#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 2.53 -0.01 -0.18 -1.32 -1.26 -5.18 115.64 110.22 1xrz s THR 2 Ca 0.00 -1.06 0.07 0.00 -1.21 0.00 0.00 61.69 59.50 1xrz s THR 2 Cb 0.00 -2.59 -0.02 0.00 -1.51 0.00 0.00 72.50 68.38 1xrz s THR 2 CO 0.00 0.00 -0.23 -0.31 -2.21 0.00 0.00 174.62 171.87 1xrz s TYR 3 N -2.52 2.43 0.00 9.09 2.02 -0.93 -4.99 117.35 122.46 1xrz s TYR 3 Ca 0.56 -0.35 0.04 0.00 -0.37 0.00 0.00 57.07 56.95 1xrz s TYR 3 Cb -0.07 -1.50 -0.03 0.00 -0.40 0.00 0.00 41.96 39.96 1xrz s TYR 3 CO 0.35 0.08 -0.09 -1.14 -1.57 0.00 0.00 175.55 173.17 1xrz s GLN 4 N -0.86 2.48 1.12 -0.62 -0.44 -1.26 -1.22 119.66 118.86 1xrz s GLN 4 Ca 0.11 -0.75 -0.17 0.00 -2.50 0.00 0.00 55.36 52.05 1xrz s GLN 4 Cb -0.10 -2.45 0.16 0.00 -1.64 0.00 0.00 33.01 28.98 1xrz s GLN 4 CO 0.01 0.60 0.22 0.00 0.50 0.00 0.00 175.29 176.61 1xrz n GLN 6 N -2.36 0.94 -0.11 0.00 7.27 -1.26 -4.71 117.38 117.15 1xrz n GLN 6 Ca 0.04 -0.03 -0.18 0.00 0.07 0.00 0.00 57.00 56.90 1xrz n GLN 6 Cb 0.51 -1.48 -0.09 0.00 2.41 0.00 0.00 30.24 31.60 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 -2.64 0.00 -2.67 3.69 4.01 -1.26 -5.06 117.16 113.23 1xrz n TYR 7 Ca -0.28 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.46 1xrz n TYR 7 Cb 1.05 -0.81 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 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 1.58 2.61 -0.28 0.00 2.12 -1.26 -4.39 118.70 119.08 1xrz s GLU 9 Ca 0.00 -1.14 -0.16 0.00 0.36 0.00 0.00 54.97 54.03 1xrz s GLU 9 Cb 0.00 -3.16 0.10 0.00 0.26 0.00 0.00 34.13 31.33 1xrz s GLU 9 CO 0.00 -0.54 0.78 1.03 -0.54 0.00 0.00 175.26 175.99 1xrz s ARG 11 N 1.30 0.61 0.41 4.30 3.00 -1.26 -4.93 118.95 122.38 1xrz s ARG 11 Ca -0.03 1.04 0.04 0.00 0.00 0.00 0.00 55.73 56.78 1xrz s ARG 11 Cb -0.19 0.12 -0.04 0.00 0.00 0.00 0.00 34.95 34.85 1xrz s ARG 11 CO -0.02 -0.13 0.06 -1.12 0.00 0.00 0.00 175.30 174.10 1xrz s SER 12 N 1.52 3.14 -0.00 0.23 0.01 -0.36 -4.97 113.70 113.27 1xrz s SER 12 Ca -0.10 -1.54 0.15 0.00 1.31 0.00 0.00 55.95 55.78 1xrz s SER 12 Cb -0.05 0.20 -0.18 0.00 0.21 0.00 0.00 66.02 66.20 1xrz s SER 12 CO -0.18 -0.75 0.58 0.00 0.41 0.00 0.00 173.24 173.30 1xrz n ALA 13 N -0.93 3.67 -2.40 1.44 0.00 -1.26 -2.18 120.51 118.84 1xrz n ALA 13 Ca -0.08 -0.42 -0.08 0.00 0.00 0.00 0.00 53.44 52.87 1xrz n ALA 13 Cb 0.66 -0.55 -0.10 0.00 0.00 0.00 0.00 19.45 19.46 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 -2.73 0.38 -0.16 0.00 -1.08 -1.26 -4.88 116.67 106.94 1xrz s ASP 14 Ca 0.03 -0.81 0.06 0.00 -0.52 0.00 0.00 52.55 51.32 1xrz s ASP 14 Cb 0.11 0.18 0.44 0.00 -1.46 0.00 0.00 42.92 42.19 1xrz s ASP 14 CO 0.63 -0.52 1.27 -1.54 0.52 0.00 0.00 175.17 175.53 1xrz n SER 15 N 0.55 3.59 -0.01 -0.34 3.41 -1.26 -1.87 113.62 117.70 1xrz n SER 15 Ca -0.17 -2.61 -0.01 0.00 -0.26 0.00 0.00 58.87 55.82 1xrz n SER 15 Cb 0.59 -0.63 -0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1xrz n SER 15 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1xrz n SER 16 N 0.16 3.98 -0.02 4.04 7.64 -1.26 -4.11 113.62 124.05 1xrz n SER 16 Ca 0.20 -0.01 -0.13 0.00 1.01 0.00 0.00 58.87 59.94 1xrz n SER 16 Cb 0.87 0.02 -0.10 0.00 -1.01 0.00 0.00 64.21 63.99 1xrz n SER 16 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1xrz h ASN 17 N 0.00 0.03 -0.73 6.43 -0.73 -1.93 -1.49 115.58 117.15 1xrz h ASN 17 Ca -0.02 -0.53 0.13 0.00 1.87 0.00 0.00 56.30 57.76 1xrz h ASN 17 Cb 1.04 -0.01 -0.05 0.00 0.27 0.00 0.00 38.32 39.57 1xrz h ASN 17 CO -0.00 