#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxh n GLU 2 N 0.00 0.76 -0.11 2.12 0.00 -1.26 -4.68 120.64 117.48 1gxh n GLU 2 Ca 0.00 0.26 0.01 0.00 0.00 0.00 0.00 57.16 57.44 1gxh n GLU 2 Cb 0.00 -1.96 -0.00 0.00 0.00 0.00 0.00 31.44 29.47 1gxh n GLU 2 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1gxh n LEU 3 N 6.18 0.00 -4.69 -1.84 4.77 -1.26 -4.74 117.00 115.41 1gxh n LEU 3 Ca 0.34 0.12 -0.42 0.00 -0.03 0.00 0.00 56.01 56.02 1gxh n LEU 3 Cb 0.09 -0.79 -0.03 0.00 -2.33 0.00 0.00 43.42 40.36 1gxh n LEU 3 CO 0.83 -0.22 1.38 -0.54 -1.33 0.00 0.00 177.39 177.52 1gxh s LYS 4 N -1.08 4.17 0.00 3.23 -0.14 -1.26 -4.90 119.74 119.75 1gxh s LYS 4 Ca 0.00 2.46 0.25 0.00 -1.36 0.00 0.00 55.97 57.33 1gxh s LYS 4 Cb 0.00 -3.53 1.15 0.00 -1.68 0.00 0.00 37.83 33.77 1gxh s LYS 4 CO 0.00 -0.77 1.83 -1.71 -0.76 0.00 0.00 175.35 173.94 1gxh n ASN 5 N 5.41 0.00 -3.68 2.83 5.15 -1.26 -4.69 115.26 119.01 1gxh n ASN 5 Ca 0.16 0.33 -0.03 0.00 -0.60 0.00 0.00 54.58 54.45 1gxh n ASN 5 Cb 0.39 -0.44 -0.01 0.00 -0.53 0.00 0.00 39.78 39.19 1gxh n ASN 5 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1gxh s SER 6 N -2.88 -0.14 0.61 1.20 0.01 -1.26 -4.95 113.70 106.29 1gxh s SER 6 Ca 0.16 -0.44 0.32 0.00 1.31 0.00 0.00 55.95 57.30 1gxh s SER 6 Cb 0.17 0.47 1.83 0.00 0.21 0.00 0.00 66.02 68.69 1gxh s SER 6 CO 0.44 -0.88 2.16 0.40 0.41 0.00 0.00 173.24 175.78 1gxh h ILE 7 N 2.00 0.35 -0.02 1.44 1.08 -1.72 -0.77 117.51 119.88 1gxh h ILE 7 Ca -0.25 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.22 1gxh h ILE 7 Cb 1.23 0.88 0.00 0.00 -3.07 0.00 0.00 36.82 35.86 1gxh h ILE 7 CO 0.27 0.00 -0.14 -0.24 -0.69 0.00 0.00 178.15 177.36 1gxh n SER 8 N -3.60 1.99 0.00 1.72 2.88 -1.26 -2.94 113.62 112.41 1gxh n SER 8 Ca -0.01 -1.55 -0.19 0.00 -1.33 0.00 0.00 58.87 55.80 1gxh n SER 8 Cb 0.24 0.11 -0.09 0.00 -0.75 0.00 0.00 64.21 63.72 1gxh n SER 8 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1gxh h ASP 9 N 2.91 0.91 -4.24 -3.46 1.82 -1.51 -3.41 116.42 109.44 1gxh h ASP 9 Ca 0.00 -0.68 -0.53 0.00 -0.39 0.00 0.00 57.03 55.44 1gxh h ASP 9 Cb 0.71 -0.27 0.17 0.00 0.68 0.00 0.00 39.33 40.62 1gxh h ASP 9 CO 0.00 1.45 0.31 -0.31 -1.61 0.00 0.00 179.24 179.08 1gxh s TYR 10 N -3.56 1.89 0.31 0.28 2.02 -1.03 -4.88 117.35 112.38 1gxh s TYR 10 Ca -0.10 1.69 0.08 0.00 -0.37 0.00 0.00 57.07 58.36 1gxh s TYR 10 Cb 0.08 -3.37 -0.03 0.00 -0.40 0.00 0.00 41.96 38.23 1gxh s TYR 10 CO 0.91 -2.64 0.22 0.95 -1.57 0.00 0.00 175.55 173.42 1gxh s THR 11 N -2.39 3.66 0.26 -0.71 -4.23 -1.26 -1.29 115.64 109.68 1gxh s THR 11 Ca 0.69 -1.47 -0.02 0.00 -1.18 0.00 0.00 61.69 59.71 1gxh s THR 11 Cb -0.25 -3.18 0.23 0.00 1.34 0.00 0.00 72.50 70.65 1gxh s THR 11 CO 0.53 -0.23 1.77 -0.08 -0.54 0.00 0.00 174.62 176.06 1gxh h GLU 12 N 1.41 0.61 0.00 3.99 4.22 -1.92 -1.77 114.58 121.12 1gxh h