#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 3.08 0.20 2.03 1.51 0.81 -1.45 117.35 123.53 1gh9 s TYR 2 Ca 0.00 -0.01 0.06 0.00 -1.01 0.00 0.00 57.07 56.11 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 0.51 -0.09 0.96 -1.11 0.00 0.00 175.55 175.82 1gh9 s ILE 3 N -1.53 1.42 0.08 2.71 -4.36 0.60 -1.82 121.20 118.31 1gh9 s ILE 3 Ca 0.29 -2.12 0.07 0.00 -0.26 0.00 0.00 60.65 58.63 1gh9 s ILE 3 Cb -0.11 -2.10 -0.03 0.00 1.25 0.00 0.00 42.46 41.46 1gh9 s ILE 3 CO 0.21 -0.55 -0.19 -0.63 0.24 0.00 0.00 174.94 174.02 1gh9 s ILE 4 N -3.17 1.55 0.00 8.37 1.09 0.13 -1.58 121.20 127.59 1gh9 s ILE 4 Ca 0.23 -1.42 0.00 0.00 -1.10 0.00 0.00 60.65 58.36 1gh9 s ILE 4 Cb 0.02 -1.41 0.00 0.00 -1.06 0.00 0.00 42.46 40.01 1gh9 s ILE 4 CO 0.06 -0.06 0.00 2.22 -0.10 0.00 0.00 174.94 177.06 1gh9 n PHE 5 N 1.27 -0.10 -3.76 3.97 -1.74 -0.77 -2.17 117.46 114.17 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 -0.62 0.07 0.69 3.97 0.52 -1.20 -2.95 118.95 119.44 1gh9 s ARG 6 Ca 0.00 0.33 -0.11 0.00 -0.52 0.00 0.00 55.73 55.43 1gh9 s ARG 6 Cb 0.00 -0.18 0.01 0.00 0.52 0.00 0.00 34.95 35.30 1gh9 s ARG 6 CO 0.00 -0.16 1.07 0.00 0.02 0.00 0.00 175.30 176.23 1gh9 h ASP 8 N -0.65 0.00 0.00 0.00 3.32 -1.88 0.28 116.42 117.49 1gh9 h ASP 8 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1gh9 h ASP 8 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1gh9 h ASP 8 CO 0.60 0.12 0.00 0.00 -1.72 0.00 0.00 179.24 178.24 1gh9 n GLY 10 N 0.24 0.57 0.00 0.00 0.00 0.98 -5.05 105.19 101.92 1gh9 n GLY 10 Ca 0.09 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.80 0.14 -3.60 1.61 5.12 -1.11 -4.67 116.66 111.34 1gh9 n ARG 11 Ca 0.00 0.00 -0.16 0.00 -1.93 0.00 0.00 57.85 55.76 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 -3.96 -1.56 0.30 7.54 0.00 -1.26 -1.21 121.76 121.62 1gh9 s ALA 12 Ca 0.00 1.33 0.02 0.00 0.00 0.00 0.00 51.96 53.31 1gh9 s ALA 12 Cb 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 23.12 22.78 1gh9 s ALA 12 CO 0.00 -0.33 0.35 1.28 0.00 0.00 0.00 175.76 177.06 1gh9 n LEU 13 N 1.57 0.00 -3.97 0.00 4.77 -1.15 -4.89 117.00 113.31 1gh9 n LEU 13 Ca -0.18 -2.67 -0.15 0.00 -0.03 0.00 0.00 56.01 52.98 1gh9 n LEU 13 Cb 0.56 1.89 -0.14 0.00 -2.33 0.00 0.00 43.42 43.41 1gh9 n LEU 13 CO 0.18 -0.53 -0.40 -0.72 -1.33 0.00 0.00 177.39 174.59 1gh9 s TYR 14 N -3.16 0.48 0.05 -1.77 1.13 -1.26 -1.84 117.35 110.97 1gh9 s TYR 14 Ca 0.30 -0.17 -0.01 0.00 -1.41 0.00 0.00 57.07 55.78 1gh9 s TYR 14 Cb 0.00 -0.30 0.00 0.00 -1.10 0.00 0.00 41.96 40.56 1gh9 s TYR 14 CO 0.22 -0.02 0.08 0.45 -2.51 0.00 0.00 175.55 173.76 1gh9 n SER 15 N 2.65 -0.23 -4.77 -0.18 2.88 -0.62 -4.95 113.62 108.40 1gh9 n SER 15 Ca -0.15 -1.21 -0.38 0.00 -1.33 0.00 0.00 58.87 55.81 1gh9 n SER 15 Cb 0.58 0.39 -0.04 0.00 -0.75 0.00 0.00 64.21 64.38 