#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 0.96 -0.87 0.03 -0.58 -1.26 -4.90 120.64 114.02 1gxh n GLU 2 Ca 0.00 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.45 1gxh n GLU 2 Cb 0.00 -1.02 0.20 0.00 -0.57 0.00 0.00 31.44 30.05 1gxh n GLU 2 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1gxh s LEU 3 N 0.00 1.55 -0.17 -4.62 1.43 -1.26 -4.89 118.68 110.72 1gxh s LEU 3 Ca 0.00 1.50 -0.38 0.00 -1.03 0.00 0.00 54.13 54.22 1gxh s LEU 3 Cb 0.00 -3.64 -0.15 0.00 0.03 0.00 0.00 46.19 42.43 1gxh s LEU 3 CO 0.00 -3.47 1.72 0.29 0.23 0.00 0.00 176.35 175.11 1gxh n LYS 4 N -4.43 1.42 0.00 1.70 5.02 -1.26 -4.81 118.16 115.80 1gxh n LYS 4 Ca 0.05 0.52 0.10 0.00 -2.02 0.00 0.00 58.31 56.96 1gxh n LYS 4 Cb 0.55 -2.24 0.55 0.00 -0.02 0.00 0.00 35.03 33.87 1gxh n LYS 4 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1gxh n ASN 5 N 5.22 0.00 -3.64 4.39 5.03 -1.26 -4.74 115.26 120.27 1gxh n ASN 5 Ca 0.24 -0.29 -0.14 0.00 0.87 0.00 0.00 54.58 55.27 1gxh n ASN 5 Cb 0.18 -0.16 -0.06 0.00 -1.02 0.00 0.00 39.78 38.72 1gxh n ASN 5 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1gxh s SER 6 N -2.32 -0.37 0.33 6.41 0.01 -1.26 -4.79 113.70 111.72 1gxh s SER 6 Ca 0.24 0.19 0.05 0.00 1.31 0.00 0.00 55.95 57.74 1gxh s SER 6 Cb 0.14 0.44 0.69 0.00 0.21 0.00 0.00 66.02 67.49 1gxh s SER 6 CO 0.27 -0.62 1.90 0.40 0.41 0.00 0.00 173.24 175.60 1gxh h ILE 7 N 3.13 0.96 0.00 1.44 1.08 -1.80 -0.86 117.51 121.46 1gxh h ILE 7 Ca -0.30 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 63.88 1gxh h ILE 7 Cb 1.19 0.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.99 1gxh h ILE 7 CO 0.41 0.15 0.00 -0.24 -0.69 0.00 0.00 178.15 177.79 1gxh n SER 8 N -4.52 0.00 0.04 1.72 2.88 -1.25 -1.07 113.62 111.42 1gxh n SER 8 Ca 0.15 0.38 -0.04 0.00 -1.33 0.00 0.00 58.87 58.03 1gxh n SER 8 Cb 0.31 -0.45 -0.09 0.00 -0.75 0.00 0.00 64.21 63.23 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 0.00 0.00 -4.12 -3.46 3.58 -1.52 -3.38 116.42 107.53 1gxh h ASP 9 Ca 0.00 0.00 -0.51 0.00 0.42 0.00 0.00 57.03 56.94 1gxh h ASP 9 Cb 0.37 0.00 0.19 0.00 1.72 0.00 0.00 39.33 41.61 1gxh h ASP 9 CO 0.00 0.79 0.20 -0.31 -2.88 0.00 0.00 179.24 177.04 1gxh s TYR 10 N -2.78 1.65 0.31 0.28 1.51 -0.23 -4.83 117.35 113.26 1gxh s TYR 10 Ca -0.01 1.68 0.10 0.00 -1.01 0.00 0.00 57.07 57.83 1gxh s TYR 10 Cb 0.09 -3.28 -0.05 0.00 -0.11 0.00 0.00 41.96 38.60 1gxh s TYR 10 CO 0.80 -2.90 -0.06 0.95 -1.11 0.00 0.00 175.55 173.24 1gxh s THR 11 N -2.64 2.68 0.47 -0.71 -4.23 -1.26 -0.94 115.64 109.01 1gxh s THR 11 Ca 0.67 -2.10 0.15 0.00 -1.18 0.00 0.00 61.69 59.22 1gxh s THR 11 Cb -0.23 -2.66 0.31 0.00 1.34 0.00 0.00 72.50 71.26 1gxh s THR 11 CO 0.59 -0.28 2.05 -0.08 -0.54 0.00 0.00 174.62 176.36 1gxh h GLU 12 N 1.97 0.23 0.00 3.99 4.81 -1.91 -0.62 114.58 