#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 -3.94 -0.18 -1.04 -1.26 -5.13 114.28 102.73 1kls n THR 2 Ca 0.00 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.68 1kls n THR 2 Cb 0.00 -0.37 -0.05 0.00 -1.82 0.00 0.00 70.33 68.09 1kls n THR 2 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1kls s TYR 3 N 0.78 3.50 0.18 -1.42 2.02 -1.19 -4.99 117.35 116.22 1kls s TYR 3 Ca 0.00 0.32 0.10 0.00 -0.37 0.00 0.00 57.07 57.12 1kls s TYR 3 Cb 0.00 -1.81 -0.04 0.00 -0.40 0.00 0.00 41.96 39.71 1kls s TYR 3 CO 0.00 0.63 -0.15 -1.14 -1.57 0.00 0.00 175.55 173.32 1kls s GLN 4 N -1.93 1.87 0.70 -0.62 0.74 -1.26 -1.11 119.66 118.04 1kls s GLN 4 Ca 0.27 -1.34 -0.11 0.00 0.05 0.00 0.00 55.36 54.23 1kls s GLN 4 Cb -0.13 -2.06 0.01 0.00 1.10 0.00 0.00 33.01 31.93 1kls s GLN 4 CO 0.18 0.43 1.06 0.00 -0.55 0.00 0.00 175.29 176.41 1kls n GLN 6 N -3.11 2.95 0.01 0.00 -0.06 -1.26 -4.62 117.38 111.30 1kls n GLN 6 Ca 0.08 -3.88 0.00 0.00 -2.00 0.00 0.00 57.00 51.19 1kls n GLN 6 Cb 0.53 -2.05 0.00 0.00 -4.06 0.00 0.00 30.24 24.66 1kls n GLN 6 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1kls n TYR 7 N -0.81 -0.10 0.00 3.69 4.01 -1.26 -5.10 117.16 117.58 1kls n TYR 7 Ca 0.35 0.02 0.00 0.00 -0.16 0.00 0.00 57.90 58.11 1kls n TYR 7 Cb 0.89 0.44 0.00 0.00 -0.31 0.00 0.00 39.34 40.36 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 1.22 -4.19 0.00 0.00 -1.26 -4.86 120.64 111.55 1kls n GLU 9 Ca 0.00 -1.98 -0.22 0.00 0.00 0.00 0.00 57.16 54.96 1kls n GLU 9 Cb 0.00 -0.18 -0.06 0.00 0.00 0.00 0.00 31.44 31.20 1kls n GLU 9 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 1kls s LEU 10 N -3.28 3.51 0.05 -1.84 0.20 -1.26 -4.93 118.68 111.13 1kls s LEU 10 Ca 0.22 -0.45 0.08 0.00 0.69 0.00 0.00 54.13 54.66 1kls s LEU 10 Cb 0.41 -2.04 -0.03 0.00 -0.43 0.00 0.00 46.19 44.10 1kls s LEU 10 CO -0.08 -0.04 -0.21 -0.13 -0.29 0.00 0.00 176.35 175.61 1kls s ARG 11 N -3.77 1.94 0.04 1.98 0.52 -1.26 -1.01 118.95 117.38 1kls s ARG 11 Ca 0.33 -1.05 0.04 0.00 -0.52 0.00 0.00 55.73 54.53 1kls s ARG 11 Cb -0.07 -2.11 -0.02 0.00 0.52 0.00 0.00 34.95 33.27 1kls s ARG 11 CO 0.23 0.52 -0.13 -1.12 0.02 0.00 0.00 175.30 174.82 1kls s SER 12 N -1.47 1.54 -0.43 0.23 0.01 -0.27 -5.00 113.70 108.31 1kls s SER 12 Ca 0.14 -0.46 0.02 0.00 1.31 0.00 0.00 55.95 56.96 1kls s SER 12 Cb -0.10 -0.09 0.13 0.00 0.21 0.00 0.00 66.02 66.17 1kls s SER 12 CO 0.05 0.00 0.21 0.00 0.41 0.00 0.00 173.24 173.91 1kls s ALA 13 N -0.90 2.33 0.00 1.44 0.00 -1.26 -3.14 121.76 120.22 1kls s ALA 13 Ca 0.00 -2.59 0.00 0.00 0.00 0.00 0.00 51.96 49.37 1kls s ALA 13 Cb -0.08 -1.91 0.00 0.00 0.00 0.00 0.00 23.12 21.13 1kls s ALA 13 CO 0.01 -1.98 0.00 -0.25 0.00 0.00 0.00 175.76 173.54 1kls n ASP 14 N 3.69 0.00 -3.09 0.00 8.00 -1.26 -4.46 116.55 119.43 1kls n ASP 14 Ca 0.06 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.38 1kls n ASP 14 Cb 0.35 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 1kls n ASP 14 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1kls n SER 15 N 0.00 -0.12 0.00 -2.24 3.41 -1.26 0.53 113.62 113.94 1kls n SER 15 Ca 0.00 -3.03 0.00 0.00 -0.26 0.00 0.00 58.87 55.58 1kls n SER 15 Cb 0.00 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 1kls n SER 15 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1kls n SER 16 N 0.76 -0.81 -0.19 4.04 2.88 -1.26 -4.58 113.62 114.45 1kls n SER 16 Ca 0.20 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.88 1kls n SER 16 Cb 0.62 0.00 0.22 0.00 -0.75 0.00 0.00 64.21 64.31 1kls n SER 16 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1kls n ASN 17 N -3.49 0.00 -0.06 -3.46 