#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 4.09 0.08 3.15 -4.23 -1.26 -4.59 115.64 112.87 1xrz s THR 2 Ca 0.00 -1.51 0.07 0.00 -1.18 0.00 0.00 61.69 59.08 1xrz s THR 2 Cb 0.00 -3.17 -0.03 0.00 1.34 0.00 0.00 72.50 70.64 1xrz s THR 2 CO 0.00 -0.30 -0.19 -0.31 -0.54 0.00 0.00 174.62 173.29 1xrz s TYR 3 N -2.08 1.62 0.10 3.99 1.51 -0.07 -4.98 117.35 117.43 1xrz s TYR 3 Ca 0.31 -0.42 0.07 0.00 -1.01 0.00 0.00 57.07 56.02 1xrz s TYR 3 Cb -0.08 -0.91 -0.04 0.00 -0.11 0.00 0.00 41.96 40.83 1xrz s TYR 3 CO 0.23 0.15 -0.09 -0.65 -1.11 0.00 0.00 175.55 174.07 1xrz s GLN 4 N -1.74 2.19 1.06 -0.62 -1.52 -1.26 -1.50 119.66 116.27 1xrz s GLN 4 Ca 0.04 -0.99 -0.12 0.00 -1.95 0.00 0.00 55.36 52.34 1xrz s GLN 4 Cb -0.10 -2.34 0.23 0.00 -0.22 0.00 0.00 33.01 30.58 1xrz s GLN 4 CO 0.03 0.52 1.06 0.00 -0.25 0.00 0.00 175.29 176.65 1xrz n GLN 6 N -4.51 3.63 0.00 0.00 3.00 -1.26 -4.50 117.38 113.74 1xrz n GLN 6 Ca 0.05 -2.85 0.00 0.00 -0.01 0.00 0.00 57.00 54.19 1xrz n GLN 6 Cb 0.55 -1.90 0.00 0.00 0.00 0.00 0.00 30.24 28.89 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 0.28 0.00 -3.17 1.08 4.01 -1.26 -5.13 117.16 112.97 1xrz n TYR 7 Ca 0.23 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.97 1xrz n TYR 7 Cb 0.92 0.11 0.00 0.00 -0.31 0.00 0.00 39.34 40.06 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 0.50 2.87 -0.28 0.00 2.12 -1.26 -4.09 118.70 118.56 1xrz s GLU 9 Ca 0.00 -0.94 -0.15 0.00 0.36 0.00 0.00 54.97 54.24 1xrz s GLU 9 Cb 0.00 -2.84 0.08 0.00 0.26 0.00 0.00 34.13 31.64 1xrz s GLU 9 CO 0.00 -0.34 0.68 1.03 -0.54 0.00 0.00 175.26 176.09 1xrz s ARG 11 N 1.30 0.69 0.35 4.30 0.52 -1.26 -4.90 118.95 119.95 1xrz s ARG 11 Ca 0.01 1.23 0.04 0.00 -0.52 0.00 0.00 55.73 56.48 1xrz s ARG 11 Cb -0.16 0.18 -0.03 0.00 0.52 0.00 0.00 34.95 35.46 1xrz s ARG 11 CO -0.07 -0.15 0.14 -1.12 0.02 0.00 0.00 175.30 174.12 1xrz s SER 12 N 1.71 2.19 -0.00 0.23 0.01 -0.56 -4.99 113.70 112.28 1xrz s SER 12 Ca -0.10 -1.60 0.01 0.00 1.31 0.00 0.00 55.95 55.57 1xrz s SER 12 Cb -0.06 0.40 -0.02 0.00 0.21 0.00 0.00 66.02 66.55 1xrz s SER 12 CO -0.20 -0.89 0.03 0.00 0.41 0.00 0.00 173.24 172.60 1xrz n ALA 13 N -0.74 2.07 -2.45 1.44 0.00 -1.26 -0.90 120.51 118.67 1xrz n ALA 13 Ca -0.02 -0.03 -0.24 0.00 0.00 0.00 0.00 53.44 53.15 1xrz n ALA 13 Cb 0.65 -0.04 -0.08 0.00 0.00 0.00 0.00 19.45 19.97 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 -1.92 2.45 -0.56 0.00 2.15 -1.26 -4.75 116.67 112.77 1xrz s ASP 14 Ca -0.00 -1.67 0.03 0.00 0.43 0.00 0.00 52.55 51.34 1xrz s ASP 14 Cb 0.01 0.49 0.39 0.00 -0.30 0.00 0.00 42.92 43.51 1xrz s ASP 14 CO 0.05 -0.94 1.34 -0.24 -0.17 0.00 0.00 175.17 175.21 1xrz n SER 15 N -1.28 5.44 0.00 -0.34 2.88 -1.26 -4.14 113.62 114.92 1xrz n SER 15 Ca -0.03 -3.75 0.00 0.00 -1.33 0.00 0.00 58.87 53.77 1xrz n SER 15 Cb 0.65 -0.63 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 1xrz n SER 15 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1xrz n SER 16 N -0.47 0.59 0.01 -3.46 7.64 -1.26 -4.58 113.62 112.09 1xrz n SER 16 Ca 0.42 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 60.12 1xrz n SER 16 Cb 0.53 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.62 1xrz n SER 16 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1xrz h ASN 17 N 0.00 0.69 -0.74 6.43 -1.07 -2.00 -2.74 115.58 116.15 1xrz h ASN 17 Ca 0.00 -0.74 -0.00 0.00 0.07 0.00 0.00 56.30 55.63 1xrz h ASN 17 Cb 0.41 -0.21 -0.04 0.00 -2.07 0.00 0.00 38.32 36.41 1xrz h ASN 17 CO 0.00 1.33 0.46 0.25 0.07 0.00 0.00 177.43 179.54 1xrz h LEU 18 N 0.11 0.87 0.31 6.14 5.85 -1.87 0.06 115.31 126.79 1xrz h LEU 18 Ca -0.09 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1xrz h LEU 18 Cb 1.43 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1xrz h LEU 18 CO 0.15 0.66 -0.15 0.11 -0.34 0.00 0.00 178.44 178.87 1xrz h LYS 19 N 1.01 -0.40 -0.30 1.25 1.79 -1.80 -1.19 116.57 116.93 1xrz h LYS 19 Ca 0.27 0.03 0.07 0.00 -2.18 0.00 0.00 60.65 58.83 1xrz h LYS 19 Cb -0.07 0.09 -0.08 0.00 -1.58 0.00 0.00 32.23 30.59 1xrz h LYS 19 CO -0.05 -0.17 -0.36 1.15 -1.08 0.00 0.00 179.45 178.94 1xrz h THR 20 N -0.58 0.21 -0.64 -0.16 2.02 -1.12 -1.30 112.91 111.35 1xrz h THR 20 Ca -0.04 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.23 1xrz h THR 20 Cb 0.42 0.21 -0.11 0.00 -1.74 0.00 0.00 68.15 66.93 1xrz h THR 20 CO 0.07 0.00 -0.42 -0.74 0.37 0.00 0.00 175.52 174.80 1xrz h HIS 21 N -0.33 -1.24 -0.14 3.16 -0.00 -0.77 -0.17 115.15 115.66 1xrz h HIS 21 Ca 0.14 0.09 0.05 0.00 -0.00 0.00 0.00 60.37 60.64 1xrz h HIS 21 Cb 0.56 0.63 -0.05 0.00 -0.00 0.00 0.00 27.41 28.55 1xrz h HIS 21 CO -0.52 -0.41 -0.20 0.82 -0.00 0.00 0.00 177.93 177.62 1xrz h ILE 22 N -0.18 0.49 0.00 6.26 2.04 -0.14 0.42 117.51 126.40 1xrz h ILE 22 Ca 0.20 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.06 1xrz h ILE 22 Cb 0.56 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1xrz h ILE 22 CO -0.73 0.00 0.00 2.29 0.00 0.00 0.00 178.15 179.71 1xrz n LYS 23 N -5.34 0.78 -0.04 2.37 2.85 -0.37 -1.52 118.16 116.88 1xrz n LYS 23 Ca -0.03 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.16 1xrz n LYS 23 Cb 0.26 -1.03 -0.03 0.00 -0.65 0.00 0.00 35.03 33.57 1xrz n LYS 23 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1xrz n THR 24 N -0.45 0.45 0.27 0.58 -1.04 -0.14 -4.65 114.28 109.29 1xrz n THR 24 Ca 0.00 -0.14 0.06 0.00 -2.04 0.00 0.00 64.05 61.93 1xrz n THR 24 Cb 0.02 -1.19 -0.09 0.00 -1.82 0.00 0.00 70.33 67.25 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 -3.05 1.45 -0.06 -2.82 5.02 -0.04 -4.76 118.16 113.90 1xrz n LYS 25 Ca -0.15 -0.07 -0.09 0.00 -2.02 0.00 0.00 58.31 55.98 1xrz n LYS 25 Cb 0.63 -1.22 -0.06 0.00 -0.02 0.00 0.00 35.03 34.36 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 -1.67 0.00 -2.83 2.13 8.25 -0.58 -4.87 115.22 115.66 1xrz n HIS 26 Ca -0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 1xrz n HIS 26 Cb 0.28 -0.49 -0.03 0.00 1.12 0.00 0.00 29.99 30.87 1xrz n HIS 26 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1xrz s SER 27 N -5.31 6.40 0.00 0.41 0.15 -0.63 -4.98 113.70 109.75 1xrz s SER 27 Ca -0.17 -1.46 0.00 0.00 0.70 0.00 0.00 55.95 55.01 1xrz s SER 27 Cb 0.05 -2.44 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 1xrz s SER 27 CO 0.29 -1.31 0.00 2.29 1.20 0.00 0.00 173.24 175.70 1xrz n LYS 28 N 7.46 2.63 -1.96 5.44 2.85 -1.26 -4.57 118.16 128.75 1xrz n LYS 28 Ca 0.13 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 57.07 1xrz n LYS 28 Cb 0.48 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.89 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 -0.21 3.12 0.00 -1.58 2.13 -1.26 -5.19 120.64 117.65 1xrz n GLU 29 Ca 0.00 -3.88 0.00 0.00 0.66 0.00 0.00 57.16 53.94 1xrz n GLU 29 Cb 0.00 -2.27 0.00 0.00 0.27 0.00 0.00 31.44 29.44 1xrz n GLU 29 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35