#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 -0.65 -4.34 -0.18 -1.04 -1.26 -5.00 114.28 101.82 1xrz n THR 2 Ca 0.00 0.78 -0.19 0.00 -2.04 0.00 0.00 64.05 62.61 1xrz n THR 2 Cb 0.00 -1.24 -0.15 0.00 -1.82 0.00 0.00 70.33 67.12 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 -3.94 0.78 0.08 -1.42 1.51 0.13 -4.95 117.35 109.55 1xrz s TYR 3 Ca 0.00 -0.16 0.09 0.00 -1.01 0.00 0.00 57.07 55.99 1xrz s TYR 3 Cb 0.00 -0.52 -0.03 0.00 -0.11 0.00 0.00 41.96 41.30 1xrz s TYR 3 CO 0.00 -0.03 -0.24 -0.65 -1.11 0.00 0.00 175.55 173.52 1xrz s GLN 4 N -0.09 1.44 1.21 -0.62 -1.52 -1.26 -0.91 119.66 117.91 1xrz s GLN 4 Ca 0.02 -1.14 -0.15 0.00 -1.95 0.00 0.00 55.36 52.13 1xrz s GLN 4 Cb -0.05 -1.71 0.30 0.00 -0.22 0.00 0.00 33.01 31.34 1xrz s GLN 4 CO -0.00 0.42 1.01 0.00 -0.25 0.00 0.00 175.29 176.47 1xrz n GLN 6 N -5.02 0.60 -0.08 0.00 -0.06 -1.26 -4.64 117.38 106.91 1xrz n GLN 6 Ca 0.05 -0.17 -0.15 0.00 -2.00 0.00 0.00 57.00 54.73 1xrz n GLN 6 Cb 0.56 -1.45 -0.07 0.00 -4.06 0.00 0.00 30.24 25.22 1xrz n GLN 6 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1xrz n TYR 7 N -2.18 0.00 -2.52 3.69 4.01 -1.26 -5.06 117.16 113.84 1xrz n TYR 7 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1xrz n TYR 7 Cb 0.52 -0.63 0.00 0.00 -0.31 0.00 0.00 39.34 38.92 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 1.81 2.74 -0.27 0.00 2.56 -1.26 -4.20 118.70 120.09 1xrz s GLU 9 Ca 0.00 -0.76 -0.06 0.00 0.00 0.00 0.00 54.97 54.15 1xrz s GLU 9 Cb 0.00 -2.22 0.13 0.00 2.00 0.00 0.00 34.13 34.04 1xrz s GLU 9 CO 0.00 -0.00 0.55 1.03 -0.56 0.00 0.00 175.26 176.28 1xrz s ARG 11 N 0.80 0.48 0.35 4.30 0.52 -1.26 -4.82 118.95 119.32 1xrz s ARG 11 Ca -0.09 1.15 0.04 0.00 -0.52 0.00 0.00 55.73 56.31 1xrz s ARG 11 Cb -0.16 0.51 -0.05 0.00 0.52 0.00 0.00 34.95 35.77 1xrz s ARG 11 CO -0.00 -0.35 0.07 -1.12 0.02 0.00 0.00 175.30 173.92 1xrz s SER 12 N 2.78 2.54 0.00 0.23 0.01 -0.09 -5.01 113.70 114.15 1xrz s SER 12 Ca 0.03 -1.46 0.00 0.00 1.31 0.00 0.00 55.95 55.84 1xrz s SER 12 Cb -0.13 0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.17 1xrz s SER 12 CO -0.17 -0.69 0.19 0.00 0.41 0.00 0.00 173.24 172.97 1xrz n ALA 13 N -0.76 0.98 -2.60 1.44 0.00 -1.26 -0.69 120.51 117.61 1xrz n ALA 13 Ca -0.04 -0.19 -0.27 0.00 0.00 0.00 0.00 53.44 52.94 1xrz n ALA 13 Cb 0.66 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.01 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 -0.02 3.61 -0.26 0.00 2.15 -1.26 -4.80 116.67 116.09 1xrz s ASP 14 Ca 0.00 -1.42 0.09 0.00 0.43 0.00 0.00 52.55 51.65 1xrz s ASP 14 Cb 0.00 -0.20 0.45 0.00 -0.30 0.00 0.00 42.92 42.87 1xrz s ASP 14 CO 0.00 -0.54 1.20 -0.24 -0.17 0.00 0.00 175.17 175.41 1xrz n SER 15 N -0.97 3.82 0.02 -0.34 2.88 -1.26 -4.26 113.62 113.52 1xrz n SER 15 Ca -0.06 -3.71 0.00 0.00 -1.33 0.00 0.00 58.87 53.76 1xrz n SER 15 Cb 0.67 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.73 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 -0.81 0.09 -0.26 -3.46 7.64 -1.26 -4.67 113.62 110.90 1xrz n SER 16 Ca 0.35 0.08 0.05 0.00 1.01 0.00 0.00 58.87 60.36 1xrz n SER 16 Cb 0.89 0.02 0.18 0.00 -1.01 0.00 0.00 64.21 64.29 1xrz n SER 16 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1xrz h ASN 17 N 0.00 0.32 -0.64 6.43 -1.24 -2.00 -0.28 115.58 118.17 1xrz h ASN 17 Ca 0.00 0.10 -0.09 0.00 0.71 0.00 0.00 56.30 57.02 1xrz h ASN 17 Cb 0.34 