#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 -1.75 -1.48 0.03 4.71 -1.26 -4.84 120.64 116.04 1gxh n GLU 2 Ca 0.00 1.15 -0.34 0.00 -0.01 0.00 0.00 57.16 57.97 1gxh n GLU 2 Cb 0.00 -2.14 0.08 0.00 -1.01 0.00 0.00 31.44 28.38 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 0.00 3.30 0.27 -4.62 1.43 -1.26 -4.97 118.68 112.83 1gxh s LEU 3 Ca 0.00 2.21 -0.30 0.00 -1.03 0.00 0.00 54.13 55.01 1gxh s LEU 3 Cb 0.00 -4.57 -0.11 0.00 0.03 0.00 0.00 46.19 41.54 1gxh s LEU 3 CO 0.00 -2.11 1.50 -0.54 0.23 0.00 0.00 176.35 175.44 1gxh s LYS 4 N -4.05 4.20 0.53 1.70 -0.14 -1.26 -4.88 119.74 115.84 1gxh s LYS 4 Ca 0.71 2.42 0.24 0.00 -1.36 0.00 0.00 55.97 57.98 1gxh s LYS 4 Cb -0.25 -3.07 1.39 0.00 -1.68 0.00 0.00 37.83 34.22 1gxh s LYS 4 CO 0.45 -0.51 2.02 -0.97 -0.76 0.00 0.00 175.35 175.59 1gxh h ASN 5 N 4.87 0.00 -4.88 2.83 -1.24 -1.95 -3.45 115.58 111.75 1gxh h ASN 5 Ca -0.47 0.00 0.07 0.00 0.71 0.00 0.00 56.30 56.62 1gxh h ASN 5 Cb 1.22 0.00 -0.12 0.00 0.73 0.00 0.00 38.32 40.15 1gxh h ASN 5 CO 0.78 0.00 0.37 -0.44 -1.29 0.00 0.00 177.43 176.85 1gxh s SER 6 N -6.31 -0.40 0.39 1.15 0.01 -1.26 -4.57 113.70 102.71 1gxh s SER 6 Ca -0.05 -0.10 0.17 0.00 1.31 0.00 0.00 55.95 57.28 1gxh s SER 6 Cb 0.19 0.50 1.06 0.00 0.21 0.00 0.00 66.02 67.98 1gxh s SER 6 CO 0.71 -0.84 1.80 0.40 0.41 0.00 0.00 173.24 175.72 1gxh h ILE 7 N 2.00 0.59 0.00 1.44 2.04 -1.76 -0.47 117.51 121.35 1gxh h ILE 7 Ca -0.26 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.45 1gxh h ILE 7 Cb 1.26 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1gxh h ILE 7 CO 0.32 0.08 -0.24 -0.24 0.00 0.00 0.00 178.15 178.07 1gxh n SER 8 N -4.60 0.67 0.12 1.72 2.88 -1.25 -1.86 113.62 111.31 1gxh n SER 8 Ca 0.23 0.36 0.12 0.00 -1.33 0.00 0.00 58.87 58.25 1gxh n SER 8 Cb 0.79 -0.38 0.08 0.00 -0.75 0.00 0.00 64.21 63.95 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 -3.58 -3.46 3.58 -1.43 -3.35 116.42 108.18 1gxh h ASP 9 Ca 0.00 -0.04 -0.44 0.00 0.42 0.00 0.00 57.03 56.97 1gxh h ASP 9 Cb 0.70 0.00 0.18 0.00 1.72 0.00 0.00 39.33 41.93 1gxh h ASP 9 CO 0.00 0.02 0.11 -0.31 -2.88 0.00 0.00 179.24 176.18 1gxh s TYR 10 N -3.29 1.47 0.30 0.28 1.51 -0.78 -4.93 117.35 111.91 1gxh s TYR 10 Ca 0.03 0.91 0.11 0.00 -1.01 0.00 0.00 57.07 57.11 1gxh s TYR 10 Cb 0.09 -3.23 -0.05 0.00 -0.11 0.00 0.00 41.96 38.66 1gxh s TYR 10 CO 0.75 -3.50 -0.15 0.95 -1.11 0.00 0.00 175.55 172.49 1gxh s THR 11 N -2.79 2.46 0.41 -0.71 -4.23 -1.26 -2.05 115.64 107.47 1gxh s THR 11 Ca 0.67 -2.31 0.20 0.00 -1.18 0.00 0.00 61.69 59.07 1gxh s THR 11 Cb -0.19 -2.44 0.21 0.00 1.34 0.00 0.00 72.50 71.42 1gxh s THR 11 CO 0.59 -0.33 1.99 1.05 -0.54 0.00 0.00 174.62 177.38 1gxh h GLU 12 N 2.16 0.00 0.00 3.99 -0.00 -1.79 -2.57 114.58 116.38 1gxh h GLU 12 