#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 2.76 -0.32 0.58 2.01 -1.26 -5.02 115.64 114.39 1kls s THR 2 Ca 0.00 -1.38 -0.02 0.00 0.31 0.00 0.00 61.69 60.60 1kls s THR 2 Cb 0.00 -3.02 0.06 0.00 0.01 0.00 0.00 72.50 69.55 1kls s THR 2 CO 0.00 -0.03 0.04 -0.31 -0.69 0.00 0.00 174.62 173.63 1kls s TYR 3 N -2.46 3.33 0.54 4.92 1.51 -1.25 -4.94 117.35 118.99 1kls s TYR 3 Ca 0.46 -1.96 0.04 0.00 -1.01 0.00 0.00 57.07 54.60 1kls s TYR 3 Cb -0.03 -2.33 0.02 0.00 -0.11 0.00 0.00 41.96 39.52 1kls s TYR 3 CO 0.27 -0.83 0.27 -1.14 -1.11 0.00 0.00 175.55 173.01 1kls s GLN 4 N 1.24 2.24 0.24 -0.62 2.00 -1.26 -1.13 119.66 122.36 1kls s GLN 4 Ca -0.02 -2.16 0.07 0.00 -2.00 0.00 0.00 55.36 51.25 1kls s GLN 4 Cb -0.20 -1.90 -0.04 0.00 0.80 0.00 0.00 33.01 31.67 1kls s GLN 4 CO -0.01 -0.54 0.15 0.00 -0.50 0.00 0.00 175.29 174.39 1kls n GLN 6 N -0.98 2.03 0.00 0.00 10.64 -1.26 -4.36 117.38 123.45 1kls n GLN 6 Ca -0.08 -3.44 0.00 0.00 -1.83 0.00 0.00 57.00 51.65 1kls n GLN 6 Cb 0.57 -1.65 0.00 0.00 -0.86 0.00 0.00 30.24 28.31 1kls n GLN 6 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1kls n TYR 7 N -0.80 0.00 0.01 2.61 4.01 -1.26 -5.01 117.16 116.73 1kls n TYR 7 Ca 0.24 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.97 1kls n TYR 7 Cb 0.83 0.34 -0.00 0.00 -0.31 0.00 0.00 39.34 40.19 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 -3.33 0.00 -3.81 0.00 0.28 -1.26 -5.05 120.64 107.46 1kls n GLU 9 Ca -0.02 0.00 -0.28 0.00 -0.16 0.00 0.00 57.16 56.70 1kls n GLU 9 Cb 0.08 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.91 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 0.00 4.29 -0.10 -1.84 0.20 -1.26 -4.79 118.68 115.17 1kls s LEU 10 Ca 0.00 0.33 -0.02 0.00 0.69 0.00 0.00 54.13 55.13 1kls s LEU 10 Cb 0.00 -3.07 -0.03 0.00 -0.43 0.00 0.00 46.19 42.66 1kls s LEU 10 CO 0.00 0.04 -0.01 -0.60 -0.29 0.00 0.00 176.35 175.48 1kls s ARG 11 N -3.07 3.15 -0.03 1.98 3.52 -1.26 -0.88 118.95 122.37 1kls s ARG 11 Ca 0.37 -0.45 -0.02 0.00 -0.13 0.00 0.00 55.73 55.50 1kls s ARG 11 Cb -0.12 -2.81 -0.02 0.00 -1.56 0.00 0.00 34.95 30.45 1kls s ARG 11 CO 0.28 0.57 -0.06 0.45 -0.81 0.00 0.00 175.30 175.74 1kls n SER 12 N 2.53 0.46 0.00 -2.12 2.88 -0.29 -5.01 113.62 112.07 1kls n SER 12 Ca -0.18 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 1kls n SER 12 Cb 0.53 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 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 -3.27 0.00 -3.11 -1.46 0.00 -0.85 -4.88 120.51 106.94 1kls n ALA 13 Ca -0.08 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.20 1kls n ALA 13 Cb 0.49 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.79 1kls n ALA 13 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1kls s ASP 14 N 0.43 0.55 0.27 0.00 2.15 -1.26 -3.80 116.67 115.01 1kls s ASP 14 Ca 0.00 -0.07 -0.09 0.00 0.43 0.00 0.00 52.55 52.82 1kls s ASP 14 Cb 0.00 -0.15 0.44 0.00 -0.30 0.00 0.00 42.92 42.91 1kls s ASP 14 CO 0.00 0.00 1.54 -1.54 -0.17 0.00 0.00 175.17 175.00 1kls n SER 15 N 3.39 -0.38 -0.16 -0.34 3.41 -1.26 -1.63 113.62 116.65 1kls n SER 15 Ca -0.18 1.70 0.14 0.00 -0.26 0.00 0.00 58.87 60.27 1kls n SER 15 Cb 0.55 -0.50 0.26 0.00 -0.26 0.00 0.00 64.21 64.26 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 -5.60 0.12 -0.12 4.04 2.88 -1.26 -0.75 113.62 112.94 1kls n SER 16 Ca 0.15 0.82 -0.17 0.00 -1.33 0.00 0.00 58.87 58.35 1kls n SER 16 Cb 0.49 -0.38 -0.10 0.00 -0.75 0.00 0.00 64.21 63.46 1kls n SER 16 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1kls n ASN 17 N -4.20 2.17 -0.31 -3.46 2.85 -0.64 -4.41 115.26 107.25 1kls n ASN 17 Ca 0.17 -0.09 0.15 0.00 -0.11 0.00 0.00 54.58 54.70 1kls n ASN 17 Cb 0.58 -0.39 0.33 0.00 1.24 0.00 0.00 39.78 41.54 1kls n ASN 17 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 1kls h LEU 18 N -0.07 0.23 -0.06 1.20 5.85 -0.76 -0.25 115.31 121.45 1kls h LEU 18 Ca -0.52 0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.38 1kls h LEU 18 Cb 1.78 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.99 1kls h LEU 18 CO -0.10 -0.09 -0.08 0.50 -0.34 0.00 0.00 178.44 178.33 1kls h LYS 19 N 0.31 -0.05 -0.59 1.25 3.64 -1.34 -1.67 116.57 118.12 1kls h LYS 19 Ca 0.59 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 60.06 1kls h LYS 19 Cb 1.20 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.96 1kls h LYS 19 CO -0.60 -0.03 0.21 1.79 -2.27 0.00 0.00 179.45 178.55 1kls h THR 20 N -0.05 0.77 -0.16 1.00 1.35 -1.48 -2.81 112.91 111.52 1kls h THR 20 Ca 0.01 -0.13 0.02 0.00 -0.55 0.00 0.00 66.41 65.76 1kls h THR 20 Cb 0.08 0.35 -0.04 0.00 -1.73 0.00 0.00 68.15 66.82 1kls h THR 20 CO -0.08 0.07 -0.26 -0.74 -0.25 0.00 0.00 175.52 174.26 1kls h HIS 21 N 0.38 -0.78 -0.17 4.73 -0.00 -0.45 -0.94 115.15 117.92 1kls h HIS 21 Ca 0.29 0.04 0.05 0.00 -0.00 0.00 0.00 60.37 60.75 1kls h HIS 21 Cb 0.36 0.36 -0.07 0.00 -0.00 0.00 0.00 27.41 28.07 1kls h HIS 21 CO -0.17 -0.23 -0.40 0.82 -0.00 0.00 0.00 177.93 177.94 1kls h ILE 22 N -0.20 0.17 -0.52 6.26 2.04 -1.21 -0.16 117.51 123.87 1kls h ILE 22 Ca 0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.99 1kls h ILE 22 Cb 0.28 0.17 -0.09 0.00 -0.74 0.00 0.00 36.82 36.44 1kls h ILE 22 CO -0.26 0.00 -0.01 0.50 0.00 0.00 0.00 178.15 178.38 1kls h LYS 23 N -0.45 0.10 0.16 2.37 3.64 -1.27 0.18 116.57 121.30 1kls h LYS 23 Ca 0.09 -0.01 -0.31 0.00 -1.27 0.00 0.00 60.65 59.15 1kls h LYS 23 Cb 0.61 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1kls h LYS 23 CO -0.41 0.07 -1.47 1.15 -2.27 0.00 0.00 179.45 176.52 1kls h THR 24 N 0.11 1.25 0.00 1.00 2.02 -0.90 -2.78 112.91 113.61 1kls h THR 24 Ca 0.27 -2.81 0.00 0.00 0.77 0.00 0.00 66.41 64.63 1kls h THR 24 Cb 0.41 2.88 0.00 0.00 -1.74 0.00 0.00 68.15 69.70 1kls h THR 24 CO -0.45 0.84 -1.25 0.29 0.37 0.00 0.00 175.52 175.33 1kls n LYS 25 N -3.56 0.34 -0.11 6.66 5.02 -0.10 -4.35 118.16 122.05 1kls n LYS 25 Ca -0.15 -0.04 0.04 0.00 -2.02 0.00 0.00 58.31 56.13 1kls n LYS 25 Cb 1.06 -1.57 0.05 0.00 -0.02 0.00 0.00 35.03 34.55 1kls n LYS 25 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1kls n HIS 26 N -1.98 0.00 0.00 2.13 8.25 0.61 -4.96 115.22 119.27 1kls n HIS 26 Ca 0.01 -0.53 0.00 0.00 -0.26 0.00 0.00 57.72 56.94 1kls n HIS 26 Cb 0.45 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.48 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 -0.69 0.00 -3.22 0.41 7.64 -1.05 0.14 113.62 116.85 1kls n SER 27 Ca 0.06 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.63 1kls n SER 27 Cb 0.51 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.68 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 -1.93 3.70 0.00 1.43 4.76 -1.26 -4.98 118.16 119.87 1kls n LYS 28 Ca 0.00 -4.78 0.00 0.00 -2.87 0.00 0.00 58.31 50.66 1kls n LYS 28 Cb 0.00 -2.31 0.00 0.00 -1.84 0.00 0.00 35.03 30.88 1kls n LYS 28 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1kls n GLU 29 N 0.04 0.00 0.00 1.97 -0.58 0.37 -5.25 120.64 117.19 1kls n GLU 29 Ca 0.34 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.08 1kls n GLU 29 Cb 0.36 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.23 1kls n GLU 29 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01