#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 0.00 0.00 2.12 -0.00 -1.26 -4.65 120.64 116.85 1gxh n GLU 2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 1gxh n GLU 2 Cb 0.00 -0.82 0.00 0.00 -0.00 0.00 0.00 31.44 30.62 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 5.67 0.00 -4.75 -1.84 4.77 -1.26 -4.43 117.00 115.16 1gxh n LEU 3 Ca 0.37 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.94 1gxh n LEU 3 Cb 0.02 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.07 1gxh n LEU 3 CO 0.53 -0.05 0.78 -0.54 -1.33 0.00 0.00 177.39 176.79 1gxh s LYS 4 N 0.00 4.64 0.02 3.23 3.01 -1.26 -4.97 119.74 124.41 1gxh s LYS 4 Ca 0.00 1.75 0.28 0.00 -1.01 0.00 0.00 55.97 56.99 1gxh s LYS 4 Cb 0.00 -3.22 0.98 0.00 -1.01 0.00 0.00 37.83 34.58 1gxh s LYS 4 CO 0.00 0.19 1.76 0.09 0.51 0.00 0.00 175.35 177.90 1gxh n ASN 5 N 1.59 0.22 -3.49 2.83 4.13 -1.26 -4.82 115.26 114.46 1gxh n ASN 5 Ca 0.00 0.29 -0.10 0.00 1.68 0.00 0.00 54.58 56.46 1gxh n ASN 5 Cb 0.45 -0.30 -0.02 0.00 -1.54 0.00 0.00 39.78 38.37 1gxh n ASN 5 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1gxh s SER 6 N -3.16 -0.43 0.37 6.41 0.01 -1.26 -4.77 113.70 110.87 1gxh s SER 6 Ca 0.13 0.07 0.11 0.00 1.31 0.00 0.00 55.95 57.57 1gxh s SER 6 Cb 0.18 0.43 0.89 0.00 0.21 0.00 0.00 66.02 67.73 1gxh s SER 6 CO 0.59 -0.68 1.85 0.40 0.41 0.00 0.00 173.24 175.81 1gxh h ILE 7 N 2.09 0.77 0.00 1.44 1.08 -1.85 -0.63 117.51 120.42 1gxh h ILE 7 Ca -0.25 -0.21 0.00 0.00 -0.39 0.00 0.00 64.86 64.01 1gxh h ILE 7 Cb 1.25 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 35.09 1gxh h ILE 7 CO 0.33 0.11 0.00 -1.20 -0.69 0.00 0.00 178.15 176.70 1gxh n SER 8 N -4.58 0.00 -0.01 1.72 7.64 -1.25 -0.64 113.62 116.51 1gxh n SER 8 Ca 0.19 -1.33 0.06 0.00 1.01 0.00 0.00 58.87 58.80 1gxh n SER 8 Cb 0.56 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.65 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 -0.82 1.90 -3.39 6.43 2.03 -0.26 -3.95 116.55 118.49 1gxh n ASP 9 Ca 0.15 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 55.06 1gxh n ASP 9 Cb 0.07 1.59 -0.02 0.00 -0.72 0.00 0.00 41.12 42.03 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 -1.99 2.63 -0.51 -0.67 4.01 0.18 -4.68 117.16 116.12 1gxh n TYR 10 Ca -0.03 -3.06 -0.18 0.00 -0.16 0.00 0.00 57.90 54.47 1gxh n TYR 10 Cb 0.37 -2.50 -0.01 0.00 -0.31 0.00 0.00 39.34 36.89 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 3.89 0.72 -0.34 -0.72 -2.24 -1.26 -3.62 114.28 110.71 1gxh n THR 11 Ca 0.73 -0.18 0.25 0.00 -2.27 0.00 0.00 64.05 62.58 1gxh n THR 11 Cb 0.26 0.00 0.50 0.00 -2.10 0.00 0.00 70.33 68.99 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 0.36 0.28 0.00 -0.78 4.81 -1.92 0.48 114.58 117.81 1gxh h