#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 2.78 0.09 3.15 2.01 -1.26 -5.09 115.64 117.33 1kls s THR 2 Ca 0.00 -1.63 0.06 0.00 0.31 0.00 0.00 61.69 60.43 1kls s THR 2 Cb 0.00 -2.99 -0.03 0.00 0.01 0.00 0.00 72.50 69.48 1kls s THR 2 CO 0.00 -0.10 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.37 1kls s TYR 3 N -2.48 1.32 0.34 4.92 1.51 -1.13 -4.97 117.35 116.86 1kls s TYR 3 Ca 0.40 -0.50 0.04 0.00 -1.01 0.00 0.00 57.07 56.00 1kls s TYR 3 Cb -0.01 -0.72 -0.07 0.00 -0.11 0.00 0.00 41.96 41.06 1kls s TYR 3 CO 0.24 0.10 0.04 -1.14 -1.11 0.00 0.00 175.55 173.68 1kls s GLN 4 N -2.16 1.70 0.14 -0.62 0.74 -1.26 -1.17 119.66 117.02 1kls s GLN 4 Ca 0.03 -1.94 0.03 0.00 0.05 0.00 0.00 55.36 53.53 1kls s GLN 4 Cb -0.08 -1.00 -0.04 0.00 1.10 0.00 0.00 33.01 32.99 1kls s GLN 4 CO 0.03 -0.15 0.26 0.00 -0.55 0.00 0.00 175.29 174.87 1kls n GLN 6 N -0.45 2.86 0.01 0.00 -0.06 -1.26 -4.22 117.38 114.26 1kls n GLN 6 Ca -0.07 -3.98 0.00 0.00 -2.00 0.00 0.00 57.00 50.95 1kls n GLN 6 Cb 0.54 -2.00 0.00 0.00 -4.06 0.00 0.00 30.24 24.72 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 -0.57 -0.22 -0.03 3.69 4.01 -1.26 -4.98 117.16 117.80 1kls n TYR 7 Ca 0.30 0.04 -0.08 0.00 -0.16 0.00 0.00 57.90 58.00 1kls n TYR 7 Cb 0.85 0.36 -0.03 0.00 -0.31 0.00 0.00 39.34 40.21 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 -3.56 0.00 -0.04 0.00 0.00 -1.26 -5.10 120.64 110.68 1kls n GLU 9 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 57.16 57.00 1kls n GLU 9 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.94 1kls n GLU 9 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 1kls n LEU 10 N 0.00 -0.12 -4.79 4.31 7.94 -1.26 -3.49 117.00 119.59 1kls n LEU 10 Ca 0.00 0.02 -0.26 0.00 -1.11 0.00 0.00 56.01 54.66 1kls n LEU 10 Cb 0.00 -0.03 -0.05 0.00 0.53 0.00 0.00 43.42 43.87 1kls n LEU 10 CO 0.00 -0.15 -0.22 0.00 -1.11 0.00 0.00 177.39 175.91 1kls s ARG 11 N -0.03 2.86 0.11 1.96 1.70 -1.26 -0.60 118.95 123.69 1kls s ARG 11 Ca 0.02 -0.91 0.03 0.00 -0.47 0.00 0.00 55.73 54.39 1kls s ARG 11 Cb -0.02 -2.61 -0.04 0.00 -0.57 0.00 0.00 34.95 31.71 1kls s ARG 11 CO 0.02 0.47 -0.08 0.45 -1.08 0.00 0.00 175.30 175.09 1kls s SER 12 N -3.18 1.31 0.00 -2.89 0.15 -0.32 -4.94 113.70 103.83 1kls s SER 12 Ca 0.31 -0.98 -0.16 0.00 0.70 0.00 0.00 55.95 55.82 1kls s SER 12 Cb -0.10 0.06 -0.09 0.00 -1.71 0.00 0.00 66.02 64.19 1kls s SER 12 CO 0.23 -0.41 0.88 0.00 1.20 0.00 0.00 173.24 175.14 1kls h ALA 13 N 3.01 -0.79 -2.45 5.45 0.00 -1.97 -2.98 119.26 119.53 1kls h ALA 13 Ca -0.36 -0.12 -0.30 0.00 0.00 0.00 0.00 54.91 54.13 1kls h ALA 13 Cb 1.17 0.22 -0.15 0.00 0.00 0.00 0.00 17.79 19.03 1kls h ALA 13 CO 0.63 -0.75 -0.62 0.34 0.00 0.00 0.00 179.25 178.85 1kls s ASP 14 N -3.75 0.71 0.19 0.00 2.15 -1.26 -1.45 116.67 113.26 1kls s ASP 14 Ca -0.08 -1.38 -0.17 0.00 0.43 0.00 0.00 52.55 51.34 1kls s ASP 14 Cb 0.01 0.26 0.16 0.00 -0.30 0.00 0.00 42.92 43.05 1kls s ASP 14 CO 0.25 -0.78 1.62 -1.28 -0.17 0.00 0.00 175.17 174.80 1kls h SER 15 N 2.50 -0.78 -0.95 -0.34 0.87 -1.93 -0.96 113.55 111.96 1kls h SER 15 Ca -0.37 0.19 0.35 0.00 -1.23 0.00 0.00 61.79 60.73 1kls h SER 15 Cb 1.25 0.44 -0.12 0.00 -0.44 0.00 0.00 62.40 63.53 1kls h SER 15 CO 0.57 -0.25 0.59 -1.54 -0.53 0.00 0.00 176.83 175.67 1kls n SER 16 N -5.42 0.19 -0.13 6.23 3.41 -1.26 -1.00 113.62 115.65 1kls n SER 16 Ca 0.05 1.12 -0.27 0.00 -0.26 0.00 0.00 58.87 59.51 1kls n SER 16 Cb 0.33 -0.55 -0.11 0.00 -0.26 0.00 0.00 64.21 63.62 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 -4.38 1.95 -0.34 4.04 2.85 -0.45 -4.46 115.26 114.48 