#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gh9 s TYR 2 N 0.00 3.01 0.16 2.03 1.51 0.42 -1.46 117.35 123.01 1gh9 s TYR 2 Ca 0.00 -0.05 0.06 0.00 -1.01 0.00 0.00 57.07 56.07 1gh9 s TYR 2 Cb 0.00 -1.48 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 1gh9 s TYR 2 CO 0.00 0.51 -0.13 0.96 -1.11 0.00 0.00 175.55 175.78 1gh9 s ILE 3 N -1.59 1.40 0.11 2.71 -4.36 0.86 -2.06 121.20 118.26 1gh9 s ILE 3 Ca 0.28 -2.00 0.10 0.00 -0.26 0.00 0.00 60.65 58.77 1gh9 s ILE 3 Cb -0.10 -1.81 -0.04 0.00 1.25 0.00 0.00 42.46 41.76 1gh9 s ILE 3 CO 0.20 -0.59 -0.25 -0.63 0.24 0.00 0.00 174.94 173.91 1gh9 s ILE 4 N -2.83 2.07 0.00 8.37 1.09 0.34 -1.56 121.20 128.67 1gh9 s ILE 4 Ca 0.16 -1.63 0.00 0.00 -1.10 0.00 0.00 60.65 58.08 1gh9 s ILE 4 Cb -0.01 -1.83 0.00 0.00 -1.06 0.00 0.00 42.46 39.56 1gh9 s ILE 4 CO 0.03 0.08 0.00 2.22 -0.10 0.00 0.00 174.94 177.18 1gh9 n PHE 5 N 1.10 -0.04 -3.78 3.97 -1.74 -0.86 -1.49 117.46 114.62 1gh9 n PHE 5 Ca -0.18 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.57 1gh9 n PHE 5 Cb 0.53 0.00 -0.15 0.00 1.52 0.00 0.00 39.48 41.38 1gh9 n PHE 5 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 1gh9 s ARG 6 N 0.66 0.04 0.67 3.97 0.52 -1.19 -3.00 118.95 120.62 1gh9 s ARG 6 Ca 0.00 0.23 -0.11 0.00 -0.52 0.00 0.00 55.73 55.34 1gh9 s ARG 6 Cb 0.00 -0.15 -0.01 0.00 0.52 0.00 0.00 34.95 35.31 1gh9 s ARG 6 CO 0.00 -0.13 1.05 0.00 0.02 0.00 0.00 175.30 176.24 1gh9 h ASP 8 N -0.56 0.00 0.00 0.00 5.19 -1.84 0.32 116.42 119.53 1gh9 h ASP 8 Ca -0.44 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.97 1gh9 h ASP 8 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1gh9 h ASP 8 CO 0.59 0.10 0.00 0.00 -3.12 0.00 0.00 179.24 176.81 1gh9 n GLY 10 N 0.22 0.61 0.00 0.00 0.00 0.11 -5.05 105.19 101.08 1gh9 n GLY 10 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1gh9 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gh9 n ARG 11 N -2.77 0.96 -3.57 1.61 1.74 -1.10 -4.75 116.66 108.79 1gh9 n ARG 11 Ca 0.00 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.92 1gh9 n ARG 11 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.38 1gh9 n ARG 11 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1gh9 s ALA 12 N -3.86 -1.52 0.20 7.54 0.00 -1.26 -1.24 121.76 121.62 1gh9 s ALA 12 Ca 0.00 1.00 -0.00 0.00 0.00 0.00 0.00 51.96 52.96 1gh9 s ALA 12 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1gh9 s ALA 12 CO 0.00 -0.39 0.26 1.28 0.00 0.00 0.00 175.76 176.92 1gh9 n LEU 13 N 0.85 0.00 -3.93 0.00 4.77 -1.16 -4.82 117.00 112.70 1gh9 n LEU 13 Ca -0.19 -1.69 -0.13 0.00 -0.03 0.00 0.00 56.01 53.97 1gh9 n LEU 13 Cb 0.58 1.39 -0.13 0.00 -2.33 0.00 0.00 43.42 42.92 1gh9 n LEU 13 CO 0.22 -0.37 -0.38 -0.72 -1.33 0.00 0.00 177.39 174.82 1gh9 s TYR 14 N -3.61 0.26 0.01 -1.77 -0.85 -1.26 -2.03 117.35 108.10 1gh9 s TYR 14 Ca 0.18 -0.15 -0.00 0.00 -0.52 0.00 0.00 57.07 56.58 1gh9 s TYR 14 Cb -0.00 -0.17 0.00 0.00 0.38 0.00 0.00 41.96 42.17 1gh9 s TYR 14 CO 0.13 -0.04 0.02 0.45 -1.52 0.00 0.00 175.55 174.59 1gh9 n SER 15 N 2.68 -0.05 -4.77 -0.18 2.88 -0.60 -4.95 113.62 108.62 1gh9 n SER 15 Ca -0.15 -1.05 -0.38 0.00 -1.33 0.00 0.00 58.87 55.97 1gh9 n SER 15 Cb 0.58 0.09 -0.04 0.00 -0.75 0.00 0.00 64.21 64.10 1gh9 n SER 15 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1gh9 s ARG 16 N -2.01 4.25 -0.39 -1.46 0.52 -1.26 -0.10 118.95 118.50 1gh9 s ARG 16 Ca 0.01 1.63 -0.29 0.00 -0.52 0.00 0.00 55.73 56.55 1gh9 s ARG 16 Cb -0.00 -2.70 -0.08 0.00 0.52 0.00 0.00 34.95 32.68 1gh9 s ARG 16 CO 0.00 -0.10 2.31 -1.91 0.02 0.00 0.00 175.30 175.63 1gh9 n GLU 17 N 0.22 1.32 0.00 3.54 2.13 -0.53 -2.56 120.64 124.76 1gh9 n GLU 17 Ca 0.04 0.27 0.00 0.00 0.66 0.00 0.00 57.16 58.13 1gh9 n GLU 17 Cb 0.48 -2.99 0.00 0.00 0.27 0.00 0.00 31.44 29.20 1gh9 n GLU 17 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1gh9 n GLY 18 N 6.10 -0.57 3.63 8.31 0.00 -1.26 -4.92 105.19 116.47 1gh9 n GLY 18 Ca 0.37 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.97 1gh9 n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gh9 s ALA 19 N 0.00 3.33 -0.15 4.61 0.00 -1.06 -4.89 121.76 123.60 1gh9 s ALA 19 Ca 0.00 0.12 -0.15 0.00 0.00 0.00 0.00 51.96 51.92 1gh9 s ALA 19 Cb 0.00 -3.80 -0.24 0.00 0.00 0.00 0.00 23.12 19.08 1gh9 s ALA 19 CO 0.00 -1.84 0.37 0.87 0.00 0.00 0.00 175.76 175.16 1gh9 h LYS 20 N 9.57 0.15 -2.84 0.00 6.56 -1.95 -3.45 116.57 124.60 1gh9 h LYS 20 Ca -0.27 -0.26 -0.30 0.00 -1.06 0.00 0.00 60.65 58.76 1gh9 h LYS 20 Cb 1.10 0.10 -0.36 0.00 -0.57 0.00 0.00 32.23 32.51 1gh9 h LYS 20 CO 1.03 1.13 -0.62 0.95 -2.06 0.00 0.00 179.45 179.88 1gh9 s THR 21 N -2.45 -0.30 0.00 -0.16 -4.23 -1.26 -3.20 115.64 104.03 1gh9 s THR 21 Ca -0.24 0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.42 1gh9 s THR 21 Cb 0.05 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.42 1gh9 s THR 21 CO 0.70 -0.01 0.00 0.54 -0.54 0.00 0.00 174.62 175.31 1gh9 n ARG 22 N 5.33 0.70 -3.76 3.99 5.12 0.39 -4.95 116.66 123.48 1gh9 n ARG 22 Ca -0.05 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.74 