#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxh s GLU 2 N 0.00 1.57 0.83 0.03 8.01 -1.26 -5.14 118.70 122.74 1gxh s GLU 2 Ca 0.00 -1.82 -0.13 0.00 0.01 0.00 0.00 54.97 53.03 1gxh s GLU 2 Cb 0.00 -0.99 0.08 0.00 -4.31 0.00 0.00 34.13 28.91 1gxh s GLU 2 CO 0.00 -0.06 1.08 1.28 0.01 0.00 0.00 175.26 177.57 1gxh n LEU 3 N -0.61 3.64 -4.77 1.80 4.77 -1.26 -4.93 117.00 115.64 1gxh n LEU 3 Ca -0.04 0.54 -0.39 0.00 -0.03 0.00 0.00 56.01 56.09 1gxh n LEU 3 Cb 0.65 -1.46 -0.00 0.00 -2.33 0.00 0.00 43.42 40.28 1gxh n LEU 3 CO 0.41 -2.02 0.96 -0.54 -1.33 0.00 0.00 177.39 174.86 1gxh s LYS 4 N -4.05 3.88 0.00 3.23 3.01 -1.26 -4.91 119.74 119.64 1gxh s LYS 4 Ca 0.71 2.14 0.26 0.00 -1.01 0.00 0.00 55.97 58.06 1gxh s LYS 4 Cb -0.28 -2.68 1.20 0.00 -1.01 0.00 0.00 37.83 35.06 1gxh s LYS 4 CO 0.54 -0.56 1.85 0.09 0.51 0.00 0.00 175.35 177.77 1gxh n ASN 5 N -0.03 0.00 -3.66 2.83 5.03 -1.26 -4.86 115.26 113.31 1gxh n ASN 5 Ca 0.05 0.19 -0.13 0.00 0.87 0.00 0.00 54.58 55.56 1gxh n ASN 5 Cb 0.44 -0.39 -0.06 0.00 -1.02 0.00 0.00 39.78 38.75 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 -2.77 -0.28 0.32 6.41 0.01 -1.26 -4.82 113.70 111.31 1gxh s SER 6 Ca 0.19 -0.02 0.04 0.00 1.31 0.00 0.00 55.95 57.47 1gxh s SER 6 Cb 0.17 0.43 0.66 0.00 0.21 0.00 0.00 66.02 67.49 1gxh s SER 6 CO 0.43 -0.67 1.86 0.40 0.41 0.00 0.00 173.24 175.66 1gxh h ILE 7 N 2.98 0.90 0.00 1.44 1.08 -1.86 -1.36 117.51 120.69 1gxh h ILE 7 Ca -0.31 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 63.86 1gxh h ILE 7 Cb 1.21 -0.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.91 1gxh h ILE 7 CO 0.44 0.16 0.00 -0.24 -0.69 0.00 0.00 178.15 177.82 1gxh n SER 8 N -4.58 0.00 0.05 1.72 2.88 -1.25 -0.93 113.62 111.51 1gxh n SER 8 Ca 0.18 0.38 0.03 0.00 -1.33 0.00 0.00 58.87 58.12 1gxh n SER 8 Cb 0.39 -0.45 -0.06 0.00 -0.75 0.00 0.00 64.21 63.34 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 -4.23 -3.46 3.58 -1.61 -3.36 116.42 107.34 1gxh h ASP 9 Ca 0.00 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.93 1gxh h ASP 9 Cb 0.32 0.00 0.19 0.00 1.72 0.00 0.00 39.33 41.56 1gxh h ASP 9 CO 0.00 0.44 0.22 -0.31 -2.88 0.00 0.00 179.24 176.71 1gxh s TYR 10 N -3.03 1.67 0.35 0.28 2.02 -0.10 -4.82 117.35 113.72 1gxh s TYR 10 Ca -0.02 1.76 0.09 0.00 -0.37 0.00 0.00 57.07 58.52 1gxh s TYR 10 Cb 0.09 -3.32 -0.06 0.00 -0.40 0.00 0.00 41.96 38.28 1gxh s TYR 10 CO 0.80 -2.78 -0.00 0.95 -1.57 0.00 0.00 175.55 172.95 1gxh s THR 11 N -2.66 2.48 0.36 -0.71 -4.23 -1.26 -0.82 115.64 108.79 1gxh s THR 11 Ca 0.66 -2.01 0.07 0.00 -1.18 0.00 0.00 61.69 59.24 1gxh s THR 11 Cb -0.22 -2.79 0.31 0.00 1.34 0.00 0.00 72.50 71.13 1gxh s THR 11 CO 0.58 -0.17 1.92 -0.08 -0.54 0.00 0.00 174.62 176.32 1gxh h GLU 12 N 1.83 