#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4aiy h VAL 2 N 0.00 1.36 -0.79 -2.13 -1.51 -2.05 -3.29 116.25 107.84 4aiy h VAL 2 Ca 0.00 -2.71 0.14 0.00 -1.23 0.00 0.00 66.70 62.90 4aiy h VAL 2 Cb 0.00 2.54 -0.09 0.00 -2.13 0.00 0.00 31.29 31.60 4aiy h VAL 2 CO 0.00 0.73 0.35 -1.13 -1.23 0.00 0.00 177.57 176.29 4aiy h ASN 3 N 0.00 0.38 0.69 4.19 -0.73 -2.04 -1.32 115.58 116.75 4aiy h ASN 3 Ca -0.01 0.10 -0.03 0.00 1.87 0.00 0.00 56.30 58.24 4aiy h ASN 3 Cb 1.48 0.06 -0.01 0.00 0.27 0.00 0.00 38.32 40.12 4aiy h ASN 3 CO 0.10 0.15 -0.46 -0.61 -0.37 0.00 0.00 177.43 176.24 4aiy h GLN 4 N 0.51 -1.05 0.00 6.67 4.15 -1.98 0.94 115.11 124.34 4aiy h GLN 4 Ca 0.43 0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.93 4aiy h GLN 4 Cb 0.64 0.24 0.00 0.00 0.21 0.00 0.00 27.48 28.57 4aiy h GLN 4 CO -0.39 -0.70 0.00 1.58 -1.93 0.00 0.00 178.83 177.39 4aiy n HIS 5 N -5.58 0.46 -0.10 3.99 -0.00 -0.98 -1.23 115.22 111.77 4aiy n HIS 5 Ca -0.14 0.22 -0.19 0.00 0.46 0.00 0.00 57.72 58.08 4aiy n HIS 5 Cb 0.47 -0.86 -0.06 0.00 -0.12 0.00 0.00 29.99 29.42 4aiy n HIS 5 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 4aiy n LEU 6 N -1.96 1.76 -0.00 0.27 4.77 -0.54 -4.40 117.00 116.91 4aiy n LEU 6 Ca 0.00 0.30 0.01 0.00 -0.03 0.00 0.00 56.01 56.29 4aiy n LEU 6 Cb 0.08 -0.70 0.32 0.00 -2.33 0.00 0.00 43.42 40.78 4aiy n LEU 6 CO 0.09 0.16 0.97 0.00 -1.33 0.00 0.00 177.39 177.28 4aiy h GLY 8 N 0.79 0.00 2.00 0.00 0.00 -1.30 0.30 103.07 104.86 4aiy h GLY 8 Ca 0.12 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.38 4aiy h GLY 8 CO 0.00 0.00 -0.31 0.23 0.00 0.00 0.00 176.54 176.46 4aiy h SER 9 N 0.00 0.00 0.73 0.19 0.87 -1.47 -2.74 113.55 111.12 4aiy h SER 9 Ca 0.17 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.54 4aiy h SER 9 Cb 0.87 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.80 4aiy h SER 9 CO -0.00 0.31 -1.39 0.45 -0.53 0.00 0.00 176.83 175.66 4aiy h HIS 10 N 0.00 0.00 -0.73 2.24 3.86 -0.55 -3.31 115.15 116.66 4aiy h HIS 10 Ca -0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 4aiy h HIS 10 Cb 0.56 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.00 4aiy h HIS 10 CO 0.00 0.68 0.43 -0.07 0.86 0.00 0.00 177.93 179.83 4aiy h LEU 11 N 0.00 0.88 -1.10 2.43 3.38 -1.10 -1.90 115.31 117.91 4aiy h LEU 11 Ca -0.17 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 4aiy h LEU 11 Cb 1.67 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 4aiy h LEU 11 CO 0.06 0.69 0.05 -0.37 0.09 0.00 0.00 178.44 178.95 4aiy h VAL 12 N 0.99 1.22 -0.72 1.22 -1.51 -1.64 0.02 116.25 115.82 4aiy h VAL 12 Ca 0.26 -0.84 0.04 0.00 -1.23 0.00 0.00 66.70 64.93 4aiy h VAL 12 Cb -0.02 0.83 -0.05 0.00 -2.13 0.00 0.00 31.29 29.92 4aiy h VAL 12 CO -0.05 0.30 0.45 -0.33 -1.23 0.00 0.00 177.57 176.71 4aiy h GLU 13 N 0.66 0.84 -0.06 5.19 5.08 -1.44 -1.57 114.58 123.27 4aiy h GLU 13 Ca 0.14 -0.05 -0.22 0.00 -1.00 0.00 0.00 59.36 58.23 4aiy h GLU 13 Cb 0.34 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.40 4aiy h GLU 13 CO 0.01 0.55 -0.85 0.00 -1.00 0.00 0.00 179.01 177.72 4aiy h ALA 14 N 1.32 0.38 0.27 3.43 0.00 -1.17 -2.78 119.26 120.71 4aiy h ALA 14 Ca 0.30 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 4aiy h ALA 14 Cb 0.05 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 4aiy h ALA 14 CO -0.12 0.74 -0.21 -0.07 0.00 0.00 0.00 179.25 179.60 4aiy h LEU 15 N 0.35 -0.54 -0.17 0.00 3.38 -0.27 0.24 115.31 118.30 4aiy h LEU 15 Ca -0.07 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.94 4aiy h LEU 15 Cb 1.47 0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.39 