#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kls n THR 2 N 0.00 0.00 -4.90 0.58 5.66 -1.26 -4.97 114.28 109.39 1kls n THR 2 Ca 0.00 -2.12 -0.33 0.00 -3.05 0.00 0.00 64.05 58.55 1kls n THR 2 Cb 0.00 0.76 -0.14 0.00 -1.55 0.00 0.00 70.33 69.40 1kls n THR 2 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1kls s TYR 3 N -2.92 2.71 0.50 1.09 1.51 -0.34 -4.98 117.35 114.92 1kls s TYR 3 Ca 0.19 -0.45 0.07 0.00 -1.01 0.00 0.00 57.07 55.86 1kls s TYR 3 Cb 0.01 -1.72 0.02 0.00 -0.11 0.00 0.00 41.96 40.16 1kls s TYR 3 CO 0.13 -0.04 0.41 -1.14 -1.11 0.00 0.00 175.55 173.80 1kls s GLN 4 N -0.18 2.33 0.67 -0.62 2.00 -1.26 -3.07 119.66 119.53 1kls s GLN 4 Ca -0.01 -1.84 -0.02 0.00 -2.00 0.00 0.00 55.36 51.49 1kls s GLN 4 Cb -0.13 -2.21 0.08 0.00 0.80 0.00 0.00 33.01 31.54 1kls s GLN 4 CO 0.03 -0.48 0.94 0.00 -0.50 0.00 0.00 175.29 175.28 1kls n GLN 6 N -2.73 2.40 0.00 0.00 7.27 -1.26 -4.75 117.38 118.31 1kls n GLN 6 Ca 0.10 -1.99 0.00 0.00 0.07 0.00 0.00 57.00 55.18 1kls n GLN 6 Cb 0.60 -1.24 0.00 0.00 2.41 0.00 0.00 30.24 32.01 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 -0.73 0.00 0.00 3.69 4.01 -1.26 -5.09 117.16 117.78 1kls n TYR 7 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 1kls n TYR 7 Cb 0.44 0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.66 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 0.00 1.05 -4.25 0.00 0.28 -1.26 -4.85 120.64 111.61 1kls n GLU 9 Ca 0.00 -1.13 -0.34 0.00 -0.16 0.00 0.00 57.16 55.53 1kls n GLU 9 Cb 0.00 0.24 -0.11 0.00 1.43 0.00 0.00 31.44 33.00 1kls n GLU 9 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1kls s LEU 10 N -3.20 3.52 0.40 -1.84 0.20 -1.26 -4.86 118.68 111.64 1kls s LEU 10 Ca 0.10 -0.00 0.08 0.00 0.69 0.00 0.00 54.13 54.99 1kls s LEU 10 Cb 0.35 -1.86 -0.05 0.00 -0.43 0.00 0.00 46.19 44.20 1kls s LEU 10 CO -0.09 0.21 0.15 0.00 -0.29 0.00 0.00 176.35 176.32 1kls s ARG 11 N 0.15 2.22 0.00 1.98 1.04 -1.26 -2.14 118.95 120.94 1kls s ARG 11 Ca 0.01 -1.81 0.00 0.00 -1.04 0.00 0.00 55.73 52.90 1kls s ARG 11 Cb -0.13 -1.99 0.00 0.00 -2.04 0.00 0.00 34.95 30.79 1kls s ARG 11 CO 0.02 -0.06 0.00 0.45 -0.04 0.00 0.00 175.30 175.67 1kls n SER 12 N -1.19 0.00 0.06 -2.89 2.88 -1.18 -5.03 113.62 106.27 1kls n SER 12 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1kls n SER 12 Cb 0.64 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 1kls n SER 12 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1kls n ALA 13 N -1.77 0.00 -2.22 -1.46 0.00 -1.26 -4.89 120.51 108.91 1kls n ALA 13 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1kls n ALA 13 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1kls n ALA 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1kls s ASP 14 N -1.30 1.31 0.20 0.00 1.11 -1.26 -1.19 116.67 115.54 1kls s ASP 14 Ca 0.00 -1.09 -0.13 0.00 0.18 0.00 0.00 52.55 51.51 1kls s ASP 14 Cb 0.00 0.08 0.25 0.00 1.07 0.00 0.00 42.92 44.32 1kls s ASP 14 CO 0.00 -0.49 1.29 -1.54 1.18 0.00 0.00 175.17 175.61 1kls n SER 15 N -0.18 -0.48 0.00 0.27 3.41 -1.26 -2.80 113.62 112.58 1kls n SER 15 Ca -0.09 1.45 0.00 0.00 -0.26 0.00 0.00 58.87 59.97 1kls n SER 15 Cb 0.62 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1kls n SER 15 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1kls n SER 16 N -5.26 0.00 -0.09 4.04 3.41 -1.26 -0.61 113.62 113.85 1kls n SER 16 Ca 0.10 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.54 1kls n SER 16 Cb 0.35 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.23 1kls n SER 16 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1kls n ASN 17 N -3.08 1.93 -0.33 4.04 5.15 -1.12 -4.63 115.26 