#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 2.13 -3.81 6.31 -1.04 -1.26 -4.96 114.28 111.65 2kjm n THR 2 Ca 0.00 -3.00 -0.27 0.00 -2.04 0.00 0.00 64.05 58.74 2kjm n THR 2 Cb 0.00 -0.24 0.04 0.00 -1.82 0.00 0.00 70.33 68.31 2kjm n THR 2 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2kjm n ASP 3 N -1.20 -4.18 0.00 8.00 9.92 -1.26 -4.88 116.55 122.95 2kjm n ASP 3 Ca 0.18 -0.75 0.00 0.00 -0.53 0.00 0.00 54.79 53.70 2kjm n ASP 3 Cb 0.68 -4.14 0.00 0.00 -0.64 0.00 0.00 41.12 37.02 2kjm n ASP 3 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2kjm n GLU 4 N -4.63 0.00 -0.17 -1.24 1.02 -1.26 -0.13 120.64 114.22 2kjm n GLU 4 Ca -0.05 0.28 0.14 0.00 -0.02 0.00 0.00 57.16 57.51 2kjm n GLU 4 Cb 0.57 -1.10 0.26 0.00 -0.02 0.00 0.00 31.44 31.15 2kjm n GLU 4 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2kjm n SER 5 N -1.34 0.11 0.11 1.62 3.41 -1.26 0.36 113.62 116.63 2kjm n SER 5 Ca 0.00 0.89 -0.23 0.00 -0.26 0.00 0.00 58.87 59.27 2kjm n SER 5 Cb 0.00 -0.40 -0.14 0.00 -0.26 0.00 0.00 64.21 63.41 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 1.29 0.00 -3.33 2.07 -1.92 -3.21 116.25 111.15 2kjm h VAL 6 Ca 0.41 -2.58 0.00 0.00 0.82 0.00 0.00 66.70 65.35 2kjm h VAL 6 Cb 1.02 2.83 0.00 0.00 -1.52 0.00 0.00 31.29 33.63 2kjm h VAL 6 CO -0.44 0.78 0.00 0.25 0.02 0.00 0.00 177.57 178.18 2kjm h LEU 7 N 0.22 0.00 -2.38 2.57 5.85 0.99 -2.80 115.31 119.76 2kjm h LEU 7 Ca -0.21 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.52 2kjm h LEU 7 Cb 2.02 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 43.04 2kjm h LEU 7 CO 0.25 0.00 0.20 0.00 -0.34 0.00 0.00 178.44 178.55 2kjm h MET 8 N 0.00 0.00 -0.10 1.25 -0.00 -0.28 0.07 114.93 115.87 2kjm h MET 8 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.69 2kjm h MET 8 Cb 0.34 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.94 2kjm h MET 8 CO 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 176.91 176.92 2kjm h ARG 9 N 0.00 0.13 0.08 -0.10 2.47 -1.71 0.14 114.38 115.40 2kjm h ARG 9 Ca 0.02 -0.01 -0.37 0.00 -1.26 0.00 0.00 59.98 58.36 2kjm h ARG 9 Cb 0.42 -0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.68 2kjm h ARG 9 CO -0.00 0.15 -2.10 0.54 0.56 0.00 0.00 179.97 179.12 2kjm n ARG 10 N -4.46 0.72 0.13 0.04 1.74 -0.02 -4.07 116.66 110.75 2kjm n ARG 10 Ca -0.01 0.23 0.12 0.00 -0.77 0.00 0.00 57.85 57.42 2kjm n ARG 10 Cb 0.13 -1.67 0.48 0.00 -1.02 0.00 0.00 32.46 30.39 2kjm n ARG 10 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2kjm n GLN 11 N -3.38 0.19 -0.26 5.56 1.13 -1.05 -3.02 117.38 116.55 2kjm n GLN 11 Ca -0.34 0.40 0.15 0.00 -1.94 0.00 0.00 57.00 55.27 2kjm n GLN 11 Cb 1.04 -1.86 0.43 0.00 0.11 0.00 0.00 30.24 29.96 2kjm n GLN 11 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 2kjm h LYS 12 N 0.00 0.56 0.13 -1.09 5.09 -0.86 0.30 116.57 120.70 2kjm h LYS 12 Ca 0.00 -0.03 -0.01 0.00 0.09 0.00 0.00 60.65 60.70 2kjm h LYS 12 Cb 0.39 -0.13 0.00 0.00 0.10 0.00 0.00 32.23 32.59 2kjm h LYS 12 CO 0.00 0.37 -0.06 1.96 -2.09 0.00 0.00 179.45 179.63 2kjm h GLN 13 N 0.58 -0.17 -0.84 0.07 4.20 -1.80 -3.32 115.11 113.83 2kjm h GLN 13 Ca 0.47 0.01 0.19 0.00 0.06 0.00 0.00 58.65 59.38 2kjm h GLN 13 Cb 0.91 0.04 -0.11 0.00 0.30 0.00 0.00 27.48 28.61 2kjm h GLN 13 CO -0.21 -0.11 0.34 0.82 -0.67 0.00 0.00 178.83 179.00 2kjm h ILE 14 N -0.33 0.53 -3.43 2.54 2.04 -1.70 -3.36 117.51 113.80 2kjm h ILE 14 Ca -0.02 -0.14 -0.59 0.00 1.00 0.00 0.00 64.86 65.12 2kjm h ILE 14 Cb 0.13 0.10 -0.09 0.00 -0.74 0.00 0.00 36.82 36.22 2kjm h ILE 14 CO 0.03 0.07 0.61 0.20 0.00 0.00 0.00 178.15 179.07 2kjm s ASN 15 N -5.24 6.74 0.00 1.72 0.01 0.10 -4.89 114.94 113.39 2kjm s ASN 15 Ca -0.12 0.72 0.24 0.00 -0.71 0.00 0.00 52.86 52.99 2kjm s ASN 15 Cb 0.23 -2.47 0.20 0.00 0.41 0.00 0.00 41.25 39.63 2kjm s ASN 15 CO 0.77 -0.80 1.24 0.00 -1.51 0.00 0.00 177.10 