#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 2.58 0.21 3.15 -4.23 -1.26 -4.71 115.64 111.39 1xrz s THR 2 Ca 0.00 -1.36 0.11 0.00 -1.18 0.00 0.00 61.69 59.26 1xrz s THR 2 Cb 0.00 -2.95 -0.05 0.00 1.34 0.00 0.00 72.50 70.85 1xrz s THR 2 CO 0.00 0.00 -0.22 -0.31 -0.54 0.00 0.00 174.62 173.55 1xrz s TYR 3 N -2.50 2.23 -0.04 3.99 1.51 -0.53 -4.97 117.35 117.05 1xrz s TYR 3 Ca 0.47 -0.37 0.07 0.00 -1.01 0.00 0.00 57.07 56.23 1xrz s TYR 3 Cb -0.03 -1.06 -0.01 0.00 -0.11 0.00 0.00 41.96 40.74 1xrz s TYR 3 CO 0.27 0.54 -0.24 -0.65 -1.11 0.00 0.00 175.55 174.36 1xrz s GLN 4 N -2.93 2.21 0.96 -0.62 -1.52 -1.26 -1.81 119.66 114.69 1xrz s GLN 4 Ca 0.23 -0.87 -0.12 0.00 -1.95 0.00 0.00 55.36 52.65 1xrz s GLN 4 Cb -0.07 -2.00 0.10 0.00 -0.22 0.00 0.00 33.01 30.83 1xrz s GLN 4 CO 0.11 0.45 0.74 0.00 -0.25 0.00 0.00 175.29 176.33 1xrz n GLN 6 N -3.02 1.10 -0.05 0.00 10.64 -1.26 -4.52 117.38 120.27 1xrz n GLN 6 Ca 0.08 -0.64 -0.09 0.00 -1.83 0.00 0.00 57.00 54.52 1xrz n GLN 6 Cb 0.53 -1.42 -0.04 0.00 -0.86 0.00 0.00 30.24 28.45 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 -0.51 0.00 -3.18 2.61 4.01 -1.26 -5.08 117.16 113.75 1xrz n TYR 7 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 1xrz n TYR 7 Cb 0.39 -0.38 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 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 0.19 2.13 -0.18 0.00 2.12 -1.26 -4.31 118.70 117.38 1xrz s GLU 9 Ca 0.00 -1.82 -0.31 0.00 0.36 0.00 0.00 54.97 53.21 1xrz s GLU 9 Cb 0.00 -3.68 0.14 0.00 0.26 0.00 0.00 34.13 30.86 1xrz s GLU 9 CO 0.00 -1.11 1.12 -0.98 -0.54 0.00 0.00 175.26 173.75 1xrz s ARG 11 N 1.18 0.43 0.37 4.30 1.70 -1.26 -4.93 118.95 120.74 1xrz s ARG 11 Ca 0.08 0.03 0.04 0.00 -0.47 0.00 0.00 55.73 55.40 1xrz s ARG 11 Cb -0.24 0.20 -0.03 0.00 -0.57 0.00 0.00 34.95 34.31 1xrz s ARG 11 CO -0.03 -0.15 0.14 -1.12 -1.08 0.00 0.00 175.30 173.06 1xrz s SER 12 N -1.39 2.37 -0.04 -2.89 0.01 -0.75 -4.96 113.70 106.04 1xrz s SER 12 Ca 0.04 -1.63 0.19 0.00 1.31 0.00 0.00 55.95 55.86 1xrz s SER 12 Cb -0.01 0.43 -0.30 0.00 0.21 0.00 0.00 66.02 66.35 1xrz s SER 12 CO -0.03 -0.90 0.40 0.00 0.41 0.00 0.00 173.24 173.12 1xrz n ALA 13 N -0.79 2.62 -2.66 1.44 0.00 -1.26 -1.45 120.51 118.41 1xrz n ALA 13 Ca -0.03 -0.53 -0.30 0.00 0.00 0.00 0.00 53.44 52.58 1xrz n ALA 13 Cb 0.65 -0.63 -0.08 0.00 0.00 0.00 0.00 19.45 19.39 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 -4.34 3.61 -0.24 0.00 -1.08 -1.26 -4.68 116.67 108.68 1xrz s ASP 14 Ca -0.07 -1.66 -0.18 0.00 -0.52 0.00 0.00 52.55 50.11 1xrz s ASP 14 Cb 0.12 0.51 -0.16 0.00 -1.46 0.00 0.00 42.92 41.93 1xrz s ASP 14 CO 0.81 -0.88 -0.01 -0.24 0.52 0.00 0.00 175.17 175.36 1xrz n SER 15 N -1.29 1.90 -0.08 -0.34 2.88 -1.26 -3.95 113.62 111.48 1xrz n SER 15 Ca -0.14 0.39 -0.07 0.00 -1.33 0.00 0.00 58.87 57.72 1xrz n SER 15 Cb 0.66 -0.91 -0.00 0.00 -0.75 0.00 0.00 64.21 63.21 1xrz n SER 15 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1xrz h SER 16 N -0.99 -0.61 -0.15 -3.46 0.87 -1.99 0.16 113.55 107.38 1xrz h SER 16 Ca -0.49 0.13 0.04 0.00 -1.23 0.00 0.00 61.79 60.25 1xrz h SER 16 Cb 1.43 0.32 -0.01 0.00 -0.44 0.00 0.00 62.40 63.71 1xrz h SER 16 CO -0.30 -0.22 0.30 0.78 -0.53 0.00 0.00 176.83 176.87 1xrz h ASN 17 N -0.14 0.00 0.05 6.23 4.21 -2.00 -0.86 115.58 123.06 1xrz h ASN 17 Ca 0.16 0.00 -0.24 0.00 1.21 0.00 0.00 56.30 57.43 1xrz h