123.05 1gxh h GLU 12 Ca -0.42 -0.01 -0.25 0.00 -0.13 0.00 0.00 59.36 58.54 1gxh h GLU 12 Cb 1.25 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.54 1gxh h GLU 12 CO 0.65 0.16 -1.80 2.41 -0.73 0.00 0.00 179.01 179.69 1gxh n THR 13 N -4.48 1.31 -0.25 0.32 -1.04 -1.26 -2.47 114.28 106.41 1gxh n THR 13 Ca 0.04 -0.76 -0.07 0.00 -2.04 0.00 0.00 64.05 61.22 1gxh n THR 13 Cb 0.26 -0.73 0.05 0.00 -1.82 0.00 0.00 70.33 68.09 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 1.14 0.00 -2.82 5.08 -1.89 -0.23 114.58 115.87 1gxh h GLU 14 Ca -0.29 -0.28 -0.09 0.00 -1.00 0.00 0.00 59.36 57.70 1gxh h GLU 14 Cb 1.86 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.95 1gxh h GLU 14 CO 0.05 1.01 -0.42 0.35 -1.00 0.00 0.00 179.01 179.00 1gxh h PHE 15 N 1.08 0.00 0.23 4.33 3.57 -1.20 -0.94 116.94 124.01 1gxh h PHE 15 Ca 0.22 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.73 1gxh h PHE 15 Cb 0.38 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.10 1gxh h PHE 15 CO 0.03 0.42 -0.28 -0.22 -2.23 0.00 0.00 178.31 176.03 1gxh h LYS 16 N 0.00 -0.54 -0.57 1.11 1.63 -1.14 -2.48 116.57 114.59 1gxh h LYS 16 Ca -0.00 0.04 0.16 0.00 -0.85 0.00 0.00 60.65 60.00 1gxh h LYS 16 Cb 0.75 0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 32.48 1gxh h LYS 16 CO 0.05 -0.36 0.41 -0.22 -3.45 0.00 0.00 179.45 175.88 1gxh h LYS 17 N -0.56 0.01 0.37 1.90 3.11 0.35 0.43 116.57 122.18 1gxh h LYS 17 Ca 0.00 -0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 1gxh h LYS 17 Cb 0.54 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.77 1gxh h LYS 17 CO -0.09 0.00 -0.18 0.97 -2.81 0.00 0.00 179.45 177.34 1gxh h ILE 18 N 0.01 0.00 -0.08 2.00 2.10 -1.39 -2.65 117.51 117.50 1gxh h ILE 18 Ca 0.27 -0.17 -0.11 0.00 1.08 0.00 0.00 64.86 65.93 1gxh h ILE 18 Cb 1.07 0.00 -0.01 0.00 -1.09 0.00 0.00 36.82 36.79 1gxh h ILE 18 CO -0.00 0.00 -0.46 0.40 -1.08 0.00 0.00 178.15 177.01 1gxh h ILE 19 N -0.67 1.33 -0.01 2.19 1.08 -0.45 -0.76 117.51 120.22 1gxh h ILE 19 Ca -0.05 -1.62 -0.00 0.00 -0.39 0.00 0.00 64.86 62.80 1gxh h ILE 19 Cb 0.38 1.78 -0.00 0.00 -3.07 0.00 0.00 36.82 35.91 1gxh h ILE 19 CO 0.08 0.48 0.00 -0.33 -0.69 0.00 0.00 178.15 177.69 1gxh h GLU 20 N 0.15 0.01 -0.98 2.37 5.08 -0.43 -2.94 114.58 117.84 1gxh h GLU 20 Ca 0.01 -0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.51 1gxh h GLU 20 Cb 0.86 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.02 1gxh h GLU 20 CO 0.07 0.13 0.60 0.22 -1.00 0.00 0.00 179.01 179.02 1gxh h ASP 21 N -0.11 0.83 0.08 1.42 1.82 -0.79 -1.11 116.42 118.56 1gxh h ASP 21 Ca 0.00 0.07 0.02 0.00 -0.39 0.00 0.00 57.03 56.73 1gxh h ASP 21 Cb 0.12 -0.09 -0.04 0.00 0.68 0.00 0.00 39.33 40.01 1gxh h ASP 21 CO -0.00 0.39 -0.26 0.40 -1.61 0.00 0.00 179.24 178.16 1gxh h ILE 22 N 0.88 0.43 0.01 2.25 2.04 -1.28 0.22 117.51 122.05 1gxh h ILE 22 Ca 0.51 0.00 -0.21 0.00 1.00 0.00 0.00 64.86 66.17 1gxh h ILE 22 Cb 0.63 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1gxh h ILE 22 CO -0.31 0.00 -0.92 0.40 0.00 0.00 0.00 178.15 177.32 1gxh h ILE 23 N -0.45 1.50 -0.59 -0.67 2.04 -1.10 -2.39 117.51 115.85 1gxh h ILE 23 Ca 0.04 -2.68 0.01 0.00 1.00 0.00 0.00 64.86 63.23 1gxh h ILE 23 Cb 0.49 2.52 -0.03 0.00 -0.74 0.00 0.00 36.82 39.05 1gxh h ILE 23 CO -0.17 0.78 0.39 0.78 0.00 0.00 0.00 178.15 179.93 1gxh h ASN 24 N 0.11 0.66 -4.73 1.72 2.35 -1.27 -3.49 115.58 110.94 1gxh h ASN 24 Ca -0.05 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1gxh h ASN 24 Cb 1.56 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.77 1gxh h ASN 24 CO 0.14 0.48 -0.09 0.00 -1.65 0.00 0.00 177.43 176.31 1gxh n GLU 26 N -1.26 1.49 0.00 0.00 2.13 -0.78 -4.77 120.64 117.46 1gxh n GLU 26 Ca 0.02 -0.64 0.00 0.00 0.66 0.00 0.00 57.16 57.20 1gxh n GLU 26 Cb 0.46 -1.71 0.00 0.00 0.27 0.00 0.00 31.44 30.45 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 2.33 0.98 0.00 8.31 0.00 -1.26 -5.07 105.19 110.48 1gxh n GLY 27 Ca 0.27 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1gxh n GLY 27 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gxh n ASP 28 N 2.77 0.00 0.23 1.61 9.92 -1.26 -4.82 116.55 125.00 1gxh n ASP 28 Ca 0.00 0.00 -0.15 0.00 -0.53 0.00 0.00 54.79 54.11 1gxh n ASP 28 Cb 0.00 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.40 1gxh n ASP 28 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 1gxh h GLU 29 N 0.00 -0.54 0.00 -1.24 -0.00 -2.00 -2.65 114.58 108.16 1gxh h GLU 29 Ca 0.00 0.04 -0.02 0.00 -0.00 0.00 0.00 59.36 59.37 1gxh h GLU 29 Cb 0.00 0.12 -0.00 0.00 -0.00 0.00 0.00 28.75 28.87 1gxh h GLU 29 CO 0.00 -0.29 -0.11 0.87 -0.00 0.00 0.00 179.01 179.48 1gxh h LYS 30 N -0.69 0.00 0.12 1.06 1.79 -1.98 -0.61 116.57 116.26 1gxh h LYS 30 Ca -0.06 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1gxh h LYS 30 Cb 0.50 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 1gxh h LYS 30 CO 0.09 0.11 -0.06 -0.22 -1.08 0.00 0.00 179.45 178.30 1gxh h LYS 31 N 0.00 -0.15 -0.32 3.15 3.11 -1.87 -0.70 116.57 119.79 1gxh h LYS 31 Ca -0.00 0.01 -0.10 0.00 -2.81 0.00 0.00 60.65 57.75 1gxh h LYS 31 Cb 0.28 0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.53 1gxh h LYS 31 CO 0.01 0.08 -0.23 -0.56 -2.81 0.00 0.00 179.45 175.95 1gxh h GLN 32 N -0.37 0.62 -0.65 1.90 3.07 -1.03 -2.87 115.11 115.78 1gxh h GLN 32 Ca -0.02 -0.24 0.09 0.00 0.09 0.00 0.00 58.65 58.57 1gxh h GLN 32 Cb 0.30 -0.03 -0.07 0.00 0.08 0.00 0.00 27.48 27.76 1gxh h GLN 32 CO 0.03 0.80 0.29 0.22 0.09 0.00 0.00 178.83 180.26 1gxh h ASP 33 N 0.54 0.36 -0.42 0.06 1.82 -1.08 0.21 116.42 117.91 1gxh h ASP 33 Ca 0.08 0.06 -0.09 0.00 -0.39 0.00 0.00 57.03 56.70 