#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 -2.96 -0.29 0.03 4.71 -1.26 -4.06 120.64 116.80 1gxh n GLU 2 Ca 0.00 2.07 -0.02 0.00 -0.01 0.00 0.00 57.16 59.20 1gxh n GLU 2 Cb 0.00 -3.58 -0.03 0.00 -1.01 0.00 0.00 31.44 26.82 1gxh n GLU 2 CO 0.00 0.00 0.00 1.47 0.09 0.00 0.00 177.13 178.69 1gxh n LEU 3 N -4.24 2.26 -0.43 -4.62 -0.00 -1.26 -4.80 117.00 103.91 1gxh n LEU 3 Ca -0.01 -1.26 0.06 0.00 -0.00 0.00 0.00 56.01 54.80 1gxh n LEU 3 Cb 0.66 -0.53 -0.02 0.00 -0.00 0.00 0.00 43.42 43.53 1gxh n LEU 3 CO 0.02 0.43 -0.14 0.29 -0.00 0.00 0.00 177.39 177.99 1gxh n LYS 4 N 2.17 -0.94 0.00 1.47 4.76 -1.26 -4.97 118.16 119.40 1gxh n LYS 4 Ca 0.07 0.70 0.00 0.00 -2.87 0.00 0.00 58.31 56.21 1gxh n LYS 4 Cb 0.28 -1.11 0.00 0.00 -1.84 0.00 0.00 35.03 32.36 1gxh n LYS 4 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1gxh n ASN 5 N -3.02 0.00 -3.75 4.39 2.85 -1.26 -4.96 115.26 109.50 1gxh n ASN 5 Ca -0.01 -0.76 -0.13 0.00 -0.11 0.00 0.00 54.58 53.57 1gxh n ASN 5 Cb 0.20 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.12 1gxh n ASN 5 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1gxh s SER 6 N 0.00 -0.31 0.33 1.20 0.01 -1.26 -4.91 113.70 108.75 1gxh s SER 6 Ca 0.00 0.50 0.10 0.00 1.31 0.00 0.00 55.95 57.86 1gxh s SER 6 Cb 0.00 0.58 0.99 0.00 0.21 0.00 0.00 66.02 67.80 1gxh s SER 6 CO 0.00 -0.25 1.63 0.40 0.41 0.00 0.00 173.24 175.43 1gxh h ILE 7 N 4.30 0.20 0.00 1.44 1.08 -1.90 0.16 117.51 122.80 1gxh h ILE 7 Ca -0.28 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 64.13 1gxh h ILE 7 Cb 1.18 0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.94 1gxh h ILE 7 CO 0.32 0.03 0.00 -1.54 -0.69 0.00 0.00 178.15 176.28 1gxh n SER 8 N -5.21 0.00 -0.00 1.72 3.41 -1.20 -0.49 