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 -2.05 4.32 -0.31 -1.46 0.52 -1.26 -0.29 118.95 118.42 1gh9 s ARG 16 Ca 0.03 1.59 -0.32 0.00 -0.52 0.00 0.00 55.73 56.51 1gh9 s ARG 16 Cb -0.00 -2.74 -0.09 0.00 0.52 0.00 0.00 34.95 32.64 1gh9 s ARG 16 CO 0.02 -0.02 2.22 -1.91 0.02 0.00 0.00 175.30 175.63 1gh9 n GLU 17 N 0.32 1.43 0.00 3.54 2.13 -0.53 -2.74 120.64 124.80 1gh9 n GLU 17 Ca 0.03 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.23 1gh9 n GLU 17 Cb 0.48 -2.82 0.00 0.00 0.27 0.00 0.00 31.44 29.37 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 6.21 -0.40 3.63 8.31 0.00 -1.26 -4.96 105.19 116.73 1gh9 n GLY 18 Ca 0.37 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.04 3.39 -0.18 4.61 0.00 -1.11 -4.89 121.76 123.54 1gh9 s ALA 19 Ca 0.00 0.21 -0.18 0.00 0.00 0.00 0.00 51.96 51.99 1gh9 s ALA 19 Cb 0.00 -3.77 -0.22 0.00 0.00 0.00 0.00 23.12 19.14 1gh9 s ALA 19 CO 0.00 -1.72 0.31 0.87 0.00 0.00 0.00 175.76 175.22 1gh9 h LYS 20 N 9.37 0.08 -2.88 0.00 6.56 -1.96 -3.46 116.57 124.28 1gh9 h LYS 20 Ca -0.27 -0.14 -0.32 0.00 -1.06 0.00 0.00 60.65 58.86 1gh9 h LYS 20 Cb 1.11 0.05 -0.36 0.00 -0.57 0.00 0.00 32.23 32.46 1gh9 h LYS 20 CO 1.02 1.07 -0.64 0.95 -2.06 0.00 0.00 179.45 179.79 1gh9 s THR 21 N -2.41 -0.27 0.01 -0.16 -4.23 -1.26 -3.17 115.64 104.14 1gh9 s THR 21 Ca -0.26 0.13 -0.00 0.00 -1.18 0.00 0.00 61.69 60.38 1gh9 s THR 21 Cb 0.06 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.43 1gh9 s THR 21 CO 0.65 -0.02 0.01 0.54 -0.54 0.00 0.00 174.62 175.26 1gh9 n ARG 22 N 5.32 0.37 -3.75 3.99 5.12 0.85 -4.95 116.66 123.62 1gh9 n ARG 22 Ca -0.05 -0.03 -0.13 0.00 -1.93 0.00 0.00 57.85 55.71 1gh9 n ARG 22 Cb 0.50 -0.01 -0.10 0.00 -1.16 0.00 0.00 32.46 31.68 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 -2.65 0.42 -0.27 5.56 2.20 -1.26 -2.85 119.74 120.89 1gh9 s LYS 23 Ca 0.01 0.51 -0.11 0.00 -0.36 0.00 0.00 55.97 56.01 1gh9 s LYS 23 Cb -0.00 0.21 -0.05 0.00 -1.51 0.00 0.00 37.83 36.48 1gh9 s LYS 23 CO 0.01 -0.05 0.19 0.00 -0.36 0.00 0.00 175.35 175.14 1gh9 h VAL 25 N 5.29 0.13 0.00 0.00 2.07 -2.01 -1.60 116.25 120.13 1gh9 h VAL 25 Ca -0.36 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 66.67 1gh9 h VAL 25 Cb 1.18 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.39 1gh9 h VAL 25 CO 0.58 0.04 0.00 0.00 0.02 0.00 0.00 177.57 178.21 1gh9 n GLY 27 N -0.09 0.48 0.72 0.00 0.00 -0.65 -5.17 105.19 100.49 1gh9 n GLY 27 Ca 0.01 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 0.07 -3.77 1.61 1.74 -0.92 -5.00 116.66 110.38 1gh9 n ARG 28 Ca 0.00 -0.20 -0.14 0.00 -0.77 0.00 0.00 57.85 56.75 1gh9 n ARG 28 Cb 0.00 0.29 -0.14 0.00 -1.02 0.00 0.00 32.46 31.59 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 -2.27 -0.04 -0.35 0.55 2.01 -1.26 -1.11 115.64 113.16 1gh9 s THR 29 