#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 3.20 0.19 2.03 1.51 0.49 -2.04 117.35 122.73 1gh9 s TYR 2 Ca 0.00 -0.00 0.06 0.00 -1.01 0.00 0.00 57.07 56.12 1gh9 s TYR 2 Cb 0.00 -1.53 -0.05 0.00 -0.11 0.00 0.00 41.96 40.27 1gh9 s TYR 2 CO 0.00 0.52 -0.11 0.96 -1.11 0.00 0.00 175.55 175.81 1gh9 s ILE 3 N -1.76 1.46 0.09 2.71 -4.36 0.68 -2.01 121.20 118.00 1gh9 s ILE 3 Ca 0.31 -2.13 0.08 0.00 -0.26 0.00 0.00 60.65 58.65 1gh9 s ILE 3 Cb -0.10 -2.03 -0.03 0.00 1.25 0.00 0.00 42.46 41.54 1gh9 s ILE 3 CO 0.24 -0.60 -0.20 -0.63 0.24 0.00 0.00 174.94 173.99 1gh9 s ILE 4 N -3.15 1.65 0.00 8.37 1.09 0.56 -1.54 121.20 128.18 1gh9 s ILE 4 Ca 0.21 -1.46 0.00 0.00 -1.10 0.00 0.00 60.65 58.30 1gh9 s ILE 4 Cb 0.01 -1.50 0.00 0.00 -1.06 0.00 0.00 42.46 39.92 1gh9 s ILE 4 CO 0.05 -0.03 0.00 2.22 -0.10 0.00 0.00 174.94 177.08 1gh9 n PHE 5 N 1.24 -0.08 -3.77 3.97 -1.74 -0.76 -1.42 117.46 114.90 1gh9 n PHE 5 Ca -0.19 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.56 1gh9 n PHE 5 Cb 0.54 0.00 -0.15 0.00 1.52 0.00 0.00 39.48 41.39 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 -0.25 0.05 0.77 3.97 0.52 -1.19 -2.91 118.95 119.91 1gh9 s ARG 6 Ca 0.00 0.28 -0.12 0.00 -0.52 0.00 0.00 55.73 55.37 1gh9 s ARG 6 Cb 0.00 -0.18 0.05 0.00 0.52 0.00 0.00 34.95 35.35 1gh9 s ARG 6 CO 0.00 -0.15 1.11 0.00 0.02 0.00 0.00 175.30 176.28 1gh9 h ASP 8 N -0.94 0.00 0.00 0.00 3.58 -1.88 0.22 116.42 117.40 1gh9 h ASP 8 Ca -0.46 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.99 1gh9 h ASP 8 Cb 1.27 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.32 1gh9 h ASP 8 CO 0.62 0.14 0.00 0.00 -2.88 0.00 0.00 179.24 177.12 1gh9 n GLY 10 N 0.25 0.53 0.00 0.00 0.00 0.77 -5.05 105.19 101.69 1gh9 n GLY 10 Ca 0.09 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.81 0.41 -3.62 1.61 5.12 -1.13 -4.66 116.66 111.58 1gh9 n ARG 11 Ca 0.00 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.77 1gh9 n ARG 11 Cb 0.00 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.23 1gh9 n ARG 11 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1gh9 s ALA 12 N -3.99 -1.66 0.24 7.54 0.00 -1.26 -1.90 121.76 120.73 1gh9 s ALA 12 Ca 0.00 1.68 0.02 0.00 0.00 0.00 0.00 51.96 53.66 1gh9 s ALA 12 Cb 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 1gh9 s ALA 12 CO 0.00 -0.33 0.27 1.28 0.00 0.00 0.00 175.76 176.98 1gh9 n LEU 13 N 2.17 0.00 -3.95 0.00 4.77 -1.15 -4.90 117.00 113.94 