#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 2.91 -1.90 0.03 4.71 -1.26 -4.97 120.64 120.16 1gxh n GLU 2 Ca 0.00 -3.15 -0.42 0.00 -0.01 0.00 0.00 57.16 53.58 1gxh n GLU 2 Cb 0.00 -2.26 -0.02 0.00 -1.01 0.00 0.00 31.44 28.15 1gxh n GLU 2 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1gxh s LEU 3 N -3.28 4.37 0.23 -4.62 1.43 -1.26 -4.92 118.68 110.63 1gxh s LEU 3 Ca 0.54 2.77 -0.30 0.00 -1.03 0.00 0.00 54.13 56.11 1gxh s LEU 3 Cb 0.39 -3.62 -0.10 0.00 0.03 0.00 0.00 46.19 42.89 1gxh s LEU 3 CO -0.31 -0.81 1.45 -0.54 0.23 0.00 0.00 176.35 176.37 1gxh s LYS 4 N -0.11 4.27 0.00 1.70 3.01 -1.26 -4.88 119.74 122.47 1gxh s LYS 4 Ca 0.63 2.28 0.20 0.00 -1.01 0.00 0.00 55.97 58.08 1gxh s LYS 4 Cb -0.45 -3.13 1.03 0.00 -1.01 0.00 0.00 37.83 34.27 1gxh s LYS 4 CO 0.42 -0.44 1.63 0.09 0.51 0.00 0.00 175.35 177.57 1gxh n ASN 5 N 2.66 0.00 -3.63 2.83 5.03 -1.26 -4.78 115.26 116.12 1gxh n ASN 5 Ca 0.08 -0.03 -0.12 0.00 0.87 0.00 0.00 54.58 55.38 1gxh n ASN 5 Cb 0.40 -0.27 -0.05 0.00 -1.02 0.00 0.00 39.78 38.84 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 -2.54 -0.29 0.26 6.41 0.01 -1.26 -4.94 113.70 111.36 1gxh s SER 6 Ca 0.20 -0.16 -0.01 0.00 1.31 0.00 0.00 55.95 57.29 1gxh s SER 6 Cb 0.14 0.47 0.55 0.00 0.21 0.00 0.00 66.02 67.38 1gxh s SER 6 CO 0.30 -0.79 1.74 0.40 0.41 0.00 0.00 173.24 175.30 1gxh h ILE 7 N 2.58 0.65 0.00 1.44 1.08 -1.86 -1.49 117.51 119.91 1gxh h ILE 7 Ca -0.33 -0.18 0.00 0.00 -0.39 0.00 0.00 64.86 63.96 1gxh h ILE 7 Cb 1.24 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 35.08 1gxh h ILE 7 CO 0.45 0.09 0.00 -1.20 -0.69 0.00 0.00 178.15 176.80 1gxh n SER 8 N -4.95 0.00 -0.00 1.72 7.64 -1.24 -0.27 113.62 116.51 1gxh n SER 8 Ca 0.17 -0.73 0.05 0.00 1.01 0.00 0.00 58.87 59.37 1gxh n SER 8 Cb 0.47 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.60 1gxh n SER 8 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1gxh n ASP 9 N -0.86 1.23 -3.23 6.43 2.03 -0.58 -3.72 116.55 117.85 1gxh n ASP 9 Ca 0.10 -0.47 -0.37 0.00 0.52 0.00 0.00 54.79 54.57 1gxh n ASP 9 Cb 0.05 1.20 -0.04 0.00 -0.72 0.00 0.00 41.12 41.61 1gxh n ASP 9 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1gxh n TYR 10 N -1.51 2.26 -0.74 -0.67 4.01 0.62 -4.80 117.16 116.34 1gxh n TYR 10 Ca 0.00 -2.96 -0.25 0.00 -0.16 0.00 0.00 57.90 54.54 1gxh n TYR 10 Cb 0.22 -2.38 -0.01 0.00 -0.31 0.00 0.00 39.34 36.87 1gxh n TYR 10 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1gxh n THR 11 N 3.33 0.86 -0.36 -0.72 -2.24 -1.26 -3.78 114.28 110.11 1gxh n THR 11 Ca 0.75 -0.27 0.30 0.00 -2.27 0.00 0.00 64.05 62.56 1gxh n THR 11 Cb 0.28 0.00 0.63 0.00 -2.10 0.00 0.00 70.33 69.14 1gxh n THR 11 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1gxh h GLU 12 N 0.43 0.19 0.10 -0.78 4.81 -1.93 0.46 