#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qiy h VAL 2 N 0.00 0.00 -0.99 -4.37 2.07 -2.05 1.09 116.25 112.00 1qiy h VAL 2 Ca 0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 1qiy h VAL 2 Cb 0.00 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.69 1qiy h VAL 2 CO 0.00 0.00 0.63 0.78 0.02 0.00 0.00 177.57 179.00 1qiy h ASN 3 N -0.01 0.91 0.69 0.57 2.35 -2.05 0.21 115.58 118.25 1qiy h ASN 3 Ca 0.01 0.04 -0.13 0.00 -0.55 0.00 0.00 56.30 55.67 1qiy h ASN 3 Cb 0.04 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1qiy h ASN 3 CO -0.07 0.50 -0.62 1.56 -1.65 0.00 0.00 177.43 177.15 1qiy h GLN 4 N 0.99 0.00 -0.29 0.81 4.20 -1.79 -2.33 115.11 116.70 1qiy h GLN 4 Ca 0.48 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 59.02 1qiy h GLN 4 Cb 0.47 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.25 1qiy h GLN 4 CO -0.25 0.62 -0.52 -0.92 -0.67 0.00 0.00 178.83 177.09 1qiy h TYR 5 N 0.00 1.05 -0.55 2.96 3.20 0.38 -1.24 116.97 122.77 1qiy h TYR 5 Ca -0.01 -0.36 -0.10 0.00 3.14 0.00 0.00 58.73 61.40 1qiy h TYR 5 Cb 1.13 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.18 1qiy h TYR 5 CO 0.00 1.18 -0.05 -0.07 -1.64 0.00 0.00 178.16 177.58 1qiy h LEU 6 N 0.65 0.99 -0.97 2.82 4.07 -0.66 -2.98 115.31 119.23 1qiy h LEU 6 Ca 0.02 -0.33 -0.04 0.00 0.08 0.00 0.00 57.88 57.62 1qiy h LEU 6 Cb 1.12 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 42.55 1qiy h LEU 6 CO 0.11 1.08 0.30 0.00 -1.08 0.00 0.00 178.44 178.85 1qiy h GLY 8 N 1.08 1.05 0.98 0.00 0.00 -1.07 0.14 103.07 105.25 1qiy h GLY 8 Ca 0.24 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 1qiy h GLY 8 CO -0.02 0.24 0.25 0.23 0.00 0.00 0.00 176.54 177.24 1qiy h SER 9 N 0.82 0.57 -0.21 0.19 0.87 -1.43 -2.21 113.55 112.15 1qiy h SER 9 Ca 0.33 -0.09 -0.17 0.00 -1.23 0.00 0.00 61.79 60.63 1qiy h SER 9 Cb 0.26 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1qiy h SER 9 CO -0.12 0.50 -0.54 0.45 -0.53 0.00 0.00 176.83 176.60 1qiy h HIS 10 N 0.60 0.94 -0.83 2.24 3.86 -1.12 -3.21 115.15 117.62 1qiy h HIS 10 Ca 0.16 -0.36 0.13 0.00 -1.16 0.00 0.00 60.37 59.14 1qiy h HIS 10 Cb 0.06 -0.16 -0.09 0.00 1.06 0.00 0.00 27.41 28.27 1qiy h HIS 10 CO -0.02 1.16 0.43 -0.07 0.86 0.00 0.00 177.93 180.30 1qiy h LEU 11 N 0.44 0.55 -0.85 2.43 3.38 -0.57 -1.47 115.31 119.23 1qiy h LEU 11 Ca -0.01 0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 1qiy h LEU 11 Cb 1.15 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1qiy h LEU 11 CO 0.12 0.26 -0.54 0.58 0.09 0.00 0.00 178.44 178.95 1qiy h VAL 12 N 0.66 1.38 -0.26 1.22 2.07 -1.46 -1.97 116.25 117.89 1qiy h VAL 12 Ca 0.43 -1.84 -0.18 0.00 0.82 0.00 0.00 66.70 65.93 1qiy h VAL 12 Cb 0.55 1.95 -0.00 0.00 -1.52 0.00 0.00 31.29 32.27 1qiy h VAL 12 CO -0.32 0.54 -0.55 -0.33 0.02 0.00 0.00 177.57 176.92 1qiy h GLU 13 N 0.08 0.80 -0.10 1.57 5.08 -1.39 -2.60 114.58 118.02 1qiy h GLU 13 Ca -0.00 -0.51 -0.07 0.00 -1.00 0.00 0.00 59.36 57.78 1qiy h GLU 13 Cb 0.98 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1qiy h GLU 13 CO 0.08 1.14 -0.28 0.00 -1.00 0.00 0.00 179.01 178.95 1qiy h ALA 14 N 0.76 1.36 -0.18 3.43 0.00 -1.00 -2.78 119.26 120.85 1qiy h ALA 14 Ca 0.01 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 1qiy h ALA 14 Cb 1.15 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1qiy h ALA 14 CO 0.12 0.45 -0.27 -0.07 0.00 0.00 0.00 179.25 179.48 1qiy h LEU 15 N 0.15 0.55 -0.23 0.00 3.38 -1.26 -0.55 115.31 117.35 1qiy h LEU 15 Ca 0.02 -0.52 0.05 0.00 0.09 0.00 0.00 57.88 57.52 1qiy h LEU 15 Cb 0.58 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 