0.55 0.49 0.25 -0.37 0.00 0.00 177.43 178.34 1xrz h LEU 18 N -0.49 0.42 0.52 0.34 5.85 -1.63 -0.20 115.31 120.11 1xrz h LEU 18 Ca 0.00 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1xrz h LEU 18 Cb 0.54 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.51 1xrz h LEU 18 CO 0.00 0.22 -0.25 0.50 -0.34 0.00 0.00 178.44 178.58 1xrz h LYS 19 N 0.45 -0.67 -0.67 1.25 1.63 -1.64 -1.79 116.57 115.14 1xrz h LYS 19 Ca 0.36 0.05 0.13 0.00 -0.85 0.00 0.00 60.65 60.33 1xrz h LYS 19 Cb 0.76 0.15 -0.13 0.00 -0.60 0.00 0.00 32.23 32.41 1xrz h LYS 19 CO -0.12 -0.37 -0.24 1.15 -3.45 0.00 0.00 179.45 176.43 1xrz h THR 20 N -0.91 0.25 -0.18 1.00 2.02 -0.17 -0.39 112.91 114.52 1xrz h THR 20 Ca -0.07 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.14 1xrz h THR 20 Cb 0.61 0.25 -0.06 0.00 -1.74 0.00 0.00 68.15 67.20 1xrz h THR 20 CO 0.12 0.00 -0.49 -0.74 0.37 0.00 0.00 175.52 174.77 1xrz h HIS 21 N -0.06 -1.48 -0.27 3.16 -0.00 -0.87 -2.58 115.15 113.05 1xrz h HIS 21 Ca 0.30 0.06 0.04 0.00 -0.00 0.00 0.00 60.37 60.77 1xrz h HIS 21 Cb 0.53 0.67 -0.07 0.00 -0.00 0.00 0.00 27.41 28.54 1xrz h HIS 21 CO -0.60 -0.48 -0.55 0.82 -0.00 0.00 0.00 177.93 177.12 1xrz h ILE 22 N -0.49 0.00 -0.76 6.26 2.04 -0.21 0.44 117.51 124.79 1xrz h ILE 22 Ca 0.04 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.15 1xrz h ILE 22 Cb 0.60 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.54 1xrz h ILE 22 CO -0.43 0.00 0.18 0.29 0.00 0.00 0.00 178.15 178.19 1xrz n LYS 23 N -5.41 -0.05 -0.11 2.37 4.76 -0.63 -1.22 118.16 117.87 1xrz n LYS 23 Ca -0.05 1.10 -0.15 0.00 -2.87 0.00 0.00 58.31 56.34 1xrz n LYS 23 Cb 0.36 -1.84 -0.11 0.00 -1.84 0.00 0.00 35.03 31.60 1xrz n LYS 23 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1xrz n THR 24 N -4.92 1.29 0.15 -0.18 -1.04 -0.94 -3.57 114.28 105.08 1xrz n THR 24 Ca 0.23 -0.51 0.03 0.00 -2.04 0.00 0.00 64.05 61.76 1xrz n THR 24 Cb 0.75 -1.24 0.11 0.00 -1.82 0.00 0.00 70.33 68.13 1xrz n THR 24 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1xrz h LYS 25 N 0.00 0.00 0.00 -2.82 1.79 -0.71 -3.37 116.57 111.45 1xrz h LYS 25 Ca -0.50 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 57.78 1xrz h LYS 25 Cb 1.80 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 32.43 1xrz h LYS 25 CO -0.07 0.47 -1.64 0.72 -1.08 0.00 0.00 179.45 177.84 1xrz n HIS 26 N -3.29 0.00 0.00 -1.35 8.25 -0.36 -5.04 115.22 113.43 1xrz n HIS 26 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1xrz n HIS 26 Cb 0.68 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 31.37 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 -3.24 0.00 0.00 0.41 3.41 -0.65 -5.05 113.62 108.50 1xrz n SER 27 Ca -0.22 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 1xrz n SER 27 Cb 0.68 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.63 1xrz n SER 27 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1xrz n LYS 28 N -0.69 0.00 -0.29 4.33 5.02 -1.25 -4.17 118.16 121.10 1xrz n LYS 28 Ca 0.00 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.36 1xrz n LYS 28 Cb 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 35.03 35.12 1xrz n LYS 28 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1xrz n GLU 29 N 1.00 1.00 0.00 1.97 0.00 -1.26 -4.59 120.64 118.76 1xrz n GLU 29 Ca 0.00 -2.32 0.00 0.00 0.00 0.00 0.00 57.16 54.84 1xrz n GLU 29 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 31.44 30.20 1xrz n GLU 29 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76