#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 2.52 -0.18 0.58 2.01 -1.26 -4.98 115.64 114.33 1xrz s THR 2 Ca 0.00 -1.71 0.01 0.00 0.31 0.00 0.00 61.69 60.30 1xrz s THR 2 Cb 0.00 -2.97 0.03 0.00 0.01 0.00 0.00 72.50 69.57 1xrz s THR 2 CO 0.00 -0.06 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.43 1xrz s TYR 3 N -2.55 2.37 0.16 4.92 1.51 -1.25 -4.91 117.35 117.60 1xrz s TYR 3 Ca 0.40 -1.47 0.10 0.00 -1.01 0.00 0.00 57.07 55.09 1xrz s TYR 3 Cb 0.02 -1.66 -0.04 0.00 -0.11 0.00 0.00 41.96 40.17 1xrz s TYR 3 CO 0.23 -0.72 -0.22 1.14 -1.11 0.00 0.00 175.55 174.87 1xrz s GLN 4 N 1.41 1.34 0.79 -0.62 1.03 -1.26 -0.77 119.66 121.59 1xrz s GLN 4 Ca 0.02 -1.39 -0.13 0.00 0.04 0.00 0.00 55.36 53.90 1xrz s GLN 4 Cb -0.15 -1.57 0.07 0.00 0.03 0.00 0.00 33.01 31.40 1xrz s GLN 4 CO -0.10 0.34 1.18 0.00 -2.54 0.00 0.00 175.29 174.18 1xrz n GLN 6 N -3.26 2.31 0.00 0.00 1.13 -1.26 -4.47 117.38 111.83 1xrz n GLN 6 Ca 0.13 -3.02 0.00 0.00 -1.94 0.00 0.00 57.00 52.16 1xrz n GLN 6 Cb 0.51 -1.84 0.00 0.00 0.11 0.00 0.00 30.24 29.02 1xrz n GLN 6 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1xrz n TYR 7 N -0.87 -0.03 -3.18 1.08 4.02 -1.26 -5.12 117.16 111.79 1xrz n TYR 7 Ca 0.29 0.01 0.00 0.00 -0.01 0.00 0.00 57.90 58.19 1xrz n TYR 7 Cb 1.00 0.33 0.00 0.00 -0.02 0.00 0.00 39.34 40.66 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 0.47 2.15 -0.28 0.00 2.12 -1.26 -4.42 118.70 117.48 1xrz s GLU 9 Ca 0.00 -1.51 -0.19 0.00 0.36 0.00 0.00 54.97 53.63 1xrz s GLU 9 Cb 0.00 -3.25 0.09 0.00 0.26 0.00 0.00 34.13 31.23 1xrz s GLU 9 CO 0.00 -0.78 0.77 1.03 -0.54 0.00 0.00 175.26 175.75 1xrz s ARG 11 N 1.15 0.67 0.03 4.30 1.81 -1.26 -4.93 118.95 120.72 1xrz s ARG 11 Ca 0.00 1.02 -0.01 0.00 -1.72 0.00 0.00 55.73 55.03 1xrz s ARG 11 Cb -0.20 0.21 -0.00 0.00 -0.45 0.00 0.00 34.95 34.50 1xrz s ARG 11 CO -0.03 -0.12 -0.01 0.43 -0.68 0.00 0.00 175.30 174.88 1xrz n SER 12 N 3.62 0.51 0.00 0.23 7.64 0.06 -5.00 113.62 120.67 1xrz n SER 12 Ca -0.18 0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.77 1xrz n SER 12 Cb 0.57 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 1xrz n SER 12 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xrz n ALA 13 N -3.25 0.00 -2.20 -0.43 0.00 -0.94 -4.92 120.51 108.79 1xrz n ALA 13 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.20 1xrz n ALA 13 Cb 0.32 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.79 1xrz n ALA 13 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xrz s ASP 14 N 0.62 4.92 -0.20 0.00 2.15 -1.26 -3.97 116.67 118.92 1xrz s ASP 14 Ca 0.00 -1.00 -0.16 0.00 0.43 0.00 0.00 52.55 51.83 1xrz s ASP 14 Cb 0.00 0.27 -0.09 0.00 -0.30 0.00 0.00 42.92 42.80 1xrz s ASP 14 CO 0.00 -1.18 -0.23 -1.54 -0.17 0.00 0.00 175.17 172.05 1xrz n SER 15 N -1.99 1.90 -0.11 -0.34 3.41 -1.26 -3.89 113.62 111.35 1xrz n SER 15 Ca 0.07 0.41 -0.09 0.00 -0.26 0.00 0.00 58.87 59.00 1xrz n SER 15 Cb 0.63 -0.83 -0.04 0.00 -0.26 0.00 0.00 64.21 63.71 1xrz n SER 15 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1xrz h SER 16 N -1.00 -1.31 -0.94 4.04 0.02 -1.99 -0.47 113.55 111.90 1xrz h SER 16 Ca -0.25 0.20 0.26 0.00 -0.84 0.00 0.00 61.79 61.16 1xrz h SER 16 Cb 1.12 0.58 -0.13 0.00 0.14 0.00 0.00 62.40 64.10 1xrz h SER 16 CO -0.15 -0.36 0.45 -1.13 -1.14 0.00 0.00 176.83 174.49 1xrz h ASN 17 N -0.33 0.38 0.05 3.07 -0.00 -1.97 -0.00 115.58 116.79 1xrz h ASN 17 Ca 0.14 0.17 -0.11 0.00 -0.00 0.00 0.00 56.30 56.50 1xrz