114.58 117.86 1gxh h GLU 12 Ca -0.16 -0.01 -0.27 0.00 -0.13 0.00 0.00 59.36 58.79 1gxh h GLU 12 Cb 0.77 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.11 1gxh h GLU 12 CO 0.29 0.13 -1.24 1.15 -0.73 0.00 0.00 179.01 178.60 1gxh h THR 13 N 0.19 1.49 -0.21 0.32 2.02 -1.98 -2.53 112.91 112.21 1gxh h THR 13 Ca 0.63 -3.10 -0.14 0.00 0.77 0.00 0.00 66.41 64.58 1gxh h THR 13 Cb 2.02 2.90 0.00 0.00 -1.74 0.00 0.00 68.15 71.32 1gxh h THR 13 CO -0.21 0.89 -0.41 -0.33 0.37 0.00 0.00 175.52 175.84 1gxh h GLU 14 N 0.06 0.64 -0.87 6.66 5.08 -0.45 -1.59 114.58 124.11 1gxh h GLU 14 Ca -0.13 -0.41 -0.02 0.00 -1.00 0.00 0.00 59.36 57.80 1gxh h GLU 14 Cb 1.94 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 31.20 1gxh h GLU 14 CO 0.18 1.03 0.48 0.35 -1.00 0.00 0.00 179.01 180.05 1gxh h PHE 15 N 0.33 1.19 -0.42 4.33 3.57 -1.17 -1.45 116.94 123.32 1gxh h PHE 15 Ca 0.01 -0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.57 1gxh h PHE 15 Cb 1.01 -0.38 -0.09 0.00 2.79 0.00 0.00 35.95 39.28 1gxh h PHE 15 CO 0.09 0.82 -0.27 -0.22 -2.23 0.00 0.00 178.31 176.50 1gxh h LYS 16 N 1.21 -0.18 -0.45 1.11 1.63 -1.33 -0.09 116.57 118.47 1gxh h LYS 16 Ca 0.31 0.01 0.08 0.00 -0.85 0.00 0.00 60.65 60.20 1gxh h LYS 16 Cb 0.02 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.67 1gxh h LYS 16 CO -0.05 -0.12 0.30 -0.22 -3.45 0.00 0.00 179.45 175.91 1gxh h LYS 17 N -0.19 0.25 0.40 1.90 3.11 -0.24 0.59 116.57 122.39 1gxh h LYS 17 Ca 0.19 -0.02 -0.02 0.00 -2.81 0.00 0.00 60.65 58.00 1gxh h LYS 17 Cb 0.50 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.68 1gxh h LYS 17 CO -0.53 0.17 -0.19 0.97 -2.81 0.00 0.00 179.45 177.05 1gxh h ILE 18 N 0.26 0.54 -0.13 2.00 2.10 -0.91 -1.78 117.51 119.58 1gxh h ILE 18 Ca 0.20 -0.49 -0.03 0.00 1.08 0.00 0.00 64.86 65.62 1gxh h ILE 18 Cb 0.47 0.75 -0.01 0.00 -1.09 0.00 0.00 36.82 36.94 1gxh h ILE 18 CO -0.04 0.08 -0.06 0.40 -1.08 0.00 0.00 178.15 177.45 1gxh h ILE 19 N -0.85 1.13 0.06 2.19 1.08 0.06 -2.68 117.51 118.49 1gxh h ILE 19 Ca -0.06 -0.53 -0.32 0.00 -0.39 0.00 0.00 64.86 63.57 1gxh h ILE 19 Cb 0.55 1.09 -0.03 0.00 -3.07 0.00 0.00 36.82 35.35 1gxh h ILE 19 CO 0.09 0.17 -1.77 -0.33 -0.69 0.00 0.00 178.15 175.62 1gxh h GLU 20 N 0.19 0.12 -0.40 2.37 5.08 0.04 -2.97 114.58 119.02 1gxh h GLU 20 Ca 0.04 -0.20 0.08 0.00 -1.00 0.00 0.00 59.36 58.28 1gxh h GLU 20 Cb 0.23 0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 1gxh h GLU 20 CO 0.01 0.82 -0.03 0.22 -1.00 0.00 0.00 179.01 179.03 1gxh h ASP 21 N 0.03 -0.22 0.53 1.42 1.82 -0.99 -0.32 116.42 118.70 1gxh h ASP 21 Ca -0.32 0.10 -0.02 0.00 -0.39 0.00 0.00 57.03 56.40 1gxh h ASP 21 Cb 2.02 0.19 -0.00 0.00 0.68 0.00 0.00 39.33 42.21 1gxh h ASP 21 CO 0.09 -0.07 -0.32 0.16 -1.61 0.00 0.00 179.24 177.49 1gxh h ILE 22 N 0.07 