#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 1.71 0.00 2.12 0.00 -1.26 -4.77 120.64 118.44 1gxh n GLU 2 Ca 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 57.16 53.83 1gxh n GLU 2 Cb 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 31.44 29.84 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 -0.99 0.00 -3.85 -1.84 4.77 -1.26 -4.92 117.00 108.91 1gxh n LEU 3 Ca 0.21 0.00 -0.51 0.00 -0.03 0.00 0.00 56.01 55.68 1gxh n LEU 3 Cb 0.74 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.77 1gxh n LEU 3 CO 0.01 -0.33 0.52 0.29 -1.33 0.00 0.00 177.39 176.54 1gxh n LYS 4 N -0.14 0.00 0.31 3.23 4.76 -1.26 -4.72 118.16 120.34 1gxh n LYS 4 Ca 0.00 0.00 0.17 0.00 -2.87 0.00 0.00 58.31 55.61 1gxh n LYS 4 Cb 0.00 -1.28 0.92 0.00 -1.84 0.00 0.00 35.03 32.83 1gxh n LYS 4 CO 0.00 0.00 0.00 -0.91 -1.37 0.00 0.00 177.40 175.12 1gxh h ASN 5 N 2.66 0.00 0.00 4.39 2.35 -1.91 -3.44 115.58 119.63 1gxh h ASN 5 Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 1gxh h ASN 5 Cb 1.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.59 1gxh h ASN 5 CO 0.57 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 175.15 1gxh n SER 6 N -2.84 0.00 -0.36 5.81 7.64 -1.26 -4.98 113.62 117.62 1gxh n SER 6 Ca -0.02 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.92 1gxh n SER 6 Cb 0.22 0.00 0.23 0.00 -1.01 0.00 0.00 64.21 63.65 1gxh n SER 6 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1gxh h ILE 7 N 0.14 0.96 0.00 0.44 1.08 -1.84 0.72 117.51 119.01 1gxh h ILE 7 Ca 0.00 -0.36 0.00 0.00 -0.39 0.00 0.00 64.86 64.11 1gxh h ILE 7 Cb 0.00 -0.17 0.00 0.00 -3.07 0.00 0.00 36.82 33.58 1gxh h ILE 7 CO 0.00 0.19 0.00 -0.24 -0.69 0.00 0.00 178.15 177.41 1gxh n SER 8 N -4.59 0.00 0.04 1.72 2.88 -1.25 -0.65 113.62 111.77 1gxh n SER 8 Ca 0.18 0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 1gxh n SER 8 Cb 0.31 -0.41 -0.07 0.00 -0.75 0.00 0.00 64.21 63.29 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 -0.59 -3.46 3.58 -1.21 -3.21 116.42 111.53 1gxh h ASP 9 Ca 0.00 0.00 -0.71 0.00 0.42 0.00 0.00 57.03 56.74 1gxh h ASP 9 Cb 0.32 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.32 1gxh h ASP 9 CO 0.00 0.57 3.11 -1.22 -2.88 0.00 0.00 179.24 178.81 1gxh n TYR 10 N -2.91 2.54 -0.50 0.28 4.01 0.17 -4.73 117.16 116.02 1gxh n TYR 10 Ca -0.09 -2.96 -0.17 0.00 -0.16 0.00 0.00 57.90 54.53 1gxh n TYR 10 Cb 0.83 -2.17 -0.01 0.00 -0.31 0.00 0.00 39.34 37.68 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 2.71 0.63 -0.33 -0.72 -2.24 -1.26 -3.84 114.28 109.23 1gxh n THR 11 Ca 0.69 -0.18 0.29 0.00 -2.27 0.00 0.00 64.05 62.58 1gxh n THR 11 Cb 0.24 0.00 0.61 0.00 -2.10 0.00 0.00 70.33 69.08 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 0.32 0.22 