Ca 0.05 0.15 -0.15 0.00 0.31 0.00 0.00 61.69 62.06 1gh9 s THR 29 Cb -0.00 -0.19 -0.01 0.00 0.01 0.00 0.00 72.50 72.31 1gh9 s THR 29 CO 0.00 0.06 0.33 -0.69 -0.69 0.00 0.00 174.62 173.64 1gh9 s VAL 30 N 0.94 5.20 -0.31 3.82 1.01 -1.13 -3.18 120.40 126.76 1gh9 s VAL 30 Ca -0.07 -0.11 -0.14 0.00 0.00 0.00 0.00 61.98 61.65 1gh9 s VAL 30 Cb -0.10 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 1gh9 s VAL 30 CO -0.04 -0.11 0.34 0.21 0.00 0.00 0.00 175.10 175.50 1gh9 s ASN 31 N 1.73 6.18 1.14 3.32 2.47 -0.92 -0.11 114.94 128.76 1gh9 s ASN 31 Ca 0.10 0.00 -0.09 0.00 0.42 0.00 0.00 52.86 53.29 1gh9 s ASN 31 Cb -0.17 -2.19 0.13 0.00 -1.45 0.00 0.00 41.25 37.57 1gh9 s ASN 31 CO 0.11 -0.24 0.40 1.33 -3.72 0.00 0.00 177.10 174.98 1gh9 n VAL 32 N 5.17 0.00 -0.29 -5.21 0.24 -1.19 -3.23 118.33 113.81 1gh9 n VAL 32 Ca -0.09 -0.12 -0.26 0.00 -2.04 0.00 0.00 64.34 61.83 1gh9 n VAL 32 Cb 0.50 -0.81 0.25 0.00 -1.47 0.00 0.00 33.84 32.31 1gh9 n VAL 32 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1gh9 n LYS 33 N -3.10 -3.91 -0.01 7.34 4.01 -1.26 -4.78 118.16 116.44 1gh9 n LYS 33 Ca 0.06 -1.24 -0.22 0.00 -0.51 0.00 0.00 58.31 56.40 1gh9 n LYS 33 Cb 0.24 -1.76 -0.13 0.00 -0.51 0.00 0.00 35.03 32.86 1gh9 n LYS 33 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 1gh9 h ASP 34 N -3.41 0.33 0.00 4.39 3.32 -1.99 -3.46 116.42 115.60 1gh9 h ASP 34 Ca -0.33 -0.84 0.00 0.00 0.02 0.00 0.00 57.03 55.88 1gh9 h ASP 34 Cb 1.13 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1gh9 h ASP 34 CO 0.20 1.73 0.00 0.54 -1.72 0.00 0.00 179.24 179.99 1gh9 n ARG 35 N -3.79 0.00 0.00 3.56 5.12 -1.26 -5.03 116.66 115.26 1gh9 n ARG 35 Ca -0.30 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.62 1gh9 n ARG 35 Cb 0.94 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 32.24 1gh9 n ARG 35 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1gh9 n ARG 36 N 0.00 0.00 -3.62 5.56 5.12 -1.26 -5.08 116.66 117.38 1gh9 n ARG 36 Ca 0.00 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.77 1gh9 n ARG 36 Cb 0.00 -0.01 -0.07 0.00 -1.16 0.00 0.00 32.46 31.23 1gh9 n ARG 36 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1gh9 s ILE 37 N 0.00 0.03 0.27 0.55 -1.09 -1.26 -4.51 121.20 115.19 1gh9 s ILE 37 Ca 0.00 -0.26 -0.06 0.00 -2.23 0.00 0.00 60.65 58.10 1gh9 s ILE 37 Cb 0.00 -0.88 -0.06 0.00 -1.58 0.00 0.00 42.46 39.94 1gh9 s ILE 37 CO 0.00 -0.14 0.54 0.12 -1.23 0.00 0.00 174.94 174.23 1gh9 s PHE 38 N -1.75 3.47 -0.19 3.97 5.36 -0.92 -4.69 117.98 123.22 1gh9 s PHE 38 Ca -0.09 0.67 -0.05 0.00 -0.96 0.00 0.00 56.93 56.50 1gh9 s PHE 38 Cb -0.02 -2.12 0.01 0.00 -0.34 0.00 0.00 43.02 40.55 1gh9 s PHE 38 CO 0.03 0.21 0.11 0.41 -1.46 0.00 0.00 175.22 174.52 1gh9 n GLY 39 N -0.73 -1.74 3.42 13.12 0.00 -1.26 -0.69 105.19 117.31 1gh9 n GLY 39 Ca -0.01 0.38 -0.45 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.50 3.57 -0.24 1.61 6.06 -1.26 -0.69 118.95 126.49 1gh9 s ARG 40 Ca 0.05 -1.89 -0.16 0.00 -2.50 0.00 0.00 55.73 51.23 1gh9 s ARG 40 Cb -0.01 -4.76 -0.03 0.00 0.06 0.00 0.00 34.95 30.20 1gh9 s ARG 40 CO 0.44 -1.65 0.44 0.00 -2.50 0.00 0.00 175.30 172.02 1gh9 s ALA 41 N 2.13 3.57 0.00 6.12 0.00 -0.76 -4.95 121.76 127.88 1gh9 s ALA 41 Ca 0.28 -0.63 -0.15 0.00 0.00 0.00 0.00 51.96 51.47 1gh9 s ALA 41 Cb -0.07 -2.75 -0.34 0.00 0.00 0.00 0.00 23.12 19.96 1gh9 s ALA 41 CO -0.08 -0.56 0.89 0.22 0.00 0.00 0.00 175.76 176.23 1gh9 h ASP 42 N 7.83 0.77 -3.35 0.00 1.82 -1.95 0.23 116.42 121.77 1gh9 h ASP 42 Ca -0.32 -0.93 -0.56 0.00 -0.39 0.00 0.00 57.03 54.83 1gh9 h ASP 42 Cb 1.15 -0.25 -0.05 0.00 0.68 0.00 0.00 39.33 40.86 1gh9 h ASP 42 CO 0.70 1.73 0.05 -1.81 -1.61 0.00 0.00 179.24 178.29 1gh9 s ASP 43 N -7.49 7.01 0.36 2.28 1.01 -1.26 -4.33 116.67 114.25 1gh9 s ASP 43 Ca -0.11 1.20 0.08 0.00 0.71 0.00 0.00 52.55 54.43 1gh9 s ASP 43 Cb 0.04 -2.40 0.80 0.00 1.01 0.00 0.00 42.92 42.38 1gh9 s ASP 43 CO 0.92 0.01 1.92 2.19 0.21 0.00 0.00 175.17 180.41 1gh9 h PHE 44 N 6.08 0.77 -0.33 4.23 -0.00 -2.00 0.08 116.94 125.77 1gh9 h PHE 44 Ca -0.43 0.02 -0.11 0.00 -0.00 0.00 0.00 57.97 57.44 1gh9 h PHE 44 Cb 1.20 -0.25 -0.01 0.00 -0.00 0.00 0.00 35.95 36.89 1gh9 h PHE 44 CO 0.65 0.34 -0.27 1.49 -0.00 0.00 0.00 178.31 180.53 1gh9 h GLU 45 N 0.70 0.67 0.00 6.09 4.81 -1.98 -2.72 114.58 122.14 1gh9 h GLU 45 Ca 0.38 -0.28 -0.05 0.00 -0.13 0.00 0.00 59.36 59.28 1gh9 h GLU 45 Cb 0.51 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 1gh9 h GLU 45 CO -0.15 0.86 -0.26 0.93 -0.73 0.00 0.00 179.01 179.67 1gh9 h GLU 46 N 0.58 0.00 -0.38 1.92 3.07 -1.41 -2.85 114.58 115.51 1gh9 h GLU 46 Ca 0.08 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.95 1gh9 h GLU 46 Cb 0.75 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.64 1gh9 h GLU 46 CO 0.06 0.26 0.23 0.00 -1.40 0.00 0.00 179.01 178.16 1gh9 h ALA 47 N 1.74 0.48 -0.54 3.43 0.00 -1.02 -0.26 119.26 123.09 1gh9 h ALA 47 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1gh9 h ALA 47 Cb 0.55 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1gh9 h ALA 47 CO 0.03 -0.11 0.35 0.77 0.00 0.00 0.00 179.25 180.30 1gh9 h SER 48 N 0.46 0.62 0.06 0.00 0.02 -1.56 -0.96 113.55 112.19 1gh9 h SER 48 Ca 0.15 -0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 60.97 1gh9 h SER 48 Cb 0.00 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1gh9 h SER 48 CO -0.07 0.45 -0.36 1.05 -1.14 0.00 0.00 176.83 176.76 1gh9 h GLU 49 N 0.73 0.42 -0.30 3.45 -0.00 -1.47 -2.31 114.58 115.10 1gh9 h GLU 49 Ca 0.20 -0.19 -0.12 0.00 -0.00 0.00 0.00 59.36 59.24 1gh9 h GLU 49 Cb -0.08 -0.01 -0.00 0.00 -0.00 0.00 0.00 28.75 28.66 1gh9 h GLU 