GLU 12 Ca -0.10 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.02 1gxh h GLU 12 Cb 0.53 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1gxh h GLU 12 CO 0.21 0.19 -0.91 1.15 -0.73 0.00 0.00 179.01 178.92 1gxh h THR 13 N 0.29 0.42 -0.16 0.32 2.02 -1.99 -2.64 112.91 111.16 1gxh h THR 13 Ca 0.75 -1.70 -0.18 0.00 0.77 0.00 0.00 66.41 66.04 1gxh h THR 13 Cb 1.77 2.01 -0.00 0.00 -1.74 0.00 0.00 68.15 70.18 1gxh h THR 13 CO -0.60 0.24 -0.65 -0.33 0.37 0.00 0.00 175.52 174.55 1gxh h GLU 14 N 0.00 0.61 0.00 6.66 5.08 -0.35 -1.38 114.58 125.20 1gxh h GLU 14 Ca -0.06 -0.44 -0.07 0.00 -1.00 0.00 0.00 59.36 57.80 1gxh h GLU 14 Cb 1.32 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 1gxh h GLU 14 CO 0.03 1.06 -0.31 0.35 -1.00 0.00 0.00 179.01 179.14 1gxh h PHE 15 N 0.44 0.00 0.25 4.33 3.57 -1.28 -1.95 116.94 122.31 1gxh h PHE 15 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1gxh h PHE 15 Cb 1.23 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.93 1gxh h PHE 15 CO 0.06 0.31 -0.46 -0.22 -2.23 0.00 0.00 178.31 175.77 1gxh h LYS 16 N 0.00 -0.73 -0.89 1.11 1.63 -1.28 -1.68 116.57 114.73 1gxh h LYS 16 Ca -0.00 0.05 0.20 0.00 -0.85 0.00 0.00 60.65 60.04 1gxh h LYS 16 Cb 0.55 0.17 -0.07 0.00 -0.60 0.00 0.00 32.23 32.28 1gxh h LYS 16 CO 0.04 -0.49 0.59 -0.22 -3.45 0.00 0.00 179.45 175.92 1gxh h LYS 17 N -0.76 0.43 0.79 1.90 3.11 -0.48 0.37 116.57 121.93 1gxh h LYS 17 Ca -0.03 -0.03 -0.04 0.00 -2.81 0.00 0.00 60.65 57.75 1gxh h LYS 17 Cb 0.71 -0.10 0.01 0.00 -1.00 0.00 0.00 32.23 31.85 1gxh h LYS 17 CO -0.17 0.28 -0.38 0.82 -2.81 0.00 0.00 179.45 177.19 1gxh h ILE 18 N 0.44 0.00 -0.16 2.00 2.04 -1.29 -0.07 117.51 120.47 1gxh h ILE 18 Ca 0.47 -0.09 -0.08 0.00 1.00 0.00 0.00 64.86 66.15 1gxh h ILE 18 Cb 1.11 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1gxh h ILE 18 CO -0.18 0.00 -0.27 0.40 0.00 0.00 0.00 178.15 178.10 1gxh h ILE 19 N -1.16 1.25 -0.24 -0.67 5.03 0.03 -0.51 117.51 121.24 1gxh h ILE 19 Ca -0.11 -1.20 0.04 0.00 -0.12 0.00 0.00 64.86 63.47 1gxh h ILE 19 Cb 0.82 1.44 -0.04 0.00 -3.03 0.00 0.00 36.82 36.00 1gxh h ILE 19 CO 0.18 0.37 -0.01 -0.08 -0.68 0.00 0.00 178.15 177.92 1gxh h GLU 20 N 0.27 0.06 -0.81 2.37 4.81 -0.47 -2.87 114.58 117.94 1gxh h GLU 20 Ca 0.04 -0.00 0.20 0.00 -0.13 0.00 0.00 59.36 59.46 1gxh h GLU 20 Cb 0.62 -0.01 -0.14 0.00 0.63 0.00 0.00 28.75 29.86 1gxh h GLU 20 CO 0.04 0.04 0.09 0.22 -0.73 0.00 0.00 179.01 178.67 1gxh h ASP 21 N 0.06 -0.23 0.14 1.04 3.58 0.70 0.15 116.42 121.85 1gxh h ASP 21 Ca 0.12 0.20 -0.01 0.00 0.42 0.00 0.00 57.03 57.76 1gxh h ASP 21 Cb 0.15 0.32 0.00 0.00 1.72 0.00 0.00 39.33 41.53 1gxh h ASP 21 CO -0.21 -0.17 -0.07 0.40 -2.88 0.00 0.00 179.24 176.32 1gxh h ILE 22 N 0.14 