Ca -0.41 0.00 -0.28 0.00 -0.00 0.00 0.00 59.36 58.67 1gxh h GLU 12 Cb 1.26 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 29.96 1gxh h GLU 12 CO 0.63 0.19 -1.93 2.41 -0.00 0.00 0.00 179.01 180.32 1gxh n THR 13 N -3.97 1.34 -0.30 -1.06 -1.04 -1.26 -2.17 114.28 105.82 1gxh n THR 13 Ca -0.02 -0.78 -0.04 0.00 -2.04 0.00 0.00 64.05 61.17 1gxh n THR 13 Cb 0.28 -0.69 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 1.10 -0.77 -2.82 5.08 -1.96 -2.45 114.58 112.76 1gxh h GLU 14 Ca -0.34 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 57.91 1gxh h GLU 14 Cb 1.95 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 30.93 1gxh h GLU 14 CO 0.05 0.77 0.42 0.35 -1.00 0.00 0.00 179.01 179.60 1gxh h PHE 15 N 1.11 1.05 -0.45 4.33 3.57 -1.49 -0.94 116.94 124.12 1gxh h PHE 15 Ca 0.29 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.86 1gxh h PHE 15 Cb -0.05 -0.34 -0.10 0.00 2.79 0.00 0.00 35.95 38.25 1gxh h PHE 15 CO -0.01 0.73 -0.24 -0.22 -2.23 0.00 0.00 178.31 176.35 1gxh h LYS 16 N 1.08 -0.14 -0.83 1.11 1.63 -0.99 0.11 116.57 118.54 1gxh h LYS 16 Ca 0.27 0.01 0.08 0.00 -0.85 0.00 0.00 60.65 60.16 1gxh h LYS 16 Cb 0.03 0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 31.64 1gxh h LYS 16 CO -0.04 -0.09 0.54 -0.22 -3.45 0.00 0.00 179.45 176.18 1gxh h LYS 17 N -0.15 0.83 -0.43 1.90 3.11 -0.77 0.46 116.57 121.52 1gxh h LYS 17 Ca 0.21 -0.05 -0.11 0.00 -2.81 0.00 0.00 60.65 57.89 1gxh h LYS 17 Cb 0.48 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.51 1gxh h LYS 17 CO -0.54 0.55 -0.14 0.97 -2.81 0.00 0.00 179.45 177.48 1gxh h ILE 18 N 0.85 1.27 0.00 2.00 2.10 -1.09 -0.02 117.51 122.62 1gxh h ILE 18 Ca 0.37 -1.27 -0.04 0.00 1.08 0.00 0.00 64.86 65.00 1gxh h ILE 18 Cb 0.32 1.19 -0.01 0.00 -1.09 0.00 0.00 36.82 37.24 1gxh h ILE 18 CO -0.14 0.43 -0.19 0.40 -1.08 0.00 0.00 178.15 177.57 1gxh h ILE 19 N 0.68 0.42 0.03 2.19 1.08 0.86 -2.85 117.51 119.92 1gxh h ILE 19 Ca 0.10 -1.13 -0.15 0.00 -0.39 0.00 0.00 64.86 63.30 1gxh h ILE 19 Cb 0.69 1.83 -0.01 0.00 -3.07 0.00 0.00 36.82 36.26 1gxh h ILE 19 CO 0.05 0.19 -0.78 -0.08 -0.69 0.00 0.00 178.15 176.84 1gxh h GLU 20 N 0.00 0.06 -0.74 2.37 4.81 -0.16 -2.95 114.58 117.97 1gxh h GLU 20 Ca -0.00 -0.11 0.10 0.00 -0.13 0.00 0.00 59.36 59.22 1gxh h GLU 20 Cb 0.82 0.04 -0.11 0.00 0.63 0.00 0.00 28.75 30.13 1gxh h GLU 20 CO 0.02 1.05 -0.33 -0.25 -0.73 0.00 0.00 179.01 178.77 1gxh n ASP 21 N -4.39 -0.57 0.27 1.04 9.92 -0.03 -1.68 116.55 121.11 1gxh n ASP 21 Ca -0.21 1.29 -0.11 0.00 -0.53 0.00 0.00 54.79 55.23 1gxh n ASP 21 Cb 0.65 -0.26 -0.05 0.00 -0.64 0.00 0.00 41.12 40.82 1gxh n ASP 21 CO 0.00 0.00 0.00 0.16 0.13 0.00 0.00 177.20 177.49 1gxh h ILE 22 N 0.00 0.00 -0.88 0.53 3.07 -1.62 0.58 117.51 119.19 1gxh h ILE 22 Ca 0.21 -0.35 0.05 0.00 1.55 0.00 0.00 64.86 66.33 1gxh h ILE 22 Cb 0.40 0.00 -0.05 0.00 -0.27 0.00 0.00 36.82 36.89 1gxh h ILE 22 CO -0.72 0.00 0.57 0.40 -1.05 0.00 0.00 178.15 177.35 1gxh h ILE 23 N -1.07 1.10 -0.47 0.16 1.08 -1.27 -0.51 117.51 116.53 1gxh h ILE 23 Ca -0.07 -0.35 -0.07 0.00 -0.39 0.00 0.00 64.86 63.97 1gxh h ILE 23 Cb 0.55 -0.