#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gkr s ASP 7 N 0.00 6.83 -0.25 6.55 -1.08 -1.26 -4.89 116.67 122.57 2gkr s ASP 7 Ca 0.00 0.87 0.12 0.00 -0.52 0.00 0.00 52.55 53.02 2gkr s ASP 7 Cb 0.00 -2.52 0.53 0.00 -1.46 0.00 0.00 42.92 39.47 2gkr s ASP 7 CO 0.00 -0.90 1.48 0.00 0.52 0.00 0.00 175.17 176.27 2gkr h SER 9 N 1.42 0.71 -0.04 0.00 4.64 -2.00 -1.82 113.55 116.47 2gkr h SER 9 Ca 0.14 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2gkr h SER 9 Cb 1.64 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 2gkr h SER 9 CO 0.36 0.50 0.00 -0.62 -0.87 0.00 0.00 176.83 176.20 2gkr n GLU 10 N -4.45 1.15 -4.45 4.77 1.02 -1.26 -4.81 120.64 112.60 2gkr n GLU 10 Ca 0.07 -0.16 -0.25 0.00 -0.02 0.00 0.00 57.16 56.80 2gkr n GLU 10 Cb 0.09 -1.23 -0.11 0.00 -0.02 0.00 0.00 31.44 30.18 2gkr n GLU 10 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2gkr s TYR 11 N -1.63 2.30 0.53 -0.32 1.51 -0.68 -4.52 117.35 114.54 2gkr s TYR 11 Ca 0.03 -0.34 -0.16 0.00 -1.01 0.00 0.00 57.07 55.59 2gkr s TYR 11 Cb 0.02 -1.04 -0.07 0.00 -0.11 0.00 0.00 41.96 40.76 2gkr s TYR 11 CO 0.02 0.65 1.01 -1.25 -1.11 0.00 0.00 175.55 174.86 2gkr s PRO 12 N -3.24 3.78 0.01 -1.71 0.04 -1.26 -5.05 135.00 127.57 2gkr s PRO 12 Ca 0.27 1.03 0.08 0.00 0.04 0.00 0.00 61.00 62.42 2gkr s PRO 12 Cb -0.06 -2.11 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 2gkr s PRO 12 CO 0.13 -0.42 -0.23 0.15 0.04 0.00 0.00 177.00 176.68 2gkr s LYS 13 N -4.05 2.04 0.36 4.56 1.02 -1.26 -5.05 119.74 117.37 2gkr s LYS 13 Ca 0.60 -0.98 0.27 0.00 0.02 0.00 0.00 55.97 55.89 2gkr s LYS 13 Cb -0.12 -2.10 1.08 0.00 -0.52 0.00 0.00 37.83 36.17 2gkr s LYS 13 CO 0.32 0.55 1.81 -1.00 -0.92 0.00 0.00 175.35 176.11 2gkr h PRO 14 N 4.98 0.00 -3.92 -1.68 0.13 -2.01 -3.43 132.00 126.07 2gkr h PRO 14 Ca -0.46 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.51 2gkr h PRO 14 Cb 1.14 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.07 2gkr h PRO 14 CO 0.46 0.00 -0.66 0.00 -0.23 0.00 0.00 178.00 177.58 2gkr s ALA 15 N -3.42 0.07 0.10 -0.56 0.00 -1.26 -5.16 121.76 111.54 2gkr s ALA 15 Ca 0.04 -0.57 0.10 0.00 0.00 0.00 0.00 51.96 51.53 2gkr s ALA 15 Cb 0.09 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 2gkr s ALA 15 CO 0.47 -0.19 -0.25 0.00 0.00 0.00 0.00 175.76 175.79 2gkr s THR 17 N -1.01 1.93 -2.21 0.00 -4.23 -1.26 -4.98 115.64 103.89 2gkr s THR 17 Ca 0.14 0.00 0.20 0.00 -1.18 0.00 0.00 61.69 60.85 2gkr s THR 17 Cb -0.10 -2.84 0.47 0.00 1.34 0.00 0.00 72.50 71.36 2gkr s THR 17 CO 0.06 0.00 1.57 0.18 -0.54 0.00 0.00 174.62 175.89 2gkr n LEU 18 N -3.85 1.30 -4.67 4.79 7.99 -1.26 -4.91 117.00 116.39 2gkr n LEU 18 Ca 0.11 -0.54 -0.42 0.00 -0.01 0.00 0.00 56.01 55.15 2gkr n LEU 18 Cb 0.60 -0.08 -0.03 0.00 -0.11 0.00 0.00 43.42 43.80 2gkr n LEU 18 CO 0.51 0.27 1.45 -0.70 -1.51 0.00 0.00 177.39 177.41 2gkr s GLU 19 N -1.83 4.17 -0.51 3.23 2.12 -1.26 -4.93 118.70 119.68 2gkr s GLU 19 Ca 0.31 2.38 -0.15 0.00 0.36 0.00 0.00 54.97 57.87 2gkr s GLU 19 Cb 0.16 -3.98 0.11 0.00 0.26 0.00 0.00 34.13 30.69 2gkr s GLU 19 CO 0.25 -0.87 0.45 -0.47 -0.54 0.00 0.00 175.26 174.08 2gkr s TYR 20 N 3.94 3.27 -0.46 5.30 5.04 -1.26 -4.51 117.35 128.67 2gkr s TYR 20 Ca 0.79 -1.28 0.03 0.00 -2.44 0.00 0.00 57.07 54.17 2gkr s TYR 20 Cb -0.38 -3.60 0.16 0.00 0.35 0.00 0.00 41.96 38.49 2gkr s TYR 20 CO 0.35 -0.96 0.34 1.03 -1.34 0.00 0.00 175.55 174.96 2gkr s ARG 21 N 1.58 1.18 0.48 4.97 0.52 0.60 -5.02 118.95 123.26 2gkr s ARG 21 Ca 0.04 -2.22 -0.24 0.00 -0.52 0.00 0.00 55.73 52.79 2gkr s ARG 21 Cb -0.28 -1.86 -0.07 0.00 0.52 0.00 0.00 34.95 33.26 2gkr s ARG 21 CO 0.03 -1.32 1.30 -1.25 0.02 0.00 0.00 175.30 174.08 2gkr s PRO 22 N -0.05 3.58 -0.05 3.54 0.04 -1.24 -3.68 135.00 137.14 2gkr s PRO 22 Ca 0.28 2.11 -0.08 0.00 0.04 0.00 0.00 61.00 63.35 2gkr s PRO 22 Cb -0.04 -2.47 0.02 0.00 0.04 0.00 0.00 34.50 32.04 2gkr s PRO 22 CO -0.14 -0.79 0.19 -0.48 0.04 0.00 0.00 177.00 175.81 2gkr s LEU 23 N -3.01 1.29 -0.33 -3.56 2.34 -0.66 -0.56 118.68 114.19 2gkr s LEU 23 Ca 0.64 0.23 -0.14 0.00 0.06 0.00 0.00 54.13 54.93 2gkr s LEU 23 Cb -0.37 0.72 -0.02 0.00 -0.56 0.00 0.00 46.19 45.96 2gkr s LEU 23 CO 0.45 -0.17 0.30 0.00 -1.06 0.00 0.00 176.35 175.87 2gkr s GLY 25 N 1.73 1.64 0.01 0.00 0.00 -0.31 -0.67 107.32 109.71 2gkr s GLY 25 Ca 0.09 -0.18 0.08 0.00 0.00 0.00 0.00 44.72 44.72 2gkr s GLY 25 CO 0.11 0.20 1.26 -1.14 0.00 0.00 0.00 173.10 173.53 2gkr n SER 26 N -3.21 0.02 -0.43 1.64 3.41 0.52 -1.03 113.62 114.55 2gkr n SER 26 Ca 0.07 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.31 2gkr n SER 26 Cb 0.56 -0.51 0.52 0.00 -0.26 0.00 0.00 64.21 64.52 2gkr n SER 26 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2gkr n ASP 27 N -1.52 1.31 -1.43 4.04 5.75 -1.26 -4.94 116.55 118.50 2gkr n ASP 27 Ca 0.02 -1.51 -0.16 0.00 -0.01 0.00 