#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 2.79 0.08 3.15 -4.23 -1.26 -4.47 115.64 111.69 1xrz s THR 2 Ca 0.00 -1.90 0.08 0.00 -1.18 0.00 0.00 61.69 58.69 1xrz s THR 2 Cb 0.00 -2.38 -0.03 0.00 1.34 0.00 0.00 72.50 71.43 1xrz s THR 2 CO 0.00 -0.15 -0.20 -0.31 -0.54 0.00 0.00 174.62 173.42 1xrz s TYR 3 N -1.80 1.75 0.54 3.99 2.02 -0.85 -4.97 117.35 118.04 1xrz s TYR 3 Ca 0.24 -0.40 0.03 0.00 -0.37 0.00 0.00 57.07 56.57 1xrz s TYR 3 Cb -0.08 -0.99 0.04 0.00 -0.40 0.00 0.00 41.96 40.53 1xrz s TYR 3 CO 0.13 0.15 0.75 -0.65 -1.57 0.00 0.00 175.55 174.37 1xrz s GLN 4 N -1.62 2.50 0.83 -0.62 -1.52 -1.26 -2.35 119.66 115.62 1xrz s GLN 4 Ca 0.06 -0.96 -0.12 0.00 -1.95 0.00 0.00 55.36 52.39 1xrz s GLN 4 Cb -0.09 -2.54 0.09 0.00 -0.22 0.00 0.00 33.01 30.25 1xrz s GLN 4 CO 0.03 -0.70 1.14 0.00 -0.25 0.00 0.00 175.29 175.51 1xrz n GLN 6 N -3.45 3.30 0.00 0.00 -0.00 -1.26 -4.41 117.38 111.56 1xrz n GLN 6 Ca 0.07 -2.66 0.00 0.00 -0.00 0.00 0.00 57.00 54.41 1xrz n GLN 6 Cb 0.59 -1.70 0.00 0.00 -0.00 0.00 0.00 30.24 29.13 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 0.81 0.00 -3.00 2.61 4.01 -1.26 -5.11 117.16 115.21 1xrz n TYR 7 Ca 0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.96 1xrz n TYR 7 Cb 0.75 0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.99 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 0.97 2.66 -0.26 0.00 2.12 -1.26 -3.76 118.70 119.17 1xrz s GLU 9 Ca 0.00 -1.07 -0.29 0.00 0.36 0.00 0.00 54.97 53.96 1xrz s GLU 9 Cb 0.00 -2.83 0.18 0.00 0.26 0.00 0.00 34.13 31.73 1xrz s GLU 9 CO 0.00 -0.41 1.28 -0.98 -0.54 0.00 0.00 175.26 174.61 1xrz s ARG 11 N 1.23 0.18 0.37 4.30 1.70 -1.26 -4.76 118.95 120.72 1xrz s ARG 11 Ca -0.02 0.05 0.04 0.00 -0.47 0.00 0.00 55.73 55.33 1xrz s ARG 11 Cb -0.17 0.09 -0.03 0.00 -0.57 0.00 0.00 34.95 34.27 1xrz s ARG 11 CO -0.07 -0.05 0.14 -1.12 -1.08 0.00 0.00 175.30 173.11 1xrz s SER 12 N -0.97 2.39 -0.11 -2.89 0.01 -0.99 -4.94 113.70 106.20 1xrz s SER 12 Ca 0.06 -1.63 0.10 0.00 1.31 0.00 0.00 55.95 55.80 1xrz s SER 12 Cb -0.01 0.43 -0.24 0.00 0.21 0.00 0.00 66.02 66.41 1xrz s SER 12 CO -0.06 -0.90 0.40 0.00 0.41 0.00 0.00 173.24 173.09 1xrz n ALA 13 N -0.80 1.40 -4.48 1.44 0.00 -1.26 -2.01 120.51 114.80 1xrz n ALA 13 Ca -0.03 -0.91 -0.27 0.00 0.00 0.00 0.00 53.44 52.23 1xrz n ALA 13 Cb 0.65 -0.60 -0.05 0.00 0.00 0.00 0.00 19.45 19.45 1xrz n ALA 13 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xrz n ASP 14 N -3.05 3.06 -0.07 0.00 2.03 -1.26 -4.64 116.55 112.61 1xrz n ASP 14 Ca -0.25 -2.86 -0.22 0.00 0.52 0.00 0.00 54.79 51.98 1xrz n ASP 14 Cb 1.07 0.23 -0.12 0.00 -0.72 0.00 0.00 41.12 41.59 1xrz n ASP 14 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1xrz h SER 15 N 0.95 0.12 -0.63 1.67 0.87 -1.99 -3.37 113.55 111.16 1xrz h SER 15 Ca -0.35 -0.64 0.09 0.00 -1.23 0.00 0.00 61.79 59.66 1xrz h SER 15 Cb 1.10 -0.04 -0.10 0.00 -0.44 0.00 0.00 62.40 62.93 1xrz h SER 15 CO 0.58 1.58 -0.27 -1.20 -0.53 0.00 0.00 176.83 176.98 1xrz n SER 16 N -4.19 -0.47 0.11 6.23 7.64 -1.26 -0.49 113.62 121.19 1xrz n SER 16 Ca -0.31 1.11 -0.13 0.00 1.01 0.00 0.00 58.87 60.54 1xrz n SER 16 Cb 0.78 -0.23 -0.08 0.00 -1.01 0.00 0.00 64.21 63.67 1xrz n SER 16 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1xrz h ASN 17 N 0.00 -0.18 -0.85 6.43 2.35 -2.01 -1.98 115.58 119.34 1xrz h ASN 17 Ca 0.19 -0.07 0.10 0.00 -0.55 0.00 0.00 56.30 55.97 1xrz