#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 2.59 0.21 3.15 -4.23 -1.26 -4.96 115.64 111.15 1xrz s THR 2 Ca 0.00 -1.10 0.08 0.00 -1.18 0.00 0.00 61.69 59.49 1xrz s THR 2 Cb 0.00 -2.70 -0.05 0.00 1.34 0.00 0.00 72.50 71.10 1xrz s THR 2 CO 0.00 0.00 -0.14 -0.31 -0.54 0.00 0.00 174.62 173.63 1xrz s TYR 3 N -2.49 1.75 0.05 3.99 1.51 -0.33 -5.01 117.35 116.82 1xrz s TYR 3 Ca 0.54 -0.56 0.00 0.00 -1.01 0.00 0.00 57.07 56.04 1xrz s TYR 3 Cb -0.07 -0.82 -0.00 0.00 -0.11 0.00 0.00 41.96 40.96 1xrz s TYR 3 CO 0.33 0.38 0.00 0.00 -1.11 0.00 0.00 175.55 175.15 1xrz n GLN 4 N -0.40 1.74 -3.10 -0.62 10.64 -1.26 -0.94 117.38 123.43 1xrz n GLN 4 Ca -0.08 -0.36 -0.22 0.00 -1.83 0.00 0.00 57.00 54.52 1xrz n GLN 4 Cb 0.60 0.11 0.01 0.00 -0.86 0.00 0.00 30.24 30.10 1xrz n GLN 4 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1xrz n GLN 6 N -1.97 2.90 0.00 0.00 3.00 -1.26 -4.46 117.38 115.59 1xrz n GLN 6 Ca 0.01 -2.27 0.00 0.00 -0.01 0.00 0.00 57.00 54.73 1xrz n GLN 6 Cb 0.58 -1.40 0.00 0.00 0.00 0.00 0.00 30.24 29.42 1xrz n GLN 6 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1xrz n TYR 7 N 0.69 0.00 -3.37 1.08 4.02 -1.26 -5.09 117.16 113.22 1xrz n TYR 7 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.04 1xrz n TYR 7 Cb 0.52 0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.87 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 -0.12 2.95 -0.29 0.00 2.56 -1.26 -4.05 118.70 118.49 1xrz s GLU 9 Ca 0.00 -0.89 -0.15 0.00 0.00 0.00 0.00 54.97 53.94 1xrz s GLU 9 Cb 0.00 -2.84 0.11 0.00 2.00 0.00 0.00 34.13 33.40 1xrz s GLU 9 CO 0.00 -0.31 0.74 0.50 -0.56 0.00 0.00 175.26 175.64 1xrz s ARG 11 N 1.33 0.61 0.24 4.30 3.52 -1.26 -4.86 118.95 122.82 1xrz s ARG 11 Ca 0.02 1.16 0.01 0.00 -0.13 0.00 0.00 55.73 56.79 1xrz s ARG 11 Cb -0.15 0.31 -0.05 0.00 -1.56 0.00 0.00 34.95 33.50 1xrz s ARG 11 CO -0.07 -0.15 0.11 -1.12 -0.81 0.00 0.00 175.30 173.26 1xrz s SER 12 N 1.91 0.90 -0.03 -2.12 0.01 -0.12 -5.01 113.70 109.25 1xrz s SER 12 Ca -0.09 -1.38 0.19 0.00 1.31 0.00 0.00 55.95 55.98 1xrz s SER 12 Cb -0.06 0.22 -0.29 0.00 0.21 0.00 0.00 66.02 66.10 1xrz s SER 12 CO -0.19 -0.76 0.41 0.00 0.41 0.00 0.00 173.24 173.11 1xrz n ALA 13 N -0.41 2.69 -2.76 1.44 0.00 -1.26 -1.19 120.51 119.01 1xrz n ALA 13 Ca 0.01 -0.46 -0.33 0.00 0.00 0.00 0.00 53.44 52.66 1xrz n ALA 13 Cb 0.66 -0.64 -0.08 0.00 0.00 0.00 0.00 19.45 19.39 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 -4.19 4.12 -0.15 0.00 2.15 -1.26 -4.63 116.67 112.71 1xrz s ASP 14 Ca -0.07 -1.66 -0.07 0.00 0.43 0.00 0.00 52.55 51.19 1xrz s ASP 14 Cb 0.12 0.52 -0.06 0.00 -0.30 0.00 0.00 42.92 43.20 1xrz s ASP 14 CO 0.79 -0.85 -0.18 -0.24 -0.17 0.00 0.00 175.17 174.51 1xrz n SER 15 N -1.26 1.17 -0.30 -0.34 2.88 -1.26 -3.99 113.62 110.51 1xrz n SER 15 Ca -0.19 0.16 0.04 0.00 -1.33 0.00 0.00 58.87 57.54 1xrz n SER 15 Cb 0.67 -0.41 0.12 0.00 -0.75 0.00 0.00 64.21 63.84 1xrz n SER 15 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1xrz h SER 16 N -0.48 -0.76 -0.56 -3.46 0.87 -2.00 0.58 113.55 107.74 1xrz h SER 16 Ca -0.37 0.25 -0.06 0.00 -1.23 0.00 0.00 61.79 60.39 1xrz h SER 16 Cb 1.33 0.52 -0.02 0.00 -0.44 0.00 0.00 62.40 63.79 1xrz h SER 16 CO -0.21 -0.28 0.11 0.78 -0.53 0.00 0.00 176.83 176.70 1xrz h ASN 17 N 0.00 0.87 -0.62 6.23 2.35 -2.00 -2.58 115.58 119.84 1xrz h ASN 17 Ca 0.41 -0.25 0.10 0.00 -0.55 0.00 0.00 56.30 56.02 1xrz h ASN 17 Cb 0.65 -0.23 -0.08 