GLU 12 Ca -0.45 -0.04 -0.24 0.00 0.08 0.00 0.00 59.36 58.71 1gxh h GLU 12 Cb 1.25 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.32 1gxh h GLU 12 CO 0.60 0.41 -1.70 2.41 -2.18 0.00 0.00 179.01 178.55 1gxh n THR 13 N -4.86 1.36 -0.28 0.32 -1.04 -1.26 -1.23 114.28 107.29 1gxh n THR 13 Ca 0.16 -0.75 -0.06 0.00 -2.04 0.00 0.00 64.05 61.36 1gxh n THR 13 Cb 0.40 -0.81 0.07 0.00 -1.82 0.00 0.00 70.33 68.17 1gxh n THR 13 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1gxh h GLU 14 N 0.00 1.18 -0.31 -2.82 5.08 -1.97 -2.01 114.58 113.74 1gxh h GLU 14 Ca -0.26 -0.23 -0.06 0.00 -1.00 0.00 0.00 59.36 57.81 1gxh h GLU 14 Cb 1.84 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.89 1gxh h GLU 14 CO 0.06 0.97 -0.08 0.35 -1.00 0.00 0.00 179.01 179.31 1gxh h PHE 15 N 1.14 0.53 0.05 4.33 3.57 -1.05 -2.14 116.94 123.37 1gxh h PHE 15 Ca 0.26 -0.07 0.03 0.00 3.53 0.00 0.00 57.97 61.72 1gxh h PHE 15 Cb 0.25 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 1gxh h PHE 15 CO 0.02 0.57 -0.32 -0.22 -2.23 0.00 0.00 178.31 176.13 1gxh h LYS 16 N 0.47 -0.49 -0.39 1.11 1.63 -0.79 -0.72 116.57 117.39 1gxh h LYS 16 Ca 0.09 0.03 0.06 0.00 -0.85 0.00 0.00 60.65 59.99 1gxh h LYS 16 Cb 0.43 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.15 1gxh h LYS 16 CO 0.02 -0.32 0.26 -0.22 -3.45 0.00 0.00 179.45 175.74 1gxh h LYS 17 N -0.51 0.26 0.30 1.90 3.11 -0.70 0.49 116.57 121.43 1gxh h LYS 17 Ca 0.05 -0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 57.86 1gxh h LYS 17 Cb 0.57 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.74 1gxh h LYS 17 CO -0.24 0.17 -0.15 0.97 -2.81 0.00 0.00 179.45 177.40 1gxh h ILE 18 N 0.27 0.71 0.00 2.00 2.10 -1.21 -0.62 117.51 120.75 1gxh h ILE 18 Ca 0.17 -0.55 -0.00 0.00 1.08 0.00 0.00 64.86 65.56 1gxh h ILE 18 Cb 0.34 0.99 -0.00 0.00 -1.09 0.00 0.00 36.82 37.06 1gxh h ILE 18 CO -0.03 0.11 -0.00 0.40 -1.08 0.00 0.00 178.15 177.54 1gxh h ILE 19 N -0.72 0.80 0.00 2.19 5.03 0.50 -2.79 117.51 122.52 1gxh h ILE 19 Ca -0.04 -0.01 -0.01 0.00 -0.12 0.00 0.00 64.86 64.68 1gxh h ILE 19 Cb 0.49 1.00 -0.00 0.00 -3.03 0.00 0.00 36.82 35.28 1gxh h ILE 19 CO 0.07 0.00 -0.07 -0.08 -0.68 0.00 0.00 178.15 177.39 1gxh h GLU 20 N 0.00 0.00 -0.77 2.37 4.81 -0.14 -2.94 114.58 117.92 1gxh h GLU 20 Ca -0.00 0.00 0.15 0.00 -0.13 0.00 0.00 59.36 59.38 1gxh h GLU 20 Cb 0.00 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 29.24 1gxh h GLU 20 CO 0.00 0.95 -0.25 0.22 -0.73 0.00 0.00 179.01 179.20 1gxh h ASP 21 N -1.00 -0.91 0.85 1.04 1.82 -0.84 0.11 116.42 117.49 1gxh h ASP 21 Ca -0.02 0.24 -0.04 0.00 -0.39 0.00 0.00 57.03 56.82 1gxh h ASP 21 Cb 0.97 0.54 0.01 0.00 0.68 0.00 0.00 39.33 41.52 1gxh h ASP 21 CO -0.01 -0.27 -0.41 0.16 -1.61 0.00 0.00 179.24 177.10 1gxh h ILE 22 N -0.04 0.00 -0.91 2.25 3.07 -1.65 0.84 117.51 121.07 1gxh h ILE 22 Ca 