1gxh h ASP 33 Cb 0.69 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.69 1gxh h ASP 33 CO 0.05 0.21 -0.07 -0.78 -1.61 0.00 0.00 179.24 177.04 1gxh h ASP 34 N 0.51 0.78 -0.41 2.28 1.82 -0.93 -0.23 116.42 120.25 1gxh h ASP 34 Ca 0.32 -0.35 0.02 0.00 -0.39 0.00 0.00 57.03 56.63 1gxh h ASP 34 Cb 0.35 -0.21 -0.03 0.00 0.68 0.00 0.00 39.33 40.11 1gxh h ASP 34 CO -0.27 0.95 0.23 -1.13 -1.61 0.00 0.00 179.24 177.41 1gxh h ASN 35 N 0.61 0.35 0.04 2.28 -0.00 -1.30 -2.34 115.58 115.22 1gxh h ASN 35 Ca 0.11 0.01 0.01 0.00 -0.00 0.00 0.00 56.30 56.43 1gxh h ASN 35 Cb 0.59 -0.06 -0.02 0.00 -0.00 0.00 0.00 38.32 38.83 1gxh h ASN 35 CO 0.04 0.25 -0.12 -0.07 -0.00 0.00 0.00 177.43 177.53 1gxh h LEU 36 N 0.46 -0.33 -0.55 0.34 3.38 0.12 0.52 115.31 119.25 1gxh h LEU 36 Ca 0.17 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.18 1gxh h LEU 36 Cb 0.03 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1gxh h LEU 36 CO -0.09 -0.17 0.37 -0.08 0.09 0.00 0.00 178.44 178.55 1gxh h GLU 37 N -0.22 0.73 -0.78 1.13 4.81 -1.42 -2.39 114.58 116.44 1gxh h GLU 37 Ca 0.03 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1gxh h GLU 37 Cb 0.25 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 1gxh h GLU 37 CO -0.09 0.48 0.52 1.25 -0.73 0.00 0.00 179.01 180.44 1gxh h HIS 38 N 0.75 0.98 0.00 0.92 2.76 -0.59 0.24 115.15 120.21 1gxh h HIS 38 Ca 0.20 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 1gxh h HIS 38 Cb -0.09 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 28.54 1gxh h HIS 38 CO -0.04 0.62 0.00 0.35 -1.30 0.00 0.00 177.93 177.56 1gxh h PHE 39 N 1.05 0.00 0.10 5.26 3.57 0.34 0.89 116.94 128.15 1gxh h PHE 39 Ca 0.29 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.78 1gxh h PHE 39 Cb -0.12 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.62 1gxh h PHE 39 CO -0.00 0.00 -0.05 0.82 -2.23 0.00 0.00 178.31 176.85 1gxh h ILE 40 N 0.00 1.02 0.20 1.41 5.03 -0.71 -3.40 117.51 121.06 1gxh h ILE 40 Ca 0.00 -1.35 0.01 0.00 -0.12 0.00 0.00 64.86 63.40 1gxh h ILE 40 Cb 0.43 1.77 -0.03 0.00 -3.03 0.00 0.00 36.82 35.96 1gxh h ILE 40 CO 0.00 0.29 -0.33 -1.28 -0.68 0.00 0.00 178.15 176.15 1gxh h SER 41 N -0.85 -0.92 0.67 1.72 0.87 0.11 -2.60 113.55 112.54 1gxh h SER 41 Ca -0.01 0.10 -0.13 0.00 -1.23 0.00 0.00 61.79 60.51 1gxh h SER 41 Cb 0.57 0.34 -0.02 0.00 -0.44 0.00 0.00 62.40 62.85 1gxh h SER 41 CO 0.02 -0.43 -0.62 -0.37 -0.53 0.00 0.00 176.83 174.90 1gxh h VAL 42 N -0.60 1.41 -4.39 2.23 -1.51 -1.59 -3.46 116.25 108.34 1gxh h VAL 42 Ca 0.01 -2.14 -0.46 0.00 -1.23 0.00 0.00 66.70 62.87 1gxh h VAL 42 Cb 0.60 2.17 0.12 0.00 -2.13 0.00 0.00 31.29 32.04 1gxh h VAL 42 CO -0.14 0.61 0.34 -0.89 -1.23 0.00 0.00 177.57 176.26 1gxh s THR 43 N -3.56 2.00 -0.77 7.19 2.01 -0.98 -2.72 115.64 118.82 1gxh s THR 43 Ca -0.01 0.00 