5.03 -1.19 -1.20 115.26 110.89 1kls n ASN 17 Ca 0.00 0.27 -0.02 0.00 0.87 0.00 0.00 54.58 55.70 1kls n ASN 17 Cb 0.00 -0.14 -0.01 0.00 -1.02 0.00 0.00 39.78 38.62 1kls n ASN 17 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 1kls h LEU 18 N 0.00 0.00 -0.71 3.41 7.12 -0.22 -0.89 115.31 124.01 1kls h LEU 18 Ca 0.26 -0.01 0.15 0.00 0.13 0.00 0.00 57.88 58.41 1kls h LEU 18 Cb 1.03 0.00 -0.13 0.00 -0.53 0.00 0.00 40.66 41.03 1kls h LEU 18 CO -0.01 0.62 -0.09 0.50 -0.13 0.00 0.00 178.44 179.33 1kls h LYS 19 N -1.00 0.04 0.16 1.25 3.11 -1.38 0.10 116.57 118.86 1kls h LYS 19 Ca -0.00 -0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.83 1kls h LYS 19 Cb 0.24 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.46 1kls h LYS 19 CO -0.00 0.03 -0.08 1.79 -2.81 0.00 0.00 179.45 178.38 1kls h THR 20 N 0.05 0.93 -0.90 1.00 1.35 -1.59 -2.34 112.91 111.40 1kls h THR 20 Ca 0.37 -0.36 0.10 0.00 -0.55 0.00 0.00 66.41 65.97 1kls h THR 20 Cb 0.60 1.15 -0.13 0.00 -1.73 0.00 0.00 68.15 68.04 1kls h THR 20 CO -0.69 0.08 -0.52 -0.74 -0.25 0.00 0.00 175.52 173.41 1kls h HIS 21 N -0.38 -1.61 0.14 4.73 -0.00 0.48 -0.98 115.15 117.54 1kls h HIS 21 Ca -0.02 0.11 0.00 0.00 -0.00 0.00 0.00 60.37 60.47 1kls h HIS 21 Cb 0.30 0.83 -0.03 0.00 -0.00 0.00 0.00 27.41 28.51 1kls h HIS 21 CO -0.02 -0.39 -0.36 0.82 -0.00 0.00 0.00 177.93 177.98 1kls h ILE 22 N -0.06 0.00 -0.58 6.26 2.04 -1.28 0.04 117.51 123.93 1kls h ILE 22 Ca 0.20 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.28 1kls h ILE 22 Cb 0.49 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.46 1kls h ILE 22 CO -0.90 0.00 0.22 1.17 0.00 0.00 0.00 178.15 178.65 1kls n LYS 23 N -4.51 -0.04 -0.12 2.37 4.81 -0.42 -1.26 118.16 118.99 1kls n LYS 23 Ca -0.06 0.83 -0.20 0.00 -0.87 0.00 0.00 58.31 58.01 1kls n LYS 23 Cb 0.29 -1.43 -0.11 0.00 0.02 0.00 0.00 35.03 33.80 1kls n LYS 23 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1kls n THR 24 N -4.45 1.38 0.20 3.15 -2.24 -0.90 -1.62 114.28 109.81 1kls n THR 24 Ca 0.20 -0.48 0.10 0.00 -2.27 0.00 0.00 64.05 61.59 1kls n THR 24 Cb 0.66 -1.49 0.13 0.00 -2.10 0.00 0.00 70.33 67.53 1kls n THR 24 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1kls h LYS 25 N -0.26 0.00 0.00 -0.78 6.56 -0.67 -3.26 116.57 118.15 1kls h LYS 25 Ca -0.57 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.02 1kls h LYS 25 Cb 1.76 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.42 1kls h LYS 25 CO -0.17 0.13 -0.98 0.72 -2.06 0.00 0.00 179.45 177.08 1kls n HIS 26 N -3.12 0.00 -2.47 -1.35 8.25 -0.39 -4.80 115.22 111.34 1kls n HIS 26 Ca 0.03 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.15 1kls n HIS 26 Cb 0.58 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.70 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 -2.34 6.14 -0.63 0.41 2.88 -0.67 -4.98 113.62 114.44 1kls n SER 27 Ca 0.00 -3.74 0.00 0.00 -1.33 0.00 0.00 58.87 53.80 1kls n SER 27 Cb 0.49 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 1kls n SER 27 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1kls n LYS 28 N -0.34 0.00 -1.90 -1.46 3.00 -1.24 -2.71 118.16 113.51 1kls n LYS 28 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.74 1kls n LYS 28 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.41 1kls n LYS 28 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1kls n GLU 29 N -0.09 -0.53 0.00 1.64 2.13 -0.64 -4.96 120.64 118.19 1kls n GLU 29 Ca 0.00 -0.26 0.00 0.00 0.66 0.00 0.00 57.16 57.56 1kls n GLU 29 Cb 0.00 0.47 0.00 0.00 0.27 0.00 0.00 31.44 32.18 1kls n GLU 29 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89