#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 3.13 0.13 1.61 0.01 -1.26 -5.09 113.70 112.23 2k0b s SER 2 Ca 0.00 -0.99 -0.31 0.00 1.31 0.00 0.00 55.95 55.96 2k0b s SER 2 Cb 0.00 -0.22 -0.10 0.00 0.21 0.00 0.00 66.02 65.91 2k0b s SER 2 CO 0.00 -0.03 1.66 -2.16 0.41 0.00 0.00 173.24 173.12 2k0b s PRO 3 N -3.38 4.19 -0.85 12.44 0.04 -1.26 -4.67 135.00 141.50 2k0b s PRO 3 Ca 0.25 2.41 -0.20 0.00 0.04 0.00 0.00 61.00 63.50 2k0b s PRO 3 Cb -0.04 -3.39 -0.21 0.00 0.04 0.00 0.00 34.50 30.90 2k0b s PRO 3 CO 0.11 -0.71 2.34 -2.30 0.04 0.00 0.00 177.00 176.48 2k0b n PRO 4 N 4.87 0.37 0.00 0.56 -0.02 -1.26 -0.97 135.00 138.55 2k0b n PRO 4 Ca 0.15 -0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.18 2k0b n PRO 4 Cb 0.39 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.25 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 7.64 0.00 -1.34 -0.52 2.13 -1.26 -4.95 120.64 122.34 2k0b n GLU 5 Ca 0.55 0.00 0.02 0.00 0.66 0.00 0.00 57.16 58.38 2k0b n GLU 5 Cb 0.32 0.00 0.10 0.00 0.27 0.00 0.00 31.44 32.12 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 0.00 3.15 -1.56 4.31 0.00 -0.14 -4.09 120.51 122.18 2k0b n ALA 6 Ca 0.00 -2.90 -0.32 0.00 0.00 0.00 0.00 53.44 50.21 2k0b n ALA 6 Cb 0.00 -0.56 0.04 0.00 0.00 0.00 0.00 19.45 18.93 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 -2.82 5.41 0.18 0.00 1.11 -1.23 -4.54 116.67 114.77 2k0b s ASP 7 Ca 0.36 1.80 0.09 0.00 0.18 0.00 0.00 52.55 54.98 2k0b s ASP 7 Cb 0.38 -2.52 0.51 0.00 1.07 0.00 0.00 42.92 42.35 2k0b s ASP 7 CO -0.10 -1.42 1.20 -2.65 1.18 0.00 0.00 175.17 173.38 2k0b n PRO 8 N -2.57 0.06 -0.10 8.23 -0.02 -1.26 0.10 135.00 139.45 2k0b n PRO 8 Ca 0.09 0.50 -0.23 0.00 -2.02 0.00 0.00 63.50 61.84 2k0b n PRO 8 Cb 0.53 -1.86 -0.12 0.00 -0.02 0.00 0.00 33.50 32.03 2k0b n PRO 8 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2k0b n ARG 9 N -1.81 0.58 0.01 -0.52 1.74 -1.26 -4.43 116.66 110.98 2k0b n ARG 9 Ca -0.01 0.52 0.11 0.00 -0.77 0.00 0.00 57.85 57.70 2k0b n ARG 9 Cb 0.17 -1.72 -0.11 0.00 -1.02 0.00 0.00 32.46 29.78 2k0b n ARG 9 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2k0b n LEU 10 N -4.33 0.36 0.29 0.55 4.77 -0.31 -2.59 117.00 115.73 2k0b n LEU 10 Ca -0.35 -0.04 0.17 0.00 -0.03 0.00 0.00 56.01 55.76 2k0b n LEU 10 Cb 0.73 -0.02 0.81 0.00 -2.33 0.00 0.00 43.42 42.61 2k0b n LEU 10 CO 0.19 0.02 1.02 -0.29 -1.33 0.00 0.00 177.39 177.01 2k0b h ILE 11 N 0.00 0.17 0.03 -0.08 -0.00 0.54 0.82 117.51 118.98 2k0b h ILE 11 Ca 0.00 -0.45 -0.37 0.00 -0.00 0.00 0.00 64.86 64.05 2k0b h ILE 11 Cb 0.88 1.38 -0.05 0.00 -0.00 0.00 0.00 36.82 39.02 2k0b h ILE 11 CO 0.00 0.04 -2.06 -0.62 -0.00 0.00 0.00 178.15 175.51 2k0b n GLU 12 N -3.23 0.63 -0.05 2.19 1.02 -1.25 -4.15 120.64 115.81 2k0b n GLU 12 Ca -0.01 0.33 -0.16 0.00 -0.02 0.00 0.00 57.16 57.30 2k0b n GLU 12 Cb 0.25 -1.61 -0.14 0.00 -0.02 0.00 0.00 31.44 29.91 2k0b n GLU 12 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2k0b n SER 13 N -3.93 1.50 -0.06 1.62 2.88 -1.07 -4.01 113.62 110.56 2k0b n SER 13 Ca -0.42 0.14 -0.22 0.00 -1.33 0.00 0.00 58.87 57.04 2k0b n SER 13 Cb 0.89 -0.30 -0.13 0.00 -0.75 0.00 0.00 64.21 63.92 2k0b n SER 13 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 2k0b n LEU 14 N -3.22 2.44 0.28 2.46 7.94 0.13 -4.24 117.00 122.79 2k0b n LEU 14 Ca -0.32 0.22 0.14 0.00 -1.11 0.00 0.00 56.01 54.93 2k0b n LEU 14 Cb 1.05 -1.02 0.83 0.00 0.53 0.00 0.00 43.42 44.81 2k0b n LEU 14 CO 0.39 0.70 1.07 -1.28 -1.11 0.00 0.00 177.39 177.17 2k0b h SER 15 N -0.31 0.00 0.60 1.96 0.87 0.25 0.17 113.55 117.09 2k0b h SER 15 Ca -0.46 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 59.96 2k0b h SER 15 Cb 1.79 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.73 2k0b h SER 15 CO -0.06 0.04 -0.66 0.06 -0.53 0.00 0.00 176.83 175.68 2k0b h GLN 16 N 0.00 0.05 0.00 2.24 -0.00 -1.74 -2.68 115.11 112.98 2k0b h GLN 16 Ca -0.00 -0.04 -0.23 0.00 -0.00 0.00 0.00 58.65 58.38 2k0b h GLN 16 Cb 0.10 0.01 -0.04 0.00 -0.00 0.00 0.00 27.48 27.55 2k0b h GLN 16 CO 0.01 0.69 -1.56 0.00 -0.00 0.00 0.00 178.83 177.96 2k0b n MET 17 N -3.78 0.63 0.23 0.06 0.00 -0.61 -2.63 117.12 111.01 2k0b n MET 17 Ca -0.01 0.26 0.07 0.00 0.00 0.00 0.00 57.70 58.02 2k0b n MET 17 Cb 0.65 -1.80 0.57 0.00 0.00 0.00 0.00 33.22 32.63 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 0.00 0.05 3.17 5.85 -0.66 0.93 115.31 124.65 2k0b h LEU 18 Ca -0.22 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.14 2k0b h LEU 18 Cb 1.80 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.79 2k0b h LEU 18 CO 0.06 0.17 -1.99 -1.54 -0.34 0.00 0.00 178.44 174.80 2k0b n SER 19 N -4.13 2.00 0.23 1.25 3.41 -1.02 -4.40 113.62 110.97 2k0b n SER 19 Ca -0.02 0.21 0.11 0.00 -0.26 0.00 0.00 58.87 58.91 2k0b n SER 19 Cb 0.24 -0.79 0.52 0.00 -0.26 0.00 0.00 64.21 63.92 2k0b n SER 19 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 2k0b h MET 20 N -0.39 0.00 0.00 4.33 2.86 -1.48 -3.47 114.93 116.78 2k0b h MET 20 Ca -0.48 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2k0b h MET 20 Cb 1.75 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.41 2k0b h MET 20 CO -0.11 0.20 0.00 0.41 1.06 0.00 0.00 176.91 178.48 2k0b n GLY 21 N -0.03 0.70 3.20 8.32 0.00 -0.68 -5.08 105.19 111.62 2k0b n GLY 21 