49 CO -0.04 0.73 -0.29 -0.07 -0.00 0.00 0.00 179.01 179.33 1gh9 h LEU 50 N 0.35 0.77 -0.27 3.06 4.07 -0.70 -2.71 115.31 119.88 1gh9 h LEU 50 Ca 0.04 -0.47 -0.03 0.00 0.08 0.00 0.00 57.88 57.50 1gh9 h LEU 50 Cb 0.80 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 1gh9 h LEU 50 CO 0.06 1.08 0.06 0.58 -1.08 0.00 0.00 178.44 179.15 1gh9 h VAL 51 N 0.48 1.22 -0.77 1.22 2.07 -1.09 0.82 116.25 120.20 1gh9 h VAL 51 Ca 0.05 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1gh9 h VAL 51 Cb 0.86 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.78 1gh9 h VAL 51 CO 0.07 0.24 0.43 0.08 0.02 0.00 0.00 177.57 178.41 1gh9 h ARG 52 N 0.27 1.05 -0.26 1.57 -0.00 -1.46 0.11 114.38 115.66 1gh9 h ARG 52 Ca 0.08 -0.11 -0.12 0.00 -0.00 0.00 0.00 59.98 59.84 1gh9 h ARG 52 Cb 0.30 -0.21 -0.01 0.00 -0.00 0.00 0.00 29.97 30.04 1gh9 h ARG 52 CO 0.00 0.76 -0.33 -0.22 -0.00 0.00 0.00 179.97 180.18 1gh9 h LYS 53 N 1.06 0.55 0.00 0.08 3.64 -1.27 -2.31 116.57 118.32 1gh9 h LYS 53 Ca 0.27 -0.25 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1gh9 h LYS 53 Cb 0.01 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1gh9 h LYS 53 CO -0.05 0.81 -0.12 -0.07 -2.27 0.00 0.00 179.45 177.76 1gh9 h LEU 54 N 0.47 0.00 0.00 5.20 -0.00 0.72 -3.44 115.31 118.26 1gh9 h LEU 54 Ca 0.05 0.00 -0.18 0.00 -0.00 0.00 0.00 57.88 57.75 1gh9 h LEU 54 Cb 0.81 0.00 0.09 0.00 -0.00 0.00 0.00 40.66 41.56 1gh9 h LEU 54 CO 0.07 0.12 0.03 0.00 -0.00 0.00 0.00 178.44 178.65 1gh9 n GLN 55 N -3.40 -2.30 -2.44 1.13 6.02 0.24 -4.81 117.38 111.81 1gh9 n GLN 55 Ca -0.01 -0.79 -0.40 0.00 -0.01 0.00 0.00 57.00 55.79 1gh9 n GLN 55 Cb 0.29 -0.79 -0.03 0.00 1.02 0.00 0.00 30.24 30.74 1gh9 n GLN 55 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1gh9 s GLU 56 N -4.12 3.08 0.05 -1.09 -6.30 -1.26 -4.98 118.70 104.07 1gh9 s GLU 56 Ca 0.33 -0.08 -0.30 0.00 -2.50 0.00 0.00 54.97 52.41 1gh9 s GLU 56 Cb -0.04 -4.24 -0.05 0.00 0.00 0.00 0.00 34.13 29.80 1gh9 s GLU 56 CO 0.25 -2.28 1.18 -1.21 0.02 0.00 0.00 175.26 173.23 1gh9 s GLU 57 N 6.00 4.44 0.00 4.30 2.02 -1.26 -5.04 118.70 129.16 1gh9 s GLU 57 Ca 0.42 1.74 0.00 0.00 0.02 0.00 0.00 54.97 57.15 1gh9 s GLU 57 Cb -0.09 -3.37 0.00 0.00 0.10 0.00 0.00 34.13 30.77 1gh9 s GLU 57 CO 0.16 -0.26 0.00 0.36 0.02 0.00 0.00 175.26 175.54 1gh9 n LYS 58 N 4.03 0.93 -0.03 1.61 2.85 -1.26 -5.06 118.16 121.23 1gh9 n LYS 58 Ca 0.09 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.33 1gh9 n LYS 58 Cb 0.47 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 34.84 1gh9 n LYS 58 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 177.40 179.23 1gh9 h TYR 59 N -0.12 0.00 0.00 5.58 -1.99 -2.04 -3.51 116.97 114.89 1gh9 h TYR 59 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1gh9 h TYR 59 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1gh9 