#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xrz s THR 2 N 0.00 0.33 0.30 -0.18 -4.23 -1.26 -4.92 115.64 105.67 1xrz s THR 2 Ca 0.00 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.61 1xrz s THR 2 Cb 0.00 -2.42 -0.06 0.00 1.34 0.00 0.00 72.50 71.37 1xrz s THR 2 CO 0.00 0.00 -0.15 -0.31 -0.54 0.00 0.00 174.62 173.62 1xrz s TYR 3 N -3.36 2.26 0.28 3.99 1.51 -0.08 -4.98 117.35 116.98 1xrz s TYR 3 Ca 0.31 -0.43 0.06 0.00 -1.01 0.00 0.00 57.07 56.00 1xrz s TYR 3 Cb 0.03 -1.12 -0.06 0.00 -0.11 0.00 0.00 41.96 40.70 1xrz s TYR 3 CO 0.20 0.62 -0.03 -1.14 -1.11 0.00 0.00 175.55 174.08 1xrz s GLN 4 N -3.57 1.53 0.49 -0.62 2.00 -1.26 -1.28 119.66 116.94 1xrz s GLN 4 Ca 0.30 -1.79 -0.04 0.00 -2.00 0.00 0.00 55.36 51.83 1xrz s GLN 4 Cb -0.02 -1.01 -0.02 0.00 0.80 0.00 0.00 33.01 32.76 1xrz s GLN 4 CO 0.15 -0.03 0.77 0.00 -0.50 0.00 0.00 175.29 175.68 1xrz n GLN 6 N -2.26 2.28 0.00 0.00 7.27 -1.26 -4.46 117.38 118.95 1xrz n GLN 6 Ca 0.01 -3.03 0.00 0.00 0.07 0.00 0.00 57.00 54.05 1xrz n GLN 6 Cb 0.56 -1.84 0.00 0.00 2.41 0.00 0.00 30.24 31.37 1xrz n GLN 6 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1xrz n TYR 7 N -0.89 0.00 -3.00 3.69 4.02 -1.26 -5.12 117.16 114.60 1xrz n TYR 7 Ca 0.30 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.19 1xrz n TYR 7 Cb 1.01 0.30 0.00 0.00 -0.02 0.00 0.00 39.34 40.63 1xrz n TYR 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xrz s GLU 9 N 0.99 2.42 -0.20 0.00 2.56 -1.26 -4.26 118.70 118.94 1xrz s GLU 9 Ca 0.00 -1.27 -0.27 0.00 0.00 0.00 0.00 54.97 53.43 1xrz s GLU 9 Cb 0.00 -3.15 0.07 0.00 2.00 0.00 0.00 34.13 33.05 1xrz s GLU 9 CO 0.00 -0.61 0.71 0.50 -0.56 0.00 0.00 175.26 175.30 1xrz s ARG 11 N 1.24 0.90 0.22 4.30 3.52 -1.26 -4.89 118.95 122.98 1xrz s ARG 11 Ca -0.06 0.77 0.01 0.00 -0.13 0.00 0.00 55.73 56.32 1xrz s ARG 11 Cb -0.20 0.44 -0.05 0.00 -1.56 0.00 0.00 34.95 33.58 1xrz s ARG 11 CO -0.01 -0.17 0.08 -1.12 -0.81 0.00 0.00 175.30 173.27 1xrz s SER 12 N -0.11 0.92 0.00 -2.12 0.01 -0.41 -4.98 113.70 107.01 1xrz s SER 12 Ca -0.03 -1.33 0.00 0.00 1.31 0.00 0.00 55.95 55.89 1xrz s SER 12 Cb -0.03 0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.41 1xrz s SER 12 CO 0.04 -0.72 0.88 0.00 0.41 0.00 0.00 173.24 173.85 1xrz n ALA 13 N -0.36 2.12 0.08 1.44 0.00 -1.26 -0.90 120.51 121.63 1xrz n ALA 13 Ca -0.01 -0.88 0.00 0.00 0.00 0.00 0.00 53.44 52.55 1xrz n ALA 13 Cb 0.65 -0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1xrz n ALA 13 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xrz n ASP 14 N -0.37 0.10 0.00 0.00 2.03 -1.26 -4.90 116.55 112.15 1xrz n ASP 14 Ca 0.00 0.25 0.00 0.00 0.52 0.00 0.00 54.79 55.56 1xrz n ASP 14 Cb 0.19 0.14 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 1xrz n ASP 14 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1xrz n SER 15 N -3.11 0.00 -0.24 1.67 2.88 -1.26 -4.92 113.62 108.64 1xrz n SER 15 Ca 0.00 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.58 1xrz n SER 15 Cb 0.00 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 63.63 1xrz n SER 15 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1xrz h SER 16 N 0.04 0.19 -0.89 -3.46 0.02 -2.00 0.20 113.55 107.65 1xrz h SER 16 Ca 0.00 0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 1xrz h SER 16 Cb 0.00 0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 1xrz h SER 16 CO 0.00 0.07 0.47 0.78 -1.14 0.00 0.00 176.83 177.01 1xrz h ASN 17 N 0.38 1.12 -0.62 3.07 2.35 -1.99 -2.25 115.58 117.65 1xrz h ASN 17 Ca 0.39 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1xrz h ASN 17 