h ASN 17 Cb 0.35 0.05 -0.07 0.00 0.05 0.00 0.00 38.32 38.69 1xrz h ASN 17 CO -0.62 -0.04 0.50 0.25 -1.65 0.00 0.00 177.43 175.86 1xrz h LEU 18 N -0.30 0.72 0.64 1.61 5.85 -0.95 -0.60 115.31 122.27 1xrz h LEU 18 Ca -0.02 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1xrz h LEU 18 Cb 0.24 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1xrz h LEU 18 CO 0.04 0.40 -0.40 0.50 -0.34 0.00 0.00 178.44 178.64 1xrz h LYS 19 N 0.83 -0.95 -0.64 1.25 3.64 -0.83 -0.11 116.57 119.75 1xrz h LYS 19 Ca 0.41 0.06 0.12 0.00 -1.27 0.00 0.00 60.65 59.98 1xrz h LYS 19 Cb 0.38 0.22 -0.12 0.00 -0.41 0.00 0.00 32.23 32.30 1xrz h LYS 19 CO -0.25 -0.63 -0.27 1.15 -2.27 0.00 0.00 179.45 177.18 1xrz h THR 20 N -0.99 0.22 0.13 1.00 2.02 -0.64 -1.30 112.91 113.36 1xrz h THR 20 Ca -0.08 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.12 1xrz h THR 20 Cb 0.80 0.22 -0.05 0.00 -1.74 0.00 0.00 68.15 67.39 1xrz h THR 20 CO 0.07 0.00 -0.49 -0.74 0.37 0.00 0.00 175.52 174.73 1xrz h HIS 21 N -0.09 -1.41 -0.41 3.16 -0.00 -0.67 -2.66 115.15 113.08 1xrz h HIS 21 Ca 0.28 0.04 0.08 0.00 -0.00 0.00 0.00 60.37 60.77 1xrz h HIS 21 Cb 0.54 0.60 -0.09 0.00 -0.00 0.00 0.00 27.41 28.45 1xrz h HIS 21 CO -0.61 -0.58 -0.30 0.82 -0.00 0.00 0.00 177.93 177.26 1xrz h ILE 22 N -0.73 0.25 -1.06 6.26 2.04 -0.02 0.41 117.51 124.66 1xrz h ILE 22 Ca 0.00 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.17 1xrz h ILE 22 Cb 0.74 0.25 -0.12 0.00 -0.74 0.00 0.00 36.82 36.95 1xrz h ILE 22 CO -0.27 0.00 0.65 0.50 0.00 0.00 0.00 178.15 179.03 1xrz h LYS 23 N -0.23 0.36 0.00 2.37 1.63 -0.95 -0.28 116.57 119.47 1xrz h LYS 23 Ca 0.18 -0.02 -0.35 0.00 -0.85 0.00 0.00 60.65 59.61 1xrz h LYS 23 Cb 0.52 -0.08 -0.07 0.00 -0.60 0.00 0.00 32.23 32.01 1xrz h LYS 23 CO -0.54 0.24 -2.32 -2.37 -3.45 0.00 0.00 179.45 171.01 1xrz n THR 24 N -4.82 1.32 0.04 1.00 5.66 -0.64 -3.81 114.28 113.04 1xrz n THR 24 Ca 0.29 -0.76 0.07 0.00 -3.05 0.00 0.00 64.05 60.60 1xrz n THR 24 Cb 0.96 -0.64 -0.08 0.00 -1.55 0.00 0.00 70.33 69.02 1xrz n THR 24 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1xrz n LYS 25 N -2.79 0.63 -0.02 1.09 4.76 0.04 -4.68 118.16 117.19 1xrz n LYS 25 Ca -0.33 0.06 -0.03 0.00 -2.87 0.00 0.00 58.31 55.14 1xrz n LYS 25 Cb 1.09 -1.72 -0.02 0.00 -1.84 0.00 0.00 35.03 32.54 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 -2.64 0.00 -4.31 2.13 8.25 -0.22 -5.04 115.22 113.40 1xrz n HIS 26 Ca -0.06 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.10 1xrz n HIS 26 Cb 0.68 -0.14 -0.03 0.00 1.12 0.00 0.00 29.99 31.62 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 -2.81 3.11 0.00 0.41 2.88 -0.59 -5.03 113.62 111.59 1xrz n SER 27 Ca -0.07 -3.12 0.00 0.00 -1.33 0.00 0.00 58.87 54.36 1xrz n SER 27 Cb 0.56 0.15 0.00 0.00 -0.75 0.00 0.00 64.21 64.17 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 -1.59 0.00 -3.97 -1.46 4.81 -1.25 -4.09 118.16 110.61 1xrz n LYS 28 Ca -0.11 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.24 1xrz n LYS 28 Cb 0.65 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.65 1xrz n LYS 28 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1xrz s GLU 29 N 0.00 1.48 0.00 1.64 -1.05 -1.25 -4.45 118.70 115.07 1xrz s GLU 29 Ca 0.00 -1.21 0.00 0.00 -0.15 0.00 0.00 54.97 53.61 1xrz s GLU 29 Cb 0.00 0.46 0.00 0.00 -0.44 0.00 0.00 34.13 34.15 1xrz s GLU 29 CO 0.00 -0.61 0.00 0.36 0.95 0.00 0.00 175.26 175.96