1qiy h LEU 15 CO 0.04 0.96 -0.09 0.22 0.09 0.00 0.00 178.44 179.66 1qiy h TYR 16 N 0.15 -0.21 0.58 1.13 3.20 -1.42 0.19 116.97 120.58 1qiy h TYR 16 Ca 0.02 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 1qiy h TYR 16 Cb 0.84 0.13 0.01 0.00 1.54 0.00 0.00 36.73 39.24 1qiy h TYR 16 CO 0.09 -0.14 -0.28 1.25 -1.64 0.00 0.00 178.16 177.44 1qiy h LEU 17 N -0.05 -0.65 0.43 2.82 5.85 -1.41 -2.29 115.31 120.00 1qiy h LEU 17 Ca 0.12 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1qiy h LEU 17 Cb 0.23 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 1qiy h LEU 17 CO -0.27 -0.36 -0.24 0.58 -0.34 0.00 0.00 178.44 177.82 1qiy h VAL 18 N -0.94 0.51 0.00 1.05 2.07 -0.88 -3.21 116.25 114.85 1qiy h VAL 18 Ca -0.08 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1qiy h VAL 18 Cb 0.65 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1qiy h VAL 18 CO 0.13 0.00 -0.06 0.00 0.02 0.00 0.00 177.57 177.66 1qiy n GLY 20 N 0.02 2.71 0.18 0.00 0.00 -0.86 -2.04 105.19 105.20 1qiy n GLY 20 Ca 0.00 -0.22 0.14 0.00 0.00 0.00 0.00 46.02 45.95 1qiy n GLY 20 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1qiy h GLU 21 N 0.00 0.00 -0.63 1.61 5.08 -1.94 -2.91 114.58 115.78 1qiy h GLU 21 Ca 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 1qiy h GLU 21 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1qiy h GLU 21 CO 0.00 0.00 0.09 0.00 -1.00 0.00 0.00 179.01 178.10 1qiy h ARG 22 N 0.00 1.04 0.00 2.33 3.08 -1.83 -3.49 114.38 115.51 1qiy h ARG 22 Ca 0.00 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.78 1qiy h ARG 22 Cb 0.45 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1qiy h ARG 22 CO 0.00 0.96 0.00 0.41 -1.07 0.00 0.00 179.97 180.27 1qiy n GLY 23 N -0.61 -2.58 3.78 0.04 0.00 -1.10 -5.07 105.19 99.65 1qiy n GLY 23 Ca 0.04 -1.78 -0.04 0.00 0.00 0.00 0.00 46.02 44.24 1qiy n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1qiy s PHE 24 N -0.48 -0.12 -0.06 1.61 -0.71 -1.26 -4.86 117.98 112.11 1qiy s PHE 24 Ca 0.00 -0.23 0.05 0.00 -1.04 0.00 0.00 56.93 55.71 1qiy s PHE 24 Cb 0.00 0.66 -0.01 0.00 -1.21 0.00 0.00 43.02 42.47 1qiy s PHE 24 CO 0.00 -0.92 -0.22 -0.59 -1.34 0.00 0.00 175.22 172.15 1qiy s PHE 25 N -3.29 2.16 -0.23 3.49 -0.71 -1.26 -5.11 117.98 113.03 1qiy s PHE 25 Ca 0.13 -0.66 0.02 0.00 -1.04 0.00 0.00 56.93 55.38 1qiy s PHE 25 Cb -0.02 -1.43 0.05 0.00 -1.21 0.00 0.00 43.02 40.40 1qiy s PHE 25 CO 0.04 -0.22 -0.13 -0.47 -1.34 0.00 0.00 175.22 173.09 1qiy s TYR 26 N -0.03 3.07 -0.40 3.49 5.04 -1.26 -5.04 117.35 122.22 1qiy s TYR 26 Ca -0.05 -2.09 0.01 0.00 -2.44 0.00 0.00 57.07 52.50 1qiy s TYR 26 Cb -0.13 -1.90 0.13 0.00 0.35 0.00 0.00 41.96 40.40 1qiy s TYR 26 CO 0.04 -0.85 0.21 0.95 -1.34 0.00 0.00 175.55 174.55 1qiy s THR 27 N 1.18 1.13 0.62 4.34 -4.23 -1.26 -4.99 115.64 112.43 1qiy s THR 27 Ca -0.05 -2.22 0.29 0.00 -1.18 0.00 0.00 61.69 58.54 1qiy s THR 27 Cb -0.18 -1.80 0.34 0.00 1.34 0.00 0.00 72.50 72.20 1qiy s THR 27 CO -0.07 -0.87 1.90 1.55 -0.54 0.00 0.00 174.62 176.59 1qiy h PRO 28 N 7.03 0.00 -0.06 3.99 0.13 -2.04 -3.38 132.00 137.67 1qiy h PRO 28 Ca -0.02 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.19 1qiy h PRO 28 Cb 0.95 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.92 1qiy h PRO 28 CO 0.45 0.00 -0.06 0.21 -0.23 0.00 0.00 178.00 178.37 1qiy s LYS 29 N -4.39 0.06 0.00 0.86 2.20 -1.26 -5.25 119.74 111.96 1qiy s LYS 29 Ca -0.04 -0.04 0.00 0.00 -0.36 0.00 0.00 55.97 55.53 1qiy s LYS 29 Cb 0.12 0.00 0.00 0.00 -1.51 0.00 0.00 37.83 36.44 1qiy s LYS 29 CO 0.42 -0.07 0.26 2.41 -0.36 0.00 0.00 175.35 178.01