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.26 1gxh h ILE 23 CO 0.12 0.19 -0.00 0.78 -0.69 0.00 0.00 178.15 178.55 1gxh h ASN 24 N 1.03 0.81 -1.88 1.72 2.35 -1.46 -3.48 115.58 114.67 1gxh h ASN 24 Ca 0.37 -0.31 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1gxh h ASN 24 Cb 0.13 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.28 1gxh h ASN 24 CO -0.13 0.92 0.00 0.00 -1.65 0.00 0.00 177.43 176.57 1gxh n GLU 26 N -0.94 1.86 -0.16 0.00 2.13 0.16 -4.73 120.64 118.96 1gxh n GLU 26 Ca 0.00 -1.07 0.00 0.00 0.66 0.00 0.00 57.16 56.75 1gxh n GLU 26 Cb 0.39 -2.11 0.00 0.00 0.27 0.00 0.00 31.44 29.99 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 3.01 1.32 2.25 8.31 0.00 -1.26 -4.98 105.19 113.84 1gxh n GLY 27 Ca 0.40 -0.66 0.01 0.00 0.00 0.00 0.00 46.02 45.77 1gxh n GLY 27 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1gxh n ASP 28 N -0.03 1.03 0.00 1.61 2.03 -1.26 -4.99 116.55 114.94 1gxh n ASP 28 Ca 0.00 -2.03 0.00 0.00 0.52 0.00 0.00 54.79 53.28 1gxh n ASP 28 Cb 0.00 -0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.10 1gxh n ASP 28 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1gxh n GLU 29 N -0.24 0.00 -0.03 -0.67 1.02 -1.26 -4.52 120.64 114.95 1gxh n GLU 29 Ca 0.03 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.05 1gxh n GLU 29 Cb 0.93 -0.00 0.01 0.00 -0.02 0.00 0.00 31.44 32.35 1gxh n GLU 29 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1gxh h LYS 30 N 0.00 0.68 -0.31 3.49 1.57 -1.98 0.18 116.57 120.20 1gxh h LYS 30 Ca 0.00 -0.44 0.03 0.00 -1.87 0.00 0.00 60.65 58.37 1gxh h LYS 30 Cb 0.00 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1gxh h LYS 30 CO 0.00 1.06 0.12 -0.22 -0.57 0.00 0.00 179.45 179.84 1gxh h LYS 31 N 0.52 0.26 0.00 3.15 1.63 -1.96 0.46 116.57 120.63 1gxh h LYS 31 Ca 0.01 -0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.69 1gxh h LYS 31 Cb 1.14 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.70 1gxh h LYS 31 CO 0.11 0.17 -0.47 -0.56 -3.45 0.00 0.00 179.45 175.25 1gxh h GLN 32 N 0.26 0.00 -0.56 1.90 3.07 -1.52 -0.69 115.11 117.58 1gxh h GLN 32 Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.84 1gxh h GLN 32 Cb 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.62 1gxh h GLN 32 CO -0.12 0.47 0.22 0.22 0.09 0.00 0.00 178.83 179.71 1gxh h ASP 33 N 0.00 0.77 -0.19 0.06 3.58 -0.61 -0.90 116.42 119.12 1gxh h ASP 33 Ca -0.00 -0.17 0.01 0.00 0.42 0.00 