0.70 0.11 3.99 4.81 -1.91 -1.40 114.58 122.71 1gxh h GLU 12 Ca -0.43 -0.04 -0.31 0.00 -0.13 0.00 0.00 59.36 58.45 1gxh h GLU 12 Cb 1.25 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1gxh h GLU 12 CO 0.69 0.46 -1.57 1.15 -0.73 0.00 0.00 179.01 179.02 1gxh h THR 13 N 0.72 1.11 -0.51 0.32 2.02 -1.98 -2.58 112.91 112.02 1gxh h THR 13 Ca 0.38 -2.76 -0.08 0.00 0.77 0.00 0.00 66.41 64.71 1gxh h THR 13 Cb 0.48 2.73 -0.02 0.00 -1.74 0.00 0.00 68.15 69.60 1gxh h THR 13 CO -0.15 0.81 0.01 -0.33 0.37 0.00 0.00 175.52 176.22 1gxh h GLU 14 N 0.06 0.85 -0.37 6.66 5.08 -1.91 0.01 114.58 124.97 1gxh h GLU 14 Ca -0.25 -0.23 -0.10 0.00 -1.00 0.00 0.00 59.36 57.77 1gxh h GLU 14 Cb 2.02 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 31.15 1gxh h GLU 14 CO 0.15 0.85 -0.17 0.35 -1.00 0.00 0.00 179.01 179.19 1gxh h PHE 15 N 0.79 0.75 -0.14 4.33 3.57 -1.32 -1.86 116.94 123.06 1gxh h PHE 15 Ca 0.15 -0.15 0.04 0.00 3.53 0.00 0.00 57.97 61.55 1gxh h PHE 15 Cb 0.47 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.97 1gxh h PHE 15 CO 0.03 0.81 -0.17 -0.22 -2.23 0.00 0.00 178.31 176.52 1gxh h LYS 16 N 0.61 -0.20 -0.78 1.11 1.63 -1.00 -0.97 116.57 116.96 1gxh h LYS 16 Ca 0.10 0.01 0.13 0.00 -0.85 0.00 0.00 60.65 60.04 1gxh h LYS 16 Cb 0.63 0.05 -0.09 0.00 -0.60 0.00 0.00 32.23 32.22 1gxh h LYS 16 CO 0.04 -0.13 0.36 -0.22 -3.45 0.00 0.00 179.45 176.05 1gxh h LYS 17 N -0.21 0.53 0.16 1.90 3.11 -0.17 0.53 116.57 122.42 1gxh h LYS 17 Ca 0.10 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.90 1gxh h LYS 17 Cb 0.35 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 31.47 1gxh h LYS 17 CO -0.26 0.35 -0.08 0.97 -2.81 0.00 0.00 179.45 177.62 1gxh h ILE 18 N 0.55 0.91 0.00 2.00 2.10 -1.20 -1.27 117.51 120.60 1gxh h ILE 18 Ca 0.42 -0.34 -0.06 0.00 1.08 0.00 0.00 64.86 65.97 1gxh h ILE 18 Cb 0.58 1.12 -0.01 0.00 -1.09 0.00 0.00 36.82 37.42 1gxh h ILE 18 CO -0.36 0.08 -0.26 0.40 -1.08 0.00 0.00 178.15 176.93 1gxh h ILE 19 N -0.38 0.78 0.02 2.19 1.08 0.35 -1.85 117.51 119.69 1gxh h ILE 19 Ca -0.02 -1.08 -0.00 0.00 -0.39 0.00 0.00 64.86 63.36 1gxh h ILE 19 Cb 0.30 1.67 0.00 0.00 -3.07 0.00 0.00 36.82 35.72 1gxh h ILE 19 CO 0.04 0.26 -0.01 -0.08 -0.69 0.00 0.00 178.15 177.67 1gxh h GLU 20 N 0.00 -0.02 -0.75 2.37 4.81 -0.07 -2.96 114.58 117.95 1gxh h GLU 20 Ca -0.00 0.00 0.16 0.00 -0.13 0.00 0.00 59.36 59.39 1gxh h GLU 20 Cb 0.65 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 29.92 1gxh h GLU 20 CO 0.03 0.65 0.21 0.22 -0.73 0.00 0.00 179.01 179.39 1gxh h ASP 21 N -0.71 0.07 0.44 1.04 3.58 -0.39 0.36 116.42 120.80 1gxh h ASP 21 Ca -0.00 0.14 -0.02 0.00 0.42 0.00 0.00 57.03 57.57 1gxh h ASP 21 Cb 0.67 0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.91 1gxh h