1gh9 n ARG 22 Cb 0.50 0.00 -0.11 0.00 -1.16 0.00 0.00 32.46 31.69 1gh9 n ARG 22 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1gh9 s LYS 23 N -1.90 0.41 -0.23 5.56 2.20 -1.26 -2.94 119.74 121.58 1gh9 s LYS 23 Ca 0.00 0.44 -0.13 0.00 -0.36 0.00 0.00 55.97 55.93 1gh9 s LYS 23 Cb 0.00 0.20 -0.04 0.00 -1.51 0.00 0.00 37.83 36.47 1gh9 s LYS 23 CO 0.00 -0.05 0.27 0.00 -0.36 0.00 0.00 175.35 175.20 1gh9 h VAL 25 N 5.07 0.46 0.00 0.00 2.07 -2.01 -1.63 116.25 120.21 1gh9 h VAL 25 Ca -0.37 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1gh9 h VAL 25 Cb 1.17 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 32.42 1gh9 h VAL 25 CO 0.67 0.13 -0.02 0.00 0.02 0.00 0.00 177.57 178.37 1gh9 n GLY 27 N -0.05 0.53 0.10 0.00 0.00 -0.64 -5.17 105.19 99.97 1gh9 n GLY 27 Ca 0.00 -0.71 -0.00 0.00 0.00 0.00 0.00 46.02 45.31 1gh9 n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gh9 n ARG 28 N 0.00 0.01 -3.78 1.61 1.74 -1.05 -4.99 116.66 110.20 1gh9 n ARG 28 Ca 0.00 -0.03 -0.14 0.00 -0.77 0.00 0.00 57.85 56.91 1gh9 n ARG 28 Cb 0.00 0.04 -0.15 0.00 -1.02 0.00 0.00 32.46 31.33 1gh9 n ARG 28 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1gh9 s THR 29 N -2.38 -0.05 -0.40 0.55 2.01 -1.26 -1.18 115.64 112.94 1gh9 s THR 29 Ca 0.01 0.17 -0.16 0.00 0.31 0.00 0.00 61.69 62.02 1gh9 s THR 29 Cb -0.00 -0.10 0.01 0.00 0.01 0.00 0.00 72.50 72.42 1gh9 s THR 29 CO 0.00 0.07 0.37 -0.69 -0.69 0.00 0.00 174.62 173.68 1gh9 s VAL 30 N 0.91 5.16 -0.28 3.82 1.01 -1.15 -2.61 120.40 127.26 1gh9 s VAL 30 Ca -0.07 -0.36 -0.17 0.00 0.00 0.00 0.00 61.98 61.37 1gh9 s VAL 30 Cb -0.10 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1gh9 s VAL 30 CO -0.03 -0.30 0.49 0.21 0.00 0.00 0.00 175.10 175.47 1gh9 s ASN 31 N 1.75 6.38 0.85 3.32 3.84 -0.75 -0.46 114.94 129.88 1gh9 s ASN 31 Ca 0.10 0.38 0.00 0.00 0.21 0.00 0.00 52.86 53.55 1gh9 s ASN 31 Cb -0.18 -2.27 0.00 0.00 -0.55 0.00 0.00 41.25 38.26 1gh9 s ASN 31 CO 0.12 -0.31 0.00 1.33 -2.79 0.00 0.00 177.10 175.45 1gh9 n VAL 32 N 5.21 0.00 -0.19 -5.21 0.24 -1.20 -3.15 118.33 114.04 1gh9 n VAL 32 Ca -0.05 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.07 1gh9 n VAL 32 Cb 0.50 -0.59 0.18 0.00 -1.47 0.00 0.00 33.84 32.46 1gh9 n VAL 32 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1gh9 n LYS 33 N -1.46 -3.36 -0.06 7.34 4.81 -1.26 -4.73 118.16 119.45 1gh9 n LYS 33 Ca 0.00 -0.89 -0.22 0.00 -0.87 0.00 0.00 58.31 56.34 1gh9 n LYS 33 Cb 0.00 -1.23 -0.13 0.00 0.02 0.00 0.00 35.03 33.70 