1gh9 n LEU 13 Ca -0.16 -2.16 -0.13 0.00 -0.03 0.00 0.00 56.01 53.54 1gh9 n LEU 13 Cb 0.56 1.47 -0.13 0.00 -2.33 0.00 0.00 43.42 42.99 1gh9 n LEU 13 CO 0.10 -0.42 -0.38 -0.72 -1.33 0.00 0.00 177.39 174.65 1gh9 s TYR 14 N -3.20 0.32 0.00 -1.77 1.13 -1.26 -1.83 117.35 110.75 1gh9 s TYR 14 Ca 0.25 -0.19 0.00 0.00 -1.41 0.00 0.00 57.07 55.72 1gh9 s TYR 14 Cb 0.00 -0.21 0.00 0.00 -1.10 0.00 0.00 41.96 40.66 1gh9 s TYR 14 CO 0.18 -0.04 0.00 0.45 -2.51 0.00 0.00 175.55 173.63 1gh9 n SER 15 N 2.57 0.00 -4.78 -0.18 2.88 -0.59 -4.95 113.62 108.57 1gh9 n SER 15 Ca -0.16 -0.99 -0.38 0.00 -1.33 0.00 0.00 58.87 56.02 1gh9 n SER 15 Cb 0.58 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.99 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 -1.97 4.33 -0.30 -1.46 0.52 -1.26 -0.23 118.95 118.58 1gh9 s ARG 16 Ca 0.00 1.56 -0.32 0.00 -0.52 0.00 0.00 55.73 56.46 1gh9 s ARG 16 Cb 0.00 -2.74 -0.08 0.00 0.52 0.00 0.00 34.95 32.65 1gh9 s ARG 16 CO 0.00 -0.00 2.22 -1.91 0.02 0.00 0.00 175.30 175.63 1gh9 n GLU 17 N 0.33 1.48 0.00 3.54 0.00 -0.86 -2.93 120.64 122.19 1gh9 n GLU 17 Ca 0.03 0.39 0.00 0.00 0.00 0.00 0.00 57.16 57.58 1gh9 n GLU 17 Cb 0.48 -2.85 0.00 0.00 0.00 0.00 0.00 31.44 29.07 1gh9 n GLU 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1gh9 n GLY 18 N 6.17 0.24 3.61 8.31 0.00 -1.26 -4.96 105.19 117.31 1gh9 n GLY 18 Ca 0.36 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.95 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 3.11 -0.15 4.61 0.00 -1.15 -4.87 121.76 123.31 1gh9 s ALA 19 Ca 0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 51.96 51.80 1gh9 s ALA 19 Cb 0.00 -3.91 -0.24 0.00 0.00 0.00 0.00 23.12 18.97 1gh9 s ALA 19 CO 0.00 -2.26 0.35 1.57 0.00 0.00 0.00 175.76 175.42 1gh9 h LYS 20 N 10.61 0.17 -2.30 0.00 -0.00 -1.94 -3.45 116.57 119.65 1gh9 h LYS 20 Ca -0.28 -0.29 -0.26 0.00 -0.00 0.00 0.00 60.65 59.81 1gh9 h LYS 20 Cb 1.11 0.11 -0.34 0.00 -0.00 0.00 0.00 32.23 33.11 1gh9 h LYS 20 CO 1.07 1.14 -0.58 0.95 -0.00 0.00 0.00 179.45 182.03 1gh9 s THR 21 N -2.48 -0.42 0.04 0.07 -4.23 -1.26 -3.16 115.64 104.20 1gh9 s THR 21 Ca -0.24 -0.11 -0.00 0.00 -1.18 0.00 0.00 61.69 60.15 1gh9 s THR 21 Cb 0.06 -0.73 0.01 0.00 1.34 0.00 0.00 72.50 73.17 1gh9 s THR 21 CO 0.71 -0.19 0.05 0.54 -0.54 0.00 0.00 174.62 175.19 1gh9 n ARG 22 N 5.33 0.41 -3.76 3.99 5.12 0.13 -4.94 116.66 122.94 1gh9 n ARG 22 Ca -0.05 -0.12 -0.13 0.00 -1.93 0.00 0.00 