#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 0.09 -0.95 2.12 0.00 -1.26 -5.13 120.64 115.51 1gxh n GLU 2 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 57.16 55.76 1gxh n GLU 2 Cb 0.00 0.28 0.00 0.00 0.00 0.00 0.00 31.44 31.72 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 0.09 0.00 -4.67 -1.84 4.77 -1.26 -5.02 117.00 109.08 1gxh n LEU 3 Ca -0.16 0.00 -0.55 0.00 -0.03 0.00 0.00 56.01 55.27 1gxh n LEU 3 Cb 0.86 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.88 1gxh n LEU 3 CO -0.10 -0.39 1.17 0.29 -1.33 0.00 0.00 177.39 177.03 1gxh n LYS 4 N -0.79 1.18 0.00 3.23 4.76 -1.26 -4.82 118.16 120.46 1gxh n LYS 4 Ca 0.00 0.43 0.11 0.00 -2.87 0.00 0.00 58.31 55.98 1gxh n LYS 4 Cb 0.00 -2.10 0.53 0.00 -1.84 0.00 0.00 35.03 31.62 1gxh n LYS 4 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1gxh n ASN 5 N 4.35 0.00 -3.68 4.39 5.03 -1.26 -4.80 115.26 119.29 1gxh n ASN 5 Ca 0.23 0.13 -0.09 0.00 0.87 0.00 0.00 54.58 55.72 1gxh n ASN 5 Cb 0.16 -0.35 -0.02 0.00 -1.02 0.00 0.00 39.78 38.54 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 -2.70 -0.38 0.42 6.41 0.01 -1.26 -4.98 113.70 111.21 1gxh s SER 6 Ca 0.18 -0.36 0.10 0.00 1.31 0.00 0.00 55.95 57.17 1gxh s SER 6 Cb 0.15 0.67 0.93 0.00 0.21 0.00 0.00 66.02 67.98 1gxh s SER 6 CO 0.36 -1.19 2.04 0.40 0.41 0.00 0.00 173.24 175.25 1gxh h ILE 7 N 2.01 1.03 0.00 1.44 1.08 -1.87 -0.93 117.51 120.26 1gxh h ILE 7 Ca -0.25 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.05 1gxh h ILE 7 Cb 1.27 0.50 0.00 0.00 -3.07 0.00 0.00 36.82 35.53 1gxh h ILE 7 CO 0.30 0.09 0.00 -1.28 -0.69 0.00 0.00 178.15 176.56 1gxh h SER 8 N 0.48 0.00 1.41 1.72 0.87 -1.91 -1.59 113.55 114.53 1gxh h SER 8 Ca 0.19 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 1gxh h SER 8 Cb 0.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1gxh h SER 8 CO -0.05 0.00 -0.53 -0.78 -0.53 0.00 0.00 176.83 174.95 1gxh h ASP 9 N 0.00 0.00 -1.53 6.23 3.58 -1.57 -3.40 116.42 119.74 1gxh h ASP 9 Ca 0.00 -0.02 -0.71 0.00 0.42 0.00 0.00 57.03 56.72 1gxh h ASP 9 Cb 0.57 0.00 -0.19 0.00 1.72 0.00 0.00 39.33 41.42 1gxh h ASP 9 CO 0.00 0.01 1.42 -1.22 -2.88 0.00 0.00 179.24 176.57 1gxh n TYR 10 N -2.78 2.47 -0.85 0.28 4.01 -0.60 -4.95 117.16 114.74 1gxh n TYR 10 Ca 0.02 -2.49 -0.28 0.00 -0.16 0.00 0.00 57.90 54.99 1gxh n TYR 10 Cb 0.53 -1.48 -0.01 0.00 -0.31 0.00 0.00 39.34 38.07 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 0.77 0.67 -0.36 -0.72 -2.24 -1.26 -3.66 114.28 107.49 1gxh n THR 11 Ca 0.54 -0.32 0.28 0.00 -2.27 0.00 0.00 64.05 62.29 1gxh n THR 11 Cb 0.32 0.00 0.58 0.00 -2.10 0.00 0.00 70.33 69.12 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 0.34 0.25 0.10 -0.78 4.81 -1.88 0.44 114.58 117.86 