#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 2.98 0.06 0.58 2.01 -1.26 -4.90 115.64 115.11 1xrz s THR 2 Ca 0.00 -1.45 0.05 0.00 0.31 0.00 0.00 61.69 60.60 1xrz s THR 2 Cb 0.00 -3.06 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 1xrz s THR 2 CO 0.00 -0.09 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.39 1xrz s TYR 3 N -2.42 1.18 0.24 4.92 1.51 -0.96 -5.01 117.35 116.81 1xrz s TYR 3 Ca 0.43 -0.42 0.11 0.00 -1.01 0.00 0.00 57.07 56.18 1xrz s TYR 3 Cb -0.03 -0.68 -0.05 0.00 -0.11 0.00 0.00 41.96 41.09 1xrz s TYR 3 CO 0.26 0.04 -0.19 -1.14 -1.11 0.00 0.00 175.55 173.41 1xrz s GLN 4 N -1.51 1.55 0.90 -0.62 -0.44 -1.26 -1.02 119.66 117.27 1xrz s GLN 4 Ca -0.01 -1.66 -0.12 0.00 -2.50 0.00 0.00 55.36 51.06 1xrz s GLN 4 Cb -0.09 -1.62 0.13 0.00 -1.64 0.00 0.00 33.01 29.79 1xrz s GLN 4 CO 0.02 0.31 1.12 0.00 0.50 0.00 0.00 175.29 177.23 1xrz n GLN 6 N -3.79 2.72 0.03 0.00 10.64 -1.26 -4.64 117.38 121.08 1xrz n GLN 6 Ca 0.06 -2.83 0.00 0.00 -1.83 0.00 0.00 57.00 52.40 1xrz n GLN 6 Cb 0.58 -1.81 0.00 0.00 -0.86 0.00 0.00 30.24 28.15 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 -0.63 -0.47 -2.91 2.61 4.01 -1.26 -5.13 117.16 113.38 1xrz n TYR 7 Ca 0.21 0.08 0.00 0.00 -0.16 0.00 0.00 57.90 58.03 1xrz n TYR 7 Cb 0.88 0.44 0.00 0.00 -0.31 0.00 0.00 39.34 40.35 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 0.96 2.68 -0.26 0.00 2.56 -1.26 -4.40 118.70 118.98 1xrz s GLU 9 Ca 0.00 -1.11 -0.26 0.00 0.00 0.00 0.00 54.97 53.60 1xrz s GLU 9 Cb 0.00 -3.21 0.13 0.00 2.00 0.00 0.00 34.13 33.05 1xrz s GLU 9 CO 0.00 -0.54 1.07 -0.98 -0.56 0.00 0.00 175.26 174.25 1xrz s ARG 11 N 1.34 0.47 0.40 4.30 3.03 -1.26 -4.94 118.95 122.29 1xrz s ARG 11 Ca -0.02 0.46 0.04 0.00 2.03 0.00 0.00 55.73 58.24 1xrz s ARG 11 Cb -0.18 0.23 -0.03 0.00 -1.03 0.00 0.00 34.95 33.94 1xrz s ARG 11 CO -0.01 -0.08 0.13 -1.12 -1.13 0.00 0.00 175.30 173.09 1xrz s SER 12 N -0.03 2.72 -0.22 -2.89 0.01 -0.19 -4.99 113.70 108.11 1xrz s SER 12 Ca 0.03 -1.65 0.03 0.00 1.31 0.00 0.00 55.95 55.67 1xrz s SER 12 Cb -0.04 0.47 -0.20 0.00 0.21 0.00 0.00 66.02 66.45 1xrz s SER 12 CO -0.06 -0.91 -0.05 0.00 0.41 0.00 0.00 173.24 172.63 1xrz n ALA 13 N -0.89 1.35 -2.40 1.44 0.00 -1.26 -2.27 120.51 116.48 1xrz n ALA 13 Ca -0.05 -1.04 -0.15 0.00 0.00 0.00 0.00 53.44 52.20 1xrz n ALA 13 Cb 0.65 -0.24 -0.11 0.00 0.00 0.00 0.00 19.45 19.75 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 -6.46 1.63 0.13 0.00 -1.08 -1.26 -4.62 116.67 105.01 1xrz s ASP 14 Ca -0.28 -0.88 -0.19 0.00 -0.52 0.00 0.00 52.55 50.68 1xrz s ASP 14 Cb 0.08 -0.01 -0.05 0.00 -1.46 0.00 0.00 42.92 41.49 1xrz s ASP 14 CO 0.67 -0.27 1.78 -1.28 0.52 0.00 0.00 175.17 176.59 1xrz h SER 15 N 3.28 0.27 -0.87 -0.34 0.87 -1.98 -2.97 113.55 111.82 1xrz h SER 15 Ca -0.37 -0.01 0.21 0.00 -1.23 0.00 0.00 61.79 60.39 1xrz h SER 15 Cb 1.19 -0.07 -0.16 0.00 -0.44 0.00 0.00 62.40 62.92 1xrz h SER 15 CO 0.56 0.20 -0.09 -0.24 -0.53 0.00 0.00 176.83 176.73 1xrz n SER 16 N -4.92 -0.20 -0.03 6.23 2.88 -1.26 -0.31 113.62 116.00 1xrz n SER 16 Ca -0.02 1.48 -0.13 0.00 -1.33 0.00 0.00 58.87 58.86 1xrz n SER 16 Cb 0.03 -0.50 -0.09 0.00 -0.75 0.00 0.00 64.21 62.90 1xrz n SER 16 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 1xrz h ASN 17 N 0.00 0.15 -0.81 -3.46 -0.00 -1.96 -2.74 115.58 106.77 1xrz h ASN 17 Ca 0.48 -0.53 0.14 0.00 -0.00 0.00 0.00 56.30 56.38 1xrz h