176.80 2kjm n TYR 16 N 6.66 0.00 -1.94 2.20 0.18 -1.26 -4.50 117.16 118.50 2kjm n TYR 16 Ca 0.07 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 59.80 2kjm n TYR 16 Cb 0.48 -0.01 -0.06 0.00 -0.38 0.00 0.00 39.34 39.37 2kjm n TYR 16 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2kjm n GLY 17 N 1.37 0.45 3.10 -7.48 0.00 -1.26 -5.07 105.19 96.29 2kjm n GLY 17 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 2kjm n GLY 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kjm s LYS 18 N 0.00 2.14 -1.18 1.61 2.20 -1.26 -5.02 119.74 118.22 2kjm s LYS 18 Ca 0.00 -2.08 -0.22 0.00 -0.36 0.00 0.00 55.97 53.31 2kjm s LYS 18 Cb 0.00 -3.59 -0.07 0.00 -1.51 0.00 0.00 37.83 32.66 2kjm s LYS 18 CO 0.00 -1.10 1.91 0.09 -0.36 0.00 0.00 175.35 175.89 2kjm n ASN 19 N 4.17 3.32 0.21 1.43 3.02 -1.26 -4.68 115.26 121.47 2kjm n ASN 19 Ca 0.01 -2.73 0.15 0.00 -0.03 0.00 0.00 54.58 51.98 2kjm n ASN 19 Cb 0.40 -1.71 0.55 0.00 -0.61 0.00 0.00 39.78 38.41 2kjm n ASN 19 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2kjm h THR 20 N 5.95 0.00 -0.33 3.41 2.02 -1.95 -3.04 112.91 118.97 2kjm h THR 20 Ca 0.27 -0.47 0.10 0.00 0.77 0.00 0.00 66.41 67.07 2kjm h THR 20 Cb 0.91 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.69 2kjm h THR 20 CO 1.31 0.00 0.33 0.40 0.37 0.00 0.00 175.52 177.93 2kjm h ILE 21 N 0.00 0.47 0.00 3.11 2.04 -1.86 0.86 117.51 122.13 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 0.53 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 2kjm h ILE 21 CO 0.00 0.00 0.12 0.00 0.00 0.00 0.00 178.15 178.27 2kjm h ALA 22 N 1.64 1.11 0.00 1.87 0.00 -1.93 0.16 119.26 122.11 2kjm h ALA 22 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2kjm h ALA 22 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2kjm h ALA 22 CO -0.00 -0.11 0.00 -0.92 0.00 0.00 0.00 179.25 178.22 2kjm h TYR 23 N 0.00 0.00 0.00 0.00 5.03 -1.09 -2.87 116.97 118.04 2kjm h TYR 23 Ca 0.00 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.26 2kjm h TYR 23 Cb 0.24 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.51 2kjm h TYR 23 CO 0.00 0.00 -0.22 0.22 -1.32 0.00 0.00 178.16 176.84 2kjm h ASP 24 N 0.00 0.00 0.75 -2.11 1.82 -0.86 -2.14 116.42 113.87 2kjm h ASP 24 Ca 0.00 0.00 -0.11 0.00 -0.39 0.00 0.00 57.03 56.53 2kjm h ASP 24 Cb 0.50 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.50 2kjm h ASP 24 CO 0.00 0.22 -0.54 -0.09 -1.61 0.00 0.00 179.24 177.22 2kjm h ARG 25 N 0.00 0.00 0.02 0.28 2.43 -1.69 -3.12 114.38 112.31 2kjm h ARG 25 Ca -0.00 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2kjm h ARG 25 Cb 0.41 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.91 2kjm h ARG 25 CO 0.03 0.54 -0.33 -0.92 -1.51 0.00 0.00 179.97 177.78 2kjm h TYR 26 N 0.00 -0.91 0.00 2.20 3.20 -1.52 -0.74 116.97 119.19 2kjm h TYR 26 Ca -0.01 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 2kjm h TYR 26 Cb 1.06 0.40 -0.00 0.00 1.54 0.00 0.00 36.73 39.73 2kjm h TYR 26 CO 0.00 -0.43 -0.11 0.82 -1.64 0.00 0.00 178.16 176.81 2kjm h ILE 27 N -0.50 0.34 -0.07 1.81 2.04 -1.66 -2.66 117.51 116.82 2kjm h ILE 27 Ca 0.05 -0.68 0.02 0.00 1.00 0.00 0.00 64.86 65.26 2kjm h ILE 27 Cb 0.57 1.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.15 2kjm h ILE 27 CO -0.26 0.11 0.13 0.50 0.00 0.00 0.00 178.15 178.63 2kjm h LYS 28 N 0.00 0.00 0.00 2.37 3.11 -1.06 0.99 116.57 121.97 2kjm h LYS 28 Ca -0.00 0.00 -0.15 0.00 -2.81 0.00 0.00 60.65 57.69 2kjm h LYS 28 Cb 0.50 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.70 2kjm h LYS 28 CO 0.01 0.00 -1.01 0.93 -2.81 0.00 0.00 179.45 176.58 2kjm h GLU 29 N 0.00 0.00 -0.00 1.90 5.08 -1.40 -3.51 114.58 116.65 2kjm h GLU 29 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2kjm h GLU 29 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2kjm h GLU 29 CO -0.00 0.43 0.00 0.28 -1.00 0.00 0.00 179.01 178.72