Cb 0.59 -0.29 -0.03 0.00 0.05 0.00 0.00 38.32 38.65 1xrz h ASN 17 CO -0.41 0.91 0.39 0.25 -1.65 0.00 0.00 177.43 176.92 1xrz h LEU 18 N 1.25 0.74 0.07 1.61 5.85 -1.02 0.62 115.31 124.42 1xrz h LEU 18 Ca 0.31 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.98 1xrz h LEU 18 Cb 0.05 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.90 1xrz h LEU 18 CO -0.05 0.56 -0.04 0.11 -0.34 0.00 0.00 178.44 178.69 1xrz h LYS 19 N 0.84 -0.10 -0.41 1.25 1.57 -1.07 -1.32 116.57 117.34 1xrz h LYS 19 Ca 0.22 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 59.10 1xrz h LYS 19 Cb -0.05 0.02 -0.09 0.00 0.08 0.00 0.00 32.23 32.20 1xrz h LYS 19 CO -0.04 0.05 -0.18 1.15 -0.57 0.00 0.00 179.45 179.85 1xrz h THR 20 N -0.22 0.44 -0.19 -0.16 2.02 -1.09 -1.47 112.91 112.24 1xrz h THR 20 Ca -0.01 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.19 1xrz h THR 20 Cb 0.19 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 66.99 1xrz h THR 20 CO 0.02 0.00 -0.31 -0.74 0.37 0.00 0.00 175.52 174.86 1xrz h HIS 21 N -0.11 -0.94 -0.80 3.16 -0.00 -0.51 -1.81 115.15 114.14 1xrz h HIS 21 Ca 0.20 0.04 0.08 0.00 -0.00 0.00 0.00 60.37 60.69 1xrz h HIS 21 Cb 0.41 0.43 -0.11 0.00 -0.00 0.00 0.00 27.41 28.15 1xrz h HIS 21 CO -0.43 -0.28 -0.57 0.82 -0.00 0.00 0.00 177.93 177.47 1xrz h ILE 22 N -0.25 0.00 -0.84 6.26 2.04 -0.32 0.25 117.51 124.66 1xrz h ILE 22 Ca 0.03 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.06 1xrz h ILE 22 Cb 0.34 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.27 1xrz h ILE 22 CO -0.31 0.00 -0.24 0.50 0.00 0.00 0.00 178.15 178.10 1xrz h LYS 23 N -0.13 -0.02 -0.66 2.37 3.64 -0.58 -0.45 116.57 120.74 1xrz h LYS 23 Ca 0.14 0.00 -0.44 0.00 -1.27 0.00 0.00 60.65 59.08 1xrz h LYS 23 Cb 0.48 0.00 -0.27 0.00 -0.41 0.00 0.00 32.23 32.03 1xrz h LYS 23 CO -0.82 -0.01 -0.10 2.41 -2.27 0.00 0.00 179.45 178.65 1xrz n THR 24 N -5.53 2.82 0.00 1.00 -1.04 -0.50 -3.85 114.28 107.18 1xrz n THR 24 Ca 0.11 -3.29 0.00 0.00 -2.04 0.00 0.00 64.05 58.83 1xrz n THR 24 Cb 0.42 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 68.12 1xrz n THR 24 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1xrz n LYS 25 N -0.94 0.00 -0.05 -2.82 4.76 0.78 -4.29 118.16 115.60 1xrz n LYS 25 Ca 0.45 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.82 1xrz n LYS 25 Cb 0.95 -0.37 -0.05 0.00 -1.84 0.00 0.00 35.03 33.71 1xrz n LYS 25 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1xrz n HIS 26 N -0.70 0.00 -2.63 2.13 8.25 -0.24 -4.74 115.22 117.29 1xrz n HIS 26 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.15 1xrz n HIS 26 Cb 0.00 -0.41 -0.01 0.00 1.12 0.00 0.00 29.99 30.70 1xrz n HIS 26 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1xrz n SER 27 N -2.73 5.46 0.00 0.41 3.41 -0.87 -4.99 113.62 114.31 1xrz n SER 27 Ca -0.18 -3.72 0.00 0.00 -0.26 0.00 0.00 58.87 54.71 1xrz n SER 27 Cb 0.71 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1xrz n SER 27 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1xrz n LYS 28 N -0.31 0.00 0.04 4.33 4.81 -1.25 -4.60 118.16 121.17 1xrz n LYS 28 Ca 0.39 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.83 1xrz n LYS 28 Cb 0.42 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.47 1xrz n LYS 28 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1xrz n GLU 29 N 0.18 0.00 0.00 1.64 4.07 -1.26 -0.94 120.64 124.33 1xrz n GLU 29 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1xrz n GLU 29 Cb 0.00 -0.11 0.00 0.00 -0.06 0.00 0.00 31.44 31.27 1xrz n GLU 29 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70