ASP 21 CO 0.00 -0.02 -0.21 0.16 -2.88 0.00 0.00 179.24 176.29 1gxh h ILE 22 N 0.30 0.51 -0.66 2.25 3.07 -1.62 0.17 117.51 121.53 1gxh h ILE 22 Ca 0.43 -0.39 0.10 0.00 1.55 0.00 0.00 64.86 66.55 1gxh h ILE 22 Cb 0.73 0.68 -0.04 0.00 -0.27 0.00 0.00 36.82 37.92 1gxh h ILE 22 CO -0.50 0.06 0.44 0.40 -1.05 0.00 0.00 178.15 177.50 1gxh h ILE 23 N -0.84 0.90 0.00 0.16 1.08 -1.07 0.09 117.51 117.83 1gxh h ILE 23 Ca -0.06 -0.17 -0.03 0.00 -0.39 0.00 0.00 64.86 64.22 1gxh h ILE 23 Cb 0.56 0.37 -0.00 0.00 -3.07 0.00 0.00 36.82 34.67 1gxh h ILE 23 CO 0.10 0.09 -0.21 0.78 -0.69 0.00 0.00 178.15 178.22 1gxh h ASN 24 N 0.49 0.00 -6.34 1.72 2.35 -1.01 -3.49 115.58 109.30 1gxh h ASN 24 Ca 0.31 0.00 -0.46 0.00 -0.55 0.00 0.00 56.30 55.60 1gxh h ASN 24 Cb 0.55 0.00 0.06 0.00 0.05 0.00 0.00 38.32 38.98 1gxh h ASN 24 CO -0.10 0.12 -0.94 0.00 -1.65 0.00 0.00 177.43 174.87 1gxh s GLU 26 N -6.22 2.11 0.00 0.00 2.12 -1.06 -4.45 118.70 111.19 1gxh s GLU 26 Ca 0.40 0.59 0.00 0.00 0.36 0.00 0.00 54.97 56.32 1gxh s GLU 26 Cb -0.15 -4.72 0.00 0.00 0.26 0.00 0.00 34.13 29.51 1gxh s GLU 26 CO 0.88 -3.62 0.00 0.41 -0.54 0.00 0.00 175.26 172.38 1gxh n GLY 27 N 6.42 2.20 3.62 -1.50 0.00 -1.26 -4.92 105.19 109.74 1gxh n GLY 27 Ca 0.38 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.12 -0.56 0.29 1.61 -1.08 -1.26 -5.06 116.67 110.49 1gxh s ASP 28 Ca 0.00 1.00 -0.03 0.00 -0.52 0.00 0.00 52.55 53.01 1gxh s ASP 28 Cb 0.00 0.99 0.61 0.00 -1.46 0.00 0.00 42.92 43.06 1gxh s ASP 28 CO 0.00 -0.25 1.58 -0.33 0.52 0.00 0.00 175.17 176.70 1gxh h GLU 29 N 4.19 0.03 -0.17 4.34 5.08 -1.95 -0.72 114.58 125.37 1gxh h GLU 29 Ca -0.27 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 1gxh h GLU 29 Cb 1.17 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1gxh h GLU 29 CO 0.13 0.02 0.08 0.87 -1.00 0.00 0.00 179.01 179.11 1gxh h LYS 30 N 0.03 0.23 -0.68 2.33 1.57 -1.97 0.53 116.57 118.61 1gxh h LYS 30 Ca 0.53 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 59.23 1gxh h LYS 30 Cb 0.99 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.23 1gxh h LYS 30 CO -0.88 0.19 0.20 -0.22 -0.57 0.00 0.00 179.45 178.16 1gxh h LYS 31 N 0.24 1.05 -0.19 3.15 3.11 -1.49 0.10 116.57 122.53 1gxh h LYS 31 Ca 0.06 -0.22 -0.04 0.00 -2.81 0.00 0.00 60.65 57.64 1gxh h LYS 31 Cb 0.03 -0.15 -0.01 0.00 -1.00 0.00 0.00 32.23 31.10 1gxh h LYS 31 CO -0.01 0.90 -0.04 1.96 -2.81 0.00 0.00 179.45 179.46 1gxh h GLN 32 N 1.01 0.37 -0.93 1.90 4.20 -1.11 -2.97 115.11 117.57 1gxh h GLN 32 Ca 0.22 -0.14 0.15 0.00 0.06 0.00 0.00 58.65 58.94 1gxh h GLN 32 Cb 0.30 -0.02 -0.09 0.00 0.30 0.00 0.00 27.48 27.96 1gxh h GLN 32 CO -0.01 0.61 0.54 0.22 -0.67 0.00 0.00 178.83 179.52 1gxh h ASP 33 N 0.09 0.71 -0.12 1.46 3.58 -0.45 0.27 