#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 -2.74 0.58 5.66 -1.26 -5.11 114.28 111.41 1kls n THR 2 Ca 0.00 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.57 1kls n THR 2 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 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 -0.57 3.10 0.45 1.09 1.51 -1.23 -4.99 117.35 116.69 1kls s TYR 3 Ca 0.00 0.93 0.07 0.00 -1.01 0.00 0.00 57.07 57.07 1kls s TYR 3 Cb 0.00 -3.68 -0.00 0.00 -0.11 0.00 0.00 41.96 38.16 1kls s TYR 3 CO 0.00 -0.81 0.41 -1.14 -1.11 0.00 0.00 175.55 172.90 1kls s GLN 4 N 3.57 2.48 0.38 -0.62 0.74 -1.26 -0.91 119.66 124.03 1kls s GLN 4 Ca 0.41 -1.61 0.06 0.00 0.05 0.00 0.00 55.36 54.26 1kls s GLN 4 Cb -0.12 -2.36 -0.00 0.00 1.10 0.00 0.00 33.01 31.63 1kls s GLN 4 CO 0.18 -0.30 0.53 0.00 -0.55 0.00 0.00 175.29 175.15 1kls n GLN 6 N -1.78 1.42 0.02 0.00 6.02 -1.26 -4.43 117.38 117.38 1kls n GLN 6 Ca 0.02 -3.06 0.00 0.00 -0.01 0.00 0.00 57.00 53.95 1kls n GLN 6 Cb 0.58 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.35 1kls n GLN 6 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1kls n TYR 7 N -1.09 -0.37 -0.07 1.08 4.02 -1.26 -4.97 117.16 114.50 1kls n TYR 7 Ca 0.17 0.07 -0.14 0.00 -0.01 0.00 0.00 57.90 57.99 1kls n TYR 7 Cb 0.70 0.38 -0.06 0.00 -0.02 0.00 0.00 39.34 40.35 1kls n TYR 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1kls n GLU 9 N -3.38 0.00 -0.15 0.00 2.13 -1.26 -5.07 120.64 112.90 1kls n GLU 9 Ca -0.27 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 57.49 1kls n GLU 9 Cb 0.73 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.43 1kls n GLU 9 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1kls n LEU 10 N 0.00 -0.01 -4.76 4.31 0.00 -1.26 -2.07 117.00 113.21 1kls n LEU 10 Ca 0.00 0.12 -0.23 0.00 0.00 0.00 0.00 56.01 55.90 1kls n LEU 10 Cb 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 43.42 43.26 1kls n LEU 10 CO 0.00 -0.20 -0.14 0.00 0.00 0.00 0.00 177.39 177.04 1kls s ARG 11 N -0.01 2.33 0.46 1.96 1.70 -1.26 -2.33 118.95 121.81 1kls s ARG 11 Ca 0.09 -1.68 0.03 0.00 -0.47 0.00 0.00 55.73 53.70 1kls s ARG 11 Cb -0.13 -2.12 -0.02 0.00 -0.57 0.00 0.00 34.95 32.11 1kls s ARG 11 CO 0.06 -0.05 0.07 -1.12 -1.08 0.00 0.00 175.30 173.18 1kls s SER 12 N -3.92 3.45 -0.19 -2.89 0.01 -0.09 -5.00 113.70 105.06 1kls s SER 12 Ca 0.41 -1.68 0.15 0.00 1.31 0.00 0.00 55.95 56.14 1kls s SER 12 Cb 0.00 0.55 -0.22 0.00 0.21 0.00 0.00 66.02 66.56 1kls s SER 12 CO 0.24 -0.91 0.03 0.00 0.41 0.00 0.00 173.24 173.00 1kls n ALA 13 N -1.09 1.53 -2.90 1.44 0.00 -1.26 -3.57 120.51 114.66 1kls n ALA 13 Ca -0.12 -1.21 0.00 0.00 0.00 0.00 0.00 53.44 52.10 1kls n ALA 13 Cb 0.66 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1kls n ALA 13 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1kls n ASP 14 N -2.77 1.74 -0.11 0.00 8.00 -1.26 -4.75 116.55 117.40 1kls n ASP 14 Ca -0.32 -0.03 -0.18 0.00 0.71 0.00 0.00 54.79 54.97 1kls n ASP 14 Cb 1.09 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 42.13 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 -0.04 1.95 -0.28 -2.24 3.41 -1.26 -4.25 113.62 110.90 1kls n SER 15 Ca 0.00 0.34 0.03 0.00 -0.26 0.00 0.00 58.87 58.97 1kls n SER 15 Cb 0.00 -0.77 0.10 0.00 -0.26 0.00 0.00 64.21 63.28 1kls n SER 15 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1kls h SER 16 N -1.00 -0.76 -0.04 4.04 0.87 -1.99 -0.56 113.55 114.11 1kls h SER 16 Ca -0.29 0.24 0.02 0.00 -1.23 0.00 0.00 61.79 60.53 1kls h SER 16 Cb 1.25 0.50 -0.05 0.00 -0.44 0.00 0.00 62.40 63.66 1kls h SER 16 CO -0.18 -0.27 -0.48 0.78 -0.53 0.00 0.00 176.83 176.16 1kls h ASN 17 N -0.00 -1.49 0.05 6.23 4.21 -2.00 -1.92 115.58 120.66 1kls h ASN 17 Ca 0.39 0.17 0.02 0.00 1.21 0.00 0.00 56.30 58.09 1kls h ASN 17 Cb 0.59 0.57 -0.03 0.00 -1.12 0.00 0.00 38.32 38.33 1kls h ASN 17 CO -0.84 -0.45 -0.18 0.25 -1.29 0.00 0.00 177.43 174.92 1kls h LEU 18 N -0.57 -0.53 -0.95 1.61 5.85 -1.49 -1.63 115.31 117.60 1kls h LEU 18 Ca 0.02 0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.93 1kls h LEU 18 Cb 0.63 0.21 -0.14 0.00 0.37 0.00 0.00 40.66 41.73 1kls h LEU 18 CO -0.34 -0.25 -0.46 0.50 -0.34 0.00 0.00 178.44 177.54 1kls h LYS 19 N -0.32 -0.03 0.46 1.25 3.64 -0.87 -0.06 116.57 120.64 1kls h LYS 19 Ca 0.04 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1kls h LYS 19 Cb 0.37 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1kls h LYS 19 CO -0.14 -0.02 -0.44 1.15 -2.27 0.00 0.00 179.45 177.73 1kls h THR 20 N -0.03 0.12 -0.89 1.00 2.02 -1.06 -2.30 112.91 111.77 1kls h THR 20 Ca 0.26 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.52 1kls h THR 20 Cb 0.53 0.12 -0.11 0.00 -1.74 0.00 0.00 68.15 66.95 1kls h THR 20 CO -0.94 0.00 -0.53 1.57 0.37 0.00 0.00 175.52 176.00 1kls n HIS 21 N -5.53 -0.39 -0.01 3.16 -0.00 -0.15 -1.94 115.22 110.36 1kls n HIS 21 Ca -0.11 1.12 -0.05 0.00 -0.00 0.00 0.00 57.72 58.67 1kls n HIS 21 Cb 0.43 -0.57 -0.03 0.00 -0.00 0.00 0.00 29.99 29.81 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 -0.93 3.57 1.08 -1.10 -1.07 117.51 119.06 1kls h ILE 22 Ca 0.14 0.00 0.26 0.00 -0.39 0.00 0.00 64.86 64.88 1kls h ILE 22 Cb 0.37 0.00 -0.17 0.00 -3.07 0.00 0.00 36.82 33.94 1kls h ILE 22 CO -0.84 0.00 0.05 1.17 -0.69 0.00 0.00 178.15 177.84 1kls n LYS 23 N -3.58 -0.07 -0.04 2.37 3.00 -0.82 -1.07 118.16 117.95 1kls n LYS 23 Ca -0.02 1.39 -0.11 0.00 -0.00 0.00 0.00 58.31 59.57 1kls n LYS 23 Cb 0.13 -2.23 -0.14 0.00 0.00 0.00 0.00 35.03 32.79 1kls n LYS 23 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1kls n THR 24 N -5.37 1.57 0.33 3.15 5.66 -0.98 -3.22 114.28 115.42 1kls n THR 24 Ca 0.23 -0.78 0.11 0.00 -3.05 0.00 0.00 64.05 60.56 1kls n THR 24 Cb 0.75 -1.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.51 1kls n THR 24 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1kls n LYS 25 N -3.04 0.44 0.00 1.09 5.02 -0.42 -4.64 118.16 116.61 1kls n LYS 25 Ca -0.25 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.04 1kls n LYS 25 Cb 1.08 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 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 -2.22 0.00 -0.80 2.13 8.25 -0.23 -5.02 115.22 117.33 1kls n HIS 26 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.43 1kls n HIS 26 Cb 0.49 0.04 -0.01 0.00 1.12 0.00 0.00 29.99 31.62 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 -2.69 -1.45 -4.55 0.41 3.41 -0.47 -4.88 113.62 103.39 1kls n SER 27 Ca 0.00 0.08 -0.30 0.00 -0.26 0.00 0.00 58.87 58.39 1kls n SER 27 Cb 0.44 -1.47 -0.05 0.00 -0.26 0.00 0.00 64.21 62.86 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 -0.72 0.82 -0.11 4.33 4.01 -1.26 -5.04 118.16 120.20 1kls n LYS 28 Ca -0.03 -3.47 -0.23 0.00 -0.51 0.00 0.00 58.31 54.07 1kls n LYS 28 Cb 0.16 0.85 -0.11 0.00 -0.51 0.00 0.00 35.03 35.41 1kls n LYS 28 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 1kls n GLU 29 N -1.27 0.58 0.00 1.97 4.07 -1.26 -5.02 120.64 119.70 1kls n GLU 29 Ca -0.17 0.50 0.00 0.00 -0.06 0.00 0.00 57.16 57.43 1kls n GLU 29 Cb 0.61 -1.70 0.00 0.00 -0.06 0.00 0.00 31.44 30.29 1kls n GLU 29 CO 0.00 0.00 0.00 0.36 -0.06 0.00 0.00 177.13 177.43