57.85 55.62 1gh9 n ARG 22 Cb 0.50 -0.04 -0.10 0.00 -1.16 0.00 0.00 32.46 31.66 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 -2.68 0.49 -0.21 5.56 2.20 -1.26 -2.41 119.74 121.42 1gh9 s LYS 23 Ca 0.03 0.27 -0.13 0.00 -0.36 0.00 0.00 55.97 55.78 1gh9 s LYS 23 Cb -0.00 0.23 -0.04 0.00 -1.51 0.00 0.00 37.83 36.50 1gh9 s LYS 23 CO 0.02 -0.09 0.28 0.00 -0.36 0.00 0.00 175.35 175.20 1gh9 h VAL 25 N 4.96 0.00 0.00 0.00 2.07 -2.01 -2.08 116.25 119.18 1gh9 h VAL 25 Ca -0.38 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 66.78 1gh9 h VAL 25 Cb 1.16 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 1gh9 h VAL 25 CO 0.70 0.00 -0.44 0.00 0.02 0.00 0.00 177.57 177.85 1gh9 n GLY 27 N -0.19 0.01 0.00 0.00 0.00 -0.81 -5.17 105.19 99.04 1gh9 n GLY 27 Ca -0.02 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1gh9 n GLY 27 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1gh9 n ARG 28 N 0.00 0.00 -3.84 1.61 0.00 -1.08 -5.01 116.66 108.35 1gh9 n ARG 28 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.72 1gh9 n ARG 28 Cb 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 32.46 32.31 1gh9 n ARG 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1gh9 s THR 29 N -2.45 -0.01 -0.40 8.89 2.01 -1.26 -1.26 115.64 121.15 1gh9 s THR 29 Ca 0.00 0.09 -0.15 0.00 0.31 0.00 0.00 61.69 61.94 1gh9 s THR 29 Cb 0.00 -0.05 0.02 0.00 0.01 0.00 0.00 72.50 72.48 1gh9 s THR 29 CO 0.00 0.04 0.29 -0.69 -0.69 0.00 0.00 174.62 173.57 1gh9 s VAL 30 N 0.46 5.23 -0.32 3.82 1.01 -1.01 -2.93 120.40 126.65 1gh9 s VAL 30 Ca -0.04 -0.61 -0.18 0.00 0.00 0.00 0.00 61.98 61.15 1gh9 s VAL 30 Cb -0.06 -3.88 -0.01 0.00 0.00 0.00 0.00 36.38 32.43 1gh9 s VAL 30 CO -0.01 -0.27 0.52 0.21 0.00 0.00 0.00 175.10 175.55 1gh9 s ASN 31 N 1.68 6.36 0.74 3.32 2.47 -0.82 -0.69 114.94 128.01 1gh9 s ASN 31 Ca 0.05 0.18 0.00 0.00 0.42 0.00 0.00 52.86 53.51 1gh9 s ASN 31 Cb -0.19 -2.28 0.00 0.00 -1.45 0.00 0.00 41.25 37.34 1gh9 s ASN 31 CO 0.10 -0.42 0.00 1.33 -3.72 0.00 0.00 177.10 174.39 1gh9 n VAL 32 N 5.34 0.00 -0.20 -5.21 0.24 -1.19 -3.14 118.33 114.18 1gh9 n VAL 32 Ca -0.04 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.06 1gh9 n VAL 32 Cb 0.49 -0.60 0.19 0.00 -1.47 0.00 0.00 33.84 32.45 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 -1.26 -3.39 -0.06 7.34 0.00 -1.26 -4.72 118.16 114.80 1gh9 n LYS 33 Ca 0.00 -0.93 -0.22 0.00 0.00 0.00 0.00 58.31 57.17 1gh9 n LYS 33 Cb 