117.21 1kls n ASN 17 Ca 0.00 0.08 0.18 0.00 -0.60 0.00 0.00 54.58 54.24 1kls n ASN 17 Cb 0.00 -0.43 0.35 0.00 -0.53 0.00 0.00 39.78 39.16 1kls n ASN 17 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1kls h LEU 18 N -0.37 -0.28 -0.85 1.20 6.46 -0.86 0.03 115.31 120.64 1kls h LEU 18 Ca -0.45 0.27 0.17 0.00 -0.12 0.00 0.00 57.88 57.76 1kls h LEU 18 Cb 1.51 0.43 -0.16 0.00 -0.73 0.00 0.00 40.66 41.71 1kls h LEU 18 CO -0.19 -0.35 -0.19 0.11 -0.62 0.00 0.00 178.44 177.20 1kls h LYS 19 N 0.03 0.01 0.37 1.25 1.79 -1.51 -0.61 116.57 117.89 1kls h LYS 19 Ca 0.64 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 59.11 1kls h LYS 19 Cb 1.41 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.05 1kls h LYS 19 CO -0.87 0.00 -0.31 1.15 -1.08 0.00 0.00 179.45 178.35 1kls h THR 20 N 0.01 0.36 -0.76 -0.16 2.02 -1.26 -2.75 112.91 110.35 1kls h THR 20 Ca 0.42 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.67 1kls h THR 20 Cb 0.66 0.36 -0.09 0.00 -1.74 0.00 0.00 68.15 67.33 1kls h THR 20 CO -0.86 0.00 -0.45 1.57 0.37 0.00 0.00 175.52 176.15 1kls n HIS 21 N -5.43 -0.34 -0.01 3.16 -0.00 -0.26 -2.01 115.22 110.33 1kls n HIS 21 Ca -0.10 0.95 -0.01 0.00 -0.00 0.00 0.00 57.72 58.56 1kls n HIS 21 Cb 0.33 -0.55 -0.01 0.00 -0.00 0.00 0.00 29.99 29.76 1kls n HIS 21 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.34 177.16 1kls h ILE 22 N 0.00 0.00 -1.08 3.57 2.04 -1.34 -0.80 117.51 119.90 1kls h ILE 22 Ca 0.12 0.00 0.42 0.00 1.00 0.00 0.00 64.86 66.41 1kls h ILE 22 Cb 0.31 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.22 1kls h ILE 22 CO -0.72 0.00 0.62 0.11 0.00 0.00 0.00 178.15 178.16 1kls h LYS 23 N -0.04 0.03 0.07 2.37 1.57 -1.11 0.42 116.57 119.87 1kls h LYS 23 Ca 0.00 -0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 1kls h LYS 23 Cb 0.06 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.32 1kls h LYS 23 CO -0.04 0.02 -2.01 0.25 -0.57 0.00 0.00 179.45 177.09 1kls n THR 24 N -5.13 1.67 0.63 -0.16 -2.24 -0.96 -2.94 114.28 105.15 1kls n THR 24 Ca 0.38 -0.70 0.11 0.00 -2.27 0.00 0.00 64.05 61.57 1kls n THR 24 Cb 1.32 -1.41 0.01 0.00 -2.10 0.00 0.00 70.33 68.15 1kls n THR 24 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1kls n LYS 25 N -3.28 0.24 0.00 -0.78 4.01 -0.33 -4.50 118.16 113.52 1kls n LYS 25 Ca -0.30 -0.02 0.00 0.00 -0.51 0.00 0.00 58.31 57.49 1kls n LYS 25 Cb 1.05 -1.57 0.00 0.00 -0.51 0.00 0.00 35.03 34.00 1kls n LYS 25 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 1kls n HIS 26 N -1.87 0.00 -3.65 2.13 8.25 0.06 -5.05 115.22 115.09 1kls n HIS 26 Ca 0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.16 1kls n HIS 26 Cb 0.42 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.55 1kls n HIS 26 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1kls n SER 27 N -2.03 -5.17 0.00 0.41 3.41 -0.70 -4.72 113.62 104.81 1kls n SER 27 Ca 0.00 -0.55 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 1kls n SER 27 Cb 0.45 -1.64 0.00 0.00 -0.26 0.00 0.00 64.21 62.76 1kls n SER 27 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1kls n LYS 28 N -1.34 0.00 -2.61 4.33 4.76 -1.26 -0.96 118.16 121.07 1kls n LYS 28 Ca -0.20 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.12 1kls n LYS 28 Cb 0.69 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.91 1kls n LYS 28 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1kls n GLU 29 N 0.00 1.91 0.00 1.97 4.07 -1.26 -5.19 120.64 122.14 1kls n GLU 29 Ca 0.00 -3.63 0.00 0.00 -0.06 0.00 0.00 57.16 53.47 1kls n GLU 29 Cb 0.00 -1.60 0.00 0.00 -0.06 0.00 0.00 31.44 29.78 1kls n GLU 29 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70