0.00 -0.86 2.25 3.07 -1.66 -1.00 117.51 119.38 1gxh h ILE 22 Ca 0.19 0.00 0.09 0.00 1.55 0.00 0.00 64.86 66.70 1gxh h ILE 22 Cb 0.28 0.00 -0.06 0.00 -0.27 0.00 0.00 36.82 36.77 1gxh h ILE 22 CO -0.35 0.00 0.56 0.40 -1.05 0.00 0.00 178.15 177.71 1gxh h ILE 23 N -0.79 0.97 -0.43 0.16 1.08 -1.31 -0.01 117.51 117.18 1gxh h ILE 23 Ca -0.07 -0.29 -0.15 0.00 -0.39 0.00 0.00 64.86 63.96 1gxh h ILE 23 Cb 0.63 0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.42 1gxh h ILE 23 CO 0.08 0.15 -0.30 0.78 -0.69 0.00 0.00 178.15 178.17 1gxh h ASN 24 N 0.85 0.99 -1.56 1.72 2.35 -1.11 -3.48 115.58 115.34 1gxh h ASN 24 Ca 0.40 -0.42 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1gxh h ASN 24 Cb 0.40 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1gxh h ASN 24 CO -0.16 1.21 0.00 0.00 -1.65 0.00 0.00 177.43 176.83 1gxh n GLU 26 N -0.78 1.74 0.00 0.00 2.13 -0.51 -4.56 120.64 118.65 1gxh n GLU 26 Ca 0.00 -0.97 0.00 0.00 0.66 0.00 0.00 57.16 56.85 1gxh n GLU 26 Cb 0.30 -2.04 0.00 0.00 0.27 0.00 0.00 31.44 29.97 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 2.91 -0.58 3.57 8.31 0.00 -1.26 -5.05 105.19 113.09 1gxh n GLY 27 Ca 0.37 0.24 -0.14 0.00 0.00 0.00 0.00 46.02 46.49 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 -3.21 -0.58 0.30 1.61 -1.08 -1.26 -5.07 116.67 107.38 1gxh s ASP 28 Ca 0.00 0.81 0.07 0.00 -0.52 0.00 0.00 52.55 52.91 1gxh s ASP 28 Cb 0.00 0.72 0.79 0.00 -1.46 0.00 0.00 42.92 42.97 1gxh s ASP 28 CO 0.00 -0.41 1.73 1.05 0.52 0.00 0.00 175.17 178.06 1gxh h GLU 29 N 3.46 0.57 -0.82 4.34 4.11 -1.99 -2.32 114.58 121.93 1gxh h GLU 29 Ca -0.25 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 59.13 1gxh h GLU 29 Cb 1.15 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 30.24 1gxh h GLU 29 CO 0.26 0.38 0.48 0.87 0.07 0.00 0.00 179.01 181.07 1gxh h LYS 30 N 0.58 1.13 -0.88 1.06 1.57 -1.98 0.49 116.57 118.53 1gxh h LYS 30 Ca 0.60 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 59.27 1gxh h LYS 30 Cb 1.07 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 33.11 1gxh h LYS 30 CO -0.46 0.80 0.57 -0.22 -0.57 0.00 0.00 179.45 179.58 1gxh h LYS 31 N 1.14 1.17 -0.23 3.15 3.64 -1.85 0.22 116.57 123.81 1gxh h LYS 31 Ca 0.29 -0.08 -0.19 0.00 -1.27 0.00 0.00 60.65 59.41 1gxh h LYS 31 Cb -0.02 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.55 1gxh h LYS 31 CO -0.05 0.79 -0.59 1.96 -2.27 0.00 0.00 179.45 179.29 1gxh h GLN 32 N 1.20 0.81 -0.93 1.90 4.20 -0.96 -1.97 115.11 119.36 1gxh h GLN 32 Ca 0.32 -0.56 0.05 0.00 0.06 0.00 0.00 58.65 58.53 1gxh h GLN 32 Cb -0.12 0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.69 1gxh h GLN 32 CO -0.07 1.18 0.59 0.22 -0.67 0.00 0.00 178.83 180.09 1gxh h ASP 33 N 0.56 0.96 -0.30 1.46 3.58 -0.67 0.26 116.42 122.27 1gxh h ASP 