ASN 17 Cb 0.88 -0.04 -0.09 0.00 -0.00 0.00 0.00 38.32 39.06 1xrz h ASN 17 CO -0.85 0.66 0.39 0.25 -0.00 0.00 0.00 177.43 177.88 1xrz h LEU 18 N -0.35 0.45 0.69 0.34 5.85 -0.57 -0.09 115.31 121.63 1xrz h LEU 18 Ca 0.00 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 1xrz h LEU 18 Cb 0.63 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 1xrz h LEU 18 CO 0.02 0.19 -0.40 0.50 -0.34 0.00 0.00 178.44 178.41 1xrz h LYS 19 N 0.57 -0.98 -0.68 1.25 3.11 -0.86 -0.29 116.57 118.70 1xrz h LYS 19 Ca 0.44 0.07 0.13 0.00 -2.81 0.00 0.00 60.65 58.47 1xrz h LYS 19 Cb 0.62 0.22 -0.13 0.00 -1.00 0.00 0.00 32.23 31.94 1xrz h LYS 19 CO -0.36 -0.65 -0.25 1.15 -2.81 0.00 0.00 179.45 176.52 1xrz h THR 20 N -1.01 0.22 0.08 1.00 2.02 -0.98 -0.99 112.91 113.25 1xrz h THR 20 Ca -0.09 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.10 1xrz h THR 20 Cb 0.81 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 1xrz h THR 20 CO 0.11 0.00 -0.44 -0.74 0.37 0.00 0.00 175.52 174.82 1xrz h HIS 21 N -0.07 -1.27 -0.25 3.16 -0.00 -0.61 -2.96 115.15 113.16 1xrz h HIS 21 Ca 0.30 0.03 0.04 0.00 -0.00 0.00 0.00 60.37 60.75 1xrz h HIS 21 Cb 0.54 0.54 -0.07 0.00 -0.00 0.00 0.00 27.41 28.42 1xrz h HIS 21 CO -0.62 -0.49 -0.53 0.82 -0.00 0.00 0.00 177.93 177.11 1xrz h ILE 22 N -0.61 0.02 -0.93 6.26 2.04 0.18 0.97 117.51 125.44 1xrz h ILE 22 Ca -0.00 0.00 0.33 0.00 1.00 0.00 0.00 64.86 66.19 1xrz h ILE 22 Cb 0.62 0.02 -0.17 0.00 -0.74 0.00 0.00 36.82 36.55 1xrz h ILE 22 CO -0.25 0.00 0.29 0.29 0.00 0.00 0.00 178.15 178.48 1xrz n LYS 23 N -5.41 -0.06 -0.06 2.37 4.76 -0.55 -0.91 118.16 118.29 1xrz n LYS 23 Ca -0.05 1.34 -0.05 0.00 -2.87 0.00 0.00 58.31 56.68 1xrz n LYS 23 Cb 0.36 -2.28 -0.11 0.00 -1.84 0.00 0.00 35.03 31.17 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 -5.23 0.82 0.06 -0.18 -1.04 -1.03 -0.52 114.28 107.17 1xrz n THR 24 Ca 0.30 -0.55 -0.02 0.00 -2.04 0.00 0.00 64.05 61.74 1xrz n THR 24 Cb 0.99 -0.53 -0.07 0.00 -1.82 0.00 0.00 70.33 68.90 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 -0.57 -3.42 116.57 111.55 1xrz h LYS 25 Ca -0.33 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.13 1xrz h LYS 25 Cb 1.70 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.35 1xrz h LYS 25 CO 0.02 0.51 -1.06 0.72 -1.08 0.00 0.00 179.45 178.56 1xrz n HIS 26 N -3.10 0.00 -3.20 -1.35 8.25 -0.09 -5.03 115.22 110.71 1xrz n HIS 26 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 1xrz n HIS 26 Cb 0.86 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.93 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 -2.65 0.64 -4.26 0.41 7.64 -0.48 -5.04 113.62 109.88 1xrz n SER 27 Ca -0.02 -0.87 -0.41 0.00 1.01 0.00 0.00 58.87 58.58 1xrz n SER 27 Cb 0.52 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.63 1xrz n SER 27 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1xrz s LYS 28 N -1.45 2.60 0.68 1.43 2.20 -1.15 -4.18 119.74 119.87 1xrz s LYS 28 Ca 0.00 -1.56 -0.17 0.00 -0.36 0.00 0.00 55.97 53.88 1xrz s LYS 28 Cb 0.00 -3.87 -0.08 0.00 -1.51 0.00 0.00 37.83 32.37 1xrz s LYS 28 CO 0.00 -1.05 0.30 -1.91 -0.36 0.00 0.00 175.35 172.32 1xrz n GLU 29 N 4.95 0.26 0.00 4.03 0.00 0.33 -4.94 120.64 125.26 1xrz n GLU 29 Ca -0.10 0.11 0.07 0.00 0.00 0.00 0.00 57.16 57.25 1xrz n GLU 29 Cb 0.42 -1.59 0.06 0.00 0.00 0.00 0.00 31.44 30.34 1xrz n GLU 29 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76