0.05 -0.78 4.81 -1.94 0.46 114.58 117.71 1gxh h GLU 12 Ca -0.11 -0.01 -0.27 0.00 -0.13 0.00 0.00 59.36 58.84 1gxh h GLU 12 Cb 0.53 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.83 1gxh h GLU 12 CO 0.20 0.14 -1.38 1.15 -0.73 0.00 0.00 179.01 178.39 1gxh h THR 13 N 0.22 1.28 -0.54 0.32 2.02 -1.98 -2.74 112.91 111.49 1gxh h THR 13 Ca 0.60 -3.00 -0.03 0.00 0.77 0.00 0.00 66.41 64.75 1gxh h THR 13 Cb 1.88 2.70 -0.02 0.00 -1.74 0.00 0.00 68.15 70.97 1gxh h THR 13 CO -0.20 0.79 0.23 -0.33 0.37 0.00 0.00 175.52 176.37 1gxh h GLU 14 N 0.03 0.80 -0.42 6.66 5.08 -0.39 0.67 114.58 127.00 1gxh h GLU 14 Ca -0.17 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 57.97 1gxh h GLU 14 Cb 1.93 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 31.02 1gxh h GLU 14 CO 0.13 0.69 -0.09 0.35 -1.00 0.00 0.00 179.01 179.09 1gxh h PHE 15 N 0.74 0.80 -0.37 4.33 3.57 -1.33 -1.19 116.94 123.49 1gxh h PHE 15 Ca 0.18 -0.13 0.08 0.00 3.53 0.00 0.00 57.97 61.63 1gxh h PHE 15 Cb 0.18 -0.21 -0.08 0.00 2.79 0.00 0.00 35.95 38.63 1gxh h PHE 15 CO 0.00 0.79 -0.16 -0.22 -2.23 0.00 0.00 178.31 176.50 1gxh h LYS 16 N 0.67 -0.09 -0.97 1.11 1.63 -1.22 -1.50 116.57 116.20 1gxh h LYS 16 Ca 0.12 0.01 0.13 0.00 -0.85 0.00 0.00 60.65 60.05 1gxh h LYS 16 Cb 0.54 0.02 -0.08 0.00 -0.60 0.00 0.00 32.23 32.11 1gxh h LYS 16 CO 0.03 -0.06 0.61 -0.22 -3.45 0.00 0.00 179.45 176.36 1gxh h LYS 17 N -0.10 0.88 0.03 1.90 3.11 0.39 0.60 116.57 123.39 1gxh h LYS 17 Ca 0.18 -0.05 -0.00 0.00 -2.81 0.00 0.00 60.65 57.97 1gxh h LYS 17 Cb 0.38 -0.20 0.00 0.00 -1.00 0.00 0.00 32.23 31.41 1gxh h LYS 17 CO -0.43 0.58 -0.01 0.97 -2.81 0.00 0.00 179.45 177.75 1gxh h ILE 18 N 0.91 1.23 0.00 2.00 2.10 -1.20 -0.53 117.51 122.02 1gxh h ILE 18 Ca 0.48 -0.84 -0.04 0.00 1.08 0.00 0.00 64.86 65.54 1gxh h ILE 18 Cb 0.56 1.80 -0.01 0.00 -1.09 0.00 0.00 36.82 38.08 1gxh h ILE 18 CO -0.25 0.21 -0.19 0.40 -1.08 0.00 0.00 178.15 177.24 1gxh h ILE 19 N -0.41 0.79 0.02 2.19 1.08 0.10 -2.12 117.51 119.16 1gxh h ILE 19 Ca -0.00 -0.77 -0.00 0.00 -0.39 0.00 0.00 64.86 63.69 1gxh h ILE 19 Cb 0.38 1.46 0.00 0.00 -3.07 0.00 0.00 36.82 35.60 1gxh h ILE 19 CO 0.01 0.19 -0.01 -0.08 -0.69 0.00 0.00 178.15 177.57 1gxh h GLU 20 N 0.00 -0.02 -0.71 2.37 4.81 0.04 -2.94 114.58 118.12 1gxh h GLU 20 Ca -0.00 0.00 0.15 0.00 -0.13 0.00 0.00 59.36 59.38 1gxh h GLU 20 Cb 0.45 0.01 -0.13 0.00 0.63 0.00 0.00 28.75 29.71 1gxh h GLU 20 CO 0.03 0.69 -0.05 -0.44 -0.73 0.00 0.00 179.01 178.51 1gxh h ASP 21 N -0.94 -0.43 0.67 1.04 3.32 -0.51 0.56 116.42 120.12 1gxh h ASP 21 Ca -0.00 0.19 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 1gxh h ASP 21 Cb 0.73 0.36 0.01 0.00 0.22 0.00 0.00 39.33 40.65 1gxh h ASP 21 CO 0.00 -0.19 -0.32 0.16 -1.72 0.00 