116.42 121.95 1gxh h ASP 33 Ca 0.05 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 1gxh h ASP 33 Cb 0.47 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.47 1gxh h ASP 33 CO 0.02 0.31 0.03 -0.78 -2.88 0.00 0.00 179.24 175.94 1gxh h ASP 34 N 0.76 0.18 -0.83 2.28 3.58 -0.87 -0.97 116.42 120.57 1gxh h ASP 34 Ca 0.50 -0.22 0.10 0.00 0.42 0.00 0.00 57.03 57.84 1gxh h ASP 34 Cb 0.67 -0.05 -0.08 0.00 1.72 0.00 0.00 39.33 41.60 1gxh h ASP 34 CO -0.34 0.35 0.47 -1.13 -2.88 0.00 0.00 179.24 175.71 1gxh h ASN 35 N 0.01 0.65 -0.39 2.28 -1.24 -1.22 -2.98 115.58 112.70 1gxh h ASN 35 Ca 0.04 0.05 -0.11 0.00 0.71 0.00 0.00 56.30 57.00 1gxh h ASN 35 Cb 0.24 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.21 1gxh h ASN 35 CO -0.00 0.36 -0.18 -0.07 -1.29 0.00 0.00 177.43 176.25 1gxh h LEU 36 N 0.77 0.82 -0.10 0.34 3.38 0.86 0.45 115.31 121.83 1gxh h LEU 36 Ca 0.41 -0.40 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1gxh h LEU 36 Cb 0.41 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 1gxh h LEU 36 CO -0.26 1.04 -0.15 -0.08 0.09 0.00 0.00 178.44 179.08 1gxh h GLU 37 N 0.61 -0.19 -0.48 1.13 4.22 -1.49 -2.45 114.58 115.92 1gxh h GLU 37 Ca 0.09 0.01 0.01 0.00 0.08 0.00 0.00 59.36 59.55 1gxh h GLU 37 Cb 0.72 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.99 1gxh h GLU 37 CO 0.05 -0.13 0.31 1.25 -2.18 0.00 0.00 179.01 178.32 1gxh h HIS 38 N -0.20 0.59 0.00 0.92 2.76 -0.91 0.15 115.15 118.46 1gxh h HIS 38 Ca 0.08 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.27 1gxh h HIS 38 Cb 0.32 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.08 1gxh h HIS 38 CO -0.25 0.36 -0.00 0.35 -1.30 0.00 0.00 177.93 177.09 1gxh h PHE 39 N 0.63 0.00 0.30 5.26 3.57 -0.12 0.17 116.94 126.74 1gxh h PHE 39 Ca 0.18 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1gxh h PHE 39 Cb -0.05 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.70 1gxh h PHE 39 CO -0.05 0.00 -0.14 0.82 -2.23 0.00 0.00 178.31 176.71 1gxh h ILE 40 N 0.00 0.03 -0.05 1.41 5.03 -0.49 -3.39 117.51 120.05 1gxh h ILE 40 Ca -0.00 -0.72 0.03 0.00 -0.12 0.00 0.00 64.86 64.05 1gxh h ILE 40 Cb 0.02 0.06 -0.04 0.00 -3.03 0.00 0.00 36.82 33.83 1gxh h ILE 40 CO 0.00 0.01 -0.18 -1.28 -0.68 0.00 0.00 178.15 176.02 1gxh h SER 41 N -1.10 -0.54 0.60 1.72 0.87 0.19 -2.08 113.55 113.22 1gxh h SER 41 Ca -0.04 0.08 -0.14 0.00 -1.23 0.00 0.00 61.79 60.47 1gxh h SER 41 Cb 0.32 0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 1gxh h SER 41 CO 0.07 -0.24 -0.64 -0.37 -0.53 0.00 0.00 176.83 175.12 1gxh h VAL 42 N -0.27 1.45 -3.24 2.23 -1.51 -1.55 -3.45 116.25 109.91 1gxh h VAL 42 Ca 0.07 -2.18 -0.31 0.00 -1.23 0.00 0.00 66.70 63.05 1gxh h VAL 42 Cb 0.37 2.17 0.13 0.00 -2.13 0.00 0.00 31.29 31.83 1gxh