0.87 -0.04 2.25 2.04 -1.49 0.33 117.51 121.61 1gxh h ILE 22 Ca 0.47 -0.02 -0.14 0.00 1.00 0.00 0.00 64.86 66.17 1gxh h ILE 22 Cb 0.87 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1gxh h ILE 22 CO -0.67 0.00 -0.61 0.40 0.00 0.00 0.00 178.15 177.28 1gxh h ILE 23 N -0.19 1.41 -0.56 -0.67 1.08 -0.72 -2.50 117.51 115.34 1gxh h ILE 23 Ca -0.02 -2.02 -0.08 0.00 -0.39 0.00 0.00 64.86 62.35 1gxh h ILE 23 Cb 0.15 2.05 -0.02 0.00 -3.07 0.00 0.00 36.82 35.93 1gxh h ILE 23 CO 0.03 0.59 0.06 0.78 -0.69 0.00 0.00 178.15 178.92 1gxh h ASN 24 N 0.11 0.93 -4.23 1.72 2.35 -0.83 -3.48 115.58 112.14 1gxh h ASN 24 Ca -0.01 -0.28 -0.14 0.00 -0.55 0.00 0.00 56.30 55.32 1gxh h ASN 24 Cb 1.10 -0.25 0.10 0.00 0.05 0.00 0.00 38.32 39.33 1gxh h ASN 24 CO 0.09 0.97 -0.45 0.00 -1.65 0.00 0.00 177.43 176.39 1gxh n GLU 26 N -2.48 1.71 -3.58 0.00 2.13 -0.37 -4.78 120.64 113.26 1gxh n GLU 26 Ca -0.06 -0.93 0.00 0.00 0.66 0.00 0.00 57.16 56.82 1gxh n GLU 26 Cb 0.57 -2.01 0.00 0.00 0.27 0.00 0.00 31.44 30.27 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 2.86 -0.90 0.00 8.31 0.00 -1.26 -4.97 105.19 109.22 1gxh n GLY 27 Ca 0.37 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1gxh n GLY 27 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gxh n ASP 28 N 0.83 0.00 0.26 1.61 5.75 -1.26 -5.01 116.55 118.73 1gxh n ASP 28 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 54.79 54.64 1gxh n ASP 28 Cb 0.00 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.01 1gxh n ASP 28 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1gxh h GLU 29 N 0.00 -0.64 -0.37 0.11 5.08 -2.00 -3.36 114.58 113.39 1gxh h GLU 29 Ca 0.00 0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1gxh h GLU 29 Cb 0.00 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1gxh h GLU 29 CO 0.00 -0.34 0.08 0.87 -1.00 0.00 0.00 179.01 178.62 1gxh h LYS 30 N -0.96 0.55 -0.50 2.33 1.79 -1.97 -0.71 116.57 117.10 1gxh h LYS 30 Ca -0.07 -0.10 -0.01 0.00 -2.18 0.00 0.00 60.65 58.29 1gxh h LYS 30 Cb 0.60 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.14 1gxh h LYS 30 CO 0.11 0.52 0.27 -0.22 -1.08 0.00 0.00 179.45 179.05 1gxh h LYS 31 N 0.54 0.70 -0.26 3.15 1.63 -1.96 0.35 116.57 120.72 1gxh h LYS 31 Ca 0.12 -0.09 -0.09 0.00 -0.85 0.00 0.00 60.65 59.75 1gxh h LYS 31 Cb 0.23 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 1gxh h LYS 31 CO -0.00 0.56 -0.17 1.96 -3.45 0.00 0.00 179.45 178.35 1gxh h GLN 32 N 0.66 0.58 -0.78 1.90 4.20 -1.50 -2.13 115.11 118.05 1gxh h GLN 32 Ca 0.17 -0.27 0.01 0.00 0.06 0.00 0.00 58.65 58.62 1gxh h GLN 32 Cb 0.07 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 1gxh h GLN 32 CO -0.03 0.85 0.51 0.22 -0.67 0.00 0.00 178.83 179.72 1gxh h ASP 33 N 0.31 