0.00 179.24 177.18 1gxh h ILE 22 N 0.07 0.00 -0.62 0.35 3.07 -1.55 0.12 117.51 118.95 1gxh h ILE 22 Ca 0.37 -0.06 0.15 0.00 1.55 0.00 0.00 64.86 66.87 1gxh h ILE 22 Cb 0.63 0.00 -0.03 0.00 -0.27 0.00 0.00 36.82 37.14 1gxh h ILE 22 CO -0.66 0.00 0.43 0.40 -1.05 0.00 0.00 178.15 177.27 1gxh h ILE 23 N -0.96 0.77 0.07 0.16 2.04 -1.13 -1.51 117.51 116.94 1gxh h ILE 23 Ca -0.09 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 1gxh h ILE 23 Cb 0.69 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1gxh h ILE 23 CO 0.15 0.03 -0.03 0.78 0.00 0.00 0.00 178.15 179.08 1gxh h ASN 24 N 0.19 -0.08 0.00 1.72 2.35 -0.99 -3.50 115.58 115.27 1gxh h ASN 24 Ca 0.30 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 1gxh h ASN 24 Cb 0.91 0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.30 1gxh h ASN 24 CO -0.05 -0.04 0.00 0.00 -1.65 0.00 0.00 177.43 175.68 1gxh s GLU 26 N 0.00 4.11 2.01 0.00 -6.30 0.32 -4.60 118.70 114.24 1gxh s GLU 26 Ca 0.00 2.58 0.00 0.00 -2.50 0.00 0.00 54.97 55.05 1gxh s GLU 26 Cb 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 34.13 31.15 1gxh s GLU 26 CO 0.00 -0.57 0.00 0.41 0.02 0.00 0.00 175.26 175.12 1gxh n GLY 27 N 0.92 2.16 3.63 -1.50 0.00 -1.26 -4.41 105.19 104.73 1gxh n GLY 27 Ca 0.03 -0.01 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.18 0.31 1.61 2.15 -1.26 -4.98 116.67 110.31 1gxh s ASP 28 Ca 0.00 -0.15 0.08 0.00 0.43 0.00 0.00 52.55 52.90 1gxh s ASP 28 Cb 0.00 0.31 0.81 0.00 -0.30 0.00 0.00 42.92 43.73 1gxh s ASP 28 CO 0.00 -0.54 1.75 1.05 -0.17 0.00 0.00 175.17 177.26 1gxh h GLU 29 N 2.00 0.66 -0.23 4.34 4.11 -1.96 -1.45 114.58 122.06 1gxh h GLU 29 Ca -0.22 -0.04 -0.14 0.00 0.07 0.00 0.00 59.36 59.02 1gxh h GLU 29 Cb 1.21 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1gxh h GLU 29 CO 0.27 0.44 -0.46 0.87 0.07 0.00 0.00 179.01 180.20 1gxh h LYS 30 N 0.68 0.58 -0.80 1.06 1.79 -1.96 0.35 116.57 118.28 1gxh h LYS 30 Ca 0.61 -0.32 0.02 0.00 -2.18 0.00 0.00 60.65 58.78 1gxh h LYS 30 Cb 1.05 0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 31.67 1gxh h LYS 30 CO -0.43 0.92 0.53 -0.22 -1.08 0.00 0.00 179.45 179.17 1gxh h LYS 31 N 0.47 1.02 -0.40 3.15 3.11 -1.69 0.12 116.57 122.35 1gxh h LYS 31 Ca 0.03 -0.06 -0.14 0.00 -2.81 0.00 0.00 60.65 57.67 1gxh h LYS 31 Cb 0.98 -0.23 -0.01 0.00 -1.00 0.00 0.00 32.23 31.97 1gxh h LYS 31 CO 0.09 0.67 -0.32 1.96 -2.81 0.00 0.00 179.45 179.05 1gxh h GLN 32 N 1.05 0.89 -0.92 1.90 4.20 -0.45 -0.72 115.11 121.05 1gxh h GLN 32 Ca 0.30 -0.42 0.01 0.00 0.06 0.00 0.00 58.65 58.60 1gxh h GLN 32 Cb -0.07 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.66 1gxh h GLN 32 CO -0.07 1.07 0.61 0.22 -0.67 0.00 0.00 178.83 179.99 1gxh h ASP 33 N 0.75 1.06 -0.43 1.46 1.82 -0.49 0.24 116.42 120.82 1gxh h ASP 33 Ca 0.08 -0.03 -0.08 0.00 -0.39 0.00 0.00 57.03 56.61 1gxh h ASP 33 Cb 0.88 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.62 1gxh h ASP 33 CO 0.08 0.77 -0.04 -0.78 -1.61 0.00 0.00 179.24 177.66 1gxh h ASP 34 N 1.25 0.78 -0.50 2.28 3.58 -0.67 0.08 116.42 123.22 1gxh h ASP 34 Ca 0.34 -0.33 0.06 0.00 0.42 0.00 0.00 57.03 57.52 1gxh h ASP 34 Cb -0.14 -0.21 -0.05 0.00 1.72 0.00 0.00 39.33 40.64 1gxh h ASP 34 CO -0.07 0.92 0.21 -1.13 -2.88 0.00 0.00 179.24 176.29 1gxh h ASN 35 N 0.62 0.26 -0.23 2.28 -1.24 -0.78 -1.20 115.58 115.28 1gxh h ASN 35 Ca 0.12 0.05 -0.14 0.00 0.71 0.00 0.00 56.30 57.03 1gxh h ASN 35 Cb 0.55 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.60 1gxh h ASN 35 CO 0.03 0.18 -0.37 -0.07 -1.29 0.00 0.00 177.43 175.91 1gxh h LEU 36 N 0.41 0.80 -0.14 0.34 3.38 0.12 0.51 115.31 120.74 1gxh h LEU 36 Ca 0.23 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.90 1gxh h LEU 36 Cb 0.20 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 1gxh h LEU 36 CO -0.21 1.09 -0.26 -0.08 0.09 0.00 0.00 178.44 179.07 1gxh h GLU 37 N 0.63 -0.31 -0.53 1.13 4.22 -1.17 -2.06 114.58 116.49 1gxh h GLU 37 Ca 0.06 0.02 0.01 0.00 0.08 0.00 0.00 59.36 59.53 1gxh h GLU 37 Cb 0.91 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.20 1gxh h GLU 37 CO 0.08 -0.21 0.34 1.25 -2.18 0.00 0.00 179.01 178.29 1gxh h HIS 38 N -0.32 0.64 0.00 0.92 2.76 -0.63 -0.01 115.15 118.51 1gxh h HIS 38 Ca 0.10 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 1gxh h HIS 38 Cb 0.48 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.23 1gxh h HIS 38 CO -0.36 0.39 0.00 0.34 -1.30 0.00 0.00 177.93 177.00 1gxh n PHE 39 N -4.74 0.09 -0.04 5.26 7.35 0.15 -0.32 117.46 125.21 1gxh n PHE 39 Ca 0.03 0.04 -0.22 0.00 -0.76 0.00 0.00 57.45 56.55 1gxh n PHE 39 Cb 0.04 -0.57 -0.13 0.00 0.35 0.00 0.00 39.48 39.17 1gxh n PHE 39 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1gxh n ILE 40 N -1.59 1.68 0.10 -2.13 -0.00 -0.35 -4.43 119.36 112.64 1gxh n ILE 40 Ca 0.01 -0.47 -0.12 0.00 -0.00 0.00 0.00 62.75 62.16 1gxh n ILE 40 Cb 0.04 -1.79 -0.08 0.00 -0.00 0.00 0.00 39.64 37.80 1gxh n ILE 40 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 1gxh h SER 41 N -0.28 -0.24 -0.26 4.38 0.02 0.11 -0.49 113.55 116.80 1gxh h SER 41 Ca -0.44 -0.27 -0.08 0.00 -0.84 0.00 0.00 61.79 60.17 1gxh h SER 41 Cb 1.81 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 64.40 1gxh h SER 41 CO -0.04 0.19 -0.14 1.62 -1.14 0.00 0.00 176.83 177.33 1gxh h VAL 42 N -0.74 1.30 -0.55 2.27 3.04 -1.53 -3.34 116.25 116.71 1gxh h VAL 42 Ca -0.03 -1.23 -0.10 0.00 -1.01 0.00 0.00 66.70 64.33 1gxh h VAL 42 Cb 0.50 1.55 -0.02 0.00 -2.01 0.00 0.00 31.29 31.31 1gxh h VAL 42 CO 