h VAL 42 CO -0.21 0.63 0.26 0.41 -1.23 0.00 0.00 177.57 177.43 1gxh n THR 43 N -3.79 0.00 -0.76 7.19 -1.04 -0.78 -2.90 114.28 112.21 1gxh n THR 43 Ca -0.01 -0.64 0.02 0.00 -2.04 0.00 0.00 64.05 61.38 1gxh n THR 43 Cb 0.64 -1.55 0.03 0.00 -1.82 0.00 0.00 70.33 67.63 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 -3.23 1.47 -2.21 -2.82 4.71 -1.26 -4.97 120.64 112.33 1gxh n GLU 44 Ca 0.12 -1.41 -0.42 0.00 -0.01 0.00 0.00 57.16 55.44 1gxh n GLU 44 Cb 0.42 -0.91 -0.03 0.00 -1.01 0.00 0.00 31.44 29.91 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 -1.02 2.07 0.24 -0.32 2.46 -1.26 -4.89 115.29 112.57 1gxh s HIS 45 Ca 0.07 0.62 -0.03 0.00 0.47 0.00 0.00 55.06 56.19 1gxh s HIS 45 Cb 0.06 -4.25 0.27 0.00 -0.13 0.00 0.00 32.58 28.53 1gxh s HIS 45 CO 0.01 -2.30 1.70 -1.00 -2.47 0.00 0.00 174.74 170.67 1gxh h PRO 46 N 12.19 0.78 0.00 2.88 0.13 -1.97 -1.49 132.00 144.52 1gxh h PRO 46 Ca -0.29 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 1gxh h PRO 46 Cb 1.13 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1gxh h PRO 46 CO 1.12 0.86 0.00 0.77 -0.23 0.00 0.00 178.00 180.52 1gxh h SER 47 N 0.71 0.00 0.00 1.44 0.02 -2.01 -3.47 113.55 110.24 1gxh h SER 47 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1gxh h SER 47 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 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 -0.35 2.14 0.20 -3.77 0.00 -0.56 -1.53 105.19 101.32 1gxh n GLY 48 Ca 0.01 0.34 0.09 0.00 0.00 0.00 0.00 46.02 46.45 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 -0.66 1.61 4.64 -1.90 -2.54 113.55 114.69 1gxh h SER 49 Ca 0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1gxh h SER 49 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 1gxh h SER 49 CO 0.00 0.00 0.44 0.44 -0.87 0.00 0.00 176.83 176.84 1gxh h ASP 50 N 0.00 0.68 0.82 4.97 3.32 -1.65 -0.61 116.42 123.95 1gxh h ASP 50 Ca 0.00 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1gxh h ASP 50 Cb 0.56 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 1gxh h ASP 50 CO 0.00 0.47 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.88 1gxh h LEU 51 N 0.79 0.00 0.08 1.55 3.38 -1.68 0.55 115.31 119.97 1gxh h LEU 51 Ca 0.26 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.89 1gxh h LEU 51 Cb 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1gxh h LEU 51 CO -0.07 0.04 -1.90 -0.38 0.09 0.00 0.00 178.44 176.22 1gxh n ILE 52 N -3.17 1.69 0.00 1.22 5.41 -0.43 -4.52 119.36 119.56 1gxh n ILE 52 Ca -0.00 -0.49 0.00 0.00 1.00 0.00 0.00 62.75 63.26 1gxh n ILE 52 Cb 0.28 -1.79 0.00 0.00 -0.71 0.00 0.00 39.64 37.43 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 -3.72 0.00 -2.49 1.39 4.01 -0.37 -4.68 117.16 111.30 1gxh n TYR 53 Ca -0.34 