1gxh h GLU 12 Ca -0.22 -0.02 -0.29 0.00 -0.13 0.00 0.00 59.36 58.71 1gxh h GLU 12 Cb 0.92 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 1gxh h GLU 12 CO 0.32 0.17 -1.40 1.15 -0.73 0.00 0.00 179.01 178.51 1gxh h THR 13 N 0.26 1.29 -0.40 0.32 2.02 -1.90 -2.75 112.91 111.75 1gxh h THR 13 Ca 0.65 -2.93 -0.09 0.00 0.77 0.00 0.00 66.41 64.81 1gxh h THR 13 Cb 1.90 2.80 -0.01 0.00 -1.74 0.00 0.00 68.15 71.09 1gxh h THR 13 CO -0.29 0.84 -0.09 -0.33 0.37 0.00 0.00 175.52 176.01 1gxh h GLU 14 N 0.06 0.77 -0.55 6.66 5.08 -0.49 -2.04 114.58 124.07 1gxh h GLU 14 Ca -0.19 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 57.83 1gxh h GLU 14 Cb 1.98 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 31.16 1gxh h GLU 14 CO 0.16 0.90 0.14 0.35 -1.00 0.00 0.00 179.01 179.56 1gxh h PHE 15 N 0.58 0.88 -0.40 4.33 3.57 -1.08 -1.74 116.94 123.08 1gxh h PHE 15 Ca 0.10 -0.08 0.08 0.00 3.53 0.00 0.00 57.97 61.61 1gxh h PHE 15 Cb 0.61 -0.26 -0.09 0.00 2.79 0.00 0.00 35.95 39.00 1gxh h PHE 15 CO 0.05 0.73 -0.23 -0.22 -2.23 0.00 0.00 178.31 176.41 1gxh h LYS 16 N 0.82 -0.16 -0.93 1.11 1.63 -1.30 -0.12 116.57 117.62 1gxh h LYS 16 Ca 0.18 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 60.02 1gxh h LYS 16 Cb 0.30 0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 31.91 1gxh h LYS 16 CO -0.00 -0.11 0.61 -0.22 -3.45 0.00 0.00 179.45 176.28 1gxh h LYS 17 N -0.16 1.16 0.14 1.90 1.63 -0.57 0.49 116.57 121.16 1gxh h LYS 17 Ca 0.19 -0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 59.91 1gxh h LYS 17 Cb 0.46 -0.26 0.00 0.00 -0.60 0.00 0.00 32.23 31.83 1gxh h LYS 17 CO -0.50 0.77 -0.07 0.97 -3.45 0.00 0.00 179.45 177.17 1gxh h ILE 18 N 1.20 0.87 0.00 2.00 2.10 -1.15 -0.67 117.51 121.85 1gxh h ILE 18 Ca 0.36 -0.05 -0.05 0.00 1.08 0.00 0.00 64.86 66.19 1gxh h ILE 18 Cb -0.04 0.90 -0.01 0.00 -1.09 0.00 0.00 36.82 36.59 1gxh h ILE 18 CO -0.10 0.01 -0.26 0.40 -1.08 0.00 0.00 178.15 177.12 1gxh h ILE 19 N -0.22 1.00 0.03 2.19 1.08 0.60 -2.60 117.51 119.60 1gxh h ILE 19 Ca -0.02 -0.96 -0.00 0.00 -0.39 0.00 0.00 64.86 63.49 1gxh h ILE 19 Cb 0.17 1.54 0.00 0.00 -3.07 0.00 0.00 36.82 35.46 1gxh h ILE 19 CO 0.03 0.26 -0.02 -0.08 -0.69 0.00 0.00 178.15 177.65 1gxh h GLU 20 N 0.00 -0.04 -0.85 2.37 4.81 -0.09 -2.96 114.58 117.82 1gxh h GLU 20 Ca -0.00 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.35 1gxh h GLU 20 Cb 0.52 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.85 1gxh h GLU 20 CO 0.03 0.63 0.55 0.22 -0.73 0.00 0.00 179.01 179.71 1gxh h ASP 21 N -0.92 0.68 0.67 1.04 3.58 -0.74 0.12 116.42 120.85 1gxh h ASP 21 Ca -0.00 0.03 -0.03 0.00 0.42 0.00 0.00 57.03 57.44 1gxh h ASP 21 Cb 0.69 -0.11 0.01 0.00 1.72 0.00 0.00 39.33 41.63 1gxh h ASP 21 CO 