0.89 -0.19 1.46 3.58 -0.96 0.20 116.42 121.71 1gxh h ASP 33 Ca 0.05 -0.02 -0.05 0.00 0.42 0.00 0.00 57.03 57.43 1gxh h ASP 33 Cb 0.70 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 1gxh h ASP 33 CO 0.05 0.65 -0.08 0.44 -2.88 0.00 0.00 179.24 177.42 1gxh h ASP 34 N 1.06 0.39 -0.39 2.28 5.19 -0.20 -0.86 116.42 123.88 1gxh h ASP 34 Ca 0.28 -0.40 0.05 0.00 -0.62 0.00 0.00 57.03 56.34 1gxh h ASP 34 Cb -0.12 -0.11 -0.05 0.00 0.18 0.00 0.00 39.33 39.24 1gxh h ASP 34 CO -0.06 0.71 0.13 -1.13 -3.12 0.00 0.00 179.24 175.76 1gxh h ASN 35 N 0.08 0.12 -0.09 6.45 -0.00 -1.25 -2.47 115.58 118.41 1gxh h ASN 35 Ca 0.04 0.05 0.01 0.00 -0.00 0.00 0.00 56.30 56.40 1gxh h ASN 35 Cb 0.55 0.04 -0.01 0.00 -0.00 0.00 0.00 38.32 38.91 1gxh h ASN 35 CO 0.03 0.10 0.03 -0.07 -0.00 0.00 0.00 177.43 177.52 1gxh h LEU 36 N 0.28 0.04 -0.26 0.34 3.38 0.39 0.41 115.31 119.90 1gxh h LEU 36 Ca 0.18 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.21 1gxh h LEU 36 Cb 0.17 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1gxh h LEU 36 CO -0.20 0.04 -0.02 -0.08 0.09 0.00 0.00 178.44 178.27 1gxh h GLU 37 N 0.08 0.05 -0.74 1.13 4.22 -1.38 -2.34 114.58 115.60 1gxh h GLU 37 Ca 0.04 -0.00 0.04 0.00 0.08 0.00 0.00 59.36 59.52 1gxh h GLU 37 Cb 0.02 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 1gxh h GLU 37 CO -0.04 0.03 0.45 1.25 -2.18 0.00 0.00 179.01 178.53 1gxh h HIS 38 N 0.05 0.85 0.00 0.92 2.76 -0.69 0.11 115.15 119.14 1gxh h HIS 38 Ca 0.12 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 1gxh h HIS 38 Cb 0.17 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 28.86 1gxh h HIS 38 CO -0.22 0.46 0.00 0.35 -1.30 0.00 0.00 177.93 177.22 1gxh h PHE 39 N 0.87 0.00 0.07 5.26 3.57 0.09 0.11 116.94 126.90 1gxh h PHE 39 Ca 0.31 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.64 1gxh h PHE 39 Cb 0.08 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.82 1gxh h PHE 39 CO -0.05 0.00 -0.84 0.82 -2.23 0.00 0.00 178.31 176.01 1gxh h ILE 40 N 0.00 1.35 0.07 1.41 5.03 -0.33 -3.41 117.51 121.63 1gxh h ILE 40 Ca 0.00 -2.39 -0.24 0.00 -0.12 0.00 0.00 64.86 62.11 1gxh h ILE 40 Cb 0.13 2.96 -0.01 0.00 -3.03 0.00 0.00 36.82 36.87 1gxh h ILE 40 CO 0.00 0.62 -1.09 0.28 -0.68 0.00 0.00 178.15 177.28 1gxh h SER 41 N -0.62 0.32 0.05 1.72 0.02 0.97 -3.12 113.55 112.90 1gxh h SER 41 Ca -0.18 -0.32 -0.21 0.00 -0.84 0.00 0.00 61.79 60.24 1gxh h SER 41 Cb 1.45 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.89 1gxh h SER 41 CO 0.03 1.20 -0.76 1.62 -1.14 0.00 0.00 176.83 177.78 1gxh h VAL 42 N 0.08 1.33 -1.84 2.27 3.04 -1.34 -3.44 116.25 116.34 1gxh h VAL 42 Ca -0.09 -2.06 0.00 0.00 -1.01 0.00 0.00 66.70 63.54 1gxh h VAL 42 Cb 1.80 2.05 0.00 0.00 -2.01 0.00 0.00 