#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 2.00 0.10 -0.18 -4.23 -1.26 -4.47 115.64 107.60 1xrz s THR 2 Ca 0.00 -2.25 0.06 0.00 -1.18 0.00 0.00 61.69 58.32 1xrz s THR 2 Cb 0.00 -2.11 -0.03 0.00 1.34 0.00 0.00 72.50 71.69 1xrz s THR 2 CO 0.00 -0.50 -0.16 -0.31 -0.54 0.00 0.00 174.62 173.11 1xrz s TYR 3 N -2.71 1.42 0.12 3.99 1.51 -0.34 -4.98 117.35 116.36 1xrz s TYR 3 Ca 0.24 -0.48 0.09 0.00 -1.01 0.00 0.00 57.07 55.92 1xrz s TYR 3 Cb -0.03 -0.77 -0.04 0.00 -0.11 0.00 0.00 41.96 41.01 1xrz s TYR 3 CO 0.10 0.13 -0.19 -0.65 -1.11 0.00 0.00 175.55 173.82 1xrz s GLN 4 N -2.07 1.76 1.22 -0.62 -1.52 -1.26 -1.51 119.66 115.65 1xrz s GLN 4 Ca 0.04 -1.19 -0.16 0.00 -1.95 0.00 0.00 55.36 52.10 1xrz s GLN 4 Cb -0.08 -2.10 0.26 0.00 -0.22 0.00 0.00 33.01 30.87 1xrz s GLN 4 CO 0.03 0.48 0.71 0.00 -0.25 0.00 0.00 175.29 176.26 1xrz n GLN 6 N -4.31 1.66 0.00 0.00 1.13 -1.26 -4.63 117.38 109.98 1xrz n GLN 6 Ca 0.03 -1.61 0.00 0.00 -1.94 0.00 0.00 57.00 53.48 1xrz n GLN 6 Cb 0.56 -1.26 0.00 0.00 0.11 0.00 0.00 30.24 29.66 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 0.63 0.00 -2.96 1.08 4.02 -1.26 -5.12 117.16 113.55 1xrz n TYR 7 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.98 1xrz n TYR 7 Cb 0.36 0.13 0.00 0.00 -0.02 0.00 0.00 39.34 39.81 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 0.93 2.43 -0.12 0.00 2.56 -1.26 -4.18 118.70 119.07 1xrz s GLU 9 Ca 0.00 -1.24 -0.30 0.00 0.00 0.00 0.00 54.97 53.43 1xrz s GLU 9 Cb 0.00 -3.03 0.12 0.00 2.00 0.00 0.00 34.13 33.21 1xrz s GLU 9 CO 0.00 -0.56 0.94 -0.98 -0.56 0.00 0.00 175.26 174.10 1xrz s ARG 11 N 1.21 0.69 0.26 4.30 1.70 -1.26 -4.90 118.95 120.96 1xrz s ARG 11 Ca -0.06 0.07 0.02 0.00 -0.47 0.00 0.00 55.73 55.30 1xrz s ARG 11 Cb -0.19 0.33 -0.05 0.00 -0.57 0.00 0.00 34.95 34.46 1xrz s ARG 11 CO -0.03 -0.24 0.07 -1.12 -1.08 0.00 0.00 175.30 172.90 1xrz s SER 12 N -1.38 1.50 -0.06 -2.89 0.01 -0.57 -4.98 113.70 105.33 1xrz s SER 12 Ca -0.02 -1.35 0.21 0.00 1.31 0.00 0.00 55.95 56.10 1xrz s SER 12 Cb -0.00 0.09 -0.32 0.00 0.21 0.00 0.00 66.02 66.00 1xrz s SER 12 CO 0.01 -0.67 0.40 0.00 0.41 0.00 0.00 173.24 173.38 1xrz n ALA 13 N -0.49 2.56 -2.56 1.44 0.00 -1.26 -1.20 120.51 119.01 1xrz n ALA 13 Ca -0.01 -0.65 -0.30 0.00 0.00 0.00 0.00 53.44 52.48 1xrz n ALA 13 Cb 0.66 -0.63 -0.03 0.00 0.00 0.00 0.00 19.45 19.45 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 -4.64 4.43 -0.15 0.00 2.15 -1.26 -4.49 116.67 112.71 1xrz s ASP 14 Ca -0.08 -1.45 -0.12 0.00 0.43 0.00 0.00 52.55 51.33 1xrz s ASP 14 Cb 0.12 0.56 -0.07 0.00 -0.30 0.00 0.00 42.92 43.24 1xrz s ASP 14 CO 0.87 -1.05 -0.26 -1.20 -0.17 0.00 0.00 175.17 173.36 1xrz n SER 15 N -1.59 1.60 -0.37 -0.34 7.64 -1.26 -4.33 113.62 114.96 1xrz n SER 15 Ca -0.10 0.27 0.02 0.00 1.01 0.00 0.00 58.87 60.07 1xrz n SER 15 Cb 0.65 -0.62 0.08 0.00 -1.01 0.00 0.00 64.21 63.31 1xrz n SER 15 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1xrz n SER 16 N -4.08 -0.53 -0.14 6.43 7.64 -1.26 -0.29 113.62 121.39 1xrz n SER 16 Ca -0.25 1.73 -0.06 0.00 1.01 0.00 0.00 58.87 61.29 1xrz n SER 16 Cb 0.58 -0.44 -0.00 0.00 -1.01 0.00 0.00 64.21 63.33 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 -1.04 -0.58 6.43 -0.73 -2.00 -0.83 115.58 116.82 1xrz h ASN 17 Ca 0.40 0.20 0.03 0.00 1.87 0.00 0.00 56.30 58.80 1xrz h ASN 17 Cb 0.65 0.50 -0.04 0.00 0.27 0.00 0.00 38.32 39.70 1xrz