0.01 0.38 -0.32 0.16 -2.88 0.00 0.00 179.24 176.59 1gxh h ILE 22 N 0.74 0.10 -0.79 2.25 3.07 -1.64 -2.02 117.51 119.22 1gxh h ILE 22 Ca 0.41 -0.32 0.10 0.00 1.55 0.00 0.00 64.86 66.60 1gxh h ILE 22 Cb 0.55 0.14 -0.05 0.00 -0.27 0.00 0.00 36.82 37.18 1gxh h ILE 22 CO -0.17 0.01 0.52 0.40 -1.05 0.00 0.00 178.15 177.86 1gxh h ILE 23 N -1.18 0.92 -0.34 0.16 1.08 -1.03 -0.04 117.51 117.08 1gxh h ILE 23 Ca -0.09 -0.23 0.02 0.00 -0.39 0.00 0.00 64.86 64.16 1gxh h ILE 23 Cb 0.71 0.18 -0.03 0.00 -3.07 0.00 0.00 36.82 34.61 1gxh h ILE 23 CO 0.15 0.12 0.18 0.78 -0.69 0.00 0.00 178.15 178.70 1gxh h ASN 24 N 0.68 0.28 -0.65 1.72 2.35 -0.91 -3.48 115.58 115.57 1gxh h ASN 24 Ca 0.37 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.13 1gxh h ASN 24 Cb 0.51 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1gxh h ASN 24 CO -0.14 0.20 0.00 0.00 -1.65 0.00 0.00 177.43 175.84 1gxh s GLU 26 N -1.91 4.18 2.00 0.00 -6.30 -0.81 -4.53 118.70 111.33 1gxh s GLU 26 Ca 0.00 2.47 0.00 0.00 -2.50 0.00 0.00 54.97 54.94 1gxh s GLU 26 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 34.13 31.09 1gxh s GLU 26 CO 0.00 -0.51 0.00 0.41 0.02 0.00 0.00 175.26 175.18 1gxh n GLY 27 N 1.61 1.55 3.74 -1.50 0.00 -1.26 -4.70 105.19 104.63 1gxh n GLY 27 Ca 0.05 -0.39 -0.08 0.00 0.00 0.00 0.00 46.02 45.61 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 -4.00 -0.32 0.14 1.61 2.15 -1.26 -5.03 116.67 109.95 1gxh s ASP 28 Ca 0.00 -0.43 -0.26 0.00 0.43 0.00 0.00 52.55 52.30 1gxh s ASP 28 Cb 0.00 0.66 -0.04 0.00 -0.30 0.00 0.00 42.92 43.23 1gxh s ASP 28 CO 0.00 -1.18 1.30 1.21 -0.17 0.00 0.00 175.17 176.33 1gxh n GLU 29 N -0.44 -0.36 0.15 4.34 2.13 -1.26 -2.49 120.64 122.71 1gxh n GLU 29 Ca -0.07 1.28 0.03 0.00 0.66 0.00 0.00 57.16 59.05 1gxh n GLU 29 Cb 0.61 -1.88 0.39 0.00 0.27 0.00 0.00 31.44 30.83 1gxh n GLU 29 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1gxh h LYS 30 N 0.00 0.14 -0.04 5.31 1.79 -1.97 0.71 116.57 122.51 1gxh h LYS 30 Ca 0.14 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.58 1gxh h LYS 30 Cb 0.35 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.99 1gxh h LYS 30 CO -0.80 0.36 0.01 -0.22 -1.08 0.00 0.00 179.45 177.73 1gxh h LYS 31 N 0.13 0.03 0.00 3.15 3.64 -1.83 0.85 116.57 122.54 1gxh h LYS 31 Ca 0.02 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.31 1gxh h LYS 31 Cb 0.46 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 1gxh h LYS 31 CO 0.03 0.02 -0.46 -0.56 -2.27 0.00 0.00 179.45 176.22 1gxh h GLN 32 N 0.03 0.00 -0.67 1.90 3.07 -0.87 -2.17 115.11 116.40 1gxh h GLN 32 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.74 1gxh h GLN 32 Cb 0.01 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.53 1gxh h GLN 32 CO -0.01 