#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 0.77 -0.61 3.15 2.01 -1.26 -5.09 115.64 114.60 1kls s THR 2 Ca 0.00 -2.00 -0.22 0.00 0.31 0.00 0.00 61.69 59.78 1kls s THR 2 Cb 0.00 -2.33 0.07 0.00 0.01 0.00 0.00 72.50 70.25 1kls s THR 2 CO 0.00 0.00 0.89 -0.31 -0.69 0.00 0.00 174.62 174.51 1kls s TYR 3 N -3.13 2.78 0.04 4.92 1.51 -1.01 -4.99 117.35 117.46 1kls s TYR 3 Ca 0.20 -0.50 0.00 0.00 -1.01 0.00 0.00 57.07 55.77 1kls s TYR 3 Cb 0.03 -4.13 0.00 0.00 -0.11 0.00 0.00 41.96 37.74 1kls s TYR 3 CO 0.12 -1.48 0.02 0.94 -1.11 0.00 0.00 175.55 174.04 1kls n GLN 4 N 7.33 1.61 -4.14 -0.62 7.27 -1.26 -1.31 117.38 126.26 1kls n GLN 4 Ca -0.04 -0.25 -0.23 0.00 0.07 0.00 0.00 57.00 56.55 1kls n GLN 4 Cb 0.45 0.04 -0.05 0.00 2.41 0.00 0.00 30.24 33.09 1kls n GLN 4 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1kls n GLN 6 N -0.86 2.57 0.07 0.00 7.27 -1.26 -4.68 117.38 120.48 1kls n GLN 6 Ca -0.08 -3.70 0.00 0.00 0.07 0.00 0.00 57.00 53.29 1kls n GLN 6 Cb 0.57 -1.87 0.00 0.00 2.41 0.00 0.00 30.24 31.35 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 -0.77 -1.14 0.00 3.69 4.01 -1.26 -5.11 117.16 116.58 1kls n TYR 7 Ca 0.30 0.20 0.00 0.00 -0.16 0.00 0.00 57.90 58.24 1kls n TYR 7 Cb 0.87 0.49 0.00 0.00 -0.31 0.00 0.00 39.34 40.39 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 1.12 -4.14 0.00 1.02 -1.26 -4.83 120.64 112.56 1kls n GLU 9 Ca 0.00 -2.73 -0.31 0.00 -0.02 0.00 0.00 57.16 54.10 1kls n GLU 9 Cb 0.00 -0.93 -0.08 0.00 -0.02 0.00 0.00 31.44 30.41 1kls n GLU 9 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1kls s LEU 10 N -2.98 3.57 0.00 -4.62 0.20 -1.26 -4.94 118.68 108.66 1kls s LEU 10 Ca 0.27 -0.09 0.01 0.00 0.69 0.00 0.00 54.13 55.01 1kls s LEU 10 Cb 0.41 -2.24 -0.04 0.00 -0.43 0.00 0.00 46.19 43.90 1kls s LEU 10 CO -0.02 0.20 0.02 -0.13 -0.29 0.00 0.00 176.35 176.13 1kls s ARG 11 N -2.17 2.84 -0.07 1.98 3.00 -1.26 -1.59 118.95 121.68 1kls s ARG 11 Ca 0.25 -0.60 -0.01 0.00 0.00 0.00 0.00 55.73 55.38 1kls s ARG 11 Cb -0.12 -2.71 -0.04 0.00 0.00 0.00 0.00 34.95 32.09 1kls s ARG 11 CO 0.18 0.62 -0.07 0.43 0.00 0.00 0.00 175.30 176.46 1kls n SER 12 N 1.28 2.44 0.00 0.23 7.64 -0.43 -5.00 113.62 119.78 1kls n SER 12 Ca -0.14 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1kls n SER 12 Cb 0.53 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1kls n SER 12 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1kls n ALA 13 N -2.91 0.00 -2.20 -0.43 0.00 -1.07 -4.77 120.51 109.12 1kls n ALA 13 Ca -0.13 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.20 1kls n ALA 13 Cb 0.62 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.97 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 0.00 1.07 0.21 0.00 2.15 -1.26 -2.42 116.67 116.43 1kls s ASP 14 Ca 0.00 -1.10 -0.12 0.00 0.43 0.00 0.00 52.55 51.76 1kls s ASP 14 Cb 0.00 0.13 0.27 0.00 -0.30 0.00 0.00 42.92 43.02 1kls s ASP 14 CO 0.00 -0.54 1.32 -0.24 -0.17 0.00 0.00 175.17 175.54 1kls n SER 15 N -0.13 -0.47 -0.13 -0.34 2.88 -1.26 -1.88 113.62 112.29 1kls n SER 15 Ca -0.09 1.48 0.11 0.00 -1.33 0.00 0.00 58.87 59.04 1kls n SER 15 Cb 0.62 -0.38 0.21 0.00 -0.75 0.00 0.00 64.21 63.91 1kls n SER 15 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1kls n SER 16 N -5.30 0.10 -0.09 -3.46 2.88 -1.26 -0.85 113.62 105.63 1kls n SER 16 Ca 0.10 0.66 -0.12 0.00 -1.33 0.00 0.00 58.87 58.18 1kls n SER 16 Cb 0.37 -0.30 -0.10 0.00 -0.75 0.00 0.00 64.21 63.43 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 -3.99 2.20 -0.13 -3.46 5.03 -0.79 -4.36 115.26 109.76 1kls n ASN 17 Ca 0.14 -0.08 0.28 0.00 0.87 0.00 0.00 54.58 55.78 1kls n ASN 17 Cb 0.46 -0.03 0.69 0.00 -1.02 0.00 0.00 39.78 39.88 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 -8.79 3.41 5.85 -0.93 -3.10 115.31 111.75 1kls h LEU 18 Ca -0.43 0.00 -0.64 0.00 0.84 0.00 0.00 57.88 57.65 1kls h LEU 18 Cb 1.73 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 42.56 1kls h LEU 18 CO -0.05 0.00 -0.62 -0.54 -0.34 0.00 0.00 178.44 176.89 1kls s LYS 19 N -4.71 3.73 -0.33 1.25 1.02 -0.71 -0.07 119.74 119.91 1kls s LYS 19 Ca -0.04 -0.46 0.06 0.00 0.02 0.00 0.00 55.97 55.55 1kls s LYS 19 Cb 0.18 -3.19 0.63 0.00 -0.52 0.00 0.00 37.83 34.93 1kls s LYS 19 CO 0.63 0.02 1.73 0.25 -0.92 0.00 0.00 175.35 177.07 1kls n THR 20 N 4.26 2.76 -0.20 2.17 -2.24 -1.18 -4.77 114.28 115.08 1kls n THR 20 Ca -0.17 -1.53 -0.12 0.00 -2.27 0.00 0.00 64.05 59.97 1kls n THR 20 Cb 0.52 -0.47 -0.09 0.00 -2.10 0.00 0.00 70.33 68.19 1kls n THR 20 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1kls h HIS 21 N 1.70 -1.57 0.02 4.78 -0.00 -0.41 -0.90 115.15 118.77 1kls h HIS 21 Ca 0.38 0.09 -0.00 0.00 -0.00 0.00 0.00 60.37 60.84 1kls h HIS 21 Cb 2.37 0.75 -0.00 0.00 -0.00 0.00 0.00 27.41 30.53 1kls h HIS 21 CO 1.26 -0.40 -0.01 0.82 -0.00 0.00 0.00 177.93 179.59 1kls h ILE 22 N -0.25 0.00 -0.60 6.26 2.04 -1.76 -0.44 117.51 122.77 1kls h ILE 22 Ca 0.09 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.09 1kls h ILE 22 Cb 0.48 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.45 1kls h ILE 22 CO -0.62 0.00 -0.08 1.17 0.00 0.00 0.00 178.15 178.62 1kls n LYS 23 N -2.28 -0.05 -0.02 2.37 4.81 -1.08 -0.51 118.16 121.39 1kls n LYS 23 Ca -0.00 0.92 -0.02 0.00 -0.87 0.00 0.00 58.31 58.34 1kls n LYS 23 Cb 0.01 -1.41 -0.13 0.00 0.02 0.00 0.00 35.03 33.52 1kls n LYS 23 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1kls n THR 24 N -4.88 1.07 0.85 3.15 -1.04 -0.36 -0.97 114.28 112.10 1kls n THR 24 Ca 0.12 -0.72 0.09 0.00 -2.04 0.00 0.00 64.05 61.50 1kls n THR 24 Cb 0.37 -0.54 -0.11 0.00 -1.82 0.00 0.00 70.33 68.23 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 -2.74 0.60 0.00 -2.82 5.02 -0.18 -2.08 118.16 115.96 1kls n LYS 25 Ca -0.17 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 1kls n LYS 25 Cb 0.91 -1.42 0.00 0.00 -0.02 0.00 0.00 35.03 34.50 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 -1.51 0.00 -0.10 2.13 8.25 0.33 -4.85 115.22 119.47 1kls n HIS 26 Ca 0.03 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.34 1kls n HIS 26 Cb 0.32 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.36 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 -1.72 1.87 -0.06 0.41 2.88 -1.04 -4.84 113.62 111.13 1kls n SER 27 Ca 0.00 0.48 -0.03 0.00 -1.33 0.00 0.00 58.87 57.98 1kls n SER 27 Cb 0.27 -0.88 -0.01 0.00 -0.75 0.00 0.00 64.21 62.85 1kls n SER 27 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1kls h LYS 28 N -1.00 0.00 0.00 -1.46 3.64 -1.29 -3.48 116.57 112.97 1kls h LYS 28 Ca -0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 1kls h LYS 28 Cb 1.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1kls h LYS 28 CO -0.13 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.44 1kls n GLU 29 N -4.19 0.00 0.00 1.90 -0.58 -0.88 -5.03 120.64 111.86 1kls n GLU 29 Ca -0.05 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.72 1kls n GLU 29 Cb 0.20 0.00 0.03 0.00 -0.57 0.00 0.00 31.44 31.10 1kls n GLU 29 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28