1gh9 n LYS 33 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1gh9 n ASP 34 N -4.20 1.98 0.00 3.14 2.03 -1.26 -4.87 116.55 113.37 1gh9 n ASP 34 Ca 0.08 0.33 0.00 0.00 0.52 0.00 0.00 54.79 55.73 1gh9 n ASP 34 Cb 0.37 -0.93 0.00 0.00 -0.72 0.00 0.00 41.12 39.84 1gh9 n ASP 34 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1gh9 n ARG 35 N -4.03 0.00 0.00 -0.67 3.00 -1.26 -5.01 116.66 108.69 1gh9 n ARG 35 Ca -0.32 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.52 1gh9 n ARG 35 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.30 1gh9 n ARG 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1gh9 n ARG 36 N 0.00 0.00 -3.61 5.56 1.74 -1.26 -5.07 116.66 114.02 1gh9 n ARG 36 Ca 0.00 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.96 1gh9 n ARG 36 Cb 0.00 -0.06 -0.05 0.00 -1.02 0.00 0.00 32.46 31.33 1gh9 n ARG 36 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1gh9 s ILE 37 N 0.00 0.05 0.13 0.55 -1.09 -1.26 -4.53 121.20 115.05 1gh9 s ILE 37 Ca 0.00 -0.38 -0.15 0.00 -2.23 0.00 0.00 60.65 57.88 1gh9 s ILE 37 Cb 0.00 -1.02 -0.07 0.00 -1.58 0.00 0.00 42.46 39.79 1gh9 s ILE 37 CO 0.00 -0.21 0.55 0.12 -1.23 0.00 0.00 174.94 174.17 1gh9 s PHE 38 N -2.91 3.65 -0.08 3.97 2.19 -0.56 -4.71 117.98 119.54 1gh9 s PHE 38 Ca -0.03 1.10 -0.03 0.00 0.33 0.00 0.00 56.93 58.31 1gh9 s PHE 38 Cb -0.00 -2.39 0.01 0.00 -1.31 0.00 0.00 43.02 39.33 1gh9 s PHE 38 CO -0.05 0.47 0.05 0.41 1.83 0.00 0.00 175.22 177.93 1gh9 n GLY 39 N 1.02 -1.71 3.43 13.12 0.00 -1.26 -0.50 105.19 119.28 1gh9 n GLY 39 Ca -0.07 0.45 -0.44 0.00 0.00 0.00 0.00 46.02 45.97 1gh9 n GLY 39 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1gh9 s ARG 40 N -0.63 3.35 -0.26 1.61 3.00 -1.26 -1.11 118.95 123.65 1gh9 s ARG 40 Ca -0.06 -1.48 -0.13 0.00 -1.00 0.00 0.00 55.73 53.07 1gh9 s ARG 40 Cb 0.00 -4.56 -0.05 0.00 0.00 0.00 0.00 34.95 30.35 1gh9 s ARG 40 CO 0.28 -1.70 0.26 0.00 0.00 0.00 0.00 175.30 174.14 1gh9 s ALA 41 N 2.86 3.56 -0.01 6.12 0.00 -0.88 -4.96 121.76 128.45 1gh9 s ALA 41 Ca 0.24 -0.90 -0.11 0.00 0.00 0.00 0.00 51.96 51.19 1gh9 s ALA 41 Cb -0.13 -2.53 -0.32 0.00 0.00 0.00 0.00 23.12 20.15 1gh9 s ALA 41 CO -0.01 -0.46 0.83 0.38 0.00 0.00 0.00 175.76 176.50 1gh9 h ASP 42 N 7.99 0.67 -3.33 0.00 3.04 -1.95 0.12 116.42 122.95 1gh9 h ASP 42 Ca -0.35 -0.86 -0.56 0.00 -3.24 0.00 0.00 57.03 52.02 1gh9 h ASP 42 Cb 1.17 -0.22 -0.04 0.00 -1.04 0.00 0.00 39.33 39.20 1gh9 h ASP 42 CO 0.62 1.70 0.03 -1.81 -2.04 0.00 0.00 179.24 177.75 1gh9 s ASP 43 N -7.36 