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.12 1.54 0.22 1.61 0.08 0.24 -5.05 117.98 115.49 2k0b s PHE 22 Ca 0.00 -0.35 -0.05 0.00 0.12 0.00 0.00 56.93 56.64 2k0b s PHE 22 Cb 0.00 -0.93 -0.03 0.00 -0.57 0.00 0.00 43.02 41.50 2k0b s PHE 22 CO 0.00 0.05 0.26 -1.12 -0.10 0.00 0.00 175.22 174.31 2k0b s SER 23 N -1.05 0.06 0.11 1.36 0.01 -1.26 -4.17 113.70 108.76 2k0b s SER 23 Ca 0.05 -1.22 -0.31 0.00 1.31 0.00 0.00 55.95 55.79 2k0b s SER 23 Cb -0.08 0.46 -0.07 0.00 0.21 0.00 0.00 66.02 66.53 2k0b s SER 23 CO 0.01 -0.95 1.28 1.51 0.41 0.00 0.00 173.24 175.50 2k0b s ASP 24 N -3.11 6.97 -0.00 2.44 -4.77 -1.26 -4.48 116.67 112.46 2k0b s ASP 24 Ca 0.33 2.19 -0.02 0.00 -3.30 0.00 0.00 52.55 51.75 2k0b s ASP 24 Cb 0.04 -2.59 -0.01 0.00 -1.09 0.00 0.00 42.92 39.27 2k0b s ASP 24 CO 0.11 -0.52 0.56 -0.08 0.70 0.00 0.00 175.17 175.94 2k0b h GLU 25 N 6.43 -0.06 0.00 2.11 4.57 -1.80 -3.40 114.58 122.44 2k0b h GLU 25 Ca -0.42 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.75 2k0b h GLU 25 Cb 1.21 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.81 2k0b h GLU 25 CO 0.82 -0.04 -1.76 0.41 -1.18 0.00 0.00 179.01 177.26 2k0b n GLY 26 N 0.34 -1.12 0.00 1.92 0.00 -1.26 -4.95 105.19 100.13 2k0b n GLY 26 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 1.25 1.34 0.48 -0.02 0.00 -1.26 -5.03 105.19 101.95 2k0b n GLY 27 Ca -0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.10 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 0.11 1.61 4.27 -1.26 -4.45 117.44 117.72 2k0b n TRP 28 Ca 0.00 0.00 0.06 0.00 -3.89 0.00 0.00 57.50 53.67 2k0b n TRP 28 Cb 0.00 -0.04 0.51 0.00 -1.36 0.00 0.00 31.31 30.43 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 2.36 0.26 -0.01 5.67 5.85 -1.96 1.02 115.31 128.51 2k0b h LEU 29 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 2k0b h LEU 29 Cb 0.69 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.66 2k0b h LEU 29 CO 0.00 0.20 0.00 0.74 -0.34 0.00 0.00 178.44 179.04 2k0b h THR 30 N 0.31 0.00 0.00 1.05 2.02 -2.01 -3.30 112.91 110.98 2k0b h THR 30 Ca 0.08 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.73 2k0b h THR 30 Cb -0.02 1.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.93 2k0b h THR 30 CO -0.02 0.00 -0.80 0.54 0.37 0.00 0.00 175.52 175.62 2k0b n ARG 31 N -2.36 0.49 0.00 6.66 1.74 0.88 -4.22 116.66 119.85 2k0b n ARG 31 Ca 0.05 0.32 0.00 0.00 -0.77 0.00 0.00 57.85 57.46 2k0b n ARG 31 Cb 0.44 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 2k0b n ARG 31 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2k0b n LEU 32 N -4.47 0.00 -0.17 0.55 -0.00 0.32 -2.42 117.00 110.80 2k0b n