#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kjm n THR 2 N 0.00 0.00 -2.28 2.62 -2.24 -1.26 -5.09 114.28 106.03 2kjm n THR 2 Ca 0.00 -1.76 -0.35 0.00 -2.27 0.00 0.00 64.05 59.66 2kjm n THR 2 Cb 0.00 1.09 -0.04 0.00 -2.10 0.00 0.00 70.33 69.28 2kjm n THR 2 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2kjm s ASP 3 N -3.15 5.75 0.00 3.42 -4.77 -1.26 -4.63 116.67 112.02 2kjm s ASP 3 Ca 0.29 -0.71 0.00 0.00 -3.30 0.00 0.00 52.55 48.83 2kjm s ASP 3 Cb -0.01 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.26 2kjm s ASP 3 CO 0.21 -2.15 0.22 -0.62 0.70 0.00 0.00 175.17 173.52 2kjm n GLU 4 N 9.00 0.00 -0.17 2.11 -0.58 -1.26 -2.90 120.64 126.84 2kjm n GLU 4 Ca 0.29 0.26 0.17 0.00 -0.42 0.00 0.00 57.16 57.45 2kjm n GLU 4 Cb 0.49 -0.90 0.31 0.00 -0.57 0.00 0.00 31.44 30.77 2kjm n GLU 4 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2kjm n SER 5 N -1.27 0.17 -0.10 1.62 3.41 -1.26 0.34 113.62 116.54 2kjm n SER 5 Ca 0.00 0.89 -0.10 0.00 -0.26 0.00 0.00 58.87 59.40 2kjm n SER 5 Cb 0.00 -0.43 -0.03 0.00 -0.26 0.00 0.00 64.21 63.49 2kjm n SER 5 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2kjm h VAL 6 N 0.00 1.21 0.00 -3.33 2.07 -1.95 -2.68 116.25 111.58 2kjm h VAL 6 Ca 0.45 -0.71 -0.07 0.00 0.82 0.00 0.00 66.70 67.18 2kjm h VAL 6 Cb 1.17 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 2kjm h VAL 6 CO -0.42 0.23 -0.35 0.25 0.02 0.00 0.00 177.57 177.31 2kjm h LEU 7 N 0.31 0.00 -0.74 2.57 5.85 0.58 -2.98 115.31 120.89 2kjm h LEU 7 Ca 0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2kjm h LEU 7 Cb 0.28 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.31 2kjm h LEU 7 CO 0.00 0.35 0.00 0.24 -0.34 0.00 0.00 178.44 178.69 2kjm h MET 8 N 0.00 0.00 -0.15 1.25 2.86 -0.20 -3.00 114.93 115.69 2kjm h MET 8 Ca -0.00 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 2kjm h MET 8 Cb 1.08 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.73 2kjm h MET 8 CO 0.05 0.00 0.16 0.00 1.06 0.00 0.00 176.91 178.17 2kjm h ARG 9 N 0.00 0.00 0.15 1.72 2.47 -1.32 0.32 114.38 117.71 2kjm h ARG 9 Ca 0.00 0.00 -0.34 0.00 -1.26 0.00 0.00 59.98 58.38 2kjm h ARG 9 Cb 0.48 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.79 2kjm h ARG 9 CO 0.00 0.00 -1.74 -0.09 0.56 0.00 0.00 179.97 178.70 2kjm h ARG 10 N 0.00 0.31 0.00 0.04 9.65 -1.76 -3.34 114.38 119.29 2kjm h ARG 10 Ca 0.07 -0.53 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 2kjm h ARG 10 Cb 0.39 0.20 0.00 0.00 -1.39 0.00 0.00 29.97 29.17 2kjm h ARG 10 CO -0.00 1.25 0.00 0.37 2.80 0.00 0.00 179.97 184.39 2kjm h GLN 11 N -0.03 0.00 -0.18 0.20 5.75 -1.47 -3.03 115.11 116.35 2kjm h GLN 11 Ca -0.36 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.19 2kjm h GLN 11 Cb 1.98 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.52 2kjm h GLN 11 CO 0.11 0.00 0.20 -0.22 -2.65 0.00 0.00 178.83 176.27 2kjm h LYS 12 N 0.00 0.00 0.49 1.69 3.11 -0.52 -2.80 116.57 118.53 2kjm h LYS 12 Ca 0.00 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 2kjm h LYS 12 Cb 0.59 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.82 2kjm h LYS 12 CO 0.00 0.00 -0.30 1.96 -2.81 0.00 0.00 179.45 178.30 2kjm h GLN 13 N 0.00 -0.71 -0.96 1.90 1.08 -1.75 -2.80 115.11 111.87 2kjm h GLN 13 Ca 0.08 0.05 0.26 0.00 -1.45 0.00 0.00 58.65 57.59 2kjm h GLN 13 Cb 0.47 0.16 -0.13 0.00 -0.05 0.00 0.00 27.48 27.93 2kjm h GLN 13 CO -0.00 -0.48 0.49 0.82 -0.95 0.00 0.00 178.83 178.72 2kjm h ILE 14 N -0.74 0.42 -3.33 2.54 5.03 -1.74 -3.36 117.51 116.33 2kjm h ILE 14 Ca -0.07 -0.14 -0.57 0.00 -0.12 0.00 0.00 64.86 63.96 2kjm h ILE 14 Cb 0.59 -0.03 -0.06 0.00 -3.03 0.00 0.00 36.82 34.29 2kjm h ILE 14 CO 0.06 0.07 0.86 0.20 -0.68 0.00 0.00 178.15 178.67 2kjm s ASN 15 N -5.08 6.89 0.00 1.72 0.01 -1.05 -4.88 114.94 112.54 2kjm s ASN 15 Ca -0.11 1.02 0.24 0.00 -0.71 0.00 0.00 52.86 53.30 2kjm s ASN 15 Cb 0.27 -2.54 0.25 0.00 0.41 0.00 0.00 41.25 39.64 2kjm s ASN 15 CO 