7.10 0.25 4.15 1.01 -1.26 -4.30 116.67 116.26 1gh9 s ASP 43 Ca -0.12 1.31 -0.04 0.00 0.71 0.00 0.00 52.55 54.41 1gh9 s ASP 43 Cb 0.05 -2.40 0.36 0.00 1.01 0.00 0.00 42.92 41.94 1gh9 s ASP 43 CO 0.89 0.16 1.85 -0.26 0.21 0.00 0.00 175.17 178.02 1gh9 h PHE 44 N 5.08 1.02 -0.37 4.23 0.04 -2.00 -1.03 116.94 123.90 1gh9 h PHE 44 Ca -0.47 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.24 1gh9 h PHE 44 Cb 1.21 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 39.01 1gh9 h PHE 44 CO 0.66 0.50 -0.13 1.49 -0.60 0.00 0.00 178.31 180.23 1gh9 h GLU 45 N 0.99 0.66 -0.21 1.51 4.81 -1.99 -2.67 114.58 117.68 1gh9 h GLU 45 Ca 0.39 -0.21 -0.10 0.00 -0.13 0.00 0.00 59.36 59.31 1gh9 h GLU 45 Cb 0.20 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1gh9 h GLU 45 CO -0.18 0.77 -0.29 0.93 -0.73 0.00 0.00 179.01 179.50 1gh9 h GLU 46 N 0.60 0.41 0.19 1.92 5.08 -1.67 -2.69 114.58 118.41 1gh9 h GLU 46 Ca 0.10 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1gh9 h GLU 46 Cb 0.57 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1gh9 h GLU 46 CO 0.04 0.67 -0.10 0.00 -1.00 0.00 0.00 179.01 178.61 1gh9 h ALA 47 N 1.34 -0.26 -0.82 3.43 0.00 -0.88 -0.67 119.26 121.38 1gh9 h ALA 47 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gh9 h ALA 47 Cb 0.70 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 1gh9 h ALA 47 CO 0.05 -0.65 0.52 0.77 0.00 0.00 0.00 179.25 179.94 1gh9 h SER 48 N -0.27 0.97 -0.27 0.00 0.02 -1.46 -1.23 113.55 111.30 1gh9 h SER 48 Ca -0.02 -0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 60.76 1gh9 h SER 48 Cb 0.22 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1gh9 h SER 48 CO 0.03 0.72 -0.29 1.05 -1.14 0.00 0.00 176.83 177.20 1gh9 h GLU 49 N 1.13 0.77 -0.41 3.45 4.11 -1.24 -1.50 114.58 120.89 1gh9 h GLU 49 Ca 0.30 -0.34 -0.11 0.00 0.07 0.00 0.00 59.36 59.28 1gh9 h GLU 49 Cb -0.09 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1gh9 h GLU 49 CO -0.06 0.97 -0.16 -0.07 0.07 0.00 0.00 179.01 179.75 1gh9 h LEU 50 N 0.66 0.85 -0.59 3.06 3.38 -0.65 -1.76 115.31 120.25 1gh9 h LEU 50 Ca 0.08 -0.39 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 1gh9 h LEU 50 Cb 0.81 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1gh9 h LEU 50 CO 0.07 1.05 0.14 0.58 0.09 0.00 0.00 178.44 180.37 1gh9 h VAL 51 N 0.64 1.25 -0.57 1.22 2.07 -1.14 -1.34 116.25 118.38 1gh9 h VAL 51 Ca 0.09 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 1gh9 h VAL 51 Cb 0.71 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1gh9 