33 Ca -0.01 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 1gxh h ASP 33 Cb 1.20 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 42.04 1gxh h ASP 33 CO 0.13 0.63 0.08 -0.78 -2.88 0.00 0.00 179.24 176.42 1gxh h ASP 34 N 1.11 0.45 -0.79 2.28 3.58 -0.93 -0.07 116.42 122.05 1gxh h ASP 34 Ca 0.39 -0.23 0.07 0.00 0.42 0.00 0.00 57.03 57.69 1gxh h ASP 34 Cb 0.10 -0.12 -0.06 0.00 1.72 0.00 0.00 39.33 40.97 1gxh h ASP 34 CO -0.15 0.56 0.46 -1.13 -2.88 0.00 0.00 179.24 176.10 1gxh h ASN 35 N 0.32 0.69 -0.04 2.28 -1.24 -1.07 -3.21 115.58 113.31 1gxh h ASN 35 Ca 0.09 0.03 -0.17 0.00 0.71 0.00 0.00 56.30 56.97 1gxh h ASN 35 Cb 0.28 -0.10 -0.00 0.00 0.73 0.00 0.00 38.32 39.22 1gxh h ASN 35 CO 0.00 0.42 -0.57 -0.07 -1.29 0.00 0.00 177.43 175.92 1gxh h LEU 36 N 0.82 0.71 -0.31 0.34 3.38 0.14 0.40 115.31 120.79 1gxh h LEU 36 Ca 0.36 -0.39 0.07 0.00 0.09 0.00 0.00 57.88 58.01 1gxh h LEU 36 Cb 0.25 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.73 1gxh h LEU 36 CO -0.21 1.13 -0.14 -0.08 0.09 0.00 0.00 178.44 179.24 1gxh h GLU 37 N 0.48 -0.08 -0.38 1.13 4.22 -1.50 -2.25 114.58 116.20 1gxh h GLU 37 Ca 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.43 1gxh h GLU 37 Cb 1.14 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 1gxh h GLU 37 CO 0.11 -0.06 0.14 1.25 -2.18 0.00 0.00 179.01 178.28 1gxh h HIS 38 N -0.09 0.58 0.00 0.92 2.76 -0.91 0.21 115.15 118.62 1gxh h HIS 38 Ca 0.16 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.28 1gxh h HIS 38 Cb 0.33 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 29.12 1gxh h HIS 38 CO -0.35 0.53 0.02 0.35 -1.30 0.00 0.00 177.93 177.18 1gxh h PHE 39 N 0.46 0.00 0.00 5.26 3.57 -0.23 0.13 116.94 126.13 1gxh h PHE 39 Ca 0.12 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 1gxh h PHE 39 Cb 0.20 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.94 1gxh h PHE 39 CO 0.00 0.00 -0.12 0.82 -2.23 0.00 0.00 178.31 176.78 1gxh h ILE 40 N 0.00 0.72 0.37 1.41 5.03 -0.43 -3.40 117.51 121.21 1gxh h ILE 40 Ca 0.00 -1.57 -0.01 0.00 -0.12 0.00 0.00 64.86 63.15 1gxh h ILE 40 Cb 0.03 1.40 -0.01 0.00 -3.03 0.00 0.00 36.82 35.21 1gxh h ILE 40 CO 0.00 0.25 -0.32 -1.28 -0.68 0.00 0.00 178.15 176.12 1gxh h SER 41 N -1.00 -0.85 -0.53 1.72 0.87 0.20 -1.59 113.55 112.37 1gxh h SER 41 Ca -0.02 0.06 -0.07 0.00 -1.23 0.00 0.00 61.79 60.53 1gxh h SER 41 Cb 0.49 0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.70 1gxh h SER 41 CO -0.01 -0.44 0.09 -0.37 -0.53 0.00 0.00 176.83 175.57 1gxh h VAL 42 N -0.67 1.25 -0.05 2.23 -1.51 -1.59 -3.24 116.25 112.66 1gxh h VAL 42 Ca -0.05 -0.95 -0.07 0.00 -1.23 0.00 0.00 66.70 64.41 1gxh h VAL 42 Cb 0.57 0.70 -0.01 0.00 -2.13 0.00 0.00 31.29 30.42 1gxh h VAL 42 CO -0.01 0.35 -0.28 0.74 -1.23 0.00 0.00 177.57 177.14 1gxh h