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.20 1gxh n TYR 53 Cb 0.95 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.99 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 -1.39 2.58 -1.45 -0.72 4.01 0.17 -5.04 117.16 115.32 1gxh n TYR 54 Ca 0.00 -2.85 -0.31 0.00 -0.16 0.00 0.00 57.90 54.58 1gxh n TYR 54 Cb 0.00 -0.20 0.07 0.00 -0.31 0.00 0.00 39.34 38.89 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 -3.45 2.65 0.00 -0.72 0.04 -1.12 -4.75 135.00 127.65 1gxh s PRO 55 Ca 0.41 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.51 1gxh s PRO 55 Cb 0.41 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 33.00 1gxh s PRO 55 CO -0.09 -1.33 0.00 -0.85 0.04 0.00 0.00 177.00 174.77 1gxh n GLU 56 N -3.26 0.13 -1.54 4.56 0.28 -1.26 -5.01 120.64 114.53 1gxh n GLU 56 Ca 0.08 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 56.90 1gxh n GLU 56 Cb 0.53 0.00 -0.08 0.00 1.43 0.00 0.00 31.44 33.32 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 0.16 1.79 2.73 -1.84 0.00 -1.26 -0.11 105.19 106.67 1gxh n GLY 57 Ca 0.00 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.16 -5.47 -3.76 1.61 5.15 -1.26 -4.90 115.26 105.47 1gxh n ASN 58 Ca -0.19 0.20 -0.42 0.00 -0.60 0.00 0.00 54.58 53.58 1gxh n ASN 58 Cb 0.64 -3.69 -0.05 0.00 -0.53 0.00 0.00 39.78 36.15 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 -0.93 2.80 0.00 1.20 5.15 0.85 -3.33 115.26 121.00 1gxh n ASN 59 Ca -0.08 -2.71 0.00 0.00 -0.60 0.00 0.00 54.58 51.19 1gxh n ASN 59 Cb 0.52 -1.26 0.00 0.00 -0.53 0.00 0.00 39.78 38.50 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 8.07 0.00 0.04 1.20 5.75 -1.26 -4.45 116.55 125.90 1gxh n ASP 60 Ca 0.49 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 55.25 1gxh n ASP 60 Cb 0.41 0.00 0.24 0.00 -1.03 0.00 0.00 41.12 40.74 1gxh n ASP 60 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1gxh h GLY 61 N 0.00 0.46 -2.97 6.12 0.00 -1.97 -3.46 103.07 101.25 1gxh h GLY 61 Ca 0.00 -0.35 0.32 0.00 0.00 0.00 0.00 47.33 47.30 1gxh h GLY 61 CO 0.00 0.32 0.85 -0.56 0.00 0.00 0.00 176.54 177.15 1gxh s SER 62 N -6.81 -0.06 0.03 0.19 0.01 -1.26 -4.99 113.70 100.80 1gxh s SER 62 Ca -0.06 -0.10 0.02 0.00 1.31 0.00 0.00 55.95 57.11 1gxh s SER 62 Cb 0.14 0.14 0.08 0.00 0.21 0.00 0.00 66.02 66.60 1gxh s SER 62 CO 0.78 -0.26 0.96 -0.81 0.41 0.00 0.00 173.24 174.32 1gxh n PRO 63 N -0.42 0.01 -0.10 12.44 -0.04 -1.26 -1.42 135.00 144.20 1gxh n PRO 63 Ca -0.07 0.43 -0.05 0.00 -0.04 0.00 0.00 63.50 63.76 1gxh n PRO 63 Cb 0.62 -1.62 0.01 0.00 -0.04 0.00 0.00 33.50 32.47 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 0.03 0.00 0.54 4.39 -1.95 -2.66 114.58 114.93 1gxh h GLU 64 Ca 0.00 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1gxh h GLU 