0.08 0.00 0.31 0.00 0.00 61.69 62.07 1gxh s THR 43 Cb 0.12 -2.85 0.18 0.00 0.01 0.00 0.00 72.50 69.96 1gxh s THR 43 CO 0.76 0.00 1.07 -0.62 -0.69 0.00 0.00 174.62 175.14 1gxh n GLU 44 N -3.59 2.14 -2.13 4.92 4.71 -1.26 -5.00 120.64 120.43 1gxh n GLU 44 Ca 0.07 -1.65 -0.42 0.00 -0.01 0.00 0.00 57.16 55.15 1gxh n GLU 44 Cb 0.60 -1.18 -0.03 0.00 -1.01 0.00 0.00 31.44 29.82 1gxh n GLU 44 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 1gxh s HIS 45 N -0.91 1.99 0.28 -0.32 2.46 -1.26 -4.89 115.29 112.64 1gxh s HIS 45 Ca 0.15 0.65 0.03 0.00 0.47 0.00 0.00 55.06 56.35 1gxh s HIS 45 Cb 0.08 -4.19 0.42 0.00 -0.13 0.00 0.00 32.58 28.76 1gxh s HIS 45 CO 0.11 -2.52 1.73 -1.00 -2.47 0.00 0.00 174.74 170.59 1gxh h PRO 46 N 12.41 0.48 0.00 2.88 0.13 -1.97 -1.67 132.00 144.26 1gxh h PRO 46 Ca -0.30 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1gxh h PRO 46 Cb 1.14 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1gxh h PRO 46 CO 1.08 0.69 0.00 0.77 -0.23 0.00 0.00 178.00 180.31 1gxh h SER 47 N 0.43 0.00 0.00 1.44 0.02 -2.00 -3.48 113.55 109.95 1gxh h SER 47 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1gxh h SER 47 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1gxh h SER 47 CO 0.05 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 1gxh n GLY 48 N -0.15 2.65 0.06 -3.77 0.00 -0.63 -2.51 105.19 100.85 1gxh n GLY 48 Ca 0.01 -0.10 0.02 0.00 0.00 0.00 0.00 46.02 45.95 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 1.55 0.10 -0.32 1.61 7.64 -1.26 -3.10 113.62 119.83 1gxh n SER 49 Ca 0.00 0.32 0.20 0.00 1.01 0.00 0.00 58.87 60.40 1gxh n SER 49 Cb 0.00 -0.28 0.46 0.00 -1.01 0.00 0.00 64.21 63.38 1gxh n SER 49 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1gxh h ASP 50 N 0.00 0.54 0.91 6.43 3.58 -1.87 0.44 116.42 126.45 1gxh h ASP 50 Ca 0.00 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.54 1gxh h ASP 50 Cb 0.67 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.72 1gxh h ASP 50 CO 0.00 0.13 0.00 0.18 -2.88 0.00 0.00 179.24 176.67 1gxh n LEU 51 N -4.68 0.35 -0.09 2.28 4.32 -1.18 -0.45 117.00 117.54 1gxh n LEU 51 Ca 0.25 0.56 -0.21 0.00 -0.02 0.00 0.00 56.01 56.58 1gxh n LEU 51 Cb 0.78 -0.48 -0.12 0.00 -1.62 0.00 0.00 43.42 41.99 1gxh n LEU 51 CO 0.24 -0.24 -1.16 -0.38 -1.22 0.00 0.00 177.39 174.62 1gxh n ILE 52 N -1.86 1.58 -0.09 -0.08 5.41 -0.01 -4.53 119.36 119.78 1gxh n ILE 52 Ca 0.05 -0.52 -0.10 0.00 1.00 0.00 0.00 62.75 63.17 1gxh n ILE 52 Cb 0.29 -1.62 -0.13 0.00 -0.71 0.00 0.00 39.64 37.47 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 -3.57 0.00 -2.81 1.39 4.02 -0.31 -4.65 117.16 111.23 1gxh n TYR 53 Ca -0.43 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.27 1gxh n TYR 53 Cb 0.97 -0.84 -0.01 0.00 -0.02 0.00 0.00 39.34 39.43 1gxh n TYR 53 