h VAL 51 CO 0.05 0.34 0.15 -0.09 0.02 0.00 0.00 177.57 178.04 1gh9 h ARG 52 N 0.86 0.87 -0.11 1.57 2.43 -1.18 -0.93 114.38 117.89 1gh9 h ARG 52 Ca 0.19 -0.17 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 1gh9 h ARG 52 Cb 0.35 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1gh9 h ARG 52 CO 0.00 0.77 -0.23 0.87 -1.51 0.00 0.00 179.97 179.88 1gh9 h LYS 53 N 0.84 0.19 -0.04 0.20 1.57 -0.95 -1.45 116.57 116.93 1gh9 h LYS 53 Ca 0.19 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 1gh9 h LYS 53 Cb 0.28 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1gh9 h LYS 53 CO -0.00 0.41 -0.30 -0.07 -0.57 0.00 0.00 179.45 178.91 1gh9 h LEU 54 N 0.17 0.07 0.00 2.94 3.38 -0.05 -3.42 115.31 118.40 1gh9 h LEU 54 Ca 0.03 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1gh9 h LEU 54 Cb 0.51 -0.02 0.03 0.00 0.09 0.00 0.00 40.66 41.26 1gh9 h LEU 54 CO 0.03 0.37 0.00 0.00 0.09 0.00 0.00 178.44 178.94 1gh9 n GLN 55 N -4.16 -1.70 -2.41 1.13 1.13 -0.55 -4.84 117.38 106.00 1gh9 n GLN 55 Ca -0.02 -0.22 -0.37 0.00 -1.94 0.00 0.00 57.00 54.45 1gh9 n GLN 55 Cb 0.36 -0.23 -0.03 0.00 0.11 0.00 0.00 30.24 30.46 1gh9 n GLN 55 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1gh9 s GLU 56 N -3.31 3.37 0.87 -1.09 0.41 -1.26 -4.97 118.70 112.72 1gh9 s GLU 56 Ca 0.09 -1.24 -0.12 0.00 -0.41 0.00 0.00 54.97 53.29 1gh9 s GLU 56 Cb -0.01 -5.35 0.11 0.00 -1.78 0.00 0.00 34.13 27.11 1gh9 s GLU 56 CO 0.07 -2.68 1.16 -2.00 -0.49 0.00 0.00 175.26 171.32 1gh9 s GLU 57 N 5.32 1.47 0.05 1.61 2.12 -1.26 -5.01 118.70 123.00 1gh9 s GLU 57 Ca 0.56 0.21 -0.30 0.00 0.36 0.00 0.00 54.97 55.79 1gh9 s GLU 57 Cb -0.00 -1.89 -0.04 0.00 0.26 0.00 0.00 34.13 32.46 1gh9 s GLU 57 CO 0.00 -1.95 1.00 0.21 -0.54 0.00 0.00 175.26 173.98 1gh9 s LYS 58 N -5.41 4.59 -0.08 4.30 2.20 -1.26 -4.95 119.74 119.13 1gh9 s LYS 58 Ca 0.63 1.48 0.01 0.00 -0.36 0.00 0.00 55.97 57.72 1gh9 s LYS 58 Cb -0.13 -3.42 -0.25 0.00 -1.51 0.00 0.00 37.83 32.52 1gh9 s LYS 58 CO 0.51 0.02 0.50 1.88 -0.36 0.00 0.00 175.35 177.91 1gh9 h TYR 59 N 6.35 0.31 0.00 4.03 -1.99 -2.03 -3.48 116.97 120.16 1gh9 h TYR 59 Ca -0.42 -0.22 0.00 0.00 2.00 0.00 0.00 58.73 60.09 1gh9 h TYR 59 Cb 1.22 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.93 1gh9 h TYR 59 CO 0.67 1.47 0.00 0.41 -0.00 0.00 0.00 178.16 180.71 1gh9 n GLY 60 N 1.81 -0.69 3.75 3.88 0.00 -1.26 -5.15 105.19 107.54 1gh9 n GLY 60 Ca -0.25 0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 1gh9 n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gh9 