0.00 57.03 57.29 1gxh h ASP 33 Cb 1.18 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 42.02 1gxh h ASP 33 CO 0.06 0.73 0.09 -0.78 -2.88 0.00 0.00 179.24 176.45 1gxh h ASP 34 N 0.76 0.12 -0.29 2.28 1.82 -0.54 0.09 116.42 120.66 1gxh h ASP 34 Ca 0.19 0.01 0.05 0.00 -0.39 0.00 0.00 57.03 56.89 1gxh h ASP 34 Cb 0.20 -0.01 -0.05 0.00 0.68 0.00 0.00 39.33 40.15 1gxh h ASP 34 CO -0.02 0.10 -0.02 -1.13 -1.61 0.00 0.00 179.24 176.56 1gxh h ASN 35 N 0.19 -0.16 -0.75 2.28 -1.24 -1.14 -2.95 115.58 111.81 1gxh h ASN 35 Ca 0.08 0.07 0.05 0.00 0.71 0.00 0.00 56.30 57.21 1gxh h ASN 35 Cb 0.03 0.14 -0.05 0.00 0.73 0.00 0.00 38.32 39.16 1gxh h ASN 35 CO -0.06 -0.05 0.45 -0.07 -1.29 0.00 0.00 177.43 176.42 1gxh h LEU 36 N 0.06 0.72 -0.00 0.34 3.38 0.48 0.50 115.31 120.79 1gxh h LEU 36 Ca 0.14 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1gxh h LEU 36 Cb 0.20 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1gxh h LEU 36 CO -0.25 0.47 -0.07 -0.08 0.09 0.00 0.00 178.44 178.60 1gxh h GLU 37 N 0.85 -0.12 -0.25 1.13 4.22 -1.49 -2.05 114.58 116.88 1gxh h GLU 37 Ca 0.32 0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.76 1gxh h GLU 37 Cb 0.11 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1gxh h GLU 37 CO -0.15 -0.08 0.15 1.25 -2.18 0.00 0.00 179.01 178.00 1gxh h HIS 38 N -0.12 0.33 0.00 0.92 2.76 -0.70 0.62 115.15 118.97 1gxh h HIS 38 Ca 0.03 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1gxh h HIS 38 Cb 0.16 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.01 1gxh h HIS 38 CO -0.14 0.26 0.04 0.35 -1.30 0.00 0.00 177.93 177.14 1gxh h PHE 39 N 0.31 0.00 0.00 5.26 3.57 -0.12 0.11 116.94 126.07 1gxh h PHE 39 Ca 0.09 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1gxh h PHE 39 Cb 0.03 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 1gxh h PHE 39 CO -0.04 0.00 -0.16 0.82 -2.23 0.00 0.00 178.31 176.70 1gxh h ILE 40 N 0.00 0.23 -0.10 1.41 1.08 -0.21 -3.38 117.51 116.53 1gxh h ILE 40 Ca 0.00 -1.19 -0.05 0.00 -0.39 0.00 0.00 64.86 63.23 1gxh h ILE 40 Cb 0.09 0.45 -0.00 0.00 -3.07 0.00 0.00 36.82 34.28 1gxh h ILE 40 CO 0.00 0.08 -0.14 0.28 -0.69 0.00 0.00 178.15 177.68 1gxh h SER 41 N -1.00 0.30 -0.37 1.72 0.02 0.66 -2.17 113.55 112.71 1gxh h SER 41 Ca -0.01 -0.52 -0.10 0.00 -0.84 0.00 0.00 61.79 60.32 1gxh h SER 41 Cb 0.27 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1gxh h SER 41 CO -0.01 0.76 -0.16 1.62 -1.14 0.00 0.00 176.83 177.90 1gxh h VAL 42 N -0.15 1.28 -0.04 2.27 3.04 -1.11 -3.32 116.25 118.21 1gxh h VAL 42 Ca 0.01 -1.28 -0.21 0.00 -1.01 0.00 0.00 66.70 64.21 1gxh h VAL 42 Cb 0.69 1.32 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 1gxh h VAL 42 CO 0.03 0.42 -0.86 0.74 -1.01 0.00 0.00 177.57 176.90 1gxh h THR 43 N 0.56 1.37 