64 Cb 0.18 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1gxh h GLU 64 CO 0.00 0.02 -0.16 0.00 -1.16 0.00 0.00 179.01 177.71 1gxh h ALA 65 N 1.34 1.38 -0.21 3.43 0.00 -1.60 0.25 119.26 123.86 1gxh h ALA 65 Ca 0.17 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 1gxh h ALA 65 Cb 0.26 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1gxh h ALA 65 CO -0.34 0.20 -0.61 0.28 0.00 0.00 0.00 179.25 178.77 1gxh h VAL 66 N 0.00 1.29 -0.62 0.00 2.07 -1.66 -0.94 116.25 116.39 1gxh h VAL 66 Ca -0.00 -1.82 -0.00 0.00 0.82 0.00 0.00 66.70 65.70 1gxh h VAL 66 Cb 0.37 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 1gxh h VAL 66 CO 0.02 0.58 0.38 0.40 0.02 0.00 0.00 177.57 178.97 1gxh h ILE 67 N 0.51 1.18 -0.07 4.57 5.03 -0.85 0.84 117.51 128.73 1gxh h ILE 67 Ca -0.02 -0.40 0.01 0.00 -0.12 0.00 0.00 64.86 64.34 1gxh h ILE 67 Cb 1.23 0.32 -0.03 0.00 -3.03 0.00 0.00 36.82 35.32 1gxh h ILE 67 CO 0.13 0.19 -0.21 0.11 -0.68 0.00 0.00 178.15 177.69 1gxh h LYS 68 N 0.84 -0.20 -0.01 2.37 1.57 -1.03 0.45 116.57 120.56 1gxh h LYS 68 Ca 0.22 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1gxh h LYS 68 Cb -0.03 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 1gxh h LYS 68 CO -0.04 -0.13 0.01 1.49 -0.57 0.00 0.00 179.45 180.21 1gxh h GLU 69 N -0.21 0.00 0.52 3.15 4.22 -0.05 0.49 114.58 122.70 1gxh h GLU 69 Ca 0.01 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.43 1gxh h GLU 69 Cb 0.25 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.51 1gxh h GLU 69 CO -0.18 0.00 -0.25 0.82 -2.18 0.00 0.00 179.01 177.22 1gxh h ILE 70 N 0.00 0.01 -0.71 2.32 5.03 -0.47 0.17 117.51 123.86 1gxh h ILE 70 Ca 0.00 -0.49 0.16 0.00 -0.12 0.00 0.00 64.86 64.41 1gxh h ILE 70 Cb 0.03 0.01 -0.12 0.00 -3.03 0.00 0.00 36.82 33.72 1gxh h ILE 70 CO -0.00 0.00 0.06 0.11 -0.68 0.00 0.00 178.15 177.64 1gxh h LYS 71 N -1.18 0.15 0.01 2.37 1.57 0.12 -0.84 116.57 118.76 1gxh h LYS 71 Ca -0.07 -0.01 -0.29 0.00 -1.87 0.00 0.00 60.65 58.41 1gxh h LYS 71 Cb 0.54 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.77 1gxh h LYS 71 CO 0.12 0.10 -1.66 0.93 -0.57 0.00 0.00 179.45 178.36 1gxh h GLU 72 N 0.16 0.03 0.40 3.15 3.07 -0.04 0.25 114.58 121.59 1gxh h GLU 72 Ca 0.39 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.20 1gxh h GLU 72 Cb 0.67 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.59 1gxh h GLU 72 CO -0.58 0.61 -0.31 2.35 -1.40 0.00 0.00 179.01 179.68 1gxh h TRP 73 N 0.01 -0.83 -0.89 4.33 7.01 -0.67 0.29 115.95 125.20 1gxh h TRP 73 Ca -0.27 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.73 1gxh h TRP 73 Cb 2.00 0.31 -0.04 0.00 -2.10 0.00 0.00 29.16 29.32 1gxh h TRP 73 CO 0.01 -0.46 0.57 0.00 -2.79 0.00 0.00 178.44 175.77 1gxh h ARG 74 N -0.71 1.19 0.34 