0.00 54.79 53.12 2gkr n ASP 27 Cb 0.09 -0.03 -0.05 0.00 -1.03 0.00 0.00 41.12 40.10 2gkr n ASP 27 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2gkr n ASN 28 N 0.05 -4.91 -4.80 -1.12 3.02 -0.19 -5.02 115.26 102.29 2gkr n ASN 28 Ca 0.18 0.27 -0.38 0.00 -0.03 0.00 0.00 54.58 54.62 2gkr n ASN 28 Cb 0.30 -3.90 -0.06 0.00 -0.61 0.00 0.00 39.78 35.52 2gkr n ASN 28 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2gkr s LYS 29 N -3.82 4.11 -0.54 3.52 2.20 -1.26 -4.91 119.74 119.04 2gkr s LYS 29 Ca 0.00 0.52 -0.21 0.00 -0.36 0.00 0.00 55.97 55.93 2gkr s LYS 29 Cb 0.00 -3.28 0.06 0.00 -1.51 0.00 0.00 37.83 33.10 2gkr s LYS 29 CO 0.00 0.53 0.74 0.99 -0.36 0.00 0.00 175.35 177.25 2gkr s THR 30 N -0.63 4.71 0.41 3.43 2.01 -1.26 -1.16 115.64 123.14 2gkr s THR 30 Ca 0.26 -0.36 -0.23 0.00 0.31 0.00 0.00 61.69 61.67 2gkr s THR 30 Cb -0.17 -4.41 -0.09 0.00 0.01 0.00 0.00 72.50 67.84 2gkr s THR 30 CO 0.14 -0.97 1.01 -0.31 -0.69 0.00 0.00 174.62 173.80 2gkr s TYR 31 N 3.07 3.29 0.18 4.92 1.51 0.22 -4.86 117.35 125.68 2gkr s TYR 31 Ca 0.19 1.65 0.17 0.00 -1.01 0.00 0.00 57.07 58.07 2gkr s TYR 31 Cb -0.18 -3.03 0.61 0.00 -0.11 0.00 0.00 41.96 39.25 2gkr s TYR 31 CO 0.13 -0.43 1.71 0.78 -1.11 0.00 0.00 175.55 176.63 2gkr h GLY 32 N 2.32 0.00 -1.92 0.71 0.00 -1.86 -1.76 103.07 100.56 2gkr h GLY 32 Ca -0.48 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.02 2gkr h GLY 32 CO 0.62 0.00 0.54 0.54 0.00 0.00 0.00 176.54 178.24 2gkr s ASN 33 N -6.51 -0.08 0.34 0.19 2.20 -1.24 -0.29 114.94 109.56 2gkr s ASN 33 Ca -0.00 -0.55 0.03 0.00 -0.94 0.00 0.00 52.86 51.39 2gkr s ASN 33 Cb 0.11 0.49 0.64 0.00 -2.00 0.00 0.00 41.25 40.49 2gkr s ASN 33 CO 0.70 -0.95 1.98 0.50 -2.94 0.00 0.00 177.10 176.40 2gkr h LYS 34 N 2.00 0.84 -0.11 3.55 3.64 -1.91 -1.71 116.57 122.87 2gkr h LYS 34 Ca -0.26 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.06 2gkr h LYS 34 Cb 1.22 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 2gkr h LYS 34 CO 0.31 0.56 0.06 0.00 -2.27 0.00 0.00 179.45 178.11 2gkr h ASN 36 N 0.09 1.09 0.24 0.00 2.35 -1.86 -0.63 115.58 116.86 2gkr h ASN 36 Ca 0.04 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.57 2gkr h ASN 36 Cb 0.06 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.14 2gkr h ASN 36 CO -0.01 1.01 -0.12 0.15 -1.65 0.00 0.00 177.43 176.82 2gkr h PHE 37 N 1.12 -0.30 -0.68 1.19 3.57 -1.06 -2.34 116.94 118.43 2gkr h PHE 