#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kls s THR 2 N 0.00 2.71 -0.29 -0.18 2.01 -1.26 -4.87 115.64 113.76 1kls s THR 2 Ca 0.00 -2.00 0.02 0.00 0.31 0.00 0.00 61.69 60.02 1kls s THR 2 Cb 0.00 -2.76 0.08 0.00 0.01 0.00 0.00 72.50 69.83 1kls s THR 2 CO 0.00 -0.24 0.02 -0.31 -0.69 0.00 0.00 174.62 173.40 1kls s TYR 3 N -2.49 2.79 -0.26 4.92 1.51 -0.85 -4.98 117.35 117.97 1kls s TYR 3 Ca 0.34 -2.24 -0.03 0.00 -1.01 0.00 0.00 57.07 54.13 1kls s TYR 3 Cb -0.01 -2.12 0.02 0.00 -0.11 0.00 0.00 41.96 39.74 1kls s TYR 3 CO 0.19 -0.87 -0.01 -1.14 -1.11 0.00 0.00 175.55 172.61 1kls s GLN 4 N 1.25 2.91 0.00 -0.62 2.00 -1.26 -0.84 119.66 123.10 1kls s GLN 4 Ca 0.04 -0.94 0.00 0.00 -2.00 0.00 0.00 55.36 52.45 1kls s GLN 4 Cb -0.19 -3.12 0.00 0.00 0.80 0.00 0.00 33.01 30.50 1kls s GLN 4 CO -0.11 -0.42 0.16 0.00 -0.50 0.00 0.00 175.29 174.42 1kls n GLN 6 N -2.09 0.00 -0.13 0.00 7.27 -1.26 -4.92 117.38 116.25 1kls n GLN 6 Ca 0.00 0.00 -0.24 0.00 0.07 0.00 0.00 57.00 56.83 1kls n GLN 6 Cb 0.00 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 32.57 1kls n GLN 6 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1kls n TYR 7 N -0.72 0.05 -0.11 3.69 4.01 -1.26 -4.85 117.16 117.96 1kls n TYR 7 Ca 0.00 0.02 -0.24 0.00 -0.16 0.00 0.00 57.90 57.52 1kls n TYR 7 Cb 0.00 -0.87 -0.08 0.00 -0.31 0.00 0.00 39.34 38.07 1kls n TYR 7 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1kls n GLU 9 N -3.98 0.00 -4.31 0.00 2.13 -1.26 -5.10 120.64 108.11 1kls n GLU 9 Ca -0.45 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.02 1kls n GLU 9 Cb 0.83 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 32.44 1kls n GLU 9 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1kls s LEU 10 N 0.00 3.60 -0.09 4.31 0.20 -1.26 -4.91 118.68 120.53 1kls s LEU 10 Ca 0.00 0.12 0.02 0.00 0.69 0.00 0.00 54.13 54.96 1kls s LEU 10 Cb 0.00 -1.84 -0.02 0.00 -0.43 0.00 0.00 46.19 43.90 1kls s LEU 10 CO 0.00 0.33 -0.15 -0.60 -0.29 0.00 0.00 176.35 175.64 1kls s ARG 11 N -0.60 2.93 0.43 1.98 3.52 -1.26 -1.02 118.95 124.93 1kls s ARG 11 Ca 0.10 -0.72 0.04 0.00 -0.13 0.00 0.00 55.73 55.02 1kls s ARG 11 Cb -0.12 -2.47 -0.02 0.00 -1.56 0.00 0.00 34.95 30.79 1kls s ARG 11 CO 0.02 0.39 0.13 0.45 -0.81 0.00 0.00 175.30 175.49 1kls s SER 12 N -0.13 3.00 -0.01 -2.12 0.15 -0.02 -5.01 113.70 109.55 1kls s SER 12 Ca -0.02 -1.72 0.03 0.00 0.70 0.00 0.00 55.95 54.94 1kls s SER 12 Cb -0.14 0.59 -0.05 0.00 -1.71 0.00 0.00 66.02 64.72 1kls s SER 12 CO 0.04 -0.97 0.06 0.00 1.20 0.00 0.00 173.24 173.56 1kls n ALA 13 N -0.98 2.09 -3.30 5.45 0.00 -1.26 -2.02 120.51 120.50 1kls n ALA 13 Ca -0.07 -0.09 -0.05 0.00 0.00 0.00 0.00 53.44 53.22 1kls n ALA 13 Cb 0.65 -0.07 -0.02 0.00 0.00 0.00 0.00 19.45 20.01 1kls n ALA 13 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1kls n ASP 14 N -1.68 -0.20 -4.91 0.00 8.00 -1.26 -4.68 116.55 111.82 1kls n ASP 14 Ca -0.01 -1.52 -0.21 0.00 0.71 0.00 0.00 54.79 53.76 1kls n ASP 14 Cb 0.16 0.44 -0.02 0.00 -0.02 0.00 0.00 41.12 41.68 1kls n ASP 14 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1kls s SER 15 N -1.56 5.08 0.00 -2.24 0.15 -1.26 -4.29 113.70 109.58 1kls s SER 15 Ca 0.09 -0.77 0.00 0.00 0.70 0.00 0.00 55.95 55.97 1kls s SER 15 Cb 0.00 -0.40 0.00 0.00 -1.71 0.00 0.00 66.02 63.92 1kls s SER 15 CO 0.07 -0.78 0.00 -0.24 1.20 0.00 0.00 173.24 173.49 1kls n SER 16 N -1.67 0.00 -0.00 5.45 2.88 -1.26 -4.64 113.62 114.38 1kls n SER 16 Ca 0.05 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.66 1kls n SER 16 Cb 0.62 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.97 1kls n SER 16 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1kls