LEU 32 Ca -0.11 0.87 -0.04 0.00 -0.00 0.00 0.00 56.01 56.73 2k0b n LEU 32 Cb 0.41 -0.37 0.06 0.00 -0.00 0.00 0.00 43.42 43.52 2k0b n LEU 32 CO 0.17 -0.37 1.02 -0.07 -0.00 0.00 0.00 177.39 178.13 2k0b h LEU 33 N 0.00 0.35 -0.43 -1.96 4.07 -1.76 -2.78 115.31 112.80 2k0b h LEU 33 Ca 0.00 0.04 0.09 0.00 0.08 0.00 0.00 57.88 58.09 2k0b h LEU 33 Cb 0.00 -0.03 -0.09 0.00 1.08 0.00 0.00 40.66 41.62 2k0b h LEU 33 CO 0.00 0.24 -0.20 1.56 -1.08 0.00 0.00 178.44 178.95 2k0b h GLN 34 N 0.49 -0.11 0.00 1.13 7.50 -1.72 0.70 115.11 123.09 2k0b h GLN 34 Ca 0.23 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.39 2k0b h GLN 34 Cb 0.17 0.03 0.00 0.00 0.05 0.00 0.00 27.48 27.72 2k0b h GLN 34 CO -0.18 -0.07 0.00 2.41 -1.50 0.00 0.00 178.83 179.49 2k0b n THR 35 N -5.39 0.18 -1.78 -0.54 -1.04 -1.02 -3.26 114.28 101.44 2k0b n THR 35 Ca 0.03 0.04 -0.21 0.00 -2.04 0.00 0.00 64.05 61.87 2k0b n THR 35 Cb 0.30 -0.60 0.07 0.00 -1.82 0.00 0.00 70.33 68.27 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 -1.37 3.04 -2.95 -2.82 5.02 0.13 -4.94 118.16 114.27 2k0b n LYS 36 Ca 0.10 -3.80 -0.17 0.00 -2.02 0.00 0.00 58.31 52.42 2k0b n LYS 36 Cb 0.25 -2.17 -0.00 0.00 -0.02 0.00 0.00 35.03 33.09 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 -0.84 -3.61 -2.76 4.39 0.23 -1.02 -2.87 115.26 108.78 2k0b n ASN 37 Ca 0.44 -0.10 -0.00 0.00 -0.53 0.00 0.00 54.58 54.39 2k0b n ASN 37 Cb 0.90 -3.03 0.00 0.00 -2.08 0.00 0.00 39.78 35.57 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 -3.63 -2.42 -4.64 -2.53 4.01 0.22 -5.01 117.16 103.16 2k0b n TYR 38 Ca -0.06 0.92 -0.33 0.00 -0.16 0.00 0.00 57.90 58.27 2k0b n TYR 38 Cb 0.57 -3.62 -0.11 0.00 -0.31 0.00 0.00 39.34 35.86 2k0b n TYR 38 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 2k0b s ASP 39 N -2.80 4.50 0.00 7.72 -4.77 -1.14 -4.82 116.67 115.36 2k0b s ASP 39 Ca 0.00 -0.09 0.25 0.00 -3.30 0.00 0.00 52.55 49.41 2k0b s ASP 39 Cb -0.00 -1.07 0.51 0.00 -1.09 0.00 0.00 42.92 41.27 2k0b s ASP 39 CO 0.61 0.34 1.41 2.30 0.70 0.00 0.00 175.17 180.53 2k0b n ILE 40 N 2.08 0.00 -0.10 2.11 -0.00 -1.26 -3.37 119.36 118.82 2k0b n ILE 40 Ca -0.17 -0.12 -0.12 0.00 -0.00 0.00 0.00 62.75 62.34 2k0b n ILE 40 Cb 0.53 0.57 -0.04 0.00 -0.00 0.00 0.00 39.64 40.69 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 4.93 0.64 0.42 3.28 0.00 -1.97 -1.21 103.07 109.15 2k0b h GLY 41 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 46.76 2k0b h GLY 41 CO 0.00 0.51 -1.46 0.00 0.00 0.00 0.00 176.54 175.59 2k0b n ALA 42 N -2.43 2.93 0.10 3.60 0.00 -1.26 -4.05 120.51 119.40 2k0b n ALA 42 Ca -0.03 -0.41 -0.04 0.00 0.00 0.00 0.00 53.44 52.96 