0.34 -0.03 0.19 0.00 1.55 0.00 0.00 64.86 66.92 1gxh h ILE 22 Cb 0.57 0.00 -0.07 0.00 -0.27 0.00 0.00 36.82 37.05 1gxh h ILE 22 CO -0.80 0.00 0.59 0.40 -1.05 0.00 0.00 178.15 177.29 1gxh h ILE 23 N -1.16 0.71 -0.18 0.16 1.08 -1.12 0.44 117.51 117.43 1gxh h ILE 23 Ca -0.12 -0.17 -0.14 0.00 -0.39 0.00 0.00 64.86 64.04 1gxh h ILE 23 Cb 0.87 0.18 0.00 0.00 -3.07 0.00 0.00 36.82 34.80 1gxh h ILE 23 CO 0.19 0.09 -0.44 0.78 -0.69 0.00 0.00 178.15 178.08 1gxh h ASN 24 N 0.49 0.70 -1.37 1.72 2.35 -0.85 -3.49 115.58 115.13 1gxh h ASN 24 Ca 0.48 -0.57 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1gxh h ASN 24 Cb 1.07 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.23 1gxh h ASN 24 CO -0.20 1.15 0.00 0.00 -1.65 0.00 0.00 177.43 176.72 1gxh n GLU 26 N -0.68 1.81 0.00 0.00 2.13 0.16 -4.49 120.64 119.56 1gxh n GLU 26 Ca 0.00 -0.84 0.00 0.00 0.66 0.00 0.00 57.16 56.98 1gxh n GLU 26 Cb 0.27 -1.86 0.00 0.00 0.27 0.00 0.00 31.44 30.12 1gxh n GLU 26 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1gxh n GLY 27 N 2.40 -1.54 3.73 8.31 0.00 -1.26 -5.02 105.19 111.81 1gxh n GLY 27 Ca 0.36 0.54 -0.08 0.00 0.00 0.00 0.00 46.02 46.84 1gxh n GLY 27 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gxh s ASP 28 N -4.00 -0.32 0.03 1.61 2.15 -1.26 -5.06 116.67 109.82 1gxh s ASP 28 Ca 0.00 -0.48 -0.27 0.00 0.43 0.00 0.00 52.55 52.23 1gxh s ASP 28 Cb 0.00 0.69 -0.15 0.00 -0.30 0.00 0.00 42.92 43.16 1gxh s ASP 28 CO 0.00 -1.24 1.28 -0.33 -0.17 0.00 0.00 175.17 174.71 1gxh h GLU 29 N 2.02 -0.92 -0.27 4.34 5.08 -2.00 -2.97 114.58 119.85 1gxh h GLU 29 Ca -0.23 0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.27 1gxh h GLU 29 Cb 1.26 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.71 1gxh h GLU 29 CO 0.28 -0.62 0.26 0.87 -1.00 0.00 0.00 179.01 178.80 1gxh h LYS 30 N -1.05 0.00 -0.10 2.33 1.79 -1.99 -0.13 116.57 117.43 1gxh h LYS 30 Ca -0.10 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1gxh h LYS 30 Cb 0.73 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.38 1gxh h LYS 30 CO 0.16 0.00 0.05 -0.22 -1.08 0.00 0.00 179.45 178.36 1gxh h LYS 31 N 0.00 0.14 -0.51 3.15 3.11 -1.97 0.13 116.57 120.62 1gxh h LYS 31 Ca 0.13 -0.02 -0.09 0.00 -2.81 0.00 0.00 60.65 57.86 1gxh h LYS 31 Cb 0.64 -0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.83 1gxh h LYS 31 CO -0.00 0.17 -0.03 1.96 -2.81 0.00 0.00 179.45 178.73 1gxh h GLN 32 N 0.07 0.93 -0.77 1.90 4.20 -0.92 -1.26 115.11 119.26 1gxh h GLN 32 Ca 0.03 -0.31 0.06 0.00 0.06 0.00 0.00 58.65 58.49 1gxh h GLN 32 Cb 0.07 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.73 1gxh h GLN 32 CO -0.01 0.97 0.50 0.22 -0.67 0.00 0.00 178.83 179.85 1gxh h ASP 33 N 0.80 0.74 -0.22 1.46 3.58 -1.06 0.12 116.42 121.83 1gxh h ASP 33 Ca 0.14 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.49 1gxh h ASP 33 Cb 