0.00 -1.30 -0.12 0.00 0.00 0.00 0.00 35.03 33.61 1gh9 n LYS 33 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1gh9 h ASP 34 N -3.03 0.14 0.00 3.14 3.32 -1.95 -3.46 116.42 114.58 1gh9 h ASP 34 Ca -0.25 -0.67 0.00 0.00 0.02 0.00 0.00 57.03 56.13 1gh9 h ASP 34 Cb 0.85 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1gh9 h ASP 34 CO 0.15 1.59 0.00 0.54 -1.72 0.00 0.00 179.24 179.80 1gh9 n ARG 35 N -4.15 0.00 0.00 3.56 1.74 -1.26 -5.01 116.66 111.54 1gh9 n ARG 35 Ca -0.31 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.77 1gh9 n ARG 35 Cb 0.79 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.23 1gh9 n ARG 35 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1gh9 n ARG 36 N 0.00 0.00 -3.61 5.56 1.74 -1.26 -5.08 116.66 114.01 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 0.14 0.55 -1.09 -1.26 -4.52 121.20 115.08 1gh9 s ILE 37 Ca 0.00 -0.44 -0.13 0.00 -2.23 0.00 0.00 60.65 57.85 1gh9 s ILE 37 Cb 0.00 -1.07 -0.07 0.00 -1.58 0.00 0.00 42.46 39.74 1gh9 s ILE 37 CO 0.00 -0.24 0.51 0.12 -1.23 0.00 0.00 174.94 174.10 1gh9 s PHE 38 N -3.29 3.58 -0.08 3.97 2.19 -0.51 -4.72 117.98 119.11 1gh9 s PHE 38 Ca -0.00 0.97 -0.02 0.00 0.33 0.00 0.00 56.93 58.21 1gh9 s PHE 38 Cb 0.01 -2.31 0.01 0.00 -1.31 0.00 0.00 43.02 39.42 1gh9 s PHE 38 CO -0.08 0.43 0.05 0.41 1.83 0.00 0.00 175.22 177.86 1gh9 n GLY 39 N 0.71 -1.63 3.42 13.12 0.00 -1.26 -0.32 105.19 119.24 1gh9 n GLY 39 Ca -0.05 0.42 -0.44 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.64 3.54 -0.29 1.61 3.00 -1.26 -1.14 118.95 123.76 1gh9 s ARG 40 Ca -0.06 -1.81 -0.17 0.00 -1.00 0.00 0.00 55.73 52.70 1gh9 s ARG 40 Cb 0.00 -4.75 -0.02 0.00 0.00 0.00 0.00 34.95 30.18 1gh9 s ARG 40 CO 0.26 -1.68 0.46 0.00 0.00 0.00 0.00 175.30 174.35 1gh9 s ALA 41 N 2.32 3.55 0.00 6.12 0.00 -0.85 -4.94 121.76 127.96 1gh9 s ALA 41 Ca 0.28 -0.80 -0.07 0.00 0.00 0.00 0.00 51.96 51.37 1gh9 s ALA 41 Cb -0.08 -2.86 -0.30 0.00 0.00 0.00 0.00 23.12 19.88 1gh9 s ALA 41 CO -0.07 -0.85 0.87 0.22 0.00 0.00 0.00 175.76 175.93 1gh9 h ASP 42 N 8.20 0.53 -3.32 0.00 1.82 -1.94 0.14 116.42 121.85 1gh9 h ASP 42 Ca -0.30 -0.69 -0.56 0.00 -0.39 0.00 0.00 57.03 55.09 1gh9 h ASP 42 Cb 1.14 -0.17 -0.05 0.00 0.68 0.00 0.00 39.33 40.93 1gh9 h ASP 42 CO 0.70 1.57 0.02 -0.62 -1.61 0.00 0.00 179.24 179.30 1gh9 s ASP 43 N -7.19 7.06 0.25 2.28 -1.08 -1.26 -4.44 116.67 112.30 1gh9 s ASP 43 Ca -0.10 1.26 -0.04 0.00 -0.52 0.00 0.00 