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1gxh n TYR 54 N -2.74 2.03 -1.58 -0.72 4.01 0.40 -5.05 117.16 113.50 1gxh n TYR 54 Ca -0.30 -3.38 -0.33 0.00 -0.16 0.00 0.00 57.90 53.73 1gxh n TYR 54 Cb 1.03 -0.34 0.07 0.00 -0.31 0.00 0.00 39.34 39.78 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 -3.11 2.49 0.00 -0.72 0.04 -1.21 -4.73 135.00 127.76 1gxh s PRO 55 Ca 0.40 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.91 1gxh s PRO 55 Cb 0.38 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 33.02 1gxh s PRO 55 CO -0.08 -1.51 0.00 -0.85 0.04 0.00 0.00 177.00 174.60 1gxh n GLU 56 N -2.68 0.17 -3.75 4.56 -0.00 -1.26 -5.03 120.64 112.64 1gxh n GLU 56 Ca 0.11 0.00 -0.29 0.00 -0.00 0.00 0.00 57.16 56.98 1gxh n GLU 56 Cb 0.52 0.00 -0.15 0.00 -0.00 0.00 0.00 31.44 31.80 1gxh n GLU 56 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1gxh s GLY 57 N -1.89 1.03 0.00 -1.84 0.00 -1.26 -3.89 107.32 99.48 1gxh s GLY 57 Ca 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.22 1gxh s GLY 57 CO 0.00 1.53 0.00 -2.01 0.00 0.00 0.00 173.10 172.62 1gxh n ASN 58 N 4.86 0.00 -4.80 1.64 5.15 -1.26 -5.06 115.26 115.80 1gxh n ASN 58 Ca -0.04 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.59 1gxh n ASN 58 Cb 0.43 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.63 1gxh n ASN 58 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1gxh s ASN 59 N -0.02 6.89 0.00 1.20 2.47 -1.25 -4.07 114.94 120.15 1gxh s ASN 59 Ca 0.00 1.87 0.00 0.00 0.42 0.00 0.00 52.86 55.15 1gxh s ASN 59 Cb 0.00 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.23 1gxh s ASN 59 CO 0.00 -0.40 0.00 -0.67 -3.72 0.00 0.00 177.10 172.31 1gxh n ASP 60 N -0.23 0.00 0.08 -4.21 2.03 -1.26 -4.78 116.55 108.18 1gxh n ASP 60 Ca 0.06 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.42 1gxh n ASP 60 Cb 0.51 0.00 0.49 0.00 -0.72 0.00 0.00 41.12 41.40 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 0.40 -3.02 0.27 0.00 -1.98 -3.42 103.07 95.31 1gxh h GLY 61 Ca 0.00 -0.15 0.13 0.00 0.00 0.00 0.00 47.33 47.31 1gxh h GLY 61 CO 0.00 0.15 0.49 -0.56 0.00 0.00 0.00 176.54 176.62 1gxh s SER 62 N -6.81 -0.30 0.00 0.19 0.01 -1.26 -4.99 113.70 100.54 1gxh s SER 62 Ca -0.07 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.06 1gxh s SER 62 Cb 0.17 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.82 1gxh s SER 62 CO 0.71 -0.71 0.86 -2.65 0.41 0.00 0.00 173.24 171.86 1gxh n PRO 63 N -0.32 0.00 -0.23 12.44 -0.02 -1.26 -1.22 135.00 144.39 1gxh n PRO 63 Ca -0.08 0.37 -0.01 0.00 -2.02 0.00 0.00 63.50 61.76 1gxh n PRO 63 Cb 0.61 -1.57 0.05 0.00 -0.02 0.00 0.00 33.50 32.58 1gxh n PRO 63 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1gxh h GLU 64 N 0.00 -0.05 -0.37 -0.52 4.39 -1.97 -1.79 114.58 114.27 1gxh h GLU 64 Ca 0.00 