0.57 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.46 1gxh h ASP 33 CO 0.03 0.48 -0.27 0.44 -2.88 0.00 0.00 179.24 177.05 1gxh h ASP 34 N 0.84 0.61 -0.70 2.28 5.19 -0.42 -0.90 116.42 123.33 1gxh h ASP 34 Ca 0.33 -0.50 0.11 0.00 -0.62 0.00 0.00 57.03 56.35 1gxh h ASP 34 Cb 0.21 -0.17 -0.08 0.00 0.18 0.00 0.00 39.33 39.47 1gxh h ASP 34 CO -0.11 0.98 0.29 -1.13 -3.12 0.00 0.00 179.24 176.15 1gxh h ASN 35 N 0.25 0.30 -0.03 6.45 -1.24 -0.93 -3.18 115.58 117.19 1gxh h ASN 35 Ca 0.03 0.09 -0.12 0.00 0.71 0.00 0.00 56.30 57.01 1gxh h ASN 35 Cb 0.83 0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.93 1gxh h ASN 35 CO 0.06 0.15 -0.36 -0.07 -1.29 0.00 0.00 177.43 175.92 1gxh h LEU 36 N 0.47 0.54 0.07 0.34 3.38 0.64 0.45 115.31 121.21 1gxh h LEU 36 Ca 0.36 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 58.13 1gxh h LEU 36 Cb 0.49 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1gxh h LEU 36 CO -0.34 0.86 -0.17 -0.08 0.09 0.00 0.00 178.44 178.80 1gxh h GLU 37 N 0.44 -0.30 -0.89 1.13 4.22 -1.53 -2.14 114.58 115.51 1gxh h GLU 37 Ca 0.05 0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.50 1gxh h GLU 37 Cb 0.83 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.11 1gxh h GLU 37 CO 0.07 -0.20 0.51 1.25 -2.18 0.00 0.00 179.01 178.46 1gxh h HIS 38 N -0.31 1.20 0.00 0.92 2.76 -0.93 0.17 115.15 118.95 1gxh h HIS 38 Ca 0.03 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1gxh h HIS 38 Cb 0.34 -0.39 0.00 0.00 1.55 0.00 0.00 27.41 28.92 1gxh h HIS 38 CO -0.19 0.81 0.03 0.35 -1.30 0.00 0.00 177.93 177.63 1gxh h PHE 39 N 1.23 0.00 0.00 5.26 3.57 -0.10 0.96 116.94 127.86 1gxh h PHE 39 Ca 0.32 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 1gxh h PHE 39 Cb -0.01 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.72 1gxh h PHE 39 CO 0.00 0.00 -0.10 0.82 -2.23 0.00 0.00 178.31 176.81 1gxh h ILE 40 N 0.00 1.23 0.79 1.41 5.03 -0.15 -3.41 117.51 122.42 1gxh h ILE 40 Ca 0.00 -1.96 -0.04 0.00 -0.12 0.00 0.00 64.86 62.75 1gxh h ILE 40 Cb 0.05 2.36 0.01 0.00 -3.03 0.00 0.00 36.82 36.21 1gxh h ILE 40 CO 0.00 0.42 -0.39 -1.28 -0.68 0.00 0.00 178.15 176.22 1gxh h SER 41 N -1.00 -0.93 -0.48 1.72 0.87 0.17 -2.17 113.55 111.73 1gxh h SER 41 Ca -0.02 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.54 1gxh h SER 41 Cb 0.75 0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.93 1gxh h SER 41 CO -0.01 -0.65 0.21 -0.37 -0.53 0.00 0.00 176.83 175.47 1gxh h VAL 42 N -1.08 1.19 -0.06 2.23 -1.51 -1.60 -3.42 116.25 112.00 1gxh h VAL 42 Ca -0.11 -0.59 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 1gxh h VAL 42 Cb 0.83 0.57 0.00 0.00 -2.13 0.00 0.00 31.29 30.55 1gxh h VAL 42 CO 0.17 0.23 0.00 0.41 -1.23 0.00 0.00 177.57 177.15 1gxh n THR 43 N -4.35 0.00 -1.93 7.19 -1.04 -0.83 -1.95 114.28 111.37 1gxh n THR 43 