31.29 33.13 1gxh h VAL 42 CO 0.17 0.64 0.00 0.41 -1.01 0.00 0.00 177.57 177.78 1gxh n THR 43 N -3.88 0.00 -1.61 3.17 -1.04 -1.18 -2.57 114.28 107.17 1gxh n THR 43 Ca -0.06 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 61.96 1gxh n THR 43 Cb 0.73 -2.00 0.01 0.00 -1.82 0.00 0.00 70.33 67.26 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 -0.84 0.17 -2.22 -2.82 4.71 -1.23 -4.95 120.64 113.46 1gxh n GLU 44 Ca 0.00 -0.98 -0.43 0.00 -0.01 0.00 0.00 57.16 55.75 1gxh n GLU 44 Cb 0.00 -0.58 -0.02 0.00 -1.01 0.00 0.00 31.44 29.83 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 -0.21 2.39 0.19 -0.32 2.46 -1.26 -4.90 115.29 113.63 1gxh s HIS 45 Ca 0.02 0.62 -0.13 0.00 0.47 0.00 0.00 55.06 56.04 1gxh s HIS 45 Cb 0.02 -3.75 0.10 0.00 -0.13 0.00 0.00 32.58 28.81 1gxh s HIS 45 CO 0.00 -2.72 1.85 -1.00 -2.47 0.00 0.00 174.74 170.41 1gxh h PRO 46 N 9.12 0.81 -1.13 2.88 0.13 -1.98 0.13 132.00 141.96 1gxh h PRO 46 Ca -0.32 -0.05 -0.10 0.00 -0.87 0.00 0.00 66.00 64.66 1gxh h PRO 46 Cb 1.14 -0.18 -0.06 0.00 0.13 0.00 0.00 31.00 32.03 1gxh h PRO 46 CO 0.97 0.54 0.13 0.43 -0.23 0.00 0.00 178.00 179.84 1gxh n SER 47 N -4.66 3.57 -4.62 1.44 7.64 -1.26 -4.89 113.62 110.84 1gxh n SER 47 Ca 0.04 -2.35 -0.45 0.00 1.01 0.00 0.00 58.87 57.12 1gxh n SER 47 Cb 0.02 -0.65 -0.02 0.00 -1.01 0.00 0.00 64.21 62.55 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 0.34 0.10 4.74 0.23 0.00 0.44 -1.31 105.19 109.73 1gxh n GLY 48 Ca 0.11 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 1.42 0.00 0.29 1.61 2.88 -1.26 -4.60 113.62 113.96 1gxh n SER 49 Ca 0.10 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.78 1gxh n SER 49 Cb 0.31 0.00 0.87 0.00 -0.75 0.00 0.00 64.21 64.64 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 0.00 1.24 -3.46 3.58 -1.83 0.30 116.42 116.25 1gxh h ASP 50 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1gxh h ASP 50 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1gxh h ASP 50 CO 0.00 0.00 0.00 0.18 -2.88 0.00 0.00 179.24 176.54 1gxh n LEU 51 N -3.96 0.65 -0.13 2.28 4.32 -0.42 -0.72 117.00 119.01 1gxh n LEU 51 Ca -0.03 0.58 -0.22 0.00 -0.02 0.00 0.00 56.01 56.32 1gxh n LEU 51 Cb 0.09 -0.40 -0.11 0.00 -1.62 0.00 0.00 43.42 41.38 1gxh n LEU 51 CO 0.28 -0.23 -1.39 -0.38 -1.22 0.00 0.00 177.39 174.46 1gxh n ILE 52 N -2.13 1.51 -0.05 -0.08 5.41 -0.18 -4.45 119.36 119.39 1gxh n ILE 52 Ca 0.05 -0.50 -0.15 0.00 1.00 0.00 0.00 62.75 63.15 1gxh n ILE 52 Cb 0.37 -1.59 -0.13 0.00 -0.71 0.00 0.00 39.64 37.58 1gxh n ILE 52 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 176.55 178.43 1gxh h TYR 53 N -0.37 0.10 -2.14 1.39 0.05 -1.04 -3.42 116.97 111.54 1gxh h TYR 53 Ca -0.63 -0.07 -0.54 0.00 0.05 0.00 0.00 58.73 57.55 