h ASN 17 CO -1.00 -0.30 0.34 0.25 -0.37 0.00 0.00 177.43 176.35 1xrz h LEU 18 N -0.21 0.54 0.16 0.34 5.85 -0.84 -1.54 115.31 119.62 1xrz h LEU 18 Ca 0.20 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.94 1xrz h LEU 18 Cb 0.53 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1xrz h LEU 18 CO -0.57 0.38 -0.27 0.11 -0.34 0.00 0.00 178.44 177.75 1xrz h LYS 19 N 0.67 -0.49 -0.48 1.25 1.57 -0.21 -1.33 116.57 117.56 1xrz h LYS 19 Ca 0.24 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 59.13 1xrz h LYS 19 Cb 0.06 0.11 -0.10 0.00 0.08 0.00 0.00 32.23 32.38 1xrz h LYS 19 CO -0.12 -0.32 -0.44 1.15 -0.57 0.00 0.00 179.45 179.15 1xrz h THR 20 N -0.50 0.09 -0.70 -0.16 2.02 -0.75 -0.06 112.91 112.85 1xrz h THR 20 Ca 0.02 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.32 1xrz h THR 20 Cb 0.51 0.09 -0.13 0.00 -1.74 0.00 0.00 68.15 66.89 1xrz h THR 20 CO -0.13 0.00 -0.33 -0.74 0.37 0.00 0.00 175.52 174.69 1xrz h HIS 21 N -0.29 -0.91 -0.82 3.16 -0.00 -0.61 0.35 115.15 116.04 1xrz h HIS 21 Ca 0.15 0.08 0.05 0.00 -0.00 0.00 0.00 60.37 60.66 1xrz h HIS 21 Cb 0.57 0.50 -0.06 0.00 -0.00 0.00 0.00 27.41 28.43 1xrz h HIS 21 CO -0.67 -0.38 0.50 0.82 -0.00 0.00 0.00 177.93 178.20 1xrz h ILE 22 N -0.11 1.05 -0.24 6.26 2.04 0.05 0.12 117.51 126.67 1xrz h ILE 22 Ca 0.27 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1xrz h ILE 22 Cb 0.56 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 1xrz h ILE 22 CO -0.76 0.17 0.00 1.17 0.00 0.00 0.00 178.15 178.73 1xrz n LYS 23 N -4.64 2.29 0.00 2.37 4.81 0.79 -0.76 118.16 123.02 1xrz n LYS 23 Ca 0.11 -1.18 0.00 0.00 -0.87 0.00 0.00 58.31 56.38 1xrz n LYS 23 Cb 0.16 -1.64 0.00 0.00 0.02 0.00 0.00 35.03 33.56 1xrz n LYS 23 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1xrz n THR 24 N 0.27 0.00 -0.13 3.15 -1.04 0.87 -4.43 114.28 112.97 1xrz n THR 24 Ca 0.10 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.88 1xrz n THR 24 Cb 0.52 -1.22 -0.11 0.00 -1.82 0.00 0.00 70.33 67.70 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 -2.85 0.60 -0.95 -2.82 5.02 0.24 -4.18 118.16 113.22 1xrz n LYS 25 Ca 0.00 0.20 -0.05 0.00 -2.02 0.00 0.00 58.31 56.44 1xrz n LYS 25 Cb 0.46 -1.48 0.29 0.00 -0.02 0.00 0.00 35.03 34.28 1xrz n LYS 25 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1xrz n HIS 26 N -3.75 2.29 0.00 2.13 8.25 -0.73 -4.95 115.22 118.46 1xrz n HIS 26 Ca -0.49 -1.10 0.00 0.00 -0.26 0.00 0.00 57.72 55.86 1xrz n HIS 26 Cb 0.92 -0.65 0.00 0.00 1.12 0.00 0.00 29.99 31.38 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 -0.08 0.00 -0.00 0.41 7.64 0.06 -4.25 113.62 117.39 1xrz n SER 27 Ca 0.38 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.26 1xrz n SER 27 Cb 1.31 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 64.50 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 0.00 0.83 0.00 1.43 2.85 -1.26 -4.21 118.16 117.79 1xrz n LYS 28 Ca 0.00 -0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 1xrz n LYS 28 Cb 0.00 -0.96 0.00 0.00 -0.65 0.00 0.00 35.03 33.42 1xrz n LYS 28 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1xrz n GLU 29 N -1.47 0.00 0.00 -1.58 0.00 -1.26 -5.20 120.64 111.13 1xrz n GLU 29 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 57.16 57.17 1xrz n GLU 29 Cb 0.02 0.00 0.01 0.00 0.00 0.00 0.00 31.44 31.47 1xrz n GLU 29 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30