0.79 -0.92 1.27 -1.22 -1.51 0.00 0.00 177.10 175.50 2kjm n TYR 16 N 6.99 0.00 -1.93 2.20 4.01 -1.26 -4.42 117.16 122.75 2kjm n TYR 16 Ca 0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.86 2kjm n TYR 16 Cb 0.47 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.49 2kjm n TYR 16 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kjm n GLY 17 N 1.36 0.61 3.16 2.72 0.00 -1.26 -5.07 105.19 106.71 2kjm n GLY 17 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2kjm n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kjm s LYS 18 N 0.00 2.31 -0.96 1.61 -0.14 -1.26 -5.04 119.74 116.26 2kjm s LYS 18 Ca 0.00 -1.39 -0.24 0.00 -1.36 0.00 0.00 55.97 52.98 2kjm s LYS 18 Cb 0.00 -3.25 -0.04 0.00 -1.68 0.00 0.00 37.83 32.85 2kjm s LYS 18 CO 0.00 -0.71 1.90 -0.80 -0.76 0.00 0.00 175.35 174.98 2kjm s ASN 19 N 1.34 5.26 0.49 2.83 0.01 -1.26 -4.75 114.94 118.86 2kjm s ASN 19 Ca -0.02 -0.91 0.31 0.00 -0.71 0.00 0.00 52.86 51.53 2kjm s ASN 19 Cb -0.20 -2.57 1.19 0.00 0.41 0.00 0.00 41.25 40.08 2kjm s ASN 19 CO -0.02 -2.67 1.90 0.71 -1.51 0.00 0.00 177.10 175.51 2kjm h THR 20 N 7.04 0.00 -0.27 1.60 1.35 -1.95 -2.99 112.91 117.68 2kjm h THR 20 Ca 0.13 -0.53 0.08 0.00 -0.55 0.00 0.00 66.41 65.54 2kjm h THR 20 Cb 0.99 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.89 2kjm h THR 20 CO 1.23 0.00 0.26 0.40 -0.25 0.00 0.00 175.52 177.17 2kjm h ILE 21 N 0.00 0.54 0.00 6.82 2.04 -1.88 0.12 117.51 125.15 2kjm h ILE 21 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2kjm h ILE 21 Cb 0.55 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2kjm h ILE 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.15 2kjm n ALA 22 N -2.40 1.13 0.32 1.87 0.00 -1.13 -1.54 120.51 118.75 2kjm n ALA 22 Ca 0.04 0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.67 2kjm n ALA 22 Cb 0.41 -1.15 0.58 0.00 0.00 0.00 0.00 19.45 19.29 2kjm n ALA 22 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2kjm h TYR 23 N 0.00 0.00 -0.05 0.00 -1.99 -1.00 -2.55 116.97 111.37 2kjm h TYR 23 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 2kjm h TYR 23 Cb 0.05 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.78 2kjm h TYR 23 CO 0.00 0.00 -0.06 0.38 -0.00 0.00 0.00 178.16 178.48 2kjm h ASP 24 N 0.00 0.07 0.45 3.88 2.03 -1.50 -1.38 116.42 119.96 2kjm h ASP 24 Ca 0.00 -0.01 -0.05 0.00 -0.73 0.00 0.00 57.03 56.24 2kjm h ASP 24 Cb 0.27 -0.02 -0.01 0.00 -0.83 0.00 0.00 39.33 38.74 2kjm h ASP 24 CO 0.00 0.15 -0.24 -0.09 -1.03 0.00 0.00 179.24 178.03 2kjm h ARG 25 N 0.08 0.00 -0.04 4.15 2.43 -1.70 -2.79 114.38 116.51 2kjm h ARG 25 Ca 0.02 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.22 2kjm h ARG 25 Cb 0.17 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.67 2kjm h ARG 25 CO 0.01 0.24 -0.27 -0.92 -1.51 0.00 0.00 179.97 177.52 2kjm h TYR 26 N 0.00 -0.74 0.00 2.20 5.03 -1.43 -1.47 116.97 120.57 2kjm h TYR 26 Ca -0.00 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.28 2kjm h TYR 26 Cb 0.53 0.33 -0.01 0.00 1.55 0.00 0.00 36.73 39.14 2kjm h TYR 26 CO 0.00 -0.36 -0.26 0.97 -1.32 0.00 0.00 178.16 177.19 2kjm h ILE 27 N -0.39 0.57 0.00 1.81 6.09 -1.67 -2.90 117.51 121.01 2kjm h ILE 27 Ca 0.07 -1.32 0.00 0.00 -1.37 0.00 0.00 64.86 62.24 2kjm h ILE 27 Cb 0.50 1.91 0.00 0.00 0.47 0.00 0.00 36.82 39.70 2kjm h ILE 27 CO -0.26 0.26 0.00 0.11 -3.07 0.00 0.00 178.15 175.18 2kjm h LYS 28 N 0.00 0.00 0.00 2.19 1.79 -1.00 -0.50 116.57 119.05 2kjm h LYS 28 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2kjm h LYS 28 Cb 0.89 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 2kjm h LYS 28 CO 0.03 0.00 -0.25 1.49 -1.08 0.00 0.00 179.45 179.64 2kjm h GLU 29 N 0.00 0.00 0.00 3.15 4.81 -1.26 -3.50 114.58 117.78 2kjm h GLU 29 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2kjm h GLU 29 Cb 0.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.54 2kjm h GLU 29 CO 0.00 0.00 0.00 1.55 -0.73 0.00 0.00 179.01 179.83