1gxh h TYR 53 Cb 1.80 -0.01 -0.41 0.00 1.01 0.00 0.00 36.73 39.12 1gxh h TYR 53 CO -0.01 1.01 -0.92 0.66 -1.05 0.00 0.00 178.16 177.84 1gxh n TYR 54 N -4.55 2.03 -1.25 4.88 4.01 0.10 -5.07 117.16 117.32 1gxh n TYR 54 Ca -0.10 -3.90 -0.30 0.00 -0.16 0.00 0.00 57.90 53.44 1gxh n TYR 54 Cb 0.52 -0.45 0.14 0.00 -0.31 0.00 0.00 39.34 39.23 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 -2.82 1.29 0.00 -0.72 0.04 -1.24 -4.70 135.00 126.84 1gxh s PRO 55 Ca 0.44 0.77 0.00 0.00 0.04 0.00 0.00 61.00 62.24 1gxh s PRO 55 Cb 0.30 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 33.02 1gxh s PRO 55 CO -0.10 -2.21 0.00 -1.91 0.04 0.00 0.00 177.00 172.82 1gxh n GLU 56 N -3.85 -0.82 -0.04 4.56 0.00 -1.26 -4.97 120.64 114.25 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 0.56 0.00 -0.11 0.00 0.00 0.00 0.00 31.44 31.88 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 1.79 -0.68 0.27 8.31 0.00 -1.26 -3.71 105.19 109.92 1gxh n GLY 57 Ca 0.00 -0.29 0.14 0.00 0.00 0.00 0.00 46.02 45.87 1gxh n GLY 57 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1gxh h ASN 58 N 0.00 0.00 -2.55 1.61 -1.24 -2.01 -3.37 115.58 108.02 1gxh h ASN 58 Ca -0.20 0.00 -0.75 0.00 0.71 0.00 0.00 56.30 56.06 1gxh h ASN 58 Cb 1.30 0.00 -0.32 0.00 0.73 0.00 0.00 38.32 40.03 1gxh h ASN 58 CO 0.01 0.10 0.46 -3.20 -1.29 0.00 0.00 177.43 173.51 1gxh n ASN 59 N -3.57 6.00 0.00 1.15 5.15 -1.24 -4.12 115.26 118.62 1gxh n ASN 59 Ca -0.02 -3.52 0.00 0.00 -0.60 0.00 0.00 54.58 50.44 1gxh n ASN 59 Cb 0.23 -1.06 0.00 0.00 -0.53 0.00 0.00 39.78 38.41 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 0.72 1.09 -0.12 1.20 -0.08 -1.26 -4.42 116.55 113.68 1gxh n ASP 60 Ca 0.33 0.00 -0.08 0.00 -1.51 0.00 0.00 54.79 53.53 1gxh n ASP 60 Cb 0.33 0.00 0.08 0.00 2.34 0.00 0.00 41.12 43.88 1gxh n ASP 60 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1gxh h GLY 61 N 0.00 0.91 -3.23 0.27 0.00 -1.89 -3.46 103.07 95.68 1gxh h GLY 61 Ca 0.00 -0.74 0.35 0.00 0.00 0.00 0.00 47.33 46.95 1gxh h GLY 61 CO 0.00 0.67 0.93 -0.56 0.00 0.00 0.00 176.54 177.59 1gxh s SER 62 N -6.71 -0.03 0.00 0.19 0.01 -1.26 -4.98 113.70 100.92 1gxh s SER 62 Ca -0.10 -0.04 0.08 0.00 1.31 0.00 0.00 55.95 57.21 1gxh s SER 62 Cb 0.13 0.06 0.50 0.00 0.21 0.00 0.00 66.02 66.92 1gxh s SER 62 CO 0.84 -0.10 0.97 -0.81 0.41 0.00 0.00 173.24 174.55 1gxh n PRO 63 N -0.35 0.25 -0.26 12.44 -0.04 -1.26 -0.96 135.00 144.81 1gxh n PRO 63 Ca -0.05 0.02 0.07 0.00 -0.04 0.00 0.00 63.50 63.50 1gxh n PRO 63 Cb 0.61 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.79 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 0.32 -0.28 0.54 4.39 -1.99 -1.46 114.58 116.10 1gxh h GLU 64 Ca 0.00 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.72 