THR 43 N 0.88 1.22 0.00 7.19 2.02 -1.58 -3.29 112.91 119.35 1gxh h THR 43 Ca 0.18 -1.04 0.00 0.00 0.77 0.00 0.00 66.41 66.32 1gxh h THR 43 Cb 0.38 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 1gxh h THR 43 CO 0.01 0.31 0.00 -0.62 0.37 0.00 0.00 175.52 175.58 1gxh n GLU 44 N -4.18 -0.41 -2.52 6.66 1.02 -0.65 -4.92 120.64 115.64 1gxh n GLU 44 Ca -0.02 0.09 -0.43 0.00 -0.02 0.00 0.00 57.16 56.79 1gxh n GLU 44 Cb 0.35 -4.35 -0.02 0.00 -0.02 0.00 0.00 31.44 27.40 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 -0.92 2.78 0.32 -0.32 2.46 -1.26 -4.92 115.29 113.43 1gxh s HIS 45 Ca 0.00 0.85 -0.00 0.00 0.47 0.00 0.00 55.06 56.38 1gxh s HIS 45 Cb 0.00 -4.13 0.52 0.00 -0.13 0.00 0.00 32.58 28.84 1gxh s HIS 45 CO 0.00 -1.39 1.97 -1.00 -2.47 0.00 0.00 174.74 171.85 1gxh h PRO 46 N 9.27 0.95 -0.98 2.88 0.13 -1.92 -0.36 132.00 141.97 1gxh h PRO 46 Ca -0.24 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 64.81 1gxh h PRO 46 Cb 1.08 -0.21 -0.00 0.00 0.13 0.00 0.00 31.00 32.00 1gxh h PRO 46 CO 1.08 0.65 0.01 0.43 -0.23 0.00 0.00 178.00 179.94 1gxh n SER 47 N -4.41 1.63 -4.53 1.44 7.64 -1.26 -4.93 113.62 109.20 1gxh n SER 47 Ca 0.07 -2.06 -0.55 0.00 1.01 0.00 0.00 58.87 57.35 1gxh n SER 47 Cb 0.05 -0.51 -0.06 0.00 -1.01 0.00 0.00 64.21 62.68 1gxh n SER 47 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gxh n GLY 48 N 0.11 -0.11 4.38 0.23 0.00 -0.15 -0.85 105.19 108.80 1gxh n GLY 48 Ca 0.02 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.72 1gxh n GLY 48 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1gxh n SER 49 N 1.92 0.00 0.04 1.61 2.88 -1.26 -4.78 113.62 114.04 1gxh n SER 49 Ca 0.19 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1gxh n SER 49 Cb 0.15 -0.19 0.30 0.00 -0.75 0.00 0.00 64.21 63.72 1gxh n SER 49 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1gxh h ASP 50 N 0.00 0.40 0.65 -3.46 3.58 -1.38 0.44 116.42 116.65 1gxh h ASP 50 Ca 0.00 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.36 1gxh h ASP 50 Cb 0.00 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 40.94 1gxh h ASP 50 CO 0.00 0.55 0.00 0.18 -2.88 0.00 0.00 179.24 177.09 1gxh n LEU 51 N -4.23 0.05 -0.08 2.28 7.99 -1.21 -0.94 117.00 120.85 1gxh n LEU 51 Ca 0.00 0.51 -0.14 0.00 -0.01 0.00 0.00 56.01 56.37 1gxh n LEU 51 Cb 0.30 -0.50 -0.07 0.00 -0.11 0.00 0.00 43.42 43.04 1gxh n LEU 51 CO 0.39 -0.20 -1.05 -0.38 -1.51 0.00 0.00 177.39 174.64 1gxh n ILE 52 N -1.55 0.93 0.00 -0.08 5.41 -0.71 -4.54 119.36 118.83 1gxh n ILE 52 Ca 0.04 -0.31 -0.21 0.00 1.00 0.00 0.00 62.75 63.27 1gxh n ILE 52 Cb 0.22 -1.31 -0.14 0.00 -0.71 0.00 0.00 39.64 37.70 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 -3.26 1.27 -2.50 1.39 4.01 0.07 -4.67 117.16 113.46 1gxh n TYR 53 Ca -0.31 0.27 -0.17 0.00 -0.16 