52.55 53.16 1gh9 s ASP 43 Cb 0.06 -2.39 0.39 0.00 -1.46 0.00 0.00 42.92 39.52 1gh9 s ASP 43 CO 0.87 0.15 1.84 2.19 0.52 0.00 0.00 175.17 180.75 1gh9 h PHE 44 N 5.23 1.01 -0.20 -5.34 -0.00 -2.01 -0.11 116.94 115.52 1gh9 h PHE 44 Ca -0.46 0.03 -0.10 0.00 -0.00 0.00 0.00 57.97 57.43 1gh9 h PHE 44 Cb 1.21 -0.32 -0.01 0.00 -0.00 0.00 0.00 35.95 36.82 1gh9 h PHE 44 CO 0.66 0.48 -0.31 1.49 -0.00 0.00 0.00 178.31 180.63 1gh9 h GLU 45 N 0.97 0.40 0.00 6.09 4.81 -1.99 -2.45 114.58 122.41 1gh9 h GLU 45 Ca 0.41 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.41 1gh9 h GLU 45 Cb 0.26 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 1gh9 h GLU 45 CO -0.20 0.68 -0.28 1.49 -0.73 0.00 0.00 179.01 179.96 1gh9 h GLU 46 N 0.35 0.00 0.78 1.92 4.81 -1.48 -2.94 114.58 118.02 1gh9 h GLU 46 Ca 0.05 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1gh9 h GLU 46 Cb 0.73 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.11 1gh9 h GLU 46 CO 0.06 0.28 -0.42 0.00 -0.73 0.00 0.00 179.01 178.20 1gh9 h ALA 47 N 1.72 -1.12 -0.58 2.92 0.00 -0.63 0.85 119.26 122.42 1gh9 h ALA 47 Ca -0.00 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.69 1gh9 h ALA 47 Cb 0.63 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1gh9 h ALA 47 CO 0.04 -1.14 0.38 1.03 0.00 0.00 0.00 179.25 179.56 1gh9 h SER 48 N -1.10 0.62 -0.28 0.00 0.87 -1.59 -1.23 113.55 110.84 1gh9 h SER 48 Ca -0.10 -0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.30 1gh9 h SER 48 Cb 0.86 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 1gh9 h SER 48 CO 0.15 0.44 -0.35 -0.33 -0.53 0.00 0.00 176.83 176.21 1gh9 h GLU 49 N 0.73 0.82 -0.43 2.24 5.08 -1.33 -1.75 114.58 119.95 1gh9 h GLU 49 Ca 0.22 -0.41 -0.11 0.00 -1.00 0.00 0.00 59.36 58.06 1gh9 h GLU 49 Cb -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1gh9 h GLU 49 CO -0.05 1.04 -0.17 -0.07 -1.00 0.00 0.00 179.01 178.76 1gh9 h LEU 50 N 0.68 0.89 -1.04 1.33 3.38 -0.15 -2.81 115.31 117.59 1gh9 h LEU 50 Ca 0.06 -0.39 -0.07 0.00 0.09 0.00 0.00 57.88 57.58 1gh9 h LEU 50 Cb 0.91 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1gh9 h LEU 50 CO 0.08 1.08 -0.07 0.58 0.09 0.00 0.00 178.44 180.20 1gh9 h VAL 51 N 0.70 1.23 -0.52 1.22 2.07 -1.18 0.43 116.25 120.20 1gh9 h VAL 51 Ca 0.10 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 1gh9 h VAL 51 Cb 0.73 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1gh9 h VAL 51 CO 0.06 0.33 0.29 -0.09 0.02 0.00 0.00 177.57 178.17 1gh9 h ARG 52 N 0.56 0.72 -0.29 1.57 2.43 -1.16 0.80 114.38 119.02 1gh9 h ARG 52 Ca 0.11 -0.08 -0.13 0.00 -0.81 0.00 0.00 59.98 59.07 1gh9 h ARG 52 Cb 0.46 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1gh9 h ARG 52 CO 0.02 0.56 -0.35 -0.22 -1.51 0.00 0.00 179.97 178.47 1gh9 h LYS 53 N 0.69 0.64 0.00 0.20 3.64 -1.24 -2.39 116.57 118.11 1gh9 h LYS 53 Ca 0.18 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1gh9 h LYS 53 Cb 0.04 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1gh9 h LYS 53 CO -0.03 0.90 0.00 1.28 -2.27 0.00 0.00 179.45 179.33 1gh9 n LEU 54 N -4.06 0.24 0.00 5.20 7.99 0.12 -4.61 117.00 121.88 1gh9 n LEU 54 Ca -0.01 0.57 -0.01 0.00 -0.01 0.00 0.00 56.01 56.54 1gh9 n LEU 54 Cb 0.49 -0.54 0.01 0.00 -0.11 0.00 0.00 43.42 43.27 1gh9 n LEU 54 CO 0.45 -0.41 0.02 0.00 -1.51 0.00 0.00 177.39 175.93 1gh9 n GLN 55 N -1.78 -1.44 -2.15 3.23 1.13 0.20 -4.68 117.38 111.89 1gh9 n GLN 55 Ca 0.02 -0.06 -0.40 0.00 -1.94 0.00 0.00 57.00 54.63 1gh9 n GLN 55 Cb 0.16 -0.06 -0.02 0.00 0.11 0.00 0.00 30.24 30.43 1gh9 n GLN 55 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1gh9 n GLU 56 N -1.80 2.60 -1.68 -1.09 2.13 -1.26 -4.96 120.64 114.58 1gh9 n GLU 56 Ca 0.01 -2.82 -0.30 0.00 0.66 0.00 0.00 57.16 54.71 1gh9 n GLU 56 Cb 0.02 -3.45 0.06 0.00 0.27 0.00 0.00 31.44 28.35 1gh9 n GLU 56 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1gh9 s GLU 57 N 4.61 2.58 0.42 5.31 2.12 -1.26 -5.07 118.70 127.41 1gh9 s GLU 57 Ca 0.56 0.65 -0.07 0.00 0.36 0.00 0.00 54.97 56.47 1gh9 s GLU 57 Cb 0.06 -1.97 0.10 0.00 0.26 0.00 0.00 34.13 32.57 1gh9 s GLU 57 CO 0.06 -1.27 0.55 1.63 -0.54 0.00 0.00 175.26 175.69 1gh9 n LYS 58 N -3.20 -0.70 -2.91 4.30 5.02 -1.26 -4.95 118.16 114.46 1gh9 n LYS 58 Ca 0.07 -0.85 -0.44 0.00 -2.02 0.00 0.00 58.31 55.07 1gh9 n LYS 58 Cb 0.56 -0.59 -0.00 0.00 -0.02 0.00 0.00 35.03 34.98 1gh9 n LYS 58 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1gh9 s TYR 59 N -2.17 3.43 0.00 2.13 2.02 -1.26 -4.43 117.35 117.06 1gh9 s TYR 59 Ca 0.31 -2.07 0.00 0.00 -0.37 0.00 0.00 57.07 54.94 1gh9 s TYR 59 Cb -0.01 -4.36 0.00 0.00 -0.40 0.00 0.00 41.96 37.19 1gh9 s TYR 59 CO 0.22 -1.44 0.00 0.41 -1.57 0.00 0.00 175.55 173.18 1gh9 n GLY 60 N 4.26 0.50 3.97 0.71 0.00 -1.26 -5.09 105.19 108.27 1gh9 n GLY 60 Ca 0.38 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.47 4.26 0.90 1.61 0.01 -1.26 -5.07 