#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xrz n THR 2 N 0.00 0.00 -4.43 3.15 -1.04 -1.26 -5.08 114.28 105.61 1xrz n THR 2 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.78 1xrz n THR 2 Cb 0.00 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.38 1xrz n THR 2 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1xrz s TYR 3 N -2.19 1.62 0.12 -1.42 1.51 -0.37 -5.03 117.35 111.60 1xrz s TYR 3 Ca 0.00 -0.39 0.09 0.00 -1.01 0.00 0.00 57.07 55.76 1xrz s TYR 3 Cb 0.00 -0.94 -0.04 0.00 -0.11 0.00 0.00 41.96 40.87 1xrz s TYR 3 CO 0.00 0.11 -0.21 -0.65 -1.11 0.00 0.00 175.55 173.69 1xrz s GLN 4 N -1.43 1.20 0.74 -0.62 -1.52 -1.26 -1.30 119.66 115.48 1xrz s GLN 4 Ca 0.05 -1.25 -0.13 0.00 -1.95 0.00 0.00 55.36 52.07 1xrz s GLN 4 Cb -0.09 -1.46 0.04 0.00 -0.22 0.00 0.00 33.01 31.29 1xrz s GLN 4 CO 0.02 0.33 1.14 0.00 -0.25 0.00 0.00 175.29 176.54 1xrz n GLN 6 N -2.97 2.01 0.00 0.00 1.13 -1.26 -4.39 117.38 111.91 1xrz n GLN 6 Ca 0.11 -3.14 0.00 0.00 -1.94 0.00 0.00 57.00 52.04 1xrz n GLN 6 Cb 0.52 -1.92 0.00 0.00 0.11 0.00 0.00 30.24 28.95 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 -1.09 -0.07 -2.81 1.08 4.02 -1.26 -5.13 117.16 111.90 1xrz n TYR 7 Ca 0.40 0.01 0.00 0.00 -0.01 0.00 0.00 57.90 58.30 1xrz n TYR 7 Cb 1.21 0.46 0.00 0.00 -0.02 0.00 0.00 39.34 40.99 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 1.19 2.54 -0.21 0.00 2.12 -1.26 -4.25 118.70 118.82 1xrz s GLU 9 Ca 0.00 -1.18 -0.27 0.00 0.36 0.00 0.00 54.97 53.88 1xrz s GLU 9 Cb 0.00 -3.05 0.10 0.00 0.26 0.00 0.00 34.13 31.43 1xrz s GLU 9 CO 0.00 -0.53 0.86 -0.98 -0.54 0.00 0.00 175.26 174.06 1xrz s ARG 11 N 1.25 0.74 0.04 4.30 1.70 -1.26 -4.89 118.95 120.82 1xrz s ARG 11 Ca -0.04 0.60 -0.05 0.00 -0.47 0.00 0.00 55.73 55.77 1xrz s ARG 11 Cb -0.19 0.35 -0.01 0.00 -0.57 0.00 0.00 34.95 34.53 1xrz s ARG 11 CO -0.03 -0.14 0.08 -1.12 -1.08 0.00 0.00 175.30 173.01 1xrz s SER 12 N -0.20 0.20 -0.06 -2.89 0.01 -0.42 -5.02 113.70 105.32 1xrz s SER 12 Ca -0.01 -0.55 0.11 0.00 1.31 0.00 0.00 55.95 56.80 1xrz s SER 12 Cb -0.03 0.22 0.28 0.00 0.21 0.00 0.00 66.02 66.70 1xrz s SER 12 CO 0.01 -0.50 1.22 0.00 0.41 0.00 0.00 173.24 174.37 1xrz n ALA 13 N 0.79 2.34 -2.30 1.44 0.00 -1.26 -1.23 120.51 120.28 1xrz n ALA 13 Ca -0.19 -1.59 -0.16 0.00 0.00 0.00 0.00 53.44 51.50 1xrz n ALA 13 Cb 0.58 -0.39 -0.10 0.00 0.00 0.00 0.00 19.45 19.54 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 -1.48 1.39 -0.30 0.00 -1.08 -1.26 -4.91 116.67 109.03 1xrz s ASP 14 Ca 0.23 -1.29 0.11 0.00 -0.52 0.00 0.00 52.55 51.08 1xrz s ASP 14 Cb 0.17 0.11 0.47 0.00 -1.46 0.00 0.00 42.92 42.20 1xrz s ASP 14 CO 0.09 -0.63 1.16 -1.20 0.52 0.00 0.00 175.17 175.10 1xrz n SER 15 N -0.40 4.09 0.03 -0.34 7.64 -1.26 -4.42 113.62 118.96 1xrz n SER 15 Ca -0.03 -3.35 0.00 0.00 1.01 0.00 0.00 58.87 56.50 1xrz n SER 15 Cb 0.65 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 1xrz n SER 15 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1xrz n SER 16 N -0.65 0.14 -0.16 6.43 2.88 -1.26 -4.67 113.62 116.33 1xrz n SER 16 Ca 0.35 0.09 -0.02 0.00 -1.33 0.00 0.00 58.87 57.96 1xrz n SER 16 Cb 0.90 0.01 0.06 0.00 -0.75 0.00 0.00 64.21 64.44 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 -0.11 -0.45 -3.46 4.21 -2.00 -0.50 115.58 113.27 1xrz h ASN 17 Ca 0.00 0.10 -0.04 0.00 1.21 0.00 0.00 56.30 57.58 1xrz h ASN 17 Cb 0.36 0.17 -0.02 0.00 -1.12 0.00 0.00 38.32 37.71 1xrz h ASN 17 CO 0.00 -0.03 0.15 0.25 -1.29 0.00 0.00 177.43 176.52 1xrz h LEU 18 N 0.17 0.69 0.34 1.61 5.85 -1.87 0.14 115.31 122.24 1xrz h LEU 18 Ca 0.25 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 1xrz h LEU 18 Cb 0.36 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1xrz h LEU 18 CO -0.37 0.66 -0.17 0.50 -0.34 0.00 0.00 178.44 178.72 1xrz h LYS 19 N 0.73 -0.44 -0.38 1.25 1.63 -1.52 -1.98 116.57 115.86 1xrz h LYS 19 Ca 0.17 0.03 0.07 0.00 -0.85 0.00 0.00 60.65 60.07 1xrz h LYS 19 Cb 0.22 0.10 -0.09 0.00 -0.60 0.00 0.00 32.23 31.86 1xrz h LYS 19 CO -0.01 -0.17 -0.35 1.15 -3.45 0.00 0.00 179.45 176.62 1xrz h THR 20 N -0.68 0.20 -0.72 1.00 2.02 -0.86 -1.38 112.91 112.49 1xrz h THR 20 Ca -0.05 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.22 1xrz h THR 20 Cb 0.48 0.20 -0.11 0.00 -1.74 0.00 0.00 68.15 66.98 1xrz h THR 20 CO 0.08 0.00 -0.49 -0.74 0.37 0.00 0.00 175.52 174.73 1xrz h HIS 21 N -0.28 -1.50 -0.04 3.16 -0.00 -0.80 -0.65 115.15 115.04 1xrz h HIS 21 Ca 0.16 0.10 0.04 0.00 -0.00 0.00 0.00 60.37 60.66 1xrz h HIS 21 Cb 0.55 0.75 -0.05 0.00 -0.00 0.00 0.00 27.41 28.67 1xrz h HIS 21 CO -0.55 -0.42 -0.27 0.82 -0.00 0.00 0.00 177.93 177.51 1xrz h ILE 22 N -0.16 0.38 0.00 6.26 2.04 -0.50 -0.27 117.51 125.25 1xrz h ILE 22 Ca 0.18 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.04 1xrz h ILE 22 Cb 0.53 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1xrz h ILE 22 CO -0.78 0.00 0.30 0.11 0.00 0.00 0.00 178.15 177.77 1xrz h LYS 23 N -0.39 0.00 0.00 2.37 1.79 -0.24 -1.96 116.57 118.13 1xrz h LYS 23 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1xrz h LYS 23 Cb 0.50 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 1xrz h LYS 23 CO -0.26 0.00 -0.99 -2.37 -1.08 0.00 0.00 179.45 174.74 1xrz n THR 24 N -2.19 0.00 0.45 -0.16 5.66 -0.70 -4.54 114.28 112.80 1xrz n THR 24 Ca -0.01 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.10 1xrz n THR 24 Cb 0.32 -0.73 -0.09 0.00 -1.55 0.00 0.00 70.33 68.29 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 -2.26 0.36 -0.07 1.09 4.76 -0.20 -4.58 118.16 117.26 1xrz n LYS 25 Ca 0.00 -0.07 -0.16 0.00 -2.87 0.00 0.00 58.31 55.21 1xrz n LYS 25 Cb 0.50 -1.55 -0.05 0.00 -1.84 0.00 0.00 35.03 32.08 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 -1.98 0.00 0.00 2.13 8.25 -0.83 -4.75 115.22 118.04 1xrz n HIS 26 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1xrz n HIS 26 Cb 0.46 -0.54 0.00 0.00 1.12 0.00 0.00 29.99 31.04 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 -3.69 0.00 0.03 0.41 3.41 -0.80 -4.36 113.62 108.62 1xrz n SER 27 Ca -0.29 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 1xrz n SER 27 Cb 0.70 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 1xrz n SER 27 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1xrz n LYS 28 N -1.59 0.00 -0.65 4.33 4.81 -1.26 -5.09 118.16 118.70 1xrz n LYS 28 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1xrz n LYS 28 Cb 0.00 -0.18 0.00 0.00 0.02 0.00 0.00 35.03 34.87 1xrz n LYS 28 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1xrz n GLU 29 N -2.98 -0.03 0.00 1.64 -0.58 -1.26 -5.14 120.64 112.29 1xrz n GLU 29 Ca 0.00 0.07 0.09 0.00 -0.42 0.00 0.00 57.16 56.90 1xrz n GLU 29 Cb 0.00 -0.08 0.07 0.00 -0.57 0.00 0.00 31.44 30.86 1xrz n GLU 29 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28