0.00 0.05 0.00 0.00 38.32 38.71 1xrz h ASN 17 CO -0.87 0.90 0.22 0.25 -1.65 0.00 0.00 177.43 176.28 1xrz h LEU 18 N 0.81 0.19 -0.02 1.61 5.85 -0.04 0.13 115.31 123.84 1xrz h LEU 18 Ca 0.17 0.09 0.02 0.00 0.84 0.00 0.00 57.88 59.00 1xrz h LEU 18 Cb 0.39 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1xrz h LEU 18 CO 0.01 0.11 -0.07 0.11 -0.34 0.00 0.00 178.44 178.26 1xrz h LYS 19 N 0.38 -0.11 -0.30 1.25 1.57 -0.93 -1.74 116.57 116.69 1xrz h LYS 19 Ca 0.32 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.17 1xrz h LYS 19 Cb 0.42 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.68 1xrz h LYS 19 CO -0.33 -0.07 -0.19 1.15 -0.57 0.00 0.00 179.45 179.44 1xrz h THR 20 N -0.11 0.46 -0.74 -0.16 2.02 -0.79 -1.23 112.91 112.36 1xrz h THR 20 Ca 0.04 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.33 1xrz h THR 20 Cb 0.16 0.46 -0.13 0.00 -1.74 0.00 0.00 68.15 66.91 1xrz h THR 20 CO -0.09 0.00 -0.41 -0.74 0.37 0.00 0.00 175.52 174.65 1xrz h HIS 21 N -0.16 -1.19 0.11 3.16 -0.00 -0.03 0.28 115.15 117.32 1xrz h HIS 21 Ca 0.16 0.09 0.02 0.00 -0.00 0.00 0.00 60.37 60.64 1xrz h HIS 21 Cb 0.40 0.62 -0.05 0.00 -0.00 0.00 0.00 27.41 28.39 1xrz h HIS 21 CO -0.38 -0.40 -0.47 0.82 -0.00 0.00 0.00 177.93 177.50 1xrz h ILE 22 N -0.13 0.09 -1.00 6.26 2.04 -0.43 0.55 117.51 124.90 1xrz h ILE 22 Ca 0.24 0.00 0.39 0.00 1.00 0.00 0.00 64.86 66.49 1xrz h ILE 22 Cb 0.56 0.09 -0.17 0.00 -0.74 0.00 0.00 36.82 36.55 1xrz h ILE 22 CO -0.79 0.00 0.50 0.50 0.00 0.00 0.00 178.15 178.35 1xrz h LYS 23 N -0.69 0.05 -0.00 2.37 3.64 -0.08 -0.50 116.57 121.35 1xrz h LYS 23 Ca 0.01 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1xrz h LYS 23 Cb 0.72 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1xrz h LYS 23 CO -0.27 0.04 -0.52 2.41 -2.27 0.00 0.00 179.45 178.83 1xrz n THR 24 N -5.25 0.00 -0.03 1.00 -1.04 -0.62 -0.64 114.28 107.71 1xrz n THR 24 Ca 0.35 -0.24 -0.02 0.00 -2.04 0.00 0.00 64.05 62.11 1xrz n THR 24 Cb 1.19 1.06 -0.06 0.00 -1.82 0.00 0.00 70.33 70.69 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 -0.92 2.06 -0.12 -2.82 4.76 0.19 -4.59 118.16 116.71 1xrz n LYS 25 Ca 0.04 -0.02 -0.18 0.00 -2.87 0.00 0.00 58.31 55.28 1xrz n LYS 25 Cb 0.24 -1.20 -0.11 0.00 -1.84 0.00 0.00 35.03 32.12 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 -2.16 0.00 -4.00 2.13 8.25 -0.28 -4.99 115.22 114.17 1xrz n HIS 26 Ca -0.10 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.36 1xrz n HIS 26 Cb 0.62 -0.91 -0.00 0.00 1.12 0.00 0.00 29.99 30.82 1xrz n HIS 26 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1xrz n SER 27 N -3.32 1.92 0.05 0.41 2.88 -0.72 -5.05 113.62 109.81 1xrz n SER 27 Ca -0.43 -1.01 0.00 0.00 -1.33 0.00 0.00 58.87 56.10 1xrz n SER 27 Cb 0.93 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.40 1xrz n SER 27 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1xrz n LYS 28 N -0.00 0.00 -3.63 -1.46 4.81 0.19 -3.36 118.16 114.71 1xrz n LYS 28 Ca -0.00 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.16 1xrz n LYS 28 Cb 0.00 -0.46 -0.11 0.00 0.02 0.00 0.00 35.03 34.48 1xrz n LYS 28 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1xrz s GLU 29 N -2.00 1.51 0.00 1.64 2.02 -1.19 -3.84 118.70 116.84 1xrz s GLU 29 Ca 0.00 -2.51 0.14 0.00 0.02 0.00 0.00 54.97 52.62 1xrz s GLU 29 Cb 0.00 -2.28 0.11 0.00 0.10 0.00 0.00 34.13 32.06 1xrz s GLU 29 CO 0.00 -1.31 0.94 1.17 0.02 0.00 0.00 175.26 176.08