h ASN 17 Cb 0.58 0.14 0.01 0.00 -0.00 0.00 0.00 38.32 39.05 1xrz h ASN 17 CO -0.54 -0.05 -0.45 0.25 -0.00 0.00 0.00 177.43 176.64 1xrz h LEU 18 N 0.38 0.31 -0.28 0.34 5.85 -1.26 -2.35 115.31 118.29 1xrz h LEU 18 Ca 0.62 -0.89 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1xrz h LEU 18 Cb 1.27 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 1xrz h LEU 18 CO -0.57 1.17 0.18 0.11 -0.34 0.00 0.00 178.44 179.00 1xrz h LYS 19 N -0.51 0.36 -0.33 1.25 1.79 -0.65 -0.97 116.57 117.52 1xrz h LYS 19 Ca -0.07 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1xrz h LYS 19 Cb 1.28 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.84 1xrz h LYS 19 CO 0.09 0.24 0.19 0.00 -1.08 0.00 0.00 179.45 178.89 1xrz h THR 20 N 0.37 1.12 -0.41 -0.16 1.03 -1.13 -0.71 112.91 113.02 1xrz h THR 20 Ca 0.11 -0.30 0.07 0.00 -0.01 0.00 0.00 66.41 66.27 1xrz h THR 20 Cb -0.03 0.72 -0.09 0.00 -1.07 0.00 0.00 68.15 67.68 1xrz h THR 20 CO -0.03 0.12 -0.44 -0.74 -0.01 0.00 0.00 175.52 174.42 1xrz h HIS 21 N 0.42 -1.29 0.55 0.00 -0.00 -0.83 -1.36 115.15 112.64 1xrz h HIS 21 Ca 0.12 0.07 -0.02 0.00 -0.00 0.00 0.00 60.37 60.54 1xrz h HIS 21 Cb 0.03 0.62 -0.01 0.00 -0.00 0.00 0.00 27.41 28.06 1xrz h HIS 21 CO -0.04 -0.45 -0.38 0.82 -0.00 0.00 0.00 177.93 177.89 1xrz h ILE 22 N -0.33 0.00 -1.91 6.26 2.04 -0.83 -0.51 117.51 122.23 1xrz h ILE 22 Ca 0.13 0.00 0.56 0.00 1.00 0.00 0.00 64.86 66.56 1xrz h ILE 22 Cb 0.59 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.58 1xrz h ILE 22 CO -0.58 0.00 1.37 1.17 0.00 0.00 0.00 178.15 180.10 1xrz n LYS 23 N -4.75 -0.00 -0.10 2.37 4.81 -0.31 -0.67 118.16 119.51 1xrz n LYS 23 Ca -0.11 1.09 -0.13 0.00 -0.87 0.00 0.00 58.31 58.29 1xrz n LYS 23 Cb 0.37 -2.48 -0.10 0.00 0.02 0.00 0.00 35.03 32.85 1xrz n LYS 23 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1xrz n THR 24 N -3.98 1.14 0.06 3.15 -2.24 -0.55 -3.94 114.28 107.93 1xrz n THR 24 Ca 0.44 -0.46 0.08 0.00 -2.27 0.00 0.00 64.05 61.83 1xrz n THR 24 Cb 1.96 -1.14 -0.05 0.00 -2.10 0.00 0.00 70.33 69.00 1xrz n THR 24 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1xrz n LYS 25 N -3.03 0.62 -0.04 -0.78 4.76 -0.22 -4.50 118.16 114.96 1xrz n LYS 25 Ca -0.34 0.10 -0.06 0.00 -2.87 0.00 0.00 58.31 55.13 1xrz n LYS 25 Cb 0.89 -1.77 -0.03 0.00 -1.84 0.00 0.00 35.03 32.28 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 -2.67 0.00 0.00 2.13 8.25 -0.11 -4.99 115.22 117.83 1xrz n HIS 26 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1xrz n HIS 26 Cb 0.64 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.46 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 -2.88 0.00 -3.95 0.41 3.41 0.15 -3.69 113.62 107.08 1xrz n SER 27 Ca -0.14 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.17 1xrz n SER 27 Cb 0.64 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.44 1xrz n SER 27 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1xrz s LYS 28 N 0.00 1.75 -0.67 4.33 1.02 -1.26 -4.92 119.74 119.99 1xrz s LYS 28 Ca 0.00 -2.32 0.06 0.00 0.02 0.00 0.00 55.97 53.72 1xrz s LYS 28 Cb 0.00 -3.19 0.21 0.00 -0.52 0.00 0.00 37.83 34.33 1xrz s LYS 28 CO 0.00 -1.06 0.63 0.39 -0.92 0.00 0.00 175.35 174.39 1xrz n GLU 29 N 3.52 2.20 0.00 1.68 -0.58 -1.24 -5.23 120.64 120.99 1xrz n GLU 29 Ca 0.05 -4.59 0.12 0.00 -0.42 0.00 0.00 57.16 52.32 1xrz n GLU 29 Cb 0.35 -2.27 0.15 0.00 -0.57 0.00 0.00 31.44 29.11 1xrz n GLU 29 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01