n ASN 17 N 0.11 1.26 -0.09 -3.46 0.23 -1.26 -3.77 115.26 108.27 1kls n ASN 17 Ca 0.00 -0.32 -0.16 0.00 -0.53 0.00 0.00 54.58 53.57 1kls n ASN 17 Cb 0.00 1.42 -0.05 0.00 -2.08 0.00 0.00 39.78 39.06 1kls n ASN 17 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 1kls n LEU 18 N -1.75 1.72 -0.07 -4.53 -0.00 -1.26 -3.31 117.00 107.79 1kls n LEU 18 Ca -0.01 0.29 -0.07 0.00 -0.00 0.00 0.00 56.01 56.22 1kls n LEU 18 Cb 0.32 -0.68 -0.01 0.00 -0.00 0.00 0.00 43.42 43.06 1kls n LEU 18 CO 0.30 0.05 0.69 0.50 -0.00 0.00 0.00 177.39 178.94 1kls h LYS 19 N -0.83 -0.21 0.03 1.96 1.63 -1.88 -1.12 116.57 116.15 1kls h LYS 19 Ca -0.29 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.53 1kls h LYS 19 Cb 1.16 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.84 1kls h LYS 19 CO -0.17 -0.14 -0.02 1.15 -3.45 0.00 0.00 179.45 176.82 1kls h THR 20 N -0.22 1.00 -0.94 1.00 2.02 -1.80 -2.10 112.91 111.86 1kls h THR 20 Ca 0.16 -0.10 0.10 0.00 0.77 0.00 0.00 66.41 67.33 1kls h THR 20 Cb 0.46 1.06 -0.12 0.00 -1.74 0.00 0.00 68.15 67.82 1kls h THR 20 CO -0.43 0.02 -0.56 -0.74 0.37 0.00 0.00 175.52 174.19 1kls h HIS 21 N -0.09 -1.76 0.40 3.16 -0.00 -1.24 -0.49 115.15 115.13 1kls h HIS 21 Ca -0.00 0.12 -0.01 0.00 -0.00 0.00 0.00 60.37 60.48 1kls h HIS 21 Cb 0.08 0.90 -0.03 0.00 -0.00 0.00 0.00 27.41 28.35 1kls h HIS 21 CO -0.06 -0.39 -0.50 0.82 -0.00 0.00 0.00 177.93 177.80 1kls h ILE 22 N -0.04 0.03 -1.39 6.26 2.04 -1.09 0.11 117.51 123.42 1kls h ILE 22 Ca 0.18 0.00 0.40 0.00 1.00 0.00 0.00 64.86 66.44 1kls h ILE 22 Cb 0.45 0.03 -0.06 0.00 -0.74 0.00 0.00 36.82 36.51 1kls h ILE 22 CO -0.91 0.00 1.08 0.11 0.00 0.00 0.00 178.15 178.43 1kls h LYS 23 N -0.93 0.00 0.00 2.37 1.57 -0.44 0.17 116.57 119.31 1kls h LYS 23 Ca -0.04 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.38 1kls h LYS 23 Cb 0.84 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.08 1kls h LYS 23 CO -0.12 0.00 -2.34 2.41 -0.57 0.00 0.00 179.45 178.83 1kls n THR 24 N -3.92 1.35 0.56 -0.16 -1.04 -0.44 -3.19 114.28 107.44 1kls n THR 24 Ca 0.31 -0.50 0.12 0.00 -2.04 0.00 0.00 64.05 61.93 1kls n THR 24 Cb 1.52 -1.38 0.13 0.00 -1.82 0.00 0.00 70.33 68.78 1kls n THR 24 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1kls n LYS 25 N -3.27 0.30 0.00 -2.82 4.76 0.32 -4.23 118.16 113.22 1kls n LYS 25 Ca -0.42 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.08 1kls n LYS 25 Cb 0.93 -1.66 0.00 0.00 -1.84 0.00 0.00 35.03 32.46 1kls n LYS 25 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1kls n HIS 26 N -2.08 0.00 -2.43 2.13 8.25 -0.07 -4.84 115.22 116.18 1kls n HIS 26 Ca 0.03 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.13 1kls n HIS 26 Cb 0.44 0.12 0.01 0.00 1.12 0.00 0.00 29.99 31.68 1kls n HIS 26 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1kls n SER 27 N -2.58 6.45 -2.21 0.41 2.88 -0.50 -5.03 113.62 113.05 1kls n SER 27 Ca 0.00 -3.74 -0.21 0.00 -1.33 0.00 0.00 58.87 53.58 1kls n SER 27 Cb 0.32 -0.90 0.02 0.00 -0.75 0.00 0.00 64.21 62.89 1kls n SER 27 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1kls n LYS 28 N -0.33 0.00 -0.05 -1.46 2.85 -1.19 -4.47 118.16 113.52 1kls n LYS 28 Ca 0.45 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 57.50 1kls n LYS 28 Cb 0.34 -0.55 -0.13 0.00 -0.65 0.00 0.00 35.03 34.04 1kls n LYS 28 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1kls n GLU 29 N 1.38 0.69 0.00 -1.58 0.28 -1.26 -4.94 120.64 115.21 1kls n GLU 29 Ca -0.01 0.31 0.00 0.00 -0.16 0.00 0.00 57.16 57.30 1kls n GLU 29 Cb 0.41 -1.67 0.00 0.00 1.43 0.00 0.00 31.44 31.61 1kls n GLU 29 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60