2.65 2.47 -1.00 0.75 114.38 120.08 1gxh h ARG 74 Ca -0.03 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 58.59 1gxh h ARG 74 Cb 0.61 -0.26 -0.02 0.00 -1.65 0.00 0.00 29.97 28.65 1gxh h ARG 74 CO -0.01 0.80 -0.38 0.00 0.56 0.00 0.00 179.97 180.94 1gxh h ALA 75 N 1.41 -1.03 -0.74 0.04 0.00 -0.35 0.15 119.26 118.73 1gxh h ALA 75 Ca 0.32 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1gxh h ALA 75 Cb -0.11 0.63 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 1gxh h ALA 75 CO -0.07 -1.07 0.47 0.00 0.00 0.00 0.00 179.25 178.59 1gxh h ALA 76 N -1.09 1.43 0.00 0.00 0.00 -0.53 -1.96 119.26 117.11 1gxh h ALA 76 Ca -0.04 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1gxh h ALA 76 Cb 0.64 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1gxh h ALA 76 CO -0.07 0.51 -0.30 -0.91 0.00 0.00 0.00 179.25 178.48 1gxh h ASN 77 N 1.02 0.00 0.00 0.00 2.35 -0.74 -3.45 115.58 114.76 1gxh h ASN 77 Ca 0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1gxh h ASN 77 Cb -0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.29 1gxh h ASN 77 CO -0.06 0.30 0.00 0.61 -1.65 0.00 0.00 177.43 176.63 1gxh n GLY 78 N 0.92 0.00 0.00 2.83 0.00 -0.19 -5.07 105.19 103.67 1gxh n GLY 78 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -4.25 1.61 5.02 0.34 -4.85 118.16 116.03 1gxh n LYS 79 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.14 1gxh n LYS 79 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.91 1gxh n LYS 79 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1gxh s SER 80 N 0.00 0.73 0.00 4.39 0.01 -1.25 -4.92 113.70 112.66 1gxh s SER 80 Ca 0.00 -1.48 0.00 0.00 1.31 0.00 0.00 55.95 55.78 1gxh s SER 80 Cb 0.00 0.39 0.00 0.00 0.21 0.00 0.00 66.02 66.62 1gxh s SER 80 CO 0.00 -0.87 0.00 0.61 0.41 0.00 0.00 173.24 173.39 1gxh n GLY 81 N -0.40 -1.35 2.18 3.44 0.00 -1.26 -4.16 105.19 103.64 1gxh n GLY 81 Ca 0.03 -1.00 -0.19 0.00 0.00 0.00 0.00 46.02 44.85 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 0.37 -3.47 -1.31 1.61 3.72 -1.26 -3.95 117.46 113.17 1gxh n PHE 82 Ca 0.00 -0.60 -0.48 0.00 -0.05 0.00 0.00 57.45 56.31 1gxh n PHE 82 Cb 0.00 -0.74 -0.05 0.00 -0.94 0.00 0.00 39.48 37.75 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 -3.82 0.00 -2.52 -1.08 3.00 0.00 -4.88 118.16 108.86 1gxh n LYS 83 Ca 0.09 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 58.00 1gxh n LYS 83 Cb 0.38 -1.12 -0.02 0.00 0.00 0.00 0.00 35.03 34.27 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 -0.49 3.63 0.00 1.64 2.00 -1.26 -4.68 119.66 120.49 1gxh s GLN 84 Ca 0.69 -1.37 0.09 0.00 -2.00 0.00 0.00 55.36 52.78 1gxh s GLN 84 Cb -0.99 -5.40 0.56 0.00 0.80 0.00 0.00 33.01 27.99 1gxh s GLN 84 CO 0.51 -2.35 1.01 0.41 -0.50 0.00 0.00 175.29 174.38