0.05 0.38 -0.06 0.74 -1.01 0.00 0.00 177.57 177.68 1gxh h THR 43 N 0.27 1.27 0.00 3.17 2.02 -1.71 -3.33 112.91 114.60 1gxh h THR 43 Ca 0.06 -1.20 0.00 0.00 0.77 0.00 0.00 66.41 66.03 1gxh h THR 43 Cb 0.65 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1gxh h THR 43 CO 0.04 0.43 0.00 -0.62 0.37 0.00 0.00 175.52 175.74 1gxh n GLU 44 N -4.20 -0.52 -2.16 6.66 1.02 -0.20 -4.93 120.64 116.30 1gxh n GLU 44 Ca 0.02 0.12 -0.43 0.00 -0.02 0.00 0.00 57.16 56.85 1gxh n GLU 44 Cb 0.37 -4.44 -0.02 0.00 -0.02 0.00 0.00 31.44 27.33 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 -0.94 2.19 0.35 -0.32 2.46 -1.26 -4.89 115.29 112.88 1gxh s HIS 45 Ca 0.00 0.60 0.04 0.00 0.47 0.00 0.00 55.06 56.17 1gxh s HIS 45 Cb 0.00 -3.98 0.64 0.00 -0.13 0.00 0.00 32.58 29.11 1gxh s HIS 45 CO 0.00 -2.72 1.93 -1.00 -2.47 0.00 0.00 174.74 170.48 1gxh h PRO 46 N 10.57 0.60 -0.99 2.88 0.13 -1.94 -0.00 132.00 143.24 1gxh h PRO 46 Ca -0.32 -0.09 -0.01 0.00 -0.87 0.00 0.00 66.00 64.71 1gxh h PRO 46 Cb 1.14 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 1gxh h PRO 46 CO 1.01 0.53 0.01 0.43 -0.23 0.00 0.00 178.00 179.75 1gxh n SER 47 N -4.34 2.04 -4.54 1.44 7.64 -1.26 -4.93 113.62 109.67 1gxh n SER 47 Ca 0.03 -2.04 -0.60 0.00 1.01 0.00 0.00 58.87 57.26 1gxh n SER 47 Cb 0.17 -0.51 -0.08 0.00 -1.01 0.00 0.00 64.21 62.78 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 0.22 -0.20 4.47 0.23 0.00 -0.02 -0.98 105.19 108.92 1gxh n GLY 48 Ca 0.01 0.80 0.00 0.00 0.00 0.00 0.00 46.02 46.83 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 1.90 0.00 -0.13 1.61 2.88 -1.26 -4.77 113.62 113.85 1gxh n SER 49 Ca 0.22 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.74 1gxh n SER 49 Cb 0.06 -0.43 0.22 0.00 -0.75 0.00 0.00 64.21 63.31 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 0.75 0.62 -3.46 3.58 -1.44 -0.06 116.42 116.41 1gxh h ASP 50 Ca 0.00 -0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.34 1gxh h ASP 50 Cb 0.00 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 40.86 1gxh h ASP 50 CO 0.00 0.70 0.00 0.18 -2.88 0.00 0.00 179.24 177.24 1gxh n LEU 51 N -4.31 0.06 -0.09 2.28 7.99 -1.20 -0.71 117.00 121.02 1gxh n LEU 51 Ca 0.04 0.51 -0.12 0.00 -0.01 0.00 0.00 56.01 56.44 1gxh n LEU 51 Cb 0.19 -0.50 -0.09 0.00 -0.11 0.00 0.00 43.42 42.91 1gxh n LEU 51 CO 0.39 -0.23 -1.07 -0.38 -1.51 0.00 0.00 177.39 174.59 1gxh n ILE 52 N -1.57 1.03 -0.11 -0.08 5.41 -0.68 -4.49 119.36 118.87 1gxh n ILE 52 Ca 0.04 -0.43 -0.13 0.00 1.00 0.00 0.00 62.75 63.23 1gxh n ILE 52 Cb 0.21 -1.06 -0.14 0.00 -0.71 0.00 0.00 39.64 37.94 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 -2.95 0.00 -2.73 1.39 4.01 -0.12 -4.65 117.16 112.10 1gxh n TYR 53 Ca -0.31 