0.00 0.00 57.90 57.54 1gxh n TYR 53 Cb 0.78 -1.16 0.02 0.00 -0.31 0.00 0.00 39.34 38.67 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 -3.51 2.26 -2.27 -0.72 4.01 -0.12 -5.07 117.16 111.73 1gxh n TYR 54 Ca -0.32 -2.68 -0.37 0.00 -0.16 0.00 0.00 57.90 54.37 1gxh n TYR 54 Cb 1.04 -0.24 -0.01 0.00 -0.31 0.00 0.00 39.34 39.82 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 -3.47 3.74 0.00 -0.72 0.04 -1.20 -4.83 135.00 128.56 1gxh s PRO 55 Ca 0.39 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.17 1gxh s PRO 55 Cb 0.41 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 32.57 1gxh s PRO 55 CO -0.05 -0.56 0.00 -0.85 0.04 0.00 0.00 177.00 175.58 1gxh n GLU 56 N -0.54 0.00 -1.20 4.56 0.28 -1.26 -4.97 120.64 117.51 1gxh n GLU 56 Ca 0.08 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 57.05 1gxh n GLU 56 Cb 0.48 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.34 1gxh n GLU 56 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1gxh n GLY 57 N 0.00 0.54 2.64 -1.84 0.00 -1.26 -1.03 105.19 104.24 1gxh n GLY 57 Ca 0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 46.02 45.07 1gxh n GLY 57 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1gxh n ASN 58 N 1.57 -4.96 -4.68 1.61 5.15 -1.26 -5.00 115.26 107.69 1gxh n ASN 58 Ca -0.03 0.03 -0.46 0.00 -0.60 0.00 0.00 54.58 53.52 1gxh n ASN 58 Cb 0.14 -2.58 -0.04 0.00 -0.53 0.00 0.00 39.78 36.77 1gxh n ASN 58 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1gxh n ASN 59 N -0.62 3.38 0.11 1.20 5.15 -0.20 -4.87 115.26 119.41 1gxh n ASN 59 Ca -0.01 1.03 0.12 0.00 -0.60 0.00 0.00 54.58 55.12 1gxh n ASN 59 Cb 0.34 -1.42 0.45 0.00 -0.53 0.00 0.00 39.78 38.62 1gxh n ASN 59 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1gxh n ASP 60 N 5.01 0.70 0.00 1.20 2.03 -1.26 -4.52 116.55 119.72 1gxh n ASP 60 Ca 0.19 0.62 0.00 0.00 0.52 0.00 0.00 54.79 56.12 1gxh n ASP 60 Cb 0.30 -0.79 0.00 0.00 -0.72 0.00 0.00 41.12 39.92 1gxh n ASP 60 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1gxh n GLY 61 N 0.64 0.27 3.80 0.27 0.00 -1.26 -5.00 105.19 103.91 1gxh n GLY 61 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1gxh n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gxh s SER 62 N -2.20 5.06 0.19 1.61 0.01 -1.26 -4.83 113.70 112.29 1gxh s SER 62 Ca 0.00 1.63 0.18 0.00 1.31 0.00 0.00 55.95 59.07 1gxh s SER 62 Cb 0.00 -2.45 0.83 0.00 0.21 0.00 0.00 66.02 64.61 1gxh s SER 62 CO 0.00 -1.65 1.55 -0.81 0.41 0.00 0.00 173.24 172.74 1gxh n PRO 63 N -3.26 0.12 0.13 12.44 -0.04 -1.26 -1.05 135.00 142.07 1gxh n PRO 63 Ca 0.08 0.47 -0.13 0.00 -0.04 0.00 0.00 63.50 63.88 1gxh n PRO 63 Cb 0.54 -1.78 -0.08 0.00 -0.04 0.00 0.00 33.50 32.14 1gxh n PRO 63 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1gxh h GLU 64 N 0.00 -0.35 -0.89 0.54 -0.00 -1.99 -2.96 114.58 108.93 1gxh h GLU 64 Ca 0.00 0.02 0.06 0.00 -0.00 0.00 0.00 59.36 59.44 1gxh h GLU 64 Cb 0.18 0.08 -0.06 0.00 -0.00 0.00 0.00 28.75 28.94 1gxh h GLU 64 CO 0.00 -0.00 0.56 0.00 -0.00 0.00 0.00 179.01 179.57 1gxh h ALA 65 N -0.23 1.23 -0.29 1.06 0.00 -1.44 0.28 119.26 119.86 1gxh h ALA 65 Ca -0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1gxh h ALA 65 Cb 0.51 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1gxh h ALA 65 CO 0.06 0.33 0.06 0.28 0.00 0.00 0.00 179.25 179.98 1gxh h VAL 66 N 1.03 1.22 -0.74 0.00 2.07 -1.36 0.13 116.25 118.59 1gxh h VAL 66 Ca 0.39 -0.74 0.04 0.00 0.82 0.00 0.00 66.70 67.21 1gxh h VAL 66 Cb 0.15 1.16 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1gxh h VAL 66 CO -0.17 0.24 0.46 0.40 0.02 0.00 0.00 177.57 178.53 1gxh h ILE 67 N 0.29 1.08 0.20 4.57 5.03 -1.05 0.69 117.51 128.33 1gxh h ILE 67 Ca 0.09 -0.31 0.00 0.00 -0.12 0.00 0.00 64.86 64.53 1gxh h ILE 67 Cb 0.30 0.11 -0.03 0.00 -3.03 0.00 0.00 36.82 34.17 1gxh h ILE 67 CO 0.00 0.16 -0.45 0.11 -0.68 0.00 0.00 178.15 177.30 1gxh h LYS 68 N 0.89 -0.69 0.00 2.37 1.57 -0.87 -0.16 116.57 119.68 1gxh h LYS 68 Ca 0.31 0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.13 1gxh h LYS 68 Cb 0.05 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 1gxh h LYS 68 CO -0.12 -0.46 -0.03 0.93 -0.57 0.00 0.00 179.45 179.20 1gxh h GLU 69 N -0.71 0.00 0.18 3.15 4.39 0.46 0.41 114.58 122.46 1gxh h GLU 69 Ca -0.02 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 1gxh h GLU 69 Cb 0.68 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1gxh h GLU 69 CO -0.19 0.03 -0.09 0.82 -1.16 0.00 0.00 179.01 178.42 1gxh h ILE 70 N 0.00 0.69 -0.57 3.13 5.03 -0.56 0.13 117.51 125.36 1gxh h ILE 70 Ca -0.00 -1.09 0.12 0.00 -0.12 0.00 0.00 64.86 63.76 1gxh h ILE 70 Cb 0.09 1.17 -0.10 0.00 -3.03 0.00 0.00 36.82 34.96 1gxh h ILE 70 CO 0.00 0.19 -0.05 0.11 -0.68 0.00 0.00 178.15 177.72 1gxh h LYS 71 N -0.92 0.07 0.08 2.37 1.57 0.52 -0.93 116.57 119.32 1gxh h LYS 71 Ca -0.02 -0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.47 1gxh h LYS 71 Cb 0.49 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 1gxh h LYS 71 CO 0.04 0.05 -1.45 0.93 -0.57 0.00 0.00 179.45 178.44 1gxh h GLU 72 N 0.07 0.17 0.25 3.15 3.07 -0.21 0.35 114.58 121.44 1gxh h GLU 72 Ca 0.29 -0.29 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1gxh h GLU 72 Cb 0.46 0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 28.44 1gxh h GLU 72 CO -0.52 1.00 -0.31 2.35 -1.40 0.00 0.00 179.01 180.13 1gxh h TRP 73 N 0.05 -0.84 -0.74 4.33 7.01 -0.76 0.76 115.95 125.75 1gxh h TRP 73 Ca -0.20 0.01 0.03 0.00 2.11 0.00 0.00 58.89 60.83 1gxh h TRP 73 Cb 1.97 0.34 -0.04 0.00 -2.10 0.00 0.00 29.16 29.33 1gxh h TRP 73 CO 0.04 -0.44 