#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 1.53 -0.09 -0.18 -4.23 -1.26 -5.01 115.64 106.40 1xrz s THR 2 Ca 0.00 -1.68 0.02 0.00 -1.18 0.00 0.00 61.69 58.85 1xrz s THR 2 Cb 0.00 -2.21 -0.02 0.00 1.34 0.00 0.00 72.50 71.62 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 -2.80 2.72 -0.05 3.99 2.02 -0.48 -4.99 117.35 117.77 1xrz s TYR 3 Ca 0.25 -0.47 0.06 0.00 -0.37 0.00 0.00 57.07 56.53 1xrz s TYR 3 Cb -0.01 -1.73 -0.02 0.00 -0.40 0.00 0.00 41.96 39.81 1xrz s TYR 3 CO 0.15 -0.06 -0.21 1.14 -1.57 0.00 0.00 175.55 175.00 1xrz s GLN 4 N -0.14 2.44 0.26 -0.62 1.03 -1.26 -0.88 119.66 120.49 1xrz s GLN 4 Ca -0.01 -0.84 -0.18 0.00 0.04 0.00 0.00 55.36 54.37 1xrz s GLN 4 Cb -0.14 -2.22 -0.12 0.00 0.03 0.00 0.00 33.01 30.56 1xrz s GLN 4 CO 0.04 0.50 0.16 0.00 -2.54 0.00 0.00 175.29 173.45 1xrz n GLN 6 N 0.94 2.24 0.01 0.00 10.64 -1.26 -4.24 117.38 125.71 1xrz n GLN 6 Ca 0.10 -2.96 0.00 0.00 -1.83 0.00 0.00 57.00 52.31 1xrz n GLN 6 Cb 0.27 -2.16 0.00 0.00 -0.86 0.00 0.00 30.24 27.49 1xrz n GLN 6 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1xrz n TYR 7 N -1.10 -0.16 -2.87 2.61 4.01 -1.26 -5.13 117.16 113.25 1xrz n TYR 7 Ca 0.59 0.02 0.00 0.00 -0.16 0.00 0.00 57.90 58.35 1xrz n TYR 7 Cb 1.61 0.51 0.00 0.00 -0.31 0.00 0.00 39.34 41.15 1xrz n TYR 7 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xrz s GLU 9 N 1.25 2.37 -0.29 0.00 2.56 -1.26 -4.44 118.70 118.89 1xrz s GLU 9 Ca 0.00 -1.29 -0.16 0.00 0.00 0.00 0.00 54.97 53.52 1xrz s GLU 9 Cb 0.00 -3.07 0.14 0.00 2.00 0.00 0.00 34.13 33.20 1xrz s GLU 9 CO 0.00 -0.59 0.94 1.03 -0.56 0.00 0.00 175.26 176.08 1xrz s ARG 11 N 1.20 0.41 0.25 4.30 0.52 -1.26 -4.92 118.95 119.44 1xrz s ARG 11 Ca -0.06 0.73 0.03 0.00 -0.52 0.00 0.00 55.73 55.90 1xrz s ARG 11 Cb -0.20 0.12 -0.05 0.00 0.52 0.00 0.00 34.95 35.34 1xrz s ARG 11 CO -0.03 -0.09 0.03 -1.12 0.02 0.00 0.00 175.30 174.11 1xrz s SER 12 N 1.47 1.75 0.00 0.23 0.01 -0.06 -4.99 113.70 112.10 1xrz s SER 12 Ca -0.09 -1.28 0.08 0.00 1.31 0.00 0.00 55.95 55.98 1xrz s SER 12 Cb -0.04 0.03 -0.07 0.00 0.21 0.00 0.00 66.02 66.15 1xrz s SER 12 CO -0.16 -0.58 0.40 0.00 0.41 0.00 0.00 173.24 173.32 1xrz n ALA 13 N -0.46 3.03 -2.57 1.44 0.00 -1.26 -1.38 120.51 119.31 1xrz n ALA 13 Ca -0.04 -0.27 -0.26 0.00 0.00 0.00 0.00 53.44 52.87 1xrz n ALA 13 Cb 0.65 -0.31 -0.10 0.00 0.00 0.00 0.00 19.45 19.70 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 -1.69 3.16 -0.16 0.00 -1.08 -1.26 -4.90 116.67 110.74 1xrz s ASP 14 Ca 0.04 -1.50 -0.14 0.00 -0.52 0.00 0.00 52.55 50.43 1xrz s ASP 14 Cb 0.06 0.10 -0.05 0.00 -1.46 0.00 0.00 42.92 41.58 1xrz s ASP 14 CO 0.32 -0.70 -0.27 -0.24 0.52 0.00 0.00 175.17 174.81 1xrz n SER 15 N -1.01 1.81 -0.36 -0.34 2.88 -1.26 -3.87 113.62 111.48 1xrz n SER 15 Ca -0.07 0.45 0.05 0.00 -1.33 0.00 0.00 58.87 57.96 1xrz n SER 15 Cb 0.66 -0.78 0.12 0.00 -0.75 0.00 0.00 64.21 63.46 1xrz n SER 15 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1xrz n SER 16 N -4.44 -0.40 0.01 -3.46 2.88 -1.26 -0.69 113.62 106.25 1xrz n SER 16 Ca -0.11 1.69 -0.12 0.00 -1.33 0.00 0.00 58.87 59.01 1xrz n SER 16 Cb 0.40 -0.49 -0.06 0.00 -0.75 0.00 0.00 64.21 63.31 1xrz n SER 16 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1xrz h ASN 17 N 0.00 -1.25 -0.87 -3.46 4.21 -2.00 -0.35 115.58 111.86 1xrz h ASN 17 Ca 0.45 0.17 -0.01 0.00 1.21 0.00 0.00 56.30 58.12 1xrz h ASN 17 Cb 0.70 0.51 -0.04 0.00 -1.12 0.00 0.00 38.32 38.36 1xrz h ASN 17 CO -1.01 -0.42 0.52 0.25 -1.29 0.00 0.00 177.43 175.49 1xrz h LEU 18 N -0.48 1.05 -0.02 1.61 5.85 -1.02 -1.53 115.31 120.77 1xrz h LEU 18 Ca 0.08 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.74 1xrz h LEU 18 Cb 0.61 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1xrz h LEU 18 CO -0.38 0.81 -0.02 0.50 -0.34 0.00 0.00 178.44 179.00 1xrz h LYS 19 N 1.20 -0.03 -0.27 1.25 3.64 -0.68 -1.45 116.57 120.22 1xrz h LYS 19 Ca 0.31 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.75 1xrz h LYS 19 Cb -0.04 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 31.71 1xrz h LYS 19 CO -0.06 -0.02 -0.42 1.15 -2.27 0.00 0.00 179.45 177.83 1xrz h THR 20 N -0.03 0.13 -0.69 1.00 2.02 -0.59 -0.84 112.91 113.91 1xrz h THR 20 Ca 0.02 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.28 1xrz h THR 20 Cb 0.06 0.13 -0.11 0.00 -1.74 0.00 0.00 68.15 66.49 1xrz h THR 20 CO -0.04 0.00 -0.50 -0.74 0.37 0.00 0.00 175.52 174.60 1xrz h HIS 21 N -0.40 -1.53 -0.00 3.16 -0.00 -0.81 -1.64 115.15 113.92 1xrz h HIS 21 Ca 0.11 0.10 0.03 0.00 -0.00 0.00 0.00 60.37 60.60 1xrz h HIS 21 Cb 0.60 0.76 -0.06 0.00 -0.00 0.00 0.00 27.41 28.72 1xrz h HIS 21 CO -0.56 -0.42 -0.48 0.82 -0.00 0.00 0.00 177.93 177.29 1xrz h ILE 22 N -0.19 0.07 -0.77 6.26 2.04 -0.16 0.10 117.51 124.86 1xrz h ILE 22 Ca 0.16 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.31 1xrz h ILE 22 Cb 0.54 0.07 -0.14 0.00 -0.74 0.00 0.00 36.82 36.54 1xrz h ILE 22 CO -0.76 0.00 0.27 1.17 0.00 0.00 0.00 178.15 178.83 1xrz n LYS 23 N -5.46 -0.05 -0.10 2.37 4.81 -0.44 -0.76 118.16 118.52 1xrz n LYS 23 Ca -0.07 1.10 -0.11 0.00 -0.87 0.00 0.00 58.31 58.37 1xrz n LYS 23 Cb 0.39 -1.89 -0.13 0.00 0.02 0.00 0.00 35.03 33.42 1xrz n LYS 23 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1xrz n THR 24 N -4.87 1.25 0.37 3.15 5.66 -1.02 -3.57 114.28 115.25 1xrz n THR 24 Ca 0.25 -0.68 0.12 0.00 -3.05 0.00 0.00 64.05 60.69 1xrz n THR 24 Cb 0.85 -0.76 0.08 0.00 -1.55 0.00 0.00 70.33 68.95 1xrz n THR 24 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 1xrz h LYS 25 N 0.00 0.00 0.00 1.09 1.79 -0.53 -3.40 116.57 115.51 1xrz h LYS 25 Ca -0.49 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 1xrz h LYS 25 Cb 2.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.66 1xrz h LYS 25 CO -0.01 0.00 -0.86 0.72 -1.08 0.00 0.00 179.45 178.23 1xrz n HIS 26 N -2.36 0.00 -4.29 -1.35 8.25 0.06 -5.03 115.22 110.50 1xrz n HIS 26 Ca 0.02 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.13 1xrz n HIS 26 Cb 0.49 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.54 1xrz n HIS 26 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1xrz n SER 27 N -2.37 -1.30 0.00 0.41 7.64 -0.33 -4.76 113.62 112.91 1xrz n SER 27 Ca 0.00 -1.14 0.00 0.00 1.01 0.00 0.00 58.87 58.74 1xrz n SER 27 Cb 0.43 -2.20 0.00 0.00 -1.01 0.00 0.00 64.21 61.43 1xrz n SER 27 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1xrz n LYS 28 N -4.35 0.34 -4.54 1.43 2.85 -1.26 -5.06 118.16 107.56 1xrz n LYS 28 Ca -0.08 0.00 -0.26 0.00 -1.05 0.00 0.00 58.31 56.92 1xrz n LYS 28 Cb 0.57 -0.80 -0.11 0.00 -0.65 0.00 0.00 35.03 34.04 1xrz n LYS 28 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1xrz s GLU 29 N -1.60 1.81 0.00 -1.58 0.41 -1.26 -5.15 118.70 111.33 1xrz s GLU 29 Ca 0.00 -1.96 0.10 0.00 -0.41 0.00 0.00 54.97 52.69 1xrz s GLU 29 Cb 0.00 -1.55 0.08 0.00 -1.78 0.00 0.00 34.13 30.88 1xrz s GLU 29 CO 0.00 0.05 0.80 1.17 -0.49 0.00 0.00 175.26 176.79