0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.43 1xrz h ASN 17 CO 0.00 0.13 0.05 0.25 -1.29 0.00 0.00 177.43 176.57 1xrz h LEU 18 N 0.47 1.07 0.24 0.34 5.85 -1.86 -1.39 115.31 120.03 1xrz h LEU 18 Ca 0.41 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1xrz h LEU 18 Cb 0.59 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.34 1xrz h LEU 18 CO -0.38 1.09 -0.11 0.11 -0.34 0.00 0.00 178.44 178.81 1xrz h LYS 19 N 1.02 -0.31 -0.90 1.25 1.57 -1.41 -1.09 116.57 116.70 1xrz h LYS 19 Ca 0.19 0.02 0.19 0.00 -1.87 0.00 0.00 60.65 59.18 1xrz h LYS 19 Cb 0.51 0.07 -0.11 0.00 0.08 0.00 0.00 32.23 32.79 1xrz h LYS 19 CO 0.02 -0.03 0.46 1.79 -0.57 0.00 0.00 179.45 181.13 1xrz h THR 20 N -0.57 0.62 0.82 -0.16 1.35 -1.07 0.23 112.91 114.13 1xrz h THR 20 Ca -0.03 -0.19 -0.04 0.00 -0.55 0.00 0.00 66.41 65.59 1xrz h THR 20 Cb 0.42 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 66.85 1xrz h THR 20 CO 0.05 0.10 -0.43 -0.74 -0.25 0.00 0.00 175.52 174.26 1xrz h HIS 21 N 0.57 -1.11 -0.28 4.73 -0.00 -0.98 -2.82 115.15 115.25 1xrz h HIS 21 Ca 0.53 -0.02 0.06 0.00 -0.00 0.00 0.00 60.37 60.94 1xrz h HIS 21 Cb 0.88 0.38 -0.08 0.00 -0.00 0.00 0.00 27.41 28.59 1xrz h HIS 21 CO -0.09 -0.67 -0.40 0.82 -0.00 0.00 0.00 177.93 177.60 1xrz h ILE 22 N -1.14 0.16 -1.39 6.26 2.04 -0.23 -0.53 117.51 122.68 1xrz h ILE 22 Ca -0.11 0.00 0.43 0.00 1.00 0.00 0.00 64.86 66.18 1xrz h ILE 22 Cb 0.89 0.16 -0.11 0.00 -0.74 0.00 0.00 36.82 37.02 1xrz h ILE 22 CO 0.16 0.00 0.93 0.50 0.00 0.00 0.00 178.15 179.74 1xrz h LYS 23 N -0.38 0.09 0.00 2.37 3.64 -0.97 0.97 116.57 122.29 1xrz h LYS 23 Ca 0.12 -0.01 -0.35 0.00 -1.27 0.00 0.00 60.65 59.15 1xrz h LYS 23 Cb 0.59 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.33 1xrz h LYS 23 CO -0.48 0.06 -2.31 2.41 -2.27 0.00 0.00 179.45 176.86 1xrz n THR 24 N -4.51 1.31 0.58 1.00 -1.04 -0.72 -3.45 114.28 107.47 1xrz n THR 24 Ca 0.36 -0.61 0.11 0.00 -2.04 0.00 0.00 64.05 61.87 1xrz n THR 24 Cb 1.45 -1.05 -0.08 0.00 -1.82 0.00 0.00 70.33 68.84 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 -3.01 0.27 0.00 -2.82 4.76 -0.29 -4.58 118.16 112.50 1xrz n LYS 25 Ca -0.37 -0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.01 1xrz n LYS 25 Cb 1.00 -1.54 0.00 0.00 -1.84 0.00 0.00 35.03 32.65 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 -1.86 0.00 -3.06 2.13 8.25 0.18 -4.90 115.22 115.96 1xrz n HIS 26 Ca 0.01 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.13 1xrz n HIS 26 Cb 0.43 0.10 -0.03 0.00 1.12 0.00 0.00 29.99 31.61 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 -2.80 5.32 -0.01 0.41 7.64 -0.32 -4.58 113.62 119.29 1xrz n SER 27 Ca 0.00 -3.54 -0.01 0.00 1.01 0.00 0.00 58.87 56.33 1xrz n SER 27 Cb 0.38 -0.90 -0.00 0.00 -1.01 0.00 0.00 64.21 62.68 1xrz n SER 27 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1xrz n LYS 28 N 0.57 0.03 -4.35 1.43 0.00 -1.22 -4.48 118.16 110.13 1xrz n LYS 28 Ca 0.32 0.01 -0.18 0.00 -0.00 0.00 0.00 58.31 58.46 1xrz n LYS 28 Cb 0.36 -0.61 -0.10 0.00 -0.00 0.00 0.00 35.03 34.68 1xrz n LYS 28 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1xrz s GLU 29 N -2.02 1.36 0.00 -1.58 0.41 -1.26 -5.09 118.70 110.51 1xrz s GLU 29 Ca -0.02 -1.65 0.00 0.00 -0.41 0.00 0.00 54.97 52.89 1xrz s GLU 29 Cb 0.01 -0.93 0.00 0.00 -1.78 0.00 0.00 34.13 31.42 1xrz s GLU 29 CO 0.02 0.05 0.27 1.63 -0.49 0.00 0.00 175.26 176.74