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1gxh n THR 43 Cb 0.15 -0.13 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 1gxh n THR 43 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1gxh n GLU 44 N 0.00 0.00 -2.46 -2.82 1.02 -1.14 -4.87 120.64 110.36 1gxh n GLU 44 Ca 0.00 -0.15 -0.42 0.00 -0.02 0.00 0.00 57.16 56.57 1gxh n GLU 44 Cb 0.00 -0.09 -0.02 0.00 -0.02 0.00 0.00 31.44 31.30 1gxh n GLU 44 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1gxh s HIS 45 N 0.00 2.43 0.28 -0.32 2.46 -1.26 -4.89 115.29 113.99 1gxh s HIS 45 Ca 0.00 0.48 0.01 0.00 0.47 0.00 0.00 55.06 56.02 1gxh s HIS 45 Cb 0.00 -4.43 0.40 0.00 -0.13 0.00 0.00 32.58 28.42 1gxh s HIS 45 CO 0.00 -1.81 1.75 -1.00 -2.47 0.00 0.00 174.74 171.21 1gxh h PRO 46 N 10.41 0.59 0.00 2.88 0.13 -1.97 -1.29 132.00 142.76 1gxh h PRO 46 Ca -0.26 -0.19 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1gxh h PRO 46 Cb 1.08 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1gxh h PRO 46 CO 1.17 0.72 0.00 0.77 -0.23 0.00 0.00 178.00 180.43 1gxh h SER 47 N 0.54 0.00 0.00 1.44 0.02 -2.01 -3.47 113.55 110.07 1gxh h SER 47 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1gxh h SER 47 Cb 0.56 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1gxh h SER 47 CO 0.04 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 1gxh n GLY 48 N -0.60 2.92 0.04 -3.77 0.00 -0.49 -1.69 105.19 101.61 1gxh n GLY 48 Ca -0.01 0.10 0.03 0.00 0.00 0.00 0.00 46.02 46.14 1gxh n GLY 48 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gxh n SER 49 N 3.26 0.13 -0.35 1.61 7.64 -1.26 -2.61 113.62 122.05 1gxh n SER 49 Ca 0.00 0.49 0.05 0.00 1.01 0.00 0.00 58.87 60.43 1gxh n SER 49 Cb 0.00 -0.50 0.23 0.00 -1.01 0.00 0.00 64.21 62.93 1gxh n SER 49 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1gxh h ASP 50 N 0.00 0.94 0.39 6.43 3.32 -1.66 0.44 116.42 126.29 1gxh h ASP 50 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1gxh h ASP 50 Cb 0.18 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1gxh h ASP 50 CO 0.00 0.55 0.00 -0.07 -1.72 0.00 0.00 179.24 178.00 1gxh h LEU 51 N 1.04 0.00 0.00 1.55 3.38 -1.74 0.80 115.31 120.34 1gxh h LEU 51 Ca 0.45 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.16 1gxh h LEU 51 Cb 0.35 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 1gxh h LEU 51 CO -0.21 0.00 -2.00 -0.38 0.09 0.00 0.00 178.44 175.95 1gxh n ILE 52 N -3.05 1.00 -0.03 1.22 5.41 -0.47 -4.63 119.36 118.81 1gxh n ILE 52 Ca -0.02 -0.51 -0.04 0.00 1.00 0.00 0.00 62.75 63.19 1gxh n ILE 52 Cb 0.16 -0.86 -0.05 0.00 -0.71 0.00 0.00 39.64 38.18 1gxh n ILE 52 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1gxh n TYR 53 N -2.75 0.00 -3.13 1.39 4.01 0.02 -4.82 117.16 111.87 1gxh n TYR 53 Ca -0.27 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.26 1gxh n TYR 53 Cb 0.91 -0.33 -0.04 0.00 -0.31 0.00 0.00 