1gxh h GLU 64 Cb 0.01 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 1gxh h GLU 64 CO 0.00 0.21 0.19 0.00 -1.16 0.00 0.00 179.01 178.25 1gxh h ALA 65 N 1.63 2.00 -0.01 3.43 0.00 -1.36 -0.26 119.26 124.68 1gxh h ALA 65 Ca 0.45 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 1gxh h ALA 65 Cb 0.78 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1gxh h ALA 65 CO -0.50 -0.05 -0.00 0.28 0.00 0.00 0.00 179.25 178.98 1gxh h VAL 66 N 0.21 1.29 -0.78 0.00 2.07 -1.46 -0.33 116.25 117.24 1gxh h VAL 66 Ca 0.12 -0.85 0.06 0.00 0.82 0.00 0.00 66.70 66.85 1gxh h VAL 66 Cb 0.22 1.85 -0.06 0.00 -1.52 0.00 0.00 31.29 31.78 1gxh h VAL 66 CO -0.02 0.22 0.47 0.40 0.02 0.00 0.00 177.57 178.66 1gxh h ILE 67 N -0.34 1.02 0.67 4.57 5.03 -0.99 0.20 117.51 127.66 1gxh h ILE 67 Ca 0.00 -0.29 -0.03 0.00 -0.12 0.00 0.00 64.86 64.42 1gxh h ILE 67 Cb 0.36 0.09 0.00 0.00 -3.03 0.00 0.00 36.82 34.24 1gxh h ILE 67 CO 0.00 0.16 -0.38 0.11 -0.68 0.00 0.00 178.15 177.36 1gxh h LYS 68 N 0.86 -0.94 -0.24 2.37 1.57 -1.12 -0.36 116.57 118.71 1gxh h LYS 68 Ca 0.34 0.06 0.07 0.00 -1.87 0.00 0.00 60.65 59.25 1gxh h LYS 68 Cb 0.17 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1gxh h LYS 68 CO -0.17 -0.62 0.23 1.49 -0.57 0.00 0.00 179.45 179.80 1gxh h GLU 69 N -0.97 0.00 0.55 3.15 4.22 -0.14 0.43 114.58 121.82 1gxh h GLU 69 Ca -0.09 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.32 1gxh h GLU 69 Cb 0.77 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.02 1gxh h GLU 69 CO 0.11 0.00 -0.27 0.82 -2.18 0.00 0.00 179.01 177.49 1gxh h ILE 70 N 0.00 0.03 -0.56 2.32 5.03 -0.30 0.34 117.51 124.37 1gxh h ILE 70 Ca 0.12 -0.46 0.04 0.00 -0.12 0.00 0.00 64.86 64.44 1gxh h ILE 70 Cb 0.57 0.04 -0.03 0.00 -3.03 0.00 0.00 36.82 34.37 1gxh h ILE 70 CO -0.00 0.01 0.37 0.07 -0.68 0.00 0.00 178.15 177.92 1gxh h LYS 71 N -1.19 0.60 0.04 2.37 2.10 0.10 -0.36 116.57 120.23 1gxh h LYS 71 Ca -0.08 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.54 1gxh h LYS 71 Cb 0.58 -0.14 0.00 0.00 -0.90 0.00 0.00 32.23 31.77 1gxh h LYS 71 CO 0.12 0.40 -0.02 0.93 -2.00 0.00 0.00 179.45 178.88 1gxh h GLU 72 N 0.62 -0.05 -0.27 0.07 3.07 -0.11 -0.82 114.58 117.10 1gxh h GLU 72 Ca 0.23 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 59.16 1gxh h GLU 72 Cb 0.15 0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 27.99 1gxh h GLU 72 CO -0.06 0.59 -0.27 2.35 -1.40 0.00 0.00 179.01 180.22 1gxh h TRP 73 N -0.76 -0.72 -0.51 4.33 7.01 -0.25 0.29 115.95 125.35 1gxh h TRP 73 Ca -0.01 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.03 1gxh h TRP 73 Cb 0.66 0.36 -0.02 0.00 -2.10 0.00 0.00 29.16 28.05 1gxh h TRP 73 CO 0.15 -0.34 0.27 0.00 -2.79 0.00 0.00 178.44 