#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gky n VAL 2 N 0.00 0.00 -2.10 1.97 0.31 -1.26 -5.09 118.33 112.16 3gky n VAL 2 Ca 0.00 -1.00 -0.43 0.00 -0.01 0.00 0.00 64.34 62.90 3gky n VAL 2 Cb 0.00 0.83 -0.03 0.00 -0.91 0.00 0.00 33.84 33.74 3gky n VAL 2 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3gky s ASN 3 N -2.71 6.36 0.37 4.52 3.84 -1.26 -4.85 114.94 121.22 3gky s ASN 3 Ca 0.16 1.62 0.05 0.00 0.21 0.00 0.00 52.86 54.90 3gky s ASN 3 Cb -0.03 -2.53 0.73 0.00 -0.55 0.00 0.00 41.25 38.87 3gky s ASN 3 CO 0.12 -1.27 2.00 1.56 -2.79 0.00 0.00 177.10 176.72 3gky h GLN 4 N 10.81 0.63 -0.02 0.43 4.20 -1.98 -1.19 115.11 127.99 3gky h GLN 4 Ca -0.34 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.31 3gky h GLN 4 Cb 1.15 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.80 3gky h GLN 4 CO 1.00 0.47 0.01 1.25 -0.67 0.00 0.00 178.83 180.88 3gky h HIS 5 N 0.64 0.02 -0.18 2.96 2.76 -1.99 0.79 115.15 120.14 3gky h HIS 5 Ca 0.17 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.31 3gky h HIS 5 Cb 0.02 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 3gky h HIS 5 CO 0.00 0.18 0.03 -0.07 -1.30 0.00 0.00 177.93 176.77 3gky h LEU 6 N -0.14 0.29 -0.50 0.26 3.38 -1.91 -2.88 115.31 113.81 3gky h LEU 6 Ca 0.01 -0.27 0.09 0.00 0.09 0.00 0.00 57.88 57.80 3gky h LEU 6 Cb 0.17 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.77 3gky h LEU 6 CO -0.00 0.48 0.05 0.00 0.09 0.00 0.00 178.44 179.06 3gky h GLY 8 N 0.17 1.67 0.69 0.00 0.00 -0.66 1.00 103.07 105.94 3gky h GLY 8 Ca 0.25 -0.36 0.06 0.00 0.00 0.00 0.00 47.33 47.29 3gky h GLY 8 CO -0.37 -0.01 0.43 0.23 0.00 0.00 0.00 176.54 176.82 3gky h SER 9 N 0.78 0.65 0.36 0.19 0.87 -1.02 -0.44 113.55 114.94 3gky h SER 9 Ca 0.55 0.03 -0.17 0.00 -1.23 0.00 0.00 61.79 60.97 3gky h SER 9 Cb 0.84 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.69 3gky h SER 9 CO -0.34 0.42 -0.68 0.45 -0.53 0.00 0.00 176.83 176.15 3gky h HIS 10 N 0.79 0.38 -0.39 2.24 3.86 -0.78 -2.84 115.15 118.41 3gky h HIS 10 Ca 0.33 -0.16 -0.07 0.00 -1.16 0.00 0.00 60.37 59.31 3gky h HIS 10 Cb 0.19 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 3gky h HIS 10 CO -0.06 0.88 -0.01 -0.07 0.86 0.00 0.00 177.93 179.53 3gky h LEU 11 N 0.20 0.69 -1.26 2.43 3.38 -0.34 -1.92 115.31 118.49 3gky h LEU 11 Ca -0.02 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 3gky h LEU 11 Cb 1.23 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 3gky h LEU 11 CO 0.11 0.83 -0.28 -0.37 0.09 0.00 0.00 178.44 178.82 3gky h VAL 12 N 0.53 1.24 -0.41 1.22 -1.51 -1.06 -0.48 116.25 115.77 3gky h VAL 12 Ca 0.11 -1.11 -0.11 0.00 -1.23 0.00 0.00 66.70 64.36 3gky h VAL 12 Cb 0.49 1.50 -0.02 0.00 -2.13 0.00 0.00 31.29 31.13 3gky h VAL 12 CO 0.02 0.33 -0.19 -0.08 -1.23 0.00 0.00 177.57 176.42 3gky h GLU 13 N 0.12 0.79 -0.47 5.19 4.81 -1.30 -1.00 114.58 122.72 3gky h GLU 13 Ca 0.02 -0.30 -0.11 0.00 -0.13 0.00 0.00 59.36 58.84 3gky h GLU 13 Cb 0.57 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 3gky h GLU 13 CO 0.04 0.92 -0.12 0.00 -0.73 0.00 0.00 179.01 179.12 3gky h ALA 14 N 1.09 0.65 -0.74 2.92 0.00 -0.71 -1.85 119.26 120.62 3gky h ALA 14 Ca 0.10 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 3gky h ALA 14 Cb 0.69 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3gky h ALA 14 CO 0.05 0.56 0.26 -0.07 0.00 0.00 0.00 179.25 180.05 3gky h LEU 15 N 0.76 1.06 -0.36 0.00 3.38 -0.91 -0.06 115.31 119.19 3gky h LEU 15 Ca 0.12 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 3gky h LEU 15 Cb 0.68 