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.21 1gxh n TYR 53 Cb 0.86 -0.96 -0.01 0.00 -0.31 0.00 0.00 39.34 38.92 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 -2.95 2.81 -1.42 -0.72 4.01 0.11 -5.07 117.16 113.93 1gxh n TYR 54 Ca -0.37 -3.40 -0.29 0.00 -0.16 0.00 0.00 57.90 53.67 1gxh n TYR 54 Cb 1.06 -0.29 0.12 0.00 -0.31 0.00 0.00 39.34 39.92 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 -3.31 1.45 0.00 -0.72 0.04 -1.22 -4.75 135.00 126.49 1gxh s PRO 55 Ca 0.44 0.57 0.00 0.00 0.04 0.00 0.00 61.00 62.05 1gxh s PRO 55 Cb 0.37 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 33.06 1gxh s PRO 55 CO -0.12 -2.05 0.00 -0.85 0.04 0.00 0.00 177.00 174.02 1gxh n GLU 56 N -3.71 1.54 0.00 4.56 0.28 -1.26 -5.03 120.64 117.01 1gxh n GLU 56 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.07 1gxh n GLU 56 Cb 0.57 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.44 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 1.92 2.03 2.00 -1.84 0.00 -1.26 -0.87 105.19 107.16 1gxh n GLY 57 Ca 0.00 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.28 1gxh n GLY 57 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gxh n ASN 58 N 0.26 4.37 -3.67 1.61 4.13 -1.26 -4.78 115.26 115.92 1gxh n ASN 58 Ca 0.00 -3.70 -0.43 0.00 1.68 0.00 0.00 54.58 52.13 1gxh n ASN 58 Cb 0.00 -0.80 -0.04 0.00 -1.54 0.00 0.00 39.78 37.41 1gxh n ASN 58 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1gxh n ASN 59 N -1.07 3.04 0.00 6.41 5.15 -0.05 -3.07 115.26 125.66 1gxh n ASN 59 Ca 0.54 -2.74 0.00 0.00 -0.60 0.00 0.00 54.58 51.78 1gxh n ASN 59 Cb 1.27 -1.32 0.00 0.00 -0.53 0.00 0.00 39.78 39.20 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 7.01 0.00 0.12 1.20 5.75 -1.26 -4.49 116.55 124.88 1gxh n ASP 60 Ca 0.50 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 55.26 1gxh n ASP 60 Cb 0.40 0.00 0.15 0.00 -1.03 0.00 0.00 41.12 40.64 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 0.06 -2.68 6.12 0.00 -1.95 -3.47 103.07 101.14 1gxh h GLY 61 Ca 0.00 -0.07 0.40 0.00 0.00 0.00 0.00 47.33 47.66 1gxh h GLY 61 CO 0.00 0.06 1.00 -0.56 0.00 0.00 0.00 176.54 177.04 1gxh s SER 62 N -6.86 -0.00 0.00 0.19 0.01 -1.26 -4.97 113.70 100.81 1gxh s SER 62 Ca -0.02 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.23 1gxh s SER 62 Cb 0.12 0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.37 1gxh s SER 62 CO 0.77 -0.03 0.51 -0.81 0.41 0.00 0.00 173.24 174.10 1gxh n PRO 63 N -0.65 0.00 0.37 12.44 -0.04 -1.26 -2.70 135.00 143.16 1gxh n PRO 63 Ca -0.05 0.06 -0.18 0.00 -0.04 0.00 0.00 63.50 63.29 1gxh n PRO 63 Cb 0.62 -1.51 -0.09 0.00 -0.04 0.00 0.00 33.50 32.49 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 -0.88 -0.35 0.54 4.39 -1.97 -2.94 114.58 113.37 1gxh h