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.77 1gxh h GLU 64 Cb 0.13 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 1gxh h GLU 64 CO 0.00 -0.03 0.25 0.00 -1.16 0.00 0.00 179.01 178.07 1gxh h ALA 65 N 1.48 2.08 -0.14 3.43 0.00 -1.50 -0.15 119.26 124.46 1gxh h ALA 65 Ca 0.30 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.04 1gxh h ALA 65 Cb 0.52 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1gxh h ALA 65 CO -0.70 -0.16 -0.53 0.28 0.00 0.00 0.00 179.25 178.14 1gxh h VAL 66 N 0.21 1.34 -0.65 0.00 2.07 -1.53 -0.53 116.25 117.15 1gxh h VAL 66 Ca 0.17 -1.80 -0.02 0.00 0.82 0.00 0.00 66.70 65.87 1gxh h VAL 66 Cb 0.39 2.06 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 1gxh h VAL 66 CO -0.03 0.55 0.33 0.40 0.02 0.00 0.00 177.57 178.85 1gxh h ILE 67 N 0.26 1.21 -0.03 4.57 5.03 -0.87 0.13 117.51 127.80 1gxh h ILE 67 Ca -0.03 -0.57 0.01 0.00 -0.12 0.00 0.00 64.86 64.15 1gxh h ILE 67 Cb 1.16 0.41 -0.02 0.00 -3.03 0.00 0.00 36.82 35.33 1gxh h ILE 67 CO 0.11 0.24 -0.18 0.11 -0.68 0.00 0.00 178.15 177.75 1gxh h LYS 68 N 0.89 -0.19 0.00 2.37 1.57 -1.16 -0.19 116.57 119.86 1gxh h LYS 68 Ca 0.22 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 1gxh h LYS 68 Cb 0.08 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 1gxh h LYS 68 CO -0.03 -0.13 -0.02 1.49 -0.57 0.00 0.00 179.45 180.19 1gxh h GLU 69 N -0.20 0.00 0.40 3.15 4.22 -0.07 0.41 114.58 122.49 1gxh h GLU 69 Ca 0.01 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.43 1gxh h GLU 69 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1gxh h GLU 69 CO -0.14 0.02 -0.19 0.82 -2.18 0.00 0.00 179.01 177.35 1gxh h ILE 70 N 0.00 0.28 -0.60 2.32 5.03 -0.44 0.23 117.51 124.34 1gxh h ILE 70 Ca -0.00 -0.65 0.12 0.00 -0.12 0.00 0.00 64.86 64.21 1gxh h ILE 70 Cb 0.07 0.45 -0.10 0.00 -3.03 0.00 0.00 36.82 34.21 1gxh h ILE 70 CO 0.00 0.06 -0.04 0.11 -0.68 0.00 0.00 178.15 177.61 1gxh h LYS 71 N -1.05 0.08 0.04 2.37 1.57 0.70 -1.18 116.57 119.11 1gxh h LYS 71 Ca -0.05 -0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.42 1gxh h LYS 71 Cb 0.51 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1gxh h LYS 71 CO 0.09 0.05 -1.63 0.93 -0.57 0.00 0.00 179.45 178.32 1gxh h GLU 72 N 0.08 0.09 0.17 3.15 3.07 -0.19 0.19 114.58 121.16 1gxh h GLU 72 Ca 0.31 -0.16 0.01 0.00 -0.50 0.00 0.00 59.36 59.02 1gxh h GLU 72 Cb 0.49 0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 28.42 1gxh h GLU 72 CO -0.54 0.80 -0.33 2.35 -1.40 0.00 0.00 179.01 179.89 1gxh h TRP 73 N 0.03 -0.89 -0.48 4.33 7.01 -0.59 -0.10 115.95 125.26 1gxh h TRP 73 Ca -0.27 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 60.75 1gxh h TRP 73 Cb 1.99 0.37 -0.02 0.00 -2.10 0.00 0.00 29.16 29.39 1gxh h TRP 73 CO 0.03 -0.44 0.28 0.00 -2.79 0.00 0.00 178.44 175.52 1gxh h ARG 74 N -0.58 0.66 0.15 2.65 