37 Ca 0.24 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.71 2gkr h PHE 37 Cb 0.31 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 2gkr h PHE 37 CO 0.03 -0.09 0.31 0.00 -2.23 0.00 0.00 178.31 176.32 2gkr h ASN 39 N 0.97 1.08 -0.09 0.00 2.35 -1.08 -1.77 115.58 117.04 2gkr h ASN 39 Ca 0.23 -0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.86 2gkr h ASN 39 Cb 0.13 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 2gkr h ASN 39 CO -0.03 0.74 -0.30 0.00 -1.65 0.00 0.00 177.43 176.19 2gkr h ALA 40 N 1.42 0.97 -0.41 -0.83 0.00 -0.73 -0.87 119.26 118.81 2gkr h ALA 40 Ca 0.40 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2gkr h ALA 40 Cb 0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2gkr h ALA 40 CO -0.13 0.60 0.24 0.28 0.00 0.00 0.00 179.25 180.24 2gkr h VAL 41 N 0.49 1.03 0.03 0.00 2.07 -0.46 -0.10 116.25 119.31 2gkr h VAL 41 Ca 0.06 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 2gkr h VAL 41 Cb 0.76 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2gkr h VAL 41 CO 0.06 0.09 -0.02 0.58 0.02 0.00 0.00 177.57 178.30 2gkr h VAL 42 N 0.48 1.05 -0.96 2.57 2.07 -1.17 -1.95 116.25 118.34 2gkr h VAL 42 Ca 0.17 -0.25 0.12 0.00 0.82 0.00 0.00 66.70 67.56 2gkr h VAL 42 Cb 0.03 1.21 -0.08 0.00 -1.52 0.00 0.00 31.29 30.93 2gkr h VAL 42 CO -0.09 0.06 0.61 -0.08 0.02 0.00 0.00 177.57 178.10 2gkr h GLU 43 N -0.15 0.88 0.00 1.57 4.81 -0.83 -1.77 114.58 119.09 2gkr h GLU 43 Ca -0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2gkr h GLU 43 Cb 0.14 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.32 2gkr h GLU 43 CO 0.01 0.58 0.00 -1.13 -0.73 0.00 0.00 179.01 177.74 2gkr n SER 44 N -4.59 0.00 -3.11 1.04 3.41 -0.08 -4.87 113.62 105.42 2gkr n SER 44 Ca 0.18 -0.55 -0.23 0.00 -0.26 0.00 0.00 58.87 58.01 2gkr n SER 44 Cb 0.38 -0.06 0.04 0.00 -0.26 0.00 0.00 64.21 64.31 2gkr n SER 44 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2gkr n ASN 45 N -1.06 -6.18 -0.02 4.04 3.02 -0.67 -2.63 115.26 111.77 2gkr n ASN 45 Ca 0.15 -0.33 -0.00 0.00 -0.03 0.00 0.00 54.58 54.38 2gkr n ASN 45 Cb 0.10 -4.97 -0.00 0.00 -0.61 0.00 0.00 39.78 34.29 2gkr n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gkr n GLY 46 N -1.60 0.47 0.07 7.41 0.00 -0.76 -4.92 105.19 105.87 2gkr n GLY 46 Ca -0.10 -0.29 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 2gkr n GLY 46 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2gkr