GLU 64 Ca 0.00 0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 1gxh h GLU 64 Cb 0.02 0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 1gxh h GLU 64 CO 0.00 -0.57 0.04 0.00 -1.16 0.00 0.00 179.01 177.31 1gxh h ALA 65 N -0.67 1.41 -0.19 3.43 0.00 -1.83 -0.08 119.26 121.34 1gxh h ALA 65 Ca -0.09 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1gxh h ALA 65 Cb 0.72 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1gxh h ALA 65 CO 0.15 0.42 -0.08 0.28 0.00 0.00 0.00 179.25 180.02 1gxh h VAL 66 N 0.51 1.30 -0.69 0.00 2.07 -1.78 -1.17 116.25 116.50 1gxh h VAL 66 Ca 0.11 -1.12 0.08 0.00 0.82 0.00 0.00 66.70 66.60 1gxh h VAL 66 Cb 0.28 1.65 -0.07 0.00 -1.52 0.00 0.00 31.29 31.63 1gxh h VAL 66 CO 0.00 0.34 0.36 0.40 0.02 0.00 0.00 177.57 178.69 1gxh h ILE 67 N 0.08 0.89 0.41 4.57 5.03 -0.93 0.17 117.51 127.72 1gxh h ILE 67 Ca 0.04 -0.22 -0.01 0.00 -0.12 0.00 0.00 64.86 64.56 1gxh h ILE 67 Cb 0.55 0.21 -0.01 0.00 -3.03 0.00 0.00 36.82 34.54 1gxh h ILE 67 CO 0.03 0.11 -0.31 0.11 -0.68 0.00 0.00 178.15 177.41 1gxh h LYS 68 N 0.63 -0.69 -0.09 2.37 1.57 -1.06 0.78 116.57 120.08 1gxh h LYS 68 Ca 0.33 0.05 0.02 0.00 -1.87 0.00 0.00 60.65 59.18 1gxh h LYS 68 Cb 0.30 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 1gxh h LYS 68 CO -0.24 -0.46 0.11 0.93 -0.57 0.00 0.00 179.45 179.22 1gxh h GLU 69 N -0.72 0.00 0.07 3.15 4.39 -0.22 0.63 114.58 121.89 1gxh h GLU 69 Ca -0.04 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 1gxh h GLU 69 Cb 0.62 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1gxh h GLU 69 CO -0.00 0.00 -0.04 0.82 -1.16 0.00 0.00 179.01 178.63 1gxh h ILE 70 N 0.00 0.00 -1.00 3.13 1.08 -0.13 0.16 117.51 120.74 1gxh h ILE 70 Ca 0.04 -0.77 0.15 0.00 -0.39 0.00 0.00 64.86 63.89 1gxh h ILE 70 Cb 0.27 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 33.92 1gxh h ILE 70 CO -0.00 0.00 0.62 0.07 -0.69 0.00 0.00 178.15 178.15 1gxh h LYS 71 N -0.87 0.87 0.09 2.37 2.10 -0.61 0.46 116.57 120.98 1gxh h LYS 71 Ca -0.01 -0.05 -0.27 0.00 -2.00 0.00 0.00 60.65 58.31 1gxh h LYS 71 Cb 0.08 -0.20 -0.01 0.00 -0.90 0.00 0.00 32.23 31.20 1gxh h LYS 71 CO 0.02 0.58 -1.33 0.93 -2.00 0.00 0.00 179.45 177.64 1gxh h GLU 72 N 0.90 0.19 0.14 0.07 3.07 -0.93 0.18 114.58 118.20 1gxh h GLU 72 Ca 0.53 -0.32 0.01 0.00 -0.50 0.00 0.00 59.36 59.09 1gxh h GLU 72 Cb 0.67 0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.67 1gxh h GLU 72 CO -0.31 1.08 -0.25 2.35 -1.40 0.00 0.00 179.01 180.48 1gxh h TRP 73 N 0.05 -0.66 -0.63 4.33 7.01 -0.43 0.26 115.95 125.88 1gxh h TRP 73 Ca -0.16 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.86 1gxh h TRP 73 Cb 1.95 0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 29.25 1gxh h TRP 73 CO 0.05 -0.35 0.41 