113.70 113.68 1gh9 s SER 61 Ca 0.00 -0.10 -0.11 0.00 1.31 0.00 0.00 55.95 57.05 1gh9 s SER 61 Cb 0.00 -0.30 0.13 0.00 0.21 0.00 0.00 66.02 66.06 1gh9 s SER 61 CO 0.00 -1.92 1.09 0.00 0.41 0.00 0.00 173.24 172.82 1gh9 n HIS 63 N -3.96 -3.98 -2.56 0.00 -0.00 -1.26 -4.98 115.22 98.48 1gh9 n HIS 63 Ca 0.07 -1.11 -0.43 0.00 0.46 0.00 0.00 57.72 56.72 1gh9 n HIS 63 Cb 0.55 -1.02 -0.02 0.00 -0.12 0.00 0.00 29.99 29.38 1gh9 n HIS 63 CO 0.00 0.00 0.00 -0.06 0.46 0.00 0.00 176.34 176.74 1gh9 s PHE 64 N -3.66 2.95 -0.16 1.57 0.40 -1.26 -4.90 117.98 112.92 1gh9 s PHE 64 Ca 0.72 1.02 -0.14 0.00 -0.60 0.00 0.00 56.93 57.93 1gh9 s PHE 64 Cb -0.03 -3.88 -0.05 0.00 0.51 0.00 0.00 43.02 39.57 1gh9 s PHE 64 CO 0.52 -1.15 -0.28 0.25 0.70 0.00 0.00 175.22 175.26 1gh9 n THR 65 N 6.14 1.41 -1.05 0.64 -2.24 -1.26 -5.00 114.28 112.92 1gh9 n THR 65 Ca 0.13 0.18 -0.29 0.00 -2.27 0.00 0.00 64.05 61.80 1gh9 n THR 65 Cb 0.47 -2.33 0.17 0.00 -2.10 0.00 0.00 70.33 66.54 1gh9 n THR 65 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1gh9 s ASN 66 N -5.77 2.71 0.00 3.42 4.22 -1.25 -2.60 114.94 115.67 1gh9 s ASN 66 Ca -0.23 1.44 0.00 0.00 -2.14 0.00 0.00 52.86 51.92 1gh9 s ASN 66 Cb 0.03 -2.11 0.00 0.00 1.28 0.00 0.00 41.25 40.45 1gh9 s ASN 66 CO 0.34 -3.11 0.56 -2.65 -2.04 0.00 0.00 177.10 170.20 1gh9 n PRO 67 N -4.19 0.89 -0.05 3.55 -0.02 -1.26 -4.83 135.00 129.10 1gh9 n PRO 67 Ca 0.06 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1gh9 n PRO 67 Cb 0.55 -1.35 -0.00 0.00 -0.02 0.00 0.00 33.50 32.69 1gh9 n PRO 67 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1gh9 h SER 68 N 0.13 0.00 -3.28 2.55 0.02 -1.90 -3.46 113.55 107.61 1gh9 h SER 68 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 1gh9 h SER 68 Cb 0.56 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.05 1gh9 h SER 68 CO 0.00 0.47 -0.03 -0.54 -1.14 0.00 0.00 176.83 175.59 1gh9 s LYS 69 N -1.56 4.28 -1.35 3.45 3.01 -1.20 -4.99 119.74 121.38 1gh9 s LYS 69 Ca -0.01 0.71 -0.15 0.00 -1.01 0.00 0.00 55.97 55.50 1gh9 s LYS 69 Cb 0.00 -3.33 0.08 0.00 -1.01 0.00 0.00 37.83 33.57 1gh9 s LYS 69 CO 0.02 0.41 1.91 2.89 0.51 0.00 0.00 175.35 181.10 1gh9 n ARG 70 N 2.58 3.12 0.00 1.68 1.85 -1.26 -3.95 116.66 120.68 1gh9 n ARG 70 Ca -0.08 -3.10 0.14 0.00 -1.00 0.00 0.00 57.85 53.82 1gh9 n ARG 70 Cb 0.51 -3.32 0.52 0.00 -1.05 0.00 0.00 32.46 29.12 1gh9 n ARG 70 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71