s SER 61 N 0.00 6.96 0.00 1.61 0.01 -1.26 -4.95 113.70 116.06 1gh9 s SER 61 Ca 0.00 1.14 0.25 0.00 1.31 0.00 0.00 55.95 58.65 1gh9 s SER 61 Cb 0.00 -2.37 0.49 0.00 0.21 0.00 0.00 66.02 64.35 1gh9 s SER 61 CO 0.00 0.07 1.43 0.00 0.41 0.00 0.00 173.24 175.14 1gh9 s HIS 63 N -1.95 2.22 -0.10 0.00 4.02 -1.26 -5.03 115.29 113.19 1gh9 s HIS 63 Ca 0.32 -0.45 -0.03 0.00 1.02 0.00 0.00 55.06 55.92 1gh9 s HIS 63 Cb 0.20 -1.11 -0.05 0.00 -1.02 0.00 0.00 32.58 30.60 1gh9 s HIS 63 CO 0.31 0.59 2.67 0.34 1.02 0.00 0.00 174.74 179.66 1gh9 n PHE 64 N -0.65 0.43 -3.72 1.40 7.35 -1.26 -4.89 117.46 116.12 1gh9 n PHE 64 Ca -0.05 -1.44 -0.35 0.00 -0.76 0.00 0.00 57.45 54.85 1gh9 n PHE 64 Cb 0.62 -1.06 -0.05 0.00 0.35 0.00 0.00 39.48 39.33 1gh9 n PHE 64 CO 0.00 0.00 0.00 -0.08 -0.76 0.00 0.00 176.76 175.92 1gh9 s THR 65 N -0.28 5.26 0.67 -2.13 -1.32 -1.26 -5.09 115.64 111.49 1gh9 s THR 65 Ca 0.35 0.25 -0.13 0.00 -1.21 0.00 0.00 61.69 60.95 1gh9 s THR 65 Cb 0.20 -3.58 0.00 0.00 -1.51 0.00 0.00 72.50 67.61 1gh9 s THR 65 CO -0.03 0.38 1.08 0.20 -2.21 0.00 0.00 174.62 174.04 1gh9 s ASN 66 N -1.65 5.25 0.36 8.08 0.02 -1.26 -4.93 114.94 120.81 1gh9 s ASN 66 Ca 0.28 1.82 0.05 0.00 -1.02 0.00 0.00 52.86 53.99 1gh9 s ASN 66 Cb -0.13 -2.53 0.69 0.00 0.02 0.00 0.00 41.25 39.30 1gh9 s ASN 66 CO 0.16 -1.53 1.96 1.55 0.02 0.00 0.00 177.10 179.26 1gh9 h PRO 67 N -0.24 0.60 -0.00 -0.60 0.13 -1.97 -1.10 132.00 128.82 1gh9 h PRO 67 Ca -0.45 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1gh9 h PRO 67 Cb 1.23 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1gh9 h PRO 67 CO 0.55 0.49 -0.08 0.45 -0.23 0.00 0.00 178.00 179.18 1gh9 n SER 68 N -4.38 0.16 -4.94 1.44 2.88 -1.26 -4.85 113.62 102.67 1gh9 n SER 68 Ca 0.03 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.33 1gh9 n SER 68 Cb 0.14 -0.26 0.04 0.00 -0.75 0.00 0.00 64.21 63.38 1gh9 n SER 68 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1gh9 s LYS 69 N -2.77 2.62 0.00 -1.46 1.02 -0.42 -5.09 119.74 113.65 1gh9 s LYS 69 Ca 0.21 -0.31 0.00 0.00 0.02 0.00 0.00 55.97 55.89 1gh9 s LYS 69 Cb 0.19 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 35.18 1gh9 s LYS 69 CO 0.52 -0.82 0.00 0.54 -0.92 0.00 0.00 175.35 174.66 1gh9 n ARG 70 N -2.58 0.00 0.00 1.68 3.00 -1.26 -4.85 116.66 112.65 1gh9 n ARG 70 Ca 0.06 0.00 0.14 0.00 -0.01 0.00 0.00 57.85 58.04 1gh9 n ARG 70 Cb 0.59 0.00 0.43 0.00 0.00 0.00 0.00 32.46 33.48 1gh9 n ARG 70 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02