0.00 -2.79 0.00 0.00 178.44 175.75 1gxh h ARG 74 N -0.47 0.83 -0.29 2.65 2.47 -0.84 0.25 114.38 118.99 1gxh h ARG 74 Ca 0.02 -0.06 -0.11 0.00 -1.26 0.00 0.00 59.98 58.58 1gxh h ARG 74 Cb 0.48 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.60 1gxh h ARG 74 CO -0.12 0.56 -0.28 0.00 0.56 0.00 0.00 179.97 180.69 1gxh h ALA 75 N 1.22 0.98 0.40 0.04 0.00 -0.32 0.36 119.26 121.95 1gxh h ALA 75 Ca 0.23 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1gxh h ALA 75 Cb -0.08 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1gxh h ALA 75 CO -0.05 0.60 -0.19 0.00 0.00 0.00 0.00 179.25 179.61 1gxh h ALA 76 N 1.20 -0.56 0.00 0.00 0.00 -0.62 -1.84 119.26 117.44 1gxh h ALA 76 Ca 0.07 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1gxh h ALA 76 Cb 0.74 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1gxh h ALA 76 CO 0.06 -0.52 -0.27 -0.91 0.00 0.00 0.00 179.25 177.61 1gxh h ASN 77 N -1.10 0.00 0.00 0.00 2.35 -0.97 -3.37 115.58 112.49 1gxh h ASN 77 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1gxh h ASN 77 Cb 0.42 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1gxh h ASN 77 CO 0.09 0.27 0.00 0.61 -1.65 0.00 0.00 177.43 176.75 1gxh n GLY 78 N -0.41 -1.01 0.37 2.83 0.00 0.11 -5.06 105.19 102.02 1gxh n GLY 78 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.06 0.00 1.61 5.02 -0.46 -4.84 118.16 119.43 1gxh n LYS 79 Ca 0.00 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 1gxh n LYS 79 Cb 0.49 -0.06 0.00 0.00 -0.02 0.00 0.00 35.03 35.44 1gxh n LYS 79 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1gxh n SER 80 N 1.23 0.00 -0.29 4.39 7.64 -1.26 -4.99 113.62 120.34 1gxh n SER 80 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1gxh n SER 80 Cb 0.01 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 1gxh n SER 80 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gxh n GLY 81 N -1.66 2.83 0.00 0.23 0.00 -1.26 -2.50 105.19 102.82 1gxh n GLY 81 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.41 -0.78 1.61 3.72 -1.25 -3.81 117.46 115.54 1gxh n PHE 82 Ca 0.00 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.06 1gxh n PHE 82 Cb 0.00 0.00 0.13 0.00 -0.94 0.00 0.00 39.48 38.67 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 -0.75 -0.82 -0.71 -1.08 3.00 -1.21 -4.77 118.16 111.81 1gxh n LYS 83 Ca 0.00 -0.22 -0.12 0.00 -0.00 0.00 0.00 58.31 57.98 1gxh n LYS 83 Cb 0.00 -1.61 -0.10 0.00 0.00 0.00 0.00 35.03 33.32 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 -1.02 1.57 0.00 1.64 7.27 -1.26 -4.60 117.38 120.98 1gxh n GLN 84 Ca 0.02 -0.86 0.00 0.00 0.07 0.00 0.00 57.00 56.23 1gxh n GLN 84 Cb 0.60 -1.97 0.00 0.00 2.41 0.00 0.00 30.24 31.28 1gxh n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54