175.73 1gxh h ARG 74 N -0.26 0.71 -0.51 2.65 2.47 -1.10 0.37 114.38 118.72 1gxh h ARG 74 Ca 0.14 -0.09 -0.06 0.00 -1.26 0.00 0.00 59.98 58.72 1gxh h ARG 74 Cb 0.49 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.65 1gxh h ARG 74 CO -0.42 0.57 0.10 0.00 0.56 0.00 0.00 179.97 180.78 1gxh h ALA 75 N 1.11 0.68 -0.72 0.04 0.00 -0.51 0.11 119.26 119.97 1gxh h ALA 75 Ca 0.18 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1gxh h ALA 75 Cb 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1gxh h ALA 75 CO -0.03 0.40 0.25 0.00 0.00 0.00 0.00 179.25 179.87 1gxh h ALA 76 N 0.98 0.94 0.00 0.00 0.00 -0.30 0.72 119.26 121.60 1gxh h ALA 76 Ca 0.16 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1gxh h ALA 76 Cb 0.38 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1gxh h ALA 76 CO 0.01 0.59 0.00 0.09 0.00 0.00 0.00 179.25 179.94 1gxh n ASN 77 N -4.31 0.00 0.00 0.00 3.02 0.11 -4.87 115.26 109.20 1gxh n ASN 77 Ca 0.06 0.43 0.00 0.00 -0.03 0.00 0.00 54.58 55.03 1gxh n ASN 77 Cb 0.21 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.93 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 -1.01 0.79 3.75 7.41 0.00 0.25 -5.05 105.19 111.32 1gxh n GLY 78 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.84 2.69 0.16 1.61 1.02 0.35 -4.95 119.74 119.77 1gxh s LYS 79 Ca 0.00 -1.02 -0.31 0.00 0.02 0.00 0.00 55.97 54.66 1gxh s LYS 79 Cb 0.00 -2.50 -0.10 0.00 -0.52 0.00 0.00 37.83 34.71 1gxh s LYS 79 CO 0.00 0.45 1.52 -1.54 -0.92 0.00 0.00 175.35 174.86 1gxh s SER 80 N -3.21 6.65 0.10 2.83 1.04 -1.26 -3.06 113.70 116.78 1gxh s SER 80 Ca 0.30 2.55 0.00 0.00 0.48 0.00 0.00 55.95 59.28 1gxh s SER 80 Cb -0.09 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.44 1gxh s SER 80 CO 0.22 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.27 1gxh n GLY 81 N 3.62 -2.54 2.24 7.32 0.00 -1.26 -4.66 105.19 109.90 1gxh n GLY 81 Ca 0.13 -1.34 -0.20 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.84 -3.48 -1.50 1.61 3.01 -1.24 -3.74 117.46 111.28 1gxh n PHE 82 Ca 0.00 -0.62 -0.50 0.00 1.01 0.00 0.00 57.45 57.34 1gxh n PHE 82 Cb 0.00 -0.76 -0.04 0.00 -0.01 0.00 0.00 39.48 38.66 1gxh n PHE 82 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1gxh n LYS 83 N -3.90 0.56 -2.85 -1.08 3.00 -1.25 -4.87 118.16 107.76 1gxh n LYS 83 Ca 0.10 0.20 -0.43 0.00 -0.00 0.00 0.00 58.31 58.18 1gxh n LYS 83 Cb 0.39 -1.52 -0.04 0.00 0.00 0.00 0.00 35.03 33.86 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 -0.64 3.20 0.00 1.64 -0.44 -1.26 -4.59 119.66 117.57 1gxh s GLN 84 Ca 0.72 -0.96 0.01 0.00 -2.50 0.00 0.00 55.36 52.63 1gxh s GLN 84 Cb -0.95 -4.37 0.05 0.00 -1.64 0.00 0.00 33.01 26.11 1gxh s GLN 84 CO 0.55 -1.84 0.55 0.41 0.50 0.00 0.00 175.29 175.46