4aiy h LEU 15 CO 0.16 -0.30 0.00 0.00 0.09 0.00 0.00 178.44 178.39 4aiy n TYR 16 N -3.57 0.13 0.03 1.13 4.11 -0.66 -0.42 117.16 117.92 4aiy n TYR 16 Ca -0.06 0.06 -0.20 0.00 -0.00 0.00 0.00 57.90 57.70 4aiy n TYR 16 Cb 0.20 -0.59 -0.14 0.00 -0.00 0.00 0.00 39.34 38.80 4aiy n TYR 16 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.86 178.11 4aiy h LEU 17 N 0.00 0.42 -0.36 -3.48 5.85 -1.07 -0.69 115.31 115.97 4aiy h LEU 17 Ca 0.00 -0.93 -0.11 0.00 0.84 0.00 0.00 57.88 57.68 4aiy h LEU 17 Cb 0.16 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 4aiy h LEU 17 CO 0.00 1.42 -0.20 0.58 -0.34 0.00 0.00 178.44 179.90 4aiy h VAL 18 N -0.40 1.29 0.00 1.05 2.07 0.29 -2.54 116.25 118.00 4aiy h VAL 18 Ca -0.17 -1.33 -0.05 0.00 0.82 0.00 0.00 66.70 65.97 4aiy h VAL 18 Cb 1.63 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 4aiy h VAL 18 CO 0.12 0.44 -0.24 0.00 0.02 0.00 0.00 177.57 177.91 4aiy n GLY 20 N -0.24 1.18 0.07 0.00 0.00 -0.27 -1.97 105.19 103.96 4aiy n GLY 20 Ca -0.01 0.28 0.02 0.00 0.00 0.00 0.00 46.02 46.30 4aiy n GLY 20 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 4aiy n GLU 21 N 0.00 0.65 -0.73 1.61 1.02 -1.26 -4.77 120.64 117.15 4aiy n GLU 21 Ca 0.00 -0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.82 4aiy n GLU 21 Cb 0.00 -1.62 0.16 0.00 -0.02 0.00 0.00 31.44 29.96 4aiy n GLU 21 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 4aiy s ARG 22 N -3.04 1.06 0.52 3.49 0.52 -0.83 -5.02 118.95 115.65 4aiy s ARG 22 Ca -0.07 1.59 0.07 0.00 -0.52 0.00 0.00 55.73 56.80 4aiy s ARG 22 Cb 0.10 -1.73 0.09 0.00 0.52 0.00 0.00 34.95 33.93 4aiy s ARG 22 CO 0.85 -2.61 0.72 0.41 0.02 0.00 0.00 175.30 174.69 4aiy n GLY 23 N 0.28 1.75 3.44 -3.53 0.00 -1.26 -4.82 105.19 101.04 4aiy n GLY 23 Ca 0.12 -2.18 -0.15 0.00 0.00 0.00 0.00 46.02 43.81 4aiy n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 4aiy s PHE 24 N -2.20 -0.54 -0.28 1.61 -0.71 -1.26 -5.01 117.98 109.60 4aiy s PHE 24 Ca 0.53 1.11 -0.13 0.00 -1.04 0.00 0.00 56.93 57.40 4aiy s PHE 24 Cb -0.04 0.26 -0.04 0.00 -1.21 0.00 0.00 43.02 41.99 4aiy s PHE 24 CO 0.34 -0.43 0.31 -0.59 -1.34 0.00 0.00 175.22 173.51 4aiy s PHE 25 N -0.58 3.23 -0.31 3.49 -0.12 -1.26 -5.04 117.98 117.39 4aiy s PHE 25 Ca -0.07 0.28 -0.07 0.00 -0.05 0.00 0.00 56.93 57.02 4aiy s PHE 25 Cb -0.03 -2.51 0.02 0.00 -0.63 0.00 0.00 43.02 39.87 4aiy s PHE 25 CO 0.05 -0.22 0.10 -0.47 -0.05 0.00 0.00 175.22 174.63 4aiy s TYR 26 N 1.95 3.17 -0.32 3.49 5.04 -1.26 -5.05 117.35 124.38 4aiy s TYR 26 Ca 0.12 -1.05 0.02 0.00 -2.44 0.00 0.00 57.07 53.72 4aiy s TYR 26 Cb -0.16 -2.27 0.10 0.00 0.35 0.00 0.00 41.96 39.97 4aiy s TYR 26 CO 0.10 -0.61 0.06 0.99 -1.34 0.00 0.00 175.55 174.75 4aiy s THR 27 N 1.49 1.72 -0.48 4.34 2.01 -1.26 -4.96 115.64 118.50 4aiy s THR 27 Ca 0.02 -1.91 0.26 0.00 0.31 0.00 0.00 61.69 60.37 4aiy s THR 27 Cb -0.18 -2.25 0.31 0.00 0.01 0.00 0.00 72.50 70.40 4aiy s THR 27 CO 0.03 -0.58 1.74 1.55 -0.69 0.00 0.00 174.62 176.67 4aiy h PRO 28 N 7.81 0.00 -4.98 4.92 0.13 -2.01 -3.39 132.00 134.48 4aiy h PRO 28 Ca -0.09 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.55 4aiy h PRO 28 Cb 1.02 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.16 4aiy h PRO 28 CO 0.49 0.00 1.66 1.17 -0.23 0.00 0.00 178.00 181.10 4aiy n LYS 29 N -2.66 1.49 0.00 0.86 0.00 -1.26 -5.13 118.16 111.47 4aiy n LYS 29 Ca 0.04 -2.12 0.09 0.00 0.00 0.00 0.00 58.31 56.32 4aiy n LYS 29 Cb 0.42 -3.30 0.53 0.00 0.00 0.00 0.00 35.03 32.68 4aiy n LYS 29 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81