h TYR 59 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 1gh9 n GLY 60 N 1.72 1.34 0.00 3.88 0.00 -1.26 -4.44 105.19 106.44 1gh9 n GLY 60 Ca -0.03 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1gh9 n GLY 60 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gh9 n SER 61 N 0.00 0.00 0.00 1.61 3.41 -1.26 -4.96 113.62 112.42 1gh9 n SER 61 Ca 0.00 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 1gh9 n SER 61 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1gh9 n SER 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gh9 n HIS 63 N 0.00 -0.28 -0.61 0.00 8.25 -1.26 -4.79 115.22 116.53 1gh9 n HIS 63 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 1gh9 n HIS 63 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1gh9 n HIS 63 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1gh9 n PHE 64 N -0.28 0.38 -2.87 4.41 3.72 -1.26 -4.67 117.46 116.89 1gh9 n PHE 64 Ca 0.00 -1.25 -0.43 0.00 -0.05 0.00 0.00 57.45 55.72 1gh9 n PHE 64 Cb 0.00 -0.64 0.01 0.00 -0.94 0.00 0.00 39.48 37.91 1gh9 n PHE 64 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1gh9 n THR 65 N 1.25 5.04 -1.85 4.37 -1.04 -1.26 -4.98 114.28 115.81 1gh9 n THR 65 Ca 0.09 -5.52 -0.35 0.00 -2.04 0.00 0.00 64.05 56.23 1gh9 n THR 65 Cb 0.53 -2.18 0.05 0.00 -1.82 0.00 0.00 70.33 66.90 1gh9 n THR 65 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1gh9 s ASN 66 N -0.87 5.03 0.26 8.00 0.01 -1.25 -4.84 114.94 121.29 1gh9 s ASN 66 Ca 0.33 2.23 -0.02 0.00 -0.71 0.00 0.00 52.86 54.69 1gh9 s ASN 66 Cb 0.05 -2.58 0.43 0.00 0.41 0.00 0.00 41.25 39.56 1gh9 s ASN 66 CO 0.07 -1.69 1.85 1.55 -1.51 0.00 0.00 177.10 177.37 1gh9 h PRO 67 N 0.42 0.99 0.00 -0.60 0.13 -1.96 -1.70 132.00 129.28 1gh9 h PRO 67 Ca -0.49 -0.06 -0.13 0.00 -0.87 0.00 0.00 66.00 64.46 1gh9 h PRO 67 Cb 1.28 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1gh9 h PRO 67 CO 0.54 0.65 -0.79 0.66 -0.23 0.00 0.00 178.00 178.83 1gh9 h SER 68 N 1.02 0.00 -2.32 1.44 4.64 -1.93 -3.41 113.55 112.99 1gh9 h SER 68 Ca 0.43 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 61.08 1gh9 h SER 68 Cb 0.29 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.21 1gh9 h SER 68 CO -0.21 0.55 0.86 -0.54 -0.87 0.00 0.00 176.83 176.62 1gh9 s LYS 69 N -2.94 3.54 0.27 4.77 1.02 -0.64 -5.02 119.74 120.75 1gh9 s LYS 69 Ca 0.02 -1.61 -0.23 0.00 0.02 0.00 0.00 55.97 54.17 1gh9 s LYS 69 Cb 0.08 -4.88 -0.09 0.00 -0.52 0.00 0.00 37.83 32.42 1gh9 s LYS 69 CO 0.77 -1.82 0.84 0.50 -0.92 0.00 0.00 175.35 174.73 1gh9 s ARG 70 N 3.03 4.45 0.00 1.68 3.52 -1.26 -3.82 118.95 126.56 1gh9 s ARG 70 Ca 0.33 1.13 0.28 0.00 -0.13 0.00 0.00 55.73 57.34 1gh9 s ARG 70 Cb -0.06 -2.87 1.03 0.00 -1.56 0.00 0.00 34.95 31.49 1gh9 s ARG 70 CO -0.07 0.35 1.74 -1.91 -0.81 0.00 0.00 175.30 174.59