2k0b n ALA 42 Cb 0.36 -0.90 0.15 0.00 0.00 0.00 0.00 19.45 19.06 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 2.15 0.93 -0.11 0.00 0.00 -1.56 -2.92 119.26 117.76 2k0b h ALA 43 Ca 0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 2k0b h ALA 43 Cb 0.92 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2k0b h ALA 43 CO 0.00 0.72 -0.20 1.25 0.00 0.00 0.00 179.25 181.02 2k0b h LEU 44 N 0.13 0.17 -0.68 0.00 5.85 -1.36 0.17 115.31 119.59 2k0b h LEU 44 Ca -0.00 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.57 2k0b h LEU 44 Cb 1.06 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 2k0b h LEU 44 CO 0.09 0.38 -0.53 -0.78 -0.34 0.00 0.00 178.44 177.26 2k0b h ASP 45 N 0.16 0.00 0.13 1.25 1.82 -1.70 -3.28 116.42 114.80 2k0b h ASP 45 Ca 0.03 0.00 -0.35 0.00 -0.39 0.00 0.00 57.03 56.32 2k0b h ASP 45 Cb 0.45 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.40 2k0b h ASP 45 CO 0.03 0.53 -2.21 0.35 -1.61 0.00 0.00 179.24 176.33 2k0b n THR 46 N -3.56 1.47 0.24 2.25 -2.24 -0.76 -3.20 114.28 108.48 2k0b n THR 46 Ca -0.00 -0.81 0.09 0.00 -2.27 0.00 0.00 64.05 61.06 2k0b n THR 46 Cb 0.61 -0.73 0.62 0.00 -2.10 0.00 0.00 70.33 68.74 2k0b n THR 46 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 2k0b h ILE 47 N 0.00 0.81 0.00 2.28 3.07 -0.80 -3.41 117.51 119.46 2k0b h ILE 47 Ca -0.48 -0.62 0.00 0.00 1.55 0.00 0.00 64.86 65.31 2k0b h ILE 47 Cb 2.15 1.37 0.00 0.00 -0.27 0.00 0.00 36.82 40.07 2k0b h ILE 47 CO 0.04 0.16 0.00 0.00 -1.05 0.00 0.00 178.15 177.29 2k0b n GLN 48 N -3.90 0.00 0.00 0.16 6.02 -1.26 -4.31 117.38 114.09 2k0b n GLN 48 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 2k0b n GLN 48 Cb 0.25 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.51 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 -1.04 -0.05 -2.54 1.08 4.01 -1.24 -5.06 117.16 112.32 2k0b n TYR 49 Ca 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 2k0b n TYR 49 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2k0b n TYR 49 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2k0b n SER 50 N 0.00 -0.26 -0.30 7.72 3.41 -1.20 -4.41 113.62 118.58 2k0b n SER 50 Ca 0.00 -1.16 0.00 0.00 -0.26 0.00 0.00 58.87 57.45 2k0b n SER 50 Cb 0.00 0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2k0b n SER 50 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2k0b n LYS 51 N -0.17 0.10 -0.50 4.33 4.81 -1.26 -5.09 118.16 120.37 2k0b n LYS 51 Ca -0.06 -0.88 0.00 0.00 -0.87 0.00 0.00 58.31 56.50 2k0b n LYS 51 Cb 0.54 -0.54 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2k0b n LYS 51 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29