0.46 0.36 0.22 0.09 0.00 0.00 178.83 179.94 1gxh h ASP 33 N 0.00 0.84 -0.37 0.06 3.58 -0.73 0.20 116.42 120.00 1gxh h ASP 33 Ca -0.00 -0.10 -0.07 0.00 0.42 0.00 0.00 57.03 57.27 1gxh h ASP 33 Cb 0.94 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.77 1gxh h ASP 33 CO 0.06 0.70 -0.06 -0.78 -2.88 0.00 0.00 179.24 176.28 1gxh h ASP 34 N 0.92 0.69 -0.55 2.28 1.82 -0.68 0.38 116.42 121.28 1gxh h ASP 34 Ca 0.23 -0.35 0.08 0.00 -0.39 0.00 0.00 57.03 56.61 1gxh h ASP 34 Cb 0.05 -0.19 -0.06 0.00 0.68 0.00 0.00 39.33 39.81 1gxh h ASP 34 CO -0.04 0.87 0.19 -1.13 -1.61 0.00 0.00 179.24 177.53 1gxh h ASN 35 N 0.49 0.19 -0.49 2.28 -1.24 -1.29 -2.98 115.58 112.54 1gxh h ASN 35 Ca 0.10 0.07 -0.05 0.00 0.71 0.00 0.00 56.30 57.12 1gxh h ASN 35 Cb 0.55 0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.64 1gxh h ASN 35 CO 0.03 0.13 0.09 -0.07 -1.29 0.00 0.00 177.43 176.32 1gxh h LEU 36 N 0.37 0.76 -0.97 0.34 3.38 0.16 0.51 115.31 119.85 1gxh h LEU 36 Ca 0.27 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1gxh h LEU 36 Cb 0.31 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1gxh h LEU 36 CO -0.28 0.82 0.60 -0.08 0.09 0.00 0.00 178.44 179.59 1gxh h GLU 37 N 0.67 1.30 -0.39 1.13 4.81 -1.45 -2.04 114.58 118.62 1gxh h GLU 37 Ca 0.15 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1gxh h GLU 37 Cb 0.37 -0.28 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1gxh h GLU 37 CO 0.01 0.89 0.15 1.25 -0.73 0.00 0.00 179.01 180.58 1gxh h HIS 38 N 1.33 0.60 0.00 0.92 2.76 -0.89 0.25 115.15 120.12 1gxh h HIS 38 Ca 0.35 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.47 1gxh h HIS 38 Cb -0.09 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 28.69 1gxh h HIS 38 CO 0.00 0.54 0.00 0.34 -1.30 0.00 0.00 177.93 177.52 1gxh n PHE 39 N -4.65 0.77 -0.06 5.26 7.35 0.16 -0.22 117.46 126.07 1gxh n PHE 39 Ca -0.00 0.37 -0.06 0.00 -0.76 0.00 0.00 57.45 57.00 1gxh n PHE 39 Cb 0.15 -1.10 -0.05 0.00 0.35 0.00 0.00 39.48 38.83 1gxh n PHE 39 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1gxh h ILE 40 N 0.00 0.59 -0.08 -2.13 5.03 -0.71 -3.40 117.51 116.80 1gxh h ILE 40 Ca 0.00 -1.47 -0.12 0.00 -0.12 0.00 0.00 64.86 63.15 1gxh h ILE 40 Cb 0.10 1.14 -0.01 0.00 -3.03 0.00 0.00 36.82 35.01 1gxh h ILE 40 CO 0.00 0.20 -0.51 -1.28 -0.68 0.00 0.00 178.15 175.88 1gxh h SER 41 N -1.00 0.24 0.35 1.72 0.87 0.15 -2.54 113.55 113.34 1gxh h SER 41 Ca -0.02 -0.12 -0.25 0.00 -1.23 0.00 0.00 61.79 60.17 1gxh h SER 41 Cb 0.42 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.32 1gxh h SER 41 CO -0.01 0.71 -1.05 -0.37 -0.53 0.00 0.00 176.83 175.57 1gxh h VAL 42 N 0.18 1.40 -3.45 2.23 -1.51 -1.33 -3.46 116.25 110.30 1gxh h VAL 42 Ca 0.01 -2.56 -0.41 0.00 -1.23 0.00 