2.47 -0.97 0.37 114.38 119.13 1gxh h ARG 74 Ca 0.02 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.68 1gxh h ARG 74 Cb 0.59 -0.14 -0.04 0.00 -1.65 0.00 0.00 29.97 28.73 1gxh h ARG 74 CO -0.16 0.49 -0.49 0.00 0.56 0.00 0.00 179.97 180.37 1gxh h ALA 75 N 1.13 -0.99 -0.78 0.04 0.00 -0.50 0.29 119.26 118.46 1gxh h ALA 75 Ca 0.17 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1gxh h ALA 75 Cb 0.01 0.86 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 1gxh h ALA 75 CO -0.03 -1.10 0.51 0.00 0.00 0.00 0.00 179.25 178.63 1gxh h ALA 76 N -0.65 0.99 0.00 0.00 0.00 -0.72 -2.12 119.26 116.76 1gxh h ALA 76 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1gxh h ALA 76 Cb 0.72 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1gxh h ALA 76 CO -0.25 0.41 0.00 -0.91 0.00 0.00 0.00 179.25 178.50 1gxh h ASN 77 N 1.05 0.00 0.00 0.00 2.35 -0.70 -3.45 115.58 114.84 1gxh h ASN 77 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1gxh h ASN 77 Cb -0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.26 1gxh h ASN 77 CO -0.06 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.33 1gxh n GLY 78 N 0.70 0.00 0.39 2.83 0.00 -0.18 -5.07 105.19 103.86 1gxh n GLY 78 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1gxh n GLY 78 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1gxh n LYS 79 N 0.00 -0.06 -4.49 1.61 -0.00 0.86 -4.92 118.16 111.15 1gxh n LYS 79 Ca 0.00 0.06 -0.23 0.00 -0.00 0.00 0.00 58.31 58.14 1gxh n LYS 79 Cb 0.00 -0.10 -0.11 0.00 -0.00 0.00 0.00 35.03 34.82 1gxh n LYS 79 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1gxh s SER 80 N 0.00 2.69 0.00 -5.58 0.01 -1.25 -4.90 113.70 104.68 1gxh s SER 80 Ca 0.00 -1.39 0.00 0.00 1.31 0.00 0.00 55.95 55.87 1gxh s SER 80 Cb 0.00 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.12 1gxh s SER 80 CO 0.00 -0.60 0.00 0.61 0.41 0.00 0.00 173.24 173.66 1gxh n GLY 81 N -0.76 -0.19 1.65 3.44 0.00 -1.26 -4.15 105.19 103.92 1gxh n GLY 81 Ca -0.03 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.07 -3.35 -1.46 1.61 3.72 -1.26 -3.92 117.46 112.74 1gxh n PHE 82 Ca 0.00 -0.46 -0.53 0.00 -0.05 0.00 0.00 57.45 56.41 1gxh n PHE 82 Cb 0.00 -0.55 -0.05 0.00 -0.94 0.00 0.00 39.48 37.94 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 -3.20 0.11 -3.15 -1.08 3.00 -0.12 -4.88 118.16 108.86 1gxh n LYS 83 Ca 0.07 0.04 -0.43 0.00 -0.00 0.00 0.00 58.31 58.00 1gxh n LYS 83 Cb 0.28 -1.29 -0.07 0.00 0.00 0.00 0.00 35.03 33.95 1gxh n LYS 83 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 1gxh s GLN 84 N -0.54 3.35 0.00 1.64 0.74 -1.26 -4.60 119.66 118.98 1gxh s GLN 84 Ca 0.76 -0.34 0.00 0.00 0.05 0.00 0.00 55.36 55.83 1gxh s GLN 84 Cb -1.06 -3.92 0.00 0.00 1.10 0.00 0.00 33.01 29.13 1gxh s GLN 84 CO 0.56 -0.92 0.48 0.41 -0.55 0.00 0.00 175.29 175.28