39.34 39.57 1gxh n TYR 53 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1gxh n TYR 54 N -2.31 1.33 -1.28 -0.72 4.01 0.26 -5.04 117.16 113.42 1gxh n TYR 54 Ca -0.11 -3.86 -0.29 0.00 -0.16 0.00 0.00 57.90 53.48 1gxh n TYR 54 Cb 0.71 -0.44 0.18 0.00 -0.31 0.00 0.00 39.34 39.48 1gxh n TYR 54 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1gxh s PRO 55 N -2.60 0.35 0.00 -0.72 0.04 -1.15 -4.61 135.00 126.32 1gxh s PRO 55 Ca 0.42 0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.78 1gxh s PRO 55 Cb 0.30 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 33.10 1gxh s PRO 55 CO -0.10 -2.74 0.00 -1.91 0.04 0.00 0.00 177.00 172.29 1gxh n GLU 56 N -4.15 1.42 0.00 4.56 0.00 -1.26 -5.03 120.64 116.18 1gxh n GLU 56 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.23 1gxh n GLU 56 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.02 1gxh n GLU 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1gxh n GLY 57 N 1.98 0.20 0.10 8.31 0.00 -1.26 -4.41 105.19 110.12 1gxh n GLY 57 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1gxh n GLY 57 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gxh n ASN 58 N -0.89 0.73 -4.86 1.61 0.23 -1.26 -4.74 115.26 106.09 1gxh n ASN 58 Ca 0.00 0.58 -0.32 0.00 -0.53 0.00 0.00 54.58 54.32 1gxh n ASN 58 Cb 0.00 -0.77 -0.05 0.00 -2.08 0.00 0.00 39.78 36.87 1gxh n ASN 58 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1gxh s ASN 59 N -4.37 6.04 0.00 0.53 2.47 -1.26 -4.75 114.94 113.59 1gxh s ASN 59 Ca 0.10 0.20 0.00 0.00 0.42 0.00 0.00 52.86 53.58 1gxh s ASN 59 Cb 0.12 -1.79 0.00 0.00 -1.45 0.00 0.00 41.25 38.13 1gxh s ASN 59 CO 0.56 0.21 0.00 -0.67 -3.72 0.00 0.00 177.10 173.48 1gxh n ASP 60 N 0.63 0.00 -0.16 -4.21 2.03 -1.26 -4.51 116.55 109.08 1gxh n ASP 60 Ca -0.09 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.12 1gxh n ASP 60 Cb 0.52 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.91 1gxh n ASP 60 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1gxh h GLY 61 N 0.00 0.98 -3.09 0.27 0.00 -1.95 -3.47 103.07 95.82 1gxh h GLY 61 Ca 0.00 -0.82 0.30 0.00 0.00 0.00 0.00 47.33 46.81 1gxh h GLY 61 CO 0.00 0.75 0.82 -0.56 0.00 0.00 0.00 176.54 177.55 1gxh s SER 62 N -6.54 -0.08 0.00 0.19 0.01 -1.26 -5.01 113.70 101.01 1gxh s SER 62 Ca -0.12 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.05 1gxh s SER 62 Cb 0.11 0.16 0.01 0.00 0.21 0.00 0.00 66.02 66.52 1gxh s SER 62 CO 0.84 -0.29 1.00 -0.81 0.41 0.00 0.00 173.24 174.40 1gxh n PRO 63 N -0.36 0.00 -0.22 12.44 -0.04 -1.26 -1.53 135.00 144.03 1gxh n PRO 63 Ca -0.06 0.49 0.01 0.00 -0.04 0.00 0.00 63.50 63.91 1gxh n PRO 63 Cb 0.61 -1.51 0.12 0.00 -0.04 0.00 0.00 33.50 32.68 1gxh n PRO 63 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1gxh h GLU 64 N 0.00 0.41 0.00 0.54 4.39 -1.99 0.31 114.58 118.24 1gxh h GLU 64 Ca 0.00 