0.00 66.70 62.50 1gxh h VAL 42 Cb 0.96 2.57 0.20 0.00 -2.13 0.00 0.00 31.29 32.88 1gxh h VAL 42 CO 0.08 0.76 0.14 -0.89 -1.23 0.00 0.00 177.57 176.43 1gxh s THR 43 N -3.10 1.54 -0.03 7.19 2.01 -0.96 -3.53 115.64 118.77 1gxh s THR 43 Ca -0.06 0.00 0.04 0.00 0.31 0.00 0.00 61.69 61.98 1gxh s THR 43 Cb 0.08 -2.52 0.06 0.00 0.01 0.00 0.00 72.50 70.13 1gxh s THR 43 CO 0.88 0.00 0.91 -0.62 -0.69 0.00 0.00 174.62 175.10 1gxh n GLU 44 N -4.82 1.61 -2.16 4.92 4.71 -1.25 -4.94 120.64 118.70 1gxh n GLU 44 Ca 0.15 -1.42 -0.42 0.00 -0.01 0.00 0.00 57.16 55.46 1gxh n GLU 44 Cb 0.60 -0.93 -0.03 0.00 -1.01 0.00 0.00 31.44 30.08 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 -1.03 2.00 0.39 -0.32 2.46 -1.26 -4.88 115.29 112.66 1gxh s HIS 45 Ca 0.06 0.64 0.06 0.00 0.47 0.00 0.00 55.06 56.30 1gxh s HIS 45 Cb 0.06 -4.21 0.81 0.00 -0.13 0.00 0.00 32.58 29.11 1gxh s HIS 45 CO 0.01 -2.42 2.03 -1.00 -2.47 0.00 0.00 174.74 170.89 1gxh h PRO 46 N 12.46 0.61 0.00 2.88 0.13 -1.98 -1.80 132.00 144.30 1gxh h PRO 46 Ca -0.29 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.77 1gxh h PRO 46 Cb 1.14 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 1gxh h PRO 46 CO 1.11 0.40 -0.12 0.77 -0.23 0.00 0.00 178.00 179.93 1gxh h SER 47 N 0.63 0.00 0.00 1.44 0.02 -2.00 -3.48 113.55 110.16 1gxh h SER 47 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1gxh h SER 47 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1gxh h SER 47 CO -0.05 0.12 0.00 0.61 -1.14 0.00 0.00 176.83 176.37 1gxh n GLY 48 N -0.49 2.99 0.09 -3.77 0.00 -0.68 -2.44 105.19 100.88 1gxh n GLY 48 Ca -0.01 -0.09 0.05 0.00 0.00 0.00 0.00 46.02 45.97 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 2.61 0.26 -0.33 1.61 7.64 -1.26 -2.17 113.62 121.98 1gxh n SER 49 Ca 0.00 0.57 0.11 0.00 1.01 0.00 0.00 58.87 60.56 1gxh n SER 49 Cb 0.00 -0.59 0.31 0.00 -1.01 0.00 0.00 64.21 62.93 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 0.79 0.43 6.43 3.58 -1.87 0.27 116.42 126.05 1gxh h ASP 50 Ca 0.00 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.51 1gxh h ASP 50 Cb 0.18 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.14 1gxh h ASP 50 CO 0.00 0.37 0.00 0.18 -2.88 0.00 0.00 179.24 176.91 1gxh n LEU 51 N -4.64 0.31 -0.05 2.28 4.77 -0.92 -0.67 117.00 118.08 1gxh n LEU 51 Ca 0.20 0.60 -0.07 0.00 -0.03 0.00 0.00 56.01 56.71 1gxh n LEU 51 Cb 0.47 -0.57 -0.06 0.00 -2.33 0.00 0.00 43.42 40.92 1gxh n LEU 51 CO 0.26 -0.50 -0.86 -0.38 -1.33 0.00 0.00 177.39 174.58 1gxh n ILE 52 N -1.86 0.67 -0.03 -0.08 5.41 -0.33 -4.54 119.36 118.60 1gxh n ILE 52 Ca 0.02 -0.31 0.02 0.00 1.00 0.00 0.00 62.75 63.47 1gxh n ILE 52 Cb 0.14 -0.86 -0.09 0.00 -0.71 0.00 0.00 39.64 38.12 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 -2.67 0.00 -2.47 1.39 4.01 -0.07 -4.68 117.16 112.68 1gxh n TYR 53 Ca -0.19 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.39 1gxh n TYR 53 Cb 0.75 -0.40 0.02 0.00 -0.31 0.00 0.00 39.34 39.41 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 -2.13 2.26 -2.16 -0.72 4.01 0.16 -5.04 117.16 113.53 1gxh n TYR 54 Ca -0.09 -2.57 -0.36 0.00 -0.16 0.00 0.00 57.90 54.73 1gxh n TYR 54 Cb 0.54 -0.25 0.01 0.00 -0.31 0.00 0.00 39.34 39.33 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 -3.53 3.31 0.32 -0.72 0.04 -1.20 -4.78 135.00 128.44 1gxh s PRO 55 Ca 0.40 1.74 -0.05 0.00 0.04 0.00 0.00 61.00 63.13 1gxh s PRO 55 Cb 0.40 -2.08 0.08 0.00 0.04 0.00 0.00 34.50 32.94 1gxh s PRO 55 CO -0.04 -0.91 0.35 0.39 0.04 0.00 0.00 177.00 176.83 1gxh n GLU 56 N -1.20 -1.02 0.00 4.56 -0.58 -1.26 -4.88 120.64 116.25 1gxh n GLU 56 Ca 0.11 -0.55 0.00 0.00 -0.42 0.00 0.00 57.16 56.30 1gxh n GLU 56 Cb 0.50 -0.44 0.00 0.00 -0.57 0.00 0.00 31.44 30.93 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 1.40 2.51 2.34 0.62 0.00 -1.26 -1.01 105.19 109.78 1gxh n GLY 57 Ca 0.05 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 1gxh n GLY 57 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gxh n ASN 58 N 1.11 5.81 -3.76 1.61 6.94 -1.26 -4.89 115.26 120.82 1gxh n ASN 58 Ca 0.00 -3.76 -0.41 0.00 -0.02 0.00 0.00 54.58 50.39 1gxh n ASN 58 Cb 0.00 -0.61 -0.07 0.00 -2.36 0.00 0.00 39.78 36.74 1gxh n ASN 58 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1gxh n ASN 59 N -0.67 2.27 0.00 0.53 5.15 -0.18 -2.94 115.26 119.42 1gxh n ASN 59 Ca 0.48 -2.64 0.00 0.00 -0.60 0.00 0.00 54.58 51.82 1gxh n ASN 59 Cb 0.72 -1.10 0.00 0.00 -0.53 0.00 0.00 39.78 38.87 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 9.07 0.00 0.00 1.20 5.75 -1.26 -4.65 116.55 126.66 1gxh n ASP 60 Ca 0.48 0.00 -0.06 0.00 -0.01 0.00 0.00 54.79 55.21 1gxh n ASP 60 Cb 0.42 0.00 0.14 0.00 -1.03 0.00 0.00 41.12 40.65 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 0.57 -3.09 6.12 0.00 -1.96 -3.46 103.07 101.25 1gxh h GLY 61 Ca 0.00 -0.53 0.28 0.00 0.00 0.00 0.00 47.33 47.08 1gxh h GLY 61 CO 0.00 0.48 0.78 -0.56 0.00 0.00 0.00 176.54 177.24 1gxh s SER 62 N -6.83 -0.10 0.00 0.19 0.01 -1.26 -4.99 113.70 100.71 1gxh s SER 62 Ca -0.07 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.08 1gxh s SER 62 Cb 0.13 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.55 1gxh s SER 62 CO 0.81 -0.34 0.93 -2.65 0.41 0.00 0.00 173.24 172.40 1gxh n PRO 63 N -0.35 0.00 -0.24 12.44 -0.02 -1.26 -1.29 135.00 144.28 1gxh n PRO 63 Ca -0.05 0.43 0.04 0.00 -2.02 0.00 0.00 63.50 61.90 1gxh n PRO 63 Cb 0.61 -1.57 0.17 0.00 -0.02 0.00 0.00 33.50 32.69 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 