0.00 3.17 2.02 -1.66 -2.47 112.91 115.91 1gxh h THR 43 Ca 0.09 -2.28 0.00 0.00 0.77 0.00 0.00 66.41 64.99 1gxh h THR 43 Cb 0.70 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 69.37 1gxh h THR 43 CO 0.05 0.69 0.00 -0.62 0.37 0.00 0.00 175.52 176.01 1gxh n GLU 44 N -3.80 -1.17 -2.45 6.66 1.02 -0.83 -4.96 120.64 115.11 1gxh n GLU 44 Ca -0.06 0.29 -0.42 0.00 -0.02 0.00 0.00 57.16 56.95 1gxh n GLU 44 Cb 0.78 -4.60 -0.02 0.00 -0.02 0.00 0.00 31.44 27.58 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 -1.19 2.49 0.29 -0.32 2.46 -1.26 -4.92 115.29 112.83 1gxh s HIS 45 Ca 0.00 0.58 0.02 0.00 0.47 0.00 0.00 55.06 56.13 1gxh s HIS 45 Cb 0.00 -4.40 0.43 0.00 -0.13 0.00 0.00 32.58 28.48 1gxh s HIS 45 CO 0.00 -1.76 1.76 -1.00 -2.47 0.00 0.00 174.74 171.27 1gxh h PRO 46 N 10.31 0.56 0.00 2.88 0.13 -1.93 -1.75 132.00 142.20 1gxh h PRO 46 Ca -0.26 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 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 1.14 0.69 0.00 0.43 -0.23 0.00 0.00 178.00 180.03 1gxh n SER 47 N -4.18 0.66 0.00 1.44 7.64 -1.26 -4.90 113.62 113.02 1gxh n SER 47 Ca 0.01 0.68 0.00 0.00 1.01 0.00 0.00 58.87 60.56 1gxh n SER 47 Cb 0.35 -0.81 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 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 -0.15 2.34 0.39 0.23 0.00 -0.66 -1.69 105.19 105.65 1gxh n GLY 48 Ca 0.02 0.34 0.15 0.00 0.00 0.00 0.00 46.02 46.53 1gxh n GLY 48 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1gxh h SER 49 N 0.00 0.00 -0.37 1.61 4.64 -1.90 -2.15 113.55 115.38 1gxh h SER 49 Ca 0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 1gxh h SER 49 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1gxh h SER 49 CO 0.00 0.00 0.25 0.44 -0.87 0.00 0.00 176.83 176.65 1gxh h ASP 50 N 0.00 0.36 1.27 4.97 3.32 -1.68 -0.16 116.42 124.50 1gxh h ASP 50 Ca 0.15 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1gxh h ASP 50 Cb 1.57 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 41.03 1gxh h ASP 50 CO -0.00 0.26 -0.11 -0.07 -1.72 0.00 0.00 179.24 177.59 1gxh h LEU 51 N 0.43 0.00 0.11 1.55 4.07 -1.62 0.78 115.31 120.62 1gxh h LEU 51 Ca 0.15 0.00 -0.36 0.00 0.08 0.00 0.00 57.88 57.75 1gxh h LEU 51 Cb 0.06 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.78 1gxh h LEU 51 CO -0.03 0.11 -1.97 -0.38 -1.08 0.00 0.00 178.44 175.09 1gxh n ILE 52 N -3.19 1.76 -0.00 1.22 5.41 -0.47 -4.53 119.36 119.56 1gxh n ILE 52 Ca 0.01 -0.67 0.00 0.00 1.00 0.00 0.00 62.75 63.09 1gxh n ILE 52 Cb 0.43 -1.64 -0.00 0.00 -0.71 0.00 0.00 39.64 37.72 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 -3.42 0.00 -2.80 1.39 4.01 -0.20 -4.75 117.16 111.38 1gxh n TYR 53 Ca -0.30 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.23 1gxh n TYR 53 Cb 1.05 -0.01 -0.01 0.00 -0.31 0.00 0.00 39.34 40.06 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 -1.60 2.33 -1.21 -0.72 4.01 0.26 -5.04 117.16 115.19 1gxh n TYR 54 Ca -0.00 -3.43 -0.29 0.00 -0.16 0.00 0.00 57.90 54.01 1gxh n TYR 54 Cb 0.09 -0.34 0.15 0.00 -0.31 0.00 0.00 39.34 38.94 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 -3.17 1.03 0.00 -0.72 0.04 -1.17 -4.68 135.00 126.33 1gxh s PRO 55 Ca 0.42 0.71 0.00 0.00 0.04 0.00 0.00 61.00 62.17 1gxh s PRO 55 Cb 0.37 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 33.12 1gxh s PRO 55 CO -0.10 -2.37 0.00 0.39 0.04 0.00 0.00 177.00 174.96 1gxh n GLU 56 N -3.95 -1.08 -0.01 4.56 -0.58 -1.26 -4.98 120.64 113.34 1gxh n GLU 56 Ca 0.06 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.89 1gxh n GLU 56 Cb 0.56 0.00 -0.12 0.00 -0.57 0.00 0.00 31.44 31.31 1gxh n GLU 56 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1gxh n GLY 57 N 1.93 -0.73 0.00 0.62 0.00 -1.26 -3.84 105.19 101.92 1gxh n GLY 57 Ca 0.00 -0.41 0.06 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.95 0.00 -3.42 1.61 5.15 -1.26 -4.43 115.26 110.95 1gxh n ASN 58 Ca -0.02 0.11 -0.27 0.00 -0.60 0.00 0.00 54.58 53.81 1gxh n ASN 58 Cb 0.40 -0.29 -0.10 0.00 -0.53 0.00 0.00 39.78 39.27 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 -1.29 0.13 0.00 1.20 5.15 -1.25 -4.85 115.26 114.36 1gxh n ASN 59 Ca 0.06 -2.55 0.00 0.00 -0.60 0.00 0.00 54.58 51.49 1gxh n ASN 59 Cb 0.10 -0.59 0.00 0.00 -0.53 0.00 0.00 39.78 38.76 1gxh n ASN 59 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 1gxh n ASP 60 N 2.47 0.96 -0.10 1.20 5.75 -1.26 -4.31 116.55 121.26 1gxh n ASP 60 Ca 0.27 0.00 -0.11 0.00 -0.01 0.00 0.00 54.79 54.94 1gxh n ASP 60 Cb 0.47 0.10 -0.12 0.00 -1.03 0.00 0.00 41.12 40.54 1gxh n ASP 60 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gxh n GLY 61 N 0.94 -0.64 3.56 6.12 0.00 -1.26 -5.07 105.19 108.84 1gxh n GLY 61 Ca 0.00 -0.23 -0.08 0.00 0.00 0.00 0.00 46.02 45.71 1gxh n GLY 61 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gxh s SER 62 N -5.53 -0.29 0.60 1.61 0.15 -1.26 -5.00 113.70 103.97 1gxh s SER 62 Ca -0.17 0.13 0.35 0.00 0.70 0.00 0.00 55.95 56.96 1gxh s SER 62 Cb 0.06 0.28 1.93 0.00 -1.71 0.00 0.00 66.02 66.58 1gxh s SER 62 CO 0.63 -0.41 2.08 -0.65 1.20 0.00 0.00 173.24 176.09 1gxh h PRO 63 N 2.18 0.00 -0.88 5.44 0.11 -1.98 -0.39 132.00 136.48 1gxh h PRO 63 Ca -0.17 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.01 1gxh h PRO 63 Cb 1.20 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.25 1gxh h PRO 63 CO 0.28 0.00 0.57 0.93 -0.21 0.00 0.00 178.00 179.58 1gxh h GLU 64 N 0.00 0.94 0.00 1.05 4.39 -1.95 -0.56 114.58 118.46 1gxh h GLU 64 Ca 0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1gxh h GLU 64 Cb 0.24 