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3gky h LEU 15 CO 0.05 0.98 0.22 0.22 0.09 0.00 0.00 178.44 180.00 3gky h TYR 16 N 1.09 0.46 -0.21 1.13 3.20 -0.98 0.24 116.97 121.91 3gky h TYR 16 Ca 0.24 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 3gky h TYR 16 Cb 0.28 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 3gky h TYR 16 CO 0.02 0.32 -0.01 1.25 -1.64 0.00 0.00 178.16 178.11 3gky h LEU 17 N 0.47 0.36 0.17 2.82 5.85 -1.02 -3.11 115.31 120.85 3gky h LEU 17 Ca 0.13 -0.32 -0.31 0.00 0.84 0.00 0.00 57.88 58.22 3gky h LEU 17 Cb -0.01 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 40.93 3gky h LEU 17 CO -0.03 0.59 -1.48 0.58 -0.34 0.00 0.00 178.44 177.77 3gky h VAL 18 N 0.12 1.25 -0.11 1.05 2.07 -0.96 -3.36 116.25 116.31 3gky h VAL 18 Ca 0.06 -2.80 -0.19 0.00 0.82 0.00 0.00 66.70 64.59 3gky h VAL 18 Cb 0.41 2.89 -0.00 0.00 -1.52 0.00 0.00 31.29 33.06 3gky h VAL 18 CO 0.01 0.84 -0.71 0.00 0.02 0.00 0.00 177.57 177.73 3gky n GLY 20 N 0.54 3.59 0.01 0.00 0.00 -1.17 -2.33 105.19 105.82 3gky n GLY 20 Ca -0.05 -0.06 0.15 0.00 0.00 0.00 0.00 46.02 46.06 3gky n GLY 20 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gky n GLU 21 N 13.52 0.51 0.14 1.61 1.02 -1.26 -3.20 120.64 132.98 3gky n GLU 21 Ca 0.00 -0.01 0.13 0.00 -0.02 0.00 0.00 57.16 57.25 3gky n GLU 21 Cb 0.00 -1.50 0.31 0.00 -0.02 0.00 0.00 31.44 30.23 3gky n GLU 21 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3gky h ARG 22 N 0.03 0.00 -2.64 3.49 3.08 -1.86 -3.49 114.38 112.98 3gky h ARG 22 Ca 0.00 0.00 0.32 0.00 0.07 0.00 0.00 59.98 60.37 3gky h ARG 22 Cb 0.25 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.22 3gky h ARG 22 CO 0.00 0.00 -0.43 0.41 -1.07 0.00 0.00 179.97 178.88 3gky n GLY 23 N 1.25 -1.79 3.58 0.04 0.00 -1.19 -5.02 105.19 102.05 3gky n GLY 23 Ca 0.05 -1.22 -0.07 0.00 0.00 0.00 0.00 46.02 44.77 3gky n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3gky s PHE 24 N -2.02 -0.30 -0.04 1.61 -0.71 -1.26 -4.89 117.98 110.38 3gky s PHE 24 Ca 0.00 0.10 0.01 0.00 -1.04 0.00 0.00 56.93 56.00 3gky s PHE 24 Cb 0.00 0.57 -0.03 0.00 -1.21 0.00 0.00 43.02 42.35 3gky s PHE 24 CO 0.00 -0.66 -0.05 -0.06 -1.34 0.00 0.00 175.22 173.11 3gky s PHE 25 N -3.23 2.96 -0.28 3.49 0.08 -1.26 -5.08 117.98 114.66 3gky s PHE 25 Ca 0.07 0.03 0.03 0.00 0.12 0.00 0.00 56.93 57.18 3gky s PHE 25 Cb -0.01 -1.68 0.07 0.00 -0.57 0.00 0.00 43.02 40.83 3gky s PHE 25 CO -0.06 0.38 -0.06 -0.47 -0.10 0.00 0.00 175.22 174.91 3gky s TYR 26 N -0.91 3.36 -0.38 0.36 5.04 -1.26 -5.05 117.35 118.51 3gky s TYR 26 Ca 0.15 -2.50 0.01 0.00 -2.44 0.00 0.00 57.07 52.29 3gky s TYR 26 Cb -0.11 -2.21 0.12 0.00 0.35 0.00 0.00 41.96 40.11 3gky s TYR 26 CO 0.04 -0.90 0.16 0.95 -1.34 0.00 0.00 175.55 174.47 3gky s THR 27 N 1.06 1.37 0.06 4.34 -4.23 -1.26 -5.04 115.64 111.94 3gky s THR 27 Ca -0.03 -2.12 -0.14 0.00 -1.18 0.00 0.00 61.69 58.23 3gky s THR 27 Cb -0.20 -1.99 -0.04 0.00 1.34 0.00 0.00 72.50 71.61 3gky s THR 27 CO -0.06 -0.77 1.23 -0.65 -0.54 0.00 0.00 174.62 173.83 3gky h PRO 28 N 7.35 -0.13 -3.39 3.99 0.11 -2.05 -3.32 132.00 134.58 3gky h PRO 28 Ca -0.07 0.01 -0.67 0.00 0.11 0.00 0.00 66.00 65.39 3gky h PRO 28 Cb 0.97 0.03 -0.38 0.00 0.11 0.00 0.00 31.00 31.73 3gky h PRO 28 CO 0.49 -0.09 -0.45 0.21 -0.21 0.00 0.00 178.00 177.95 3gky s LYS 29 N -4.09 2.45 0.00 1.05 2.20 -1.26 -5.28 119.74 114.80 3gky s LYS 29 Ca -0.06 -2.81 0.00 0.00 -0.36 0.00 0.00 55.97 52.74 3gky s LYS 29 Cb 0.04 -3.57 0.00 0.00 -1.51 0.00 0.00 37.83 32.79 3gky s LYS 29 CO 0.26 -1.18 0.29 0.00 -0.36 0.00 0.00 175.35 174.35