0.34 0.00 -0.52 4.39 -1.96 -1.67 114.58 115.16 1gxh h GLU 64 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1gxh h GLU 64 Cb 0.14 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1gxh h GLU 64 CO 0.00 0.22 0.00 0.00 -1.16 0.00 0.00 179.01 178.07 1gxh h ALA 65 N 1.55 1.00 0.14 3.43 0.00 -1.55 0.77 119.26 124.59 1gxh h ALA 65 Ca 0.40 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.98 1gxh h ALA 65 Cb 0.63 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1gxh h ALA 65 CO -0.44 0.00 -1.64 0.28 0.00 0.00 0.00 179.25 177.45 1gxh h VAL 66 N 0.00 1.04 -0.49 0.00 2.07 -1.51 -2.92 116.25 114.43 1gxh h VAL 66 Ca 0.00 -2.67 -0.02 0.00 0.82 0.00 0.00 66.70 64.83 1gxh h VAL 66 Cb 0.28 2.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 1gxh h VAL 66 CO 0.00 0.82 0.22 0.40 0.02 0.00 0.00 177.57 179.03 1gxh h ILE 67 N 0.08 1.20 0.00 4.57 5.03 -0.75 0.20 117.51 127.83 1gxh h ILE 67 Ca -0.29 -0.58 0.00 0.00 -0.12 0.00 0.00 64.86 63.88 1gxh h ILE 67 Cb 2.04 0.67 0.00 0.00 -3.03 0.00 0.00 36.82 36.50 1gxh h ILE 67 CO 0.16 0.22 0.00 0.29 -0.68 0.00 0.00 178.15 178.14 1gxh n LYS 68 N -4.60 0.00 0.23 2.37 5.02 0.10 -1.28 118.16 120.00 1gxh n LYS 68 Ca 0.02 0.47 0.16 0.00 -2.02 0.00 0.00 58.31 56.94 1gxh n LYS 68 Cb 0.13 -0.86 0.69 0.00 -0.02 0.00 0.00 35.03 34.97 1gxh n LYS 68 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1gxh h GLU 69 N 0.00 0.00 0.19 1.97 3.07 -0.90 0.59 114.58 119.51 1gxh h GLU 69 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 1gxh h GLU 69 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1gxh h GLU 69 CO 0.00 0.00 -0.09 0.82 -1.40 0.00 0.00 179.01 178.34 1gxh h ILE 70 N 0.00 0.00 -0.09 3.13 5.03 -0.60 -0.74 117.51 124.24 1gxh h ILE 70 Ca 0.00 -0.17 -0.02 0.00 -0.12 0.00 0.00 64.86 64.55 1gxh h ILE 70 Cb 0.35 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 34.14 1gxh h ILE 70 CO 0.00 0.00 -0.02 0.07 -0.68 0.00 0.00 178.15 177.52 1gxh h LYS 71 N -0.43 0.13 0.02 2.37 2.10 0.47 0.13 116.57 121.36 1gxh h LYS 71 Ca -0.03 -0.02 -0.17 0.00 -2.00 0.00 0.00 60.65 58.43 1gxh h LYS 71 Cb 0.20 -0.03 0.02 0.00 -0.90 0.00 0.00 32.23 31.52 1gxh h LYS 71 CO 0.04 0.17 -0.69 0.93 -2.00 0.00 0.00 179.45 177.89 1gxh h GLU 72 N 0.13 0.43 0.35 0.07 3.07 -0.01 0.15 114.58 118.76 1gxh h GLU 72 Ca 0.03 -0.49 -0.00 0.00 -0.50 0.00 0.00 59.36 58.39 1gxh h GLU 72 Cb 0.13 0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 28.17 1gxh h GLU 72 CO 0.00 1.15 -0.30 2.35 -1.40 0.00 0.00 179.01 180.82 1gxh h TRP 73 N -0.08 -0.80 -0.94 4.33 7.01 -0.85 0.49 115.95 125.12 1gxh h TRP 73 Ca -0.09 0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.00 1gxh h TRP 73 Cb 1.41 0.30 -0.07 0.00 -2.10 0.00 0.00 29.16 28.71 