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1gxh h GLU 64 CO 0.00 0.62 0.00 0.00 -1.16 0.00 0.00 179.01 178.47 1gxh h ALA 65 N 1.53 1.00 0.06 3.43 0.00 -1.40 0.17 119.26 124.04 1gxh h ALA 65 Ca 0.38 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 55.02 1gxh h ALA 65 Cb 0.23 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.04 1gxh h ALA 65 CO -0.14 0.00 -1.12 0.28 0.00 0.00 0.00 179.25 178.26 1gxh h VAL 66 N 0.00 1.31 -0.67 0.00 2.07 -1.23 -2.91 116.25 114.82 1gxh h VAL 66 Ca 0.00 -2.41 -0.08 0.00 0.82 0.00 0.00 66.70 65.03 1gxh h VAL 66 Cb 0.33 2.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.61 1gxh h VAL 66 CO 0.00 0.73 0.11 0.40 0.02 0.00 0.00 177.57 178.83 1gxh h ILE 67 N 0.30 1.26 -0.36 4.57 5.03 -0.71 0.36 117.51 127.96 1gxh h ILE 67 Ca -0.15 -1.03 0.03 0.00 -0.12 0.00 0.00 64.86 63.59 1gxh h ILE 67 Cb 1.78 0.63 -0.05 0.00 -3.03 0.00 0.00 36.82 36.16 1gxh h ILE 67 CO 0.21 0.39 -0.27 0.11 -0.68 0.00 0.00 178.15 177.92 1gxh h LYS 68 N 1.03 -0.06 0.00 2.37 1.57 -0.88 0.28 116.57 120.87 1gxh h LYS 68 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1gxh h LYS 68 Cb 0.44 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1gxh h LYS 68 CO 0.01 -0.04 0.00 0.93 -0.57 0.00 0.00 179.45 179.78 1gxh h GLU 69 N -0.07 0.00 0.02 3.15 3.07 -0.81 0.41 114.58 120.35 1gxh h GLU 69 Ca 0.06 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1gxh h GLU 69 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 1gxh h GLU 69 CO -0.37 0.00 -0.01 0.82 -1.40 0.00 0.00 179.01 178.05 1gxh h ILE 70 N 0.00 0.00 -0.69 3.13 1.08 -0.62 -0.68 117.51 119.72 1gxh h ILE 70 Ca 0.00 -0.59 0.14 0.00 -0.39 0.00 0.00 64.86 64.02 1gxh h ILE 70 Cb 0.25 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 33.87 1gxh h ILE 70 CO 0.00 0.00 -0.14 0.11 -0.69 0.00 0.00 178.15 177.43 1gxh h LYS 71 N -0.61 0.02 0.00 2.37 1.57 -0.01 0.46 116.57 120.37 1gxh h LYS 71 Ca -0.00 -0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.53 1gxh h LYS 71 Cb 0.02 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 1gxh h LYS 71 CO 0.00 0.01 -1.38 0.93 -0.57 0.00 0.00 179.45 178.44 1gxh h GLU 72 N 0.02 0.00 0.04 3.15 3.07 -0.36 0.12 114.58 120.61 1gxh h GLU 72 Ca 0.34 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 59.21 1gxh h GLU 72 Cb 0.54 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.43 1gxh h GLU 72 CO -0.69 0.65 -0.10 2.35 -1.40 0.00 0.00 179.01 179.82 1gxh h TRP 73 N 0.00 -0.25 0.63 4.33 7.01 -0.83 -0.31 115.95 126.52 1gxh h TRP 73 Ca -0.17 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 60.81 1gxh h TRP 73 Cb 1.86 0.11 -0.00 0.00 -2.10 0.00 0.00 29.16 29.03 1gxh h TRP 73 CO 0.00 -0.15 -0.39 0.00 -2.79 0.00 0.00 178.44 175.11 1gxh h ARG 74 N -0.19 -0.92 0.00 2.65 2.47 -0.81 0.14 114.38 117.72 1gxh h ARG 74 Ca 0.02 0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.81 1gxh h ARG 74 Cb 0.21 0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 1gxh h ARG 74 CO -0.07 -0.62 0.00 0.00 0.56 0.00 0.00 179.97 179.85 1gxh h ALA 75 N -0.67 1.00 0.14 0.04 0.00 -0.66 0.66 119.26 119.76 1gxh h ALA 75 Ca -0.08 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1gxh h ALA 75 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1gxh h ALA 75 CO 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 179.26 1gxh h ALA 76 N 2.05 -0.26 -0.01 0.00 0.00 -0.84 -3.40 119.26 116.80 1gxh h ALA 76 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1gxh h ALA 76 Cb 0.22 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1gxh h ALA 76 CO 0.00 -0.24 -0.32 0.09 0.00 0.00 0.00 179.25 178.78 1gxh n ASN 77 N -3.89 1.33 0.00 0.00 3.02 0.47 -4.65 115.26 111.53 1gxh n ASN 77 Ca -0.02 -1.08 0.00 0.00 -0.03 0.00 0.00 54.58 53.44 1gxh n ASN 77 Cb 0.07 0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 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 1.36 0.00 2.49 7.41 0.00 0.19 -5.01 105.19 111.63 1gxh n GLY 78 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1gxh n GLY 78 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gxh n LYS 79 N 0.00 0.00 0.00 1.61 4.01 0.76 -4.60 118.16 119.94 1gxh n LYS 79 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1gxh n LYS 79 Cb 0.00 -1.05 0.00 0.00 -0.51 0.00 0.00 35.03 33.47 1gxh n LYS 79 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1gxh n SER 80 N 1.32 0.00 0.00 4.39 2.88 -1.26 -4.96 113.62 115.99 1gxh n SER 80 Ca 0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 1gxh n SER 80 Cb 0.04 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 1gxh n SER 80 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1gxh n GLY 81 N -1.51 -1.86 0.82 0.46 0.00 -1.26 -4.34 105.19 97.50 1gxh n GLY 81 Ca 0.00 -1.15 -0.07 0.00 0.00 0.00 0.00 46.02 44.80 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 2.00 -2.99 -0.86 1.61 3.01 -1.25 -3.79 117.46 115.19 1gxh n PHE 82 Ca 0.00 -0.23 -0.35 0.00 1.01 0.00 0.00 57.45 57.88 1gxh n PHE 82 Cb 0.00 -0.28 0.09 0.00 -0.01 0.00 0.00 39.48 39.28 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 -2.48 -0.49 -2.00 -1.08 3.00 -0.87 -4.86 118.16 109.38 1gxh n LYS 83 Ca 0.04 -0.13 -0.42 0.00 -0.00 0.00 0.00 58.31 57.80 1gxh n LYS 83 Cb 0.14 -1.41 0.00 0.00 0.00 0.00 0.00 35.03 33.77 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 0.22 3.18 0.00 1.64 7.27 -1.26 -4.51 117.38 123.91 1gxh n GLN 84 Ca 0.01 -3.00 0.00 0.00 0.07 0.00 0.00 57.00 54.08 1gxh n GLN 84 Cb 0.61 -3.14 0.00 0.00 2.41 0.00 0.00 30.24 30.12 1gxh n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54