ASN 17 Cb 0.39 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.57 1xrz h ASN 17 CO -0.40 0.00 -1.27 0.25 -1.29 0.00 0.00 177.43 174.71 1xrz h LEU 18 N 0.00 0.18 -0.25 1.61 5.85 -1.13 -3.13 115.31 118.44 1xrz h LEU 18 Ca 0.07 -0.73 0.04 0.00 0.84 0.00 0.00 57.88 58.11 1xrz h LEU 18 Cb 0.68 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.61 1xrz h LEU 18 CO -0.00 1.53 -0.00 0.50 -0.34 0.00 0.00 178.44 180.13 1xrz h LYS 19 N -0.64 0.07 -0.31 1.25 1.63 -0.51 -1.69 116.57 116.38 1xrz h LYS 19 Ca -0.31 -0.00 0.07 0.00 -0.85 0.00 0.00 60.65 59.56 1xrz h LYS 19 Cb 1.51 -0.02 -0.08 0.00 -0.60 0.00 0.00 32.23 33.05 1xrz h LYS 19 CO -0.06 0.05 -0.22 1.79 -3.45 0.00 0.00 179.45 177.55 1xrz h THR 20 N 0.07 0.41 -0.65 1.00 1.35 -1.33 -0.03 112.91 113.73 1xrz h THR 20 Ca 0.12 0.00 0.11 0.00 -0.55 0.00 0.00 66.41 66.09 1xrz h THR 20 Cb 0.15 0.41 -0.12 0.00 -1.73 0.00 0.00 68.15 66.87 1xrz h THR 20 CO -0.20 0.00 -0.37 -0.74 -0.25 0.00 0.00 175.52 173.96 1xrz h HIS 21 N -0.19 -1.05 0.24 4.73 -0.00 -1.27 -0.71 115.15 116.90 1xrz h HIS 21 Ca 0.16 0.08 0.01 0.00 -0.00 0.00 0.00 60.37 60.62 1xrz h HIS 21 Cb 0.44 0.55 -0.03 0.00 -0.00 0.00 0.00 27.41 28.37 1xrz h HIS 21 CO -0.41 -0.40 -0.33 0.82 -0.00 0.00 0.00 177.93 177.62 1xrz h ILE 22 N -0.15 0.31 0.00 6.26 2.04 -0.49 0.82 117.51 126.30 1xrz h ILE 22 Ca 0.23 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.09 1xrz h ILE 22 Cb 0.56 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1xrz h ILE 22 CO -0.73 0.00 0.23 1.17 0.00 0.00 0.00 178.15 178.83 1xrz n LYS 23 N -5.43 0.05 -0.03 2.37 4.81 -0.14 -1.11 118.16 118.67 1xrz n LYS 23 Ca -0.08 0.46 -0.06 0.00 -0.87 0.00 0.00 58.31 57.76 1xrz n LYS 23 Cb 0.34 -1.91 -0.03 0.00 0.02 0.00 0.00 35.03 33.45 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 -1.75 0.38 0.83 3.15 -1.04 -0.42 -4.67 114.28 110.76 1xrz n THR 24 Ca -0.01 -0.12 0.11 0.00 -2.04 0.00 0.00 64.05 61.99 1xrz n THR 24 Cb 0.25 -1.13 -0.06 0.00 -1.82 0.00 0.00 70.33 67.57 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 -2.98 0.11 -0.05 -2.82 5.02 0.21 -4.65 118.16 113.01 1xrz n LYS 25 Ca -0.12 -0.02 -0.07 0.00 -2.02 0.00 0.00 58.31 56.07 1xrz n LYS 25 Cb 0.61 -1.51 -0.04 0.00 -0.02 0.00 0.00 35.03 34.06 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 -1.65 0.00 -4.19 2.13 8.25 -0.27 -5.02 115.22 114.47 1xrz n HIS 26 Ca 0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.16 1xrz n HIS 26 Cb 0.37 -0.36 -0.08 0.00 1.12 0.00 0.00 29.99 31.04 1xrz n HIS 26 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1xrz s SER 27 N -5.04 5.40 0.52 0.41 1.04 -0.99 -5.06 113.70 109.97 1xrz s SER 27 Ca -0.13 0.07 0.04 0.00 0.48 0.00 0.00 55.95 56.41 1xrz s SER 27 Cb 0.04 -1.48 0.01 0.00 0.10 0.00 0.00 66.02 64.68 1xrz s SER 27 CO 0.21 0.28 0.22 -0.54 0.98 0.00 0.00 173.24 174.39 1xrz s LYS 28 N -1.63 2.23 -0.70 4.02 1.02 -1.26 -4.39 119.74 119.03 1xrz s LYS 28 Ca 0.21 -2.17 0.02 0.00 0.02 0.00 0.00 55.97 54.04 1xrz s LYS 28 Cb -0.12 -1.85 0.37 0.00 -0.52 0.00 0.00 37.83 35.71 1xrz s LYS 28 CO 0.12 -0.47 1.53 0.39 -0.92 0.00 0.00 175.35 175.99 1xrz n GLU 29 N -1.52 3.48 0.00 1.68 4.71 -1.26 -5.13 120.64 122.61 1xrz n GLU 29 Ca -0.09 -4.24 0.00 0.00 -0.01 0.00 0.00 57.16 52.82 1xrz n GLU 29 Cb 0.65 -2.29 0.00 0.00 -1.01 0.00 0.00 31.44 28.79 1xrz n GLU 29 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85