0.49 0.00 -2.79 0.00 0.00 178.44 175.74 1gxh h ARG 74 N -0.62 0.90 0.58 2.65 2.47 -0.91 0.03 114.38 119.48 1gxh h ARG 74 Ca -0.00 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 58.64 1gxh h ARG 74 Cb 0.59 -0.20 -0.00 0.00 -1.65 0.00 0.00 29.97 28.70 1gxh h ARG 74 CO -0.10 0.59 -0.38 0.00 0.56 0.00 0.00 179.97 180.65 1gxh h ALA 75 N 1.56 -1.17 -0.79 0.04 0.00 0.03 0.15 119.26 119.08 1gxh h ALA 75 Ca 0.29 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1gxh h ALA 75 Cb 0.00 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 1gxh h ALA 75 CO -0.08 -1.15 0.48 0.00 0.00 0.00 0.00 179.25 178.50 1gxh h ALA 76 N -1.32 1.08 0.00 0.00 0.00 -0.58 -0.67 119.26 117.77 1gxh h ALA 76 Ca -0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1gxh h ALA 76 Cb 0.73 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1gxh h ALA 76 CO 0.07 0.20 -0.06 -0.91 0.00 0.00 0.00 179.25 178.55 1gxh h ASN 77 N 0.87 0.00 0.00 0.00 2.35 -0.95 -3.44 115.58 114.42 1gxh h ASN 77 Ca 0.35 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 1gxh h ASN 77 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1gxh h ASN 77 CO -0.17 0.06 0.00 0.61 -1.65 0.00 0.00 177.43 176.28 1gxh n GLY 78 N 0.22 0.00 0.00 2.83 0.00 -0.64 -5.07 105.19 102.53 1gxh n GLY 78 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 -3.00 1.61 -0.00 0.42 -4.94 118.16 112.25 1gxh n LYS 79 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1gxh n LYS 79 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 35.03 35.03 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 -1.26 0.00 -5.58 0.01 -1.25 -4.93 113.70 100.69 1gxh s SER 80 Ca 0.00 -0.89 0.00 0.00 1.31 0.00 0.00 55.95 56.37 1gxh s SER 80 Cb 0.00 1.62 0.00 0.00 0.21 0.00 0.00 66.02 67.85 1gxh s SER 80 CO 0.00 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.15 1gxh n GLY 81 N 3.85 -0.39 0.00 3.44 0.00 -1.26 -4.84 105.19 105.98 1gxh n GLY 81 Ca 0.12 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.51 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 0.00 -1.68 -1.54 1.61 3.72 -1.25 -3.63 117.46 114.69 1gxh n PHE 82 Ca 0.00 0.00 -0.55 0.00 -0.05 0.00 0.00 57.45 56.85 1gxh n PHE 82 Cb 0.00 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.47 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 -1.18 0.54 -0.37 -1.08 3.00 -1.24 -4.70 118.16 113.13 1gxh n LYS 83 Ca 0.00 0.19 -0.04 0.00 -0.00 0.00 0.00 58.31 58.47 1gxh n LYS 83 Cb 0.00 -1.73 -0.05 0.00 0.00 0.00 0.00 35.03 33.25 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 1.90 0.74 0.00 1.64 7.27 -1.26 -4.58 117.38 123.08 1gxh n GLN 84 Ca 0.19 -0.32 0.13 0.00 0.07 0.00 0.00 57.00 57.07 1gxh n GLN 84 Cb 0.14 -1.61 0.78 0.00 2.41 0.00 0.00 30.24 31.97 1gxh n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54