1kls n ASN 17 Ca 0.30 0.29 0.13 0.00 -0.11 0.00 0.00 54.58 55.19 1kls n ASN 17 Cb 1.12 -0.80 0.25 0.00 1.24 0.00 0.00 39.78 41.60 1kls n ASN 17 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 1kls n LEU 18 N -4.13 -0.16 -0.31 1.20 7.94 -0.17 -0.72 117.00 120.64 1kls n LEU 18 Ca -0.49 1.64 0.08 0.00 -1.11 0.00 0.00 56.01 56.13 1kls n LEU 18 Cb 0.87 -0.57 0.19 0.00 0.53 0.00 0.00 43.42 44.43 1kls n LEU 18 CO 0.10 -1.64 0.76 0.50 -1.11 0.00 0.00 177.39 176.00 1kls h LYS 19 N 0.00 0.03 -0.10 1.96 3.64 -1.52 0.28 116.57 120.86 1kls h LYS 19 Ca 0.56 -0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.75 1kls h LYS 19 Cb 1.09 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1kls h LYS 19 CO -0.92 0.02 -0.67 1.79 -2.27 0.00 0.00 179.45 177.40 1kls h THR 20 N 0.03 1.33 -0.68 1.00 1.35 -1.18 -2.92 112.91 111.85 1kls h THR 20 Ca 0.48 -1.94 0.10 0.00 -0.55 0.00 0.00 66.41 64.50 1kls h THR 20 Cb 0.87 2.17 -0.12 0.00 -1.73 0.00 0.00 68.15 69.34 1kls h THR 20 CO -0.86 0.60 -0.42 -0.74 -0.25 0.00 0.00 175.52 173.85 1kls h HIS 21 N 0.29 -1.24 -0.01 4.73 -0.00 -0.76 -1.42 115.15 116.73 1kls h HIS 21 Ca -0.05 0.09 0.01 0.00 -0.00 0.00 0.00 60.37 60.41 1kls h HIS 21 Cb 1.32 0.64 -0.02 0.00 -0.00 0.00 0.00 27.41 29.34 1kls h HIS 21 CO 0.11 -0.41 -0.22 0.82 -0.00 0.00 0.00 177.93 178.23 1kls h ILE 22 N -0.16 0.00 -0.64 6.26 2.04 -1.33 -0.73 117.51 122.95 1kls h ILE 22 Ca 0.21 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.29 1kls h ILE 22 Cb 0.56 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.52 1kls h ILE 22 CO -0.75 0.00 0.17 0.29 0.00 0.00 0.00 178.15 177.86 1kls n LYS 23 N -3.69 -0.05 -0.05 2.37 5.02 -0.58 -0.25 118.16 120.94 1kls n LYS 23 Ca -0.03 0.92 -0.22 0.00 -2.02 0.00 0.00 58.31 56.97 1kls n LYS 23 Cb 0.16 -1.55 -0.13 0.00 -0.02 0.00 0.00 35.03 33.48 1kls n LYS 23 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1kls h THR 24 N 0.00 0.84 0.00 -0.18 2.02 -0.99 -3.40 112.91 111.21 1kls h THR 24 Ca 0.46 -2.27 0.00 0.00 0.77 0.00 0.00 66.41 65.37 1kls h THR 24 Cb 1.10 2.41 0.00 0.00 -1.74 0.00 0.00 68.15 69.92 1kls h THR 24 CO -0.55 0.58 -0.35 0.11 0.37 0.00 0.00 175.52 175.68 1kls h LYS 25 N -0.52 0.00 0.00 6.66 1.79 -0.52 -3.46 116.57 120.52 1kls h LYS 25 Ca -0.36 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.11 1kls h LYS 25 Cb 1.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.28 1kls h LYS 25 CO -0.06 0.00 0.00 0.72 -1.08 0.00 0.00 179.45 179.03 1kls n HIS 26 N -2.66 0.00 -2.20 -1.35 8.25 0.66 -5.02 115.22 112.89 1kls n HIS 26 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 1kls n HIS 26 Cb 0.50 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 1kls n HIS 26 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1kls n SER 27 N 0.00 0.00 -3.20 0.41 7.64 -1.22 -4.84 113.62 112.40 1kls n SER 27 Ca 0.00 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.52 1kls n SER 27 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 1kls n SER 27 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1kls n LYS 28 N -0.40 4.16 0.00 1.43 5.02 -1.26 -4.42 118.16 122.70 1kls n LYS 28 Ca 0.00 -4.45 0.00 0.00 -2.02 0.00 0.00 58.31 51.84 1kls n LYS 28 Cb 0.00 -2.35 0.00 0.00 -0.02 0.00 0.00 35.03 32.66 1kls n LYS 28 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1kls n GLU 29 N -0.25 0.00 0.00 1.97 -0.58 -1.26 -5.32 120.64 115.20 1kls n GLU 29 Ca 0.44 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.18 1kls n GLU 29 Cb 0.32 -0.74 0.00 0.00 -0.57 0.00 0.00 31.44 30.46 1kls n GLU 29 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28