h THR 47 N 0.00 1.47 -3.46 2.61 1.35 -1.72 -3.46 112.91 109.69 2gkr h THR 47 Ca -0.01 -3.21 -0.52 0.00 -0.55 0.00 0.00 66.41 62.12 2gkr h THR 47 Cb 0.05 2.73 0.01 0.00 -1.73 0.00 0.00 68.15 69.21 2gkr h THR 47 CO 0.01 0.84 0.53 -0.22 -0.25 0.00 0.00 175.52 176.42 2gkr s LEU 48 N -6.55 4.45 0.33 3.87 2.96 -1.26 -5.03 118.68 117.45 2gkr s LEU 48 Ca -0.01 2.13 0.04 0.00 -0.22 0.00 0.00 54.13 56.07 2gkr s LEU 48 Cb 0.09 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 43.12 2gkr s LEU 48 CO 0.82 -0.33 0.07 0.42 -1.32 0.00 0.00 176.35 176.01 2gkr s THR 49 N 0.09 1.10 -0.21 3.68 -4.23 -1.26 -4.82 115.64 109.99 2gkr s THR 49 Ca 0.53 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.84 2gkr s THR 49 Cb -0.31 -2.75 -0.03 0.00 1.34 0.00 0.00 72.50 70.76 2gkr s THR 49 CO 0.34 0.00 0.57 -0.22 -0.54 0.00 0.00 174.62 174.77 2gkr s LEU 50 N -3.49 4.12 -0.10 4.79 2.96 -1.26 -0.35 118.68 125.36 2gkr s LEU 50 Ca 0.35 0.71 -0.24 0.00 -0.22 0.00 0.00 54.13 54.74 2gkr s LEU 50 Cb 0.08 -2.78 -0.20 0.00 0.50 0.00 0.00 46.19 43.79 2gkr s LEU 50 CO 0.15 -0.24 0.79 -1.28 -1.32 0.00 0.00 176.35 174.45 2gkr h SER 51 N 7.58 -0.04 -4.59 3.68 0.87 -1.12 -3.46 113.55 116.48 2gkr h SER 51 Ca -0.32 -0.68 0.08 0.00 -1.23 0.00 0.00 61.79 59.65 2gkr h SER 51 Cb 1.15 0.01 -0.17 0.00 -0.44 0.00 0.00 62.40 62.95 2gkr h SER 51 CO 0.75 0.73 0.46 -1.38 -0.53 0.00 0.00 176.83 176.87 2gkr s HIS 52 N -2.73 -0.39 0.43 2.24 0.00 -1.13 -5.03 115.29 108.68 2gkr s HIS 52 Ca -0.15 0.36 -0.23 0.00 -3.00 0.00 0.00 55.06 52.04 2gkr s HIS 52 Cb -0.01 0.51 -0.09 0.00 -4.00 0.00 0.00 32.58 28.99 2gkr s HIS 52 CO 0.57 -0.53 1.06 -0.06 -1.00 0.00 0.00 174.74 174.78 2gkr s PHE 53 N -2.64 3.16 0.00 0.38 0.08 -1.26 -0.78 117.98 116.92 2gkr s PHE 53 Ca 0.02 1.62 0.00 0.00 0.12 0.00 0.00 56.93 58.69 2gkr s PHE 53 Cb -0.01 -3.13 0.00 0.00 -0.57 0.00 0.00 43.02 39.31 2gkr s PHE 53 CO -0.06 -0.76 0.00 0.41 -0.10 0.00 0.00 175.22 174.71 2gkr n GLY 54 N 0.20 -3.74 3.77 4.36 0.00 0.27 -4.78 105.19 105.28 2gkr n GLY 54 Ca 0.06 -2.03 -0.38 0.00 0.00 0.00 0.00 46.02 43.67 2gkr n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gkr s LYS 55 N -0.84 4.16 0.00 1.61 1.02 -1.26 -2.14 119.74 122.28 2gkr s LYS 55 Ca 0.00 1.77 0.05 0.00 0.02 0.00 0.00 55.97 57.81 2gkr s LYS 55 Cb 0.00 -2.72 0.29 0.00 -0.52 0.00 0.00 37.83 34.88 2gkr s LYS 55 CO 0.00 -0.21 0.76 0.00 -0.92 0.00 0.00 175.35 174.98