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 1gxh h GLU 64 Cb 0.01 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 28.57 1gxh h GLU 64 CO 0.00 0.27 -0.04 0.00 -1.16 0.00 0.00 179.01 178.08 1gxh h ALA 65 N 1.45 1.39 0.03 3.43 0.00 -1.62 0.17 119.26 124.10 1gxh h ALA 65 Ca 0.33 -0.03 -0.27 0.00 0.00 0.00 0.00 54.91 54.94 1gxh h ALA 65 Cb 0.43 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.23 1gxh h ALA 65 CO -0.33 0.05 -1.08 0.28 0.00 0.00 0.00 179.25 178.17 1gxh h VAL 66 N 0.00 1.28 -0.51 0.00 2.07 -1.13 -1.59 116.25 116.37 1gxh h VAL 66 Ca -0.00 -2.29 -0.08 0.00 0.82 0.00 0.00 66.70 65.15 1gxh h VAL 66 Cb 0.11 2.47 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 1gxh h VAL 66 CO 0.00 0.71 0.01 0.40 0.02 0.00 0.00 177.57 178.71 1gxh h ILE 67 N 0.34 1.25 0.00 4.57 5.03 -0.39 0.16 117.51 128.47 1gxh h ILE 67 Ca -0.14 -1.03 0.00 0.00 -0.12 0.00 0.00 64.86 63.57 1gxh h ILE 67 Cb 1.74 0.85 0.00 0.00 -3.03 0.00 0.00 36.82 36.38 1gxh h ILE 67 CO 0.21 0.37 0.00 0.29 -0.68 0.00 0.00 178.15 178.34 1gxh n LYS 68 N -4.21 0.00 0.31 2.37 5.02 0.46 -1.65 118.16 120.46 1gxh n LYS 68 Ca 0.03 0.66 0.19 0.00 -2.02 0.00 0.00 58.31 57.16 1gxh n LYS 68 Cb 0.31 -1.36 1.00 0.00 -0.02 0.00 0.00 35.03 34.95 1gxh n LYS 68 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1gxh h GLU 69 N 0.00 0.00 0.28 1.97 4.22 -0.09 0.80 114.58 121.76 1gxh h GLU 69 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 1gxh h GLU 69 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1gxh h GLU 69 CO 0.00 0.02 -0.13 0.82 -2.18 0.00 0.00 179.01 177.54 1gxh h ILE 70 N 0.00 0.59 -0.99 2.32 5.03 -0.73 0.21 117.51 123.95 1gxh h ILE 70 Ca -0.00 -0.83 0.06 0.00 -0.12 0.00 0.00 64.86 63.97 1gxh h ILE 70 Cb 0.13 0.94 -0.06 0.00 -3.03 0.00 0.00 36.82 34.80 1gxh h ILE 70 CO 0.00 0.13 0.64 0.11 -0.68 0.00 0.00 178.15 178.36 1gxh h LYS 71 N -0.91 1.14 -0.02 2.37 6.56 0.51 0.05 116.57 126.27 1gxh h LYS 71 Ca -0.04 -0.07 -0.08 0.00 -1.06 0.00 0.00 60.65 59.40 1gxh h LYS 71 Cb 0.51 -0.26 0.01 0.00 -0.57 0.00 0.00 32.23 31.92 1gxh h LYS 71 CO 0.06 0.76 -0.31 1.49 -2.06 0.00 0.00 179.45 179.39 1gxh h GLU 72 N 1.18 0.24 0.46 3.15 4.81 0.46 0.23 114.58 125.11 1gxh h GLU 72 Ca 0.42 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 1gxh h GLU 72 Cb 0.13 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1gxh h GLU 72 CO -0.16 0.93 -0.33 2.35 -0.73 0.00 0.00 179.01 181.07 1gxh h TRP 73 N -0.35 -0.88 -0.57 0.92 7.01 -0.62 0.97 115.95 122.42 1gxh h TRP 73 Ca -0.03 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 60.98 1gxh h TRP 73 Cb 1.02 0.32 -0.03 0.00 -2.10 0.00 0.00 29.16 28.37 1gxh h TRP 73 CO 0.16 -0.49 0.37 0.00 -2.79 0.00 0.00 178.44 175.68 1gxh h ARG 74 N -0.77 0.72 -0.46 2.65 2.47 -0.97 -0.15 114.38 117.86 1gxh h ARG 74 Ca -0.05 -0.04 -0.06 0.00 -1.26 0.00 0.00 