1gxh h TRP 73 CO 0.15 -0.44 0.60 0.00 -2.79 0.00 0.00 178.44 175.96 1gxh h ARG 74 N -0.66 0.95 0.83 2.65 2.47 -0.73 0.29 114.38 120.18 1gxh h ARG 74 Ca -0.02 -0.06 -0.04 0.00 -1.26 0.00 0.00 59.98 58.60 1gxh h ARG 74 Cb 0.58 -0.21 0.01 0.00 -1.65 0.00 0.00 29.97 28.70 1gxh h ARG 74 CO -0.03 0.63 -0.40 0.00 0.56 0.00 0.00 179.97 180.73 1gxh h ALA 75 N 1.53 -1.28 -0.83 0.04 0.00 -0.36 0.22 119.26 118.58 1gxh h ALA 75 Ca 0.43 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 55.14 1gxh h ALA 75 Cb 0.36 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 1gxh h ALA 75 CO -0.19 -1.20 0.53 0.00 0.00 0.00 0.00 179.25 178.38 1gxh h ALA 76 N -1.47 1.11 0.00 0.00 0.00 -0.47 -0.47 119.26 117.96 1gxh h ALA 76 Ca -0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1gxh h ALA 76 Cb 0.86 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1gxh h ALA 76 CO 0.19 0.32 -0.18 -0.91 0.00 0.00 0.00 179.25 178.67 1gxh h ASN 77 N 1.00 0.00 0.00 0.00 2.35 -1.00 -3.44 115.58 114.49 1gxh h ASN 77 Ca 0.34 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.09 1gxh h ASN 77 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1gxh h ASN 77 CO -0.14 0.18 0.00 0.61 -1.65 0.00 0.00 177.43 176.43 1gxh n GLY 78 N 0.22 0.00 0.00 2.83 0.00 -0.86 -5.08 105.19 102.30 1gxh n GLY 78 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.03 -4.95 118.16 111.84 1gxh n LYS 79 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.32 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 -1.09 0.00 -5.58 0.01 -1.25 -4.96 113.70 100.84 1gxh s SER 80 Ca 0.00 -0.66 0.00 0.00 1.31 0.00 0.00 55.95 56.60 1gxh s SER 80 Cb 0.00 1.40 0.00 0.00 0.21 0.00 0.00 66.02 67.63 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 3.95 4.06 3.51 3.44 0.00 -1.26 -4.86 105.19 114.03 1gxh n GLY 81 Ca 0.10 -2.19 -0.29 0.00 0.00 0.00 0.00 46.02 43.64 1gxh n GLY 81 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1gxh s PHE 82 N -0.62 1.13 0.39 1.61 -0.12 -1.22 -4.34 117.98 114.82 1gxh s PHE 82 Ca 0.00 0.95 -0.23 0.00 -0.05 0.00 0.00 56.93 57.60 1gxh s PHE 82 Cb 0.00 -3.14 -0.13 0.00 -0.63 0.00 0.00 43.02 39.12 1gxh s PHE 82 CO 0.00 -3.87 0.52 1.17 -0.05 0.00 0.00 175.22 172.99 1gxh n LYS 83 N -4.88 0.51 -1.55 1.99 4.81 -1.26 -4.84 118.16 112.95 1gxh n LYS 83 Ca 0.06 0.19 -0.36 0.00 -0.87 0.00 0.00 58.31 57.32 1gxh n LYS 83 Cb 0.56 -1.43 -0.03 0.00 0.02 0.00 0.00 35.03 34.15 1gxh n LYS 83 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1gxh n GLN 84 N 0.71 3.81 -0.67 1.64 7.27 -1.26 -3.15 117.38 125.73 1gxh n GLN 84 Ca 0.12 -2.58 0.00 0.00 0.07 0.00 0.00 57.00 54.61 1gxh n GLN 84 Cb 0.38 -2.63 0.00 0.00 2.41 0.00 0.00 30.24 30.40 1gxh n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54