -1.04 -0.96 -4.42 114.28 103.69 2k0b n THR 35 Ca 0.24 -0.34 -0.14 0.00 -2.04 0.00 0.00 64.05 61.77 2k0b n THR 35 Cb 0.96 1.27 0.06 0.00 -1.82 0.00 0.00 70.33 70.80 2k0b n THR 35 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2k0b n LYS 36 N 0.45 2.81 -1.88 -2.82 5.02 -0.10 -4.92 118.16 116.72 2k0b n LYS 36 Ca 0.12 -3.82 -0.11 0.00 -2.02 0.00 0.00 58.31 52.47 2k0b n LYS 36 Cb 0.51 -1.96 -0.02 0.00 -0.02 0.00 0.00 35.03 33.53 2k0b n LYS 36 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2k0b n ASN 37 N -0.72 -3.87 -3.38 4.39 5.15 -1.19 -3.67 115.26 111.98 2k0b n ASN 37 Ca 0.32 0.09 -0.16 0.00 -0.60 0.00 0.00 54.58 54.24 2k0b n ASN 37 Cb 0.90 -2.83 0.03 0.00 -0.53 0.00 0.00 39.78 37.35 2k0b n ASN 37 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2k0b n TYR 38 N -3.52 -2.44 -4.06 1.20 4.02 0.23 -4.97 117.16 107.62 2k0b n TYR 38 Ca -0.12 0.84 -0.35 0.00 -0.01 0.00 0.00 57.90 58.26 2k0b n TYR 38 Cb 0.51 -3.75 -0.09 0.00 -0.02 0.00 0.00 39.34 35.99 2k0b n TYR 38 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 2k0b s ASP 39 N -3.22 5.67 0.00 7.72 -4.77 -1.24 -4.83 116.67 116.01 2k0b s ASP 39 Ca 0.24 0.16 0.26 0.00 -3.30 0.00 0.00 52.55 49.91 2k0b s ASP 39 Cb -0.06 -1.88 0.72 0.00 -1.09 0.00 0.00 42.92 40.61 2k0b s ASP 39 CO 0.80 0.26 1.54 2.30 0.70 0.00 0.00 175.17 180.77 2k0b n ILE 40 N 2.97 0.00 -0.03 2.11 -0.00 -1.26 -2.94 119.36 120.21 2k0b n ILE 40 Ca -0.18 -0.17 -0.07 0.00 -0.00 0.00 0.00 62.75 62.33 2k0b n ILE 40 Cb 0.53 0.53 0.10 0.00 -0.00 0.00 0.00 39.64 40.81 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 4.90 0.67 0.31 3.28 0.00 -1.98 -2.17 103.07 108.08 2k0b h GLY 41 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 47.33 46.69 2k0b h GLY 41 CO 0.00 0.58 -1.49 0.00 0.00 0.00 0.00 176.54 175.63 2k0b n ALA 42 N -2.50 3.11 -0.07 3.60 0.00 -1.25 -4.14 120.51 119.26 2k0b n ALA 42 Ca -0.01 -0.45 -0.12 0.00 0.00 0.00 0.00 53.44 52.85 2k0b n ALA 42 Cb 0.49 -0.87 -0.06 0.00 0.00 0.00 0.00 19.45 19.02 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 2.23 0.27 -0.32 0.00 0.00 -1.40 -2.98 119.26 117.06 2k0b h ALA 43 Ca 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 2k0b h ALA 43 Cb 0.88 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2k0b h ALA 43 CO 0.00 0.10 0.02 -0.07 0.00 0.00 0.00 179.25 179.30 2k0b h LEU 44 N 0.09 0.44 -1.18 0.00 4.07 -1.59 -2.52 115.31 114.63 2k0b h LEU 44 Ca 0.04 -0.07 0.03 0.00 0.08 0.00 0.00 57.88 57.96 2k0b h LEU 44 Cb 0.58 -0.12 -0.05 0.00 1.08 0.00 0.00 40.66 42.16 2k0b h LEU 44 CO 0.03 0.50 0.56 -0.78 -1.08 0.00 0.00 178.44 177.67 2k0b h ASP 45 N 0.47 0.92 0.09 -0.43 3.58 -1.68 -0.43 116.42 118.94 2k0b h ASP 45 Ca 0.10 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.54 2k0b h ASP 45 Cb 0.28 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2k0b h ASP 45 CO 0.01 0.64 -0.49 0.35 -2.88 0.00 0.00 179.24 176.86 2k0b n THR 46 N -4.44 0.00 -0.06 2.25 -2.24 -0.97 -0.89 114.28 107.92 2k0b n THR 46 Ca 0.11 -0.17 -0.04 0.00 -2.27 0.00 0.00 64.05 61.69 2k0b n THR 46 Cb 0.10 0.90 -0.16 0.00 -2.10 0.00 0.00 70.33 69.08 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 1.02 0.00 2.28 -6.64 -1.09 -4.53 119.36 109.89 2k0b n ILE 47 Ca 0.09 -0.75 0.00 0.00 -1.77 0.00 0.00 62.75 60.32 2k0b n ILE 47 Cb 0.41 -0.39 0.00 0.00 -1.44 0.00 0.00 39.64 38.22 2k0b n ILE 47 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2k0b n GLN 48 N -2.65 0.00 -0.29 6.28 3.00 -1.16 -4.84 117.38 117.72 2k0b n GLN 48 Ca -0.23 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.75 2k0b n GLN 48 Cb 0.98 -0.00 0.01 0.00 0.00 0.00 0.00 30.24 31.22 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 -1.09 0.14 1.68 1.08 4.02 -0.18 -3.98 117.16 118.83 2k0b n TYR 49 Ca 0.00 -0.82 0.15 0.00 -0.01 0.00 0.00 57.90 57.22 2k0b n TYR 49 Cb 0.00 -0.41 0.80 0.00 -0.02 0.00 0.00 39.34 39.71 2k0b n TYR 49 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2k0b n SER 50 N 0.90 0.19 -0.08 7.72 2.88 -0.07 -2.32 113.62 122.84 2k0b n SER 50 Ca 0.03 -0.70 0.10 0.00 -1.33 0.00 0.00 58.87 56.97 2k0b n SER 50 Cb 0.53 -0.10 0.14 0.00 -0.75 0.00 0.00 64.21 64.03 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 -1.00 1.28 0.00 -1.46 5.02 -1.26 -5.08 118.16 115.67 2k0b n LYS 51 Ca 0.19 -2.59 0.14 0.00 -2.02 0.00 0.00 58.31 54.03 2k0b n LYS 51 Cb 0.20 -1.50 0.44 0.00 -0.02 0.00 0.00 35.03 34.15 2k0b n LYS 51 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46