59.98 58.57 1gxh h ARG 74 Cb 0.65 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.79 1gxh h ARG 74 CO 0.02 0.47 0.06 0.00 0.56 0.00 0.00 179.97 181.08 1gxh h ALA 75 N 1.23 0.61 -0.45 0.04 0.00 -0.37 0.32 119.26 120.65 1gxh h ALA 75 Ca 0.22 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1gxh h ALA 75 Cb -0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1gxh h ALA 75 CO -0.07 0.35 0.28 0.00 0.00 0.00 0.00 179.25 179.82 1gxh h ALA 76 N 0.94 0.58 0.00 0.00 0.00 -0.62 -0.15 119.26 120.01 1gxh h ALA 76 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1gxh h ALA 76 Cb 0.41 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1gxh h ALA 76 CO 0.01 -0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.34 1gxh n ASN 77 N -4.80 0.00 0.00 0.00 3.02 -0.09 -4.89 115.26 108.50 1gxh n ASN 77 Ca 0.02 -0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 1gxh n ASN 77 Cb 0.05 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1gxh n ASN 77 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gxh n GLY 78 N -0.04 0.69 3.66 7.41 0.00 -0.07 -5.03 105.19 111.80 1gxh n GLY 78 Ca 0.09 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1gxh n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gxh s LYS 79 N -0.91 2.06 0.63 1.61 1.02 0.97 -4.95 119.74 120.16 1gxh s LYS 79 Ca 0.00 -2.28 -0.17 0.00 0.02 0.00 0.00 55.97 53.54 1gxh s LYS 79 Cb 0.00 -1.27 -0.02 0.00 -0.52 0.00 0.00 37.83 36.02 1gxh s LYS 79 CO 0.00 -0.34 1.16 -1.12 -0.92 0.00 0.00 175.35 174.13 1gxh s SER 80 N -3.76 5.10 0.96 2.83 0.01 -1.26 -3.81 113.70 113.77 1gxh s SER 80 Ca 0.16 2.22 -0.12 0.00 1.31 0.00 0.00 55.95 59.53 1gxh s SER 80 Cb 0.03 -2.58 0.17 0.00 0.21 0.00 0.00 66.02 63.85 1gxh s SER 80 CO 0.09 -1.64 1.02 0.61 0.41 0.00 0.00 173.24 173.72 1gxh n GLY 81 N 0.11 -1.18 0.00 3.44 0.00 -1.26 -4.75 105.19 101.54 1gxh n GLY 81 Ca 0.12 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1gxh n GLY 81 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1gxh n PHE 82 N -3.34 -1.45 -0.80 1.61 3.72 -1.25 -3.99 117.46 111.96 1gxh n PHE 82 Ca 0.13 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.26 1gxh n PHE 82 Cb 0.45 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.98 1gxh n PHE 82 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1gxh n LYS 83 N -0.48 0.00 -1.29 -1.08 0.00 -0.41 -4.77 118.16 110.13 1gxh n LYS 83 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 58.31 58.08 1gxh n LYS 83 Cb 0.00 -0.58 -0.10 0.00 0.00 0.00 0.00 35.03 34.35 1gxh n LYS 83 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1gxh n GLN 84 N 0.62 2.63 0.00 1.64 7.27 -1.26 -4.69 117.38 123.60 1gxh n GLN 84 Ca 0.10 -1.83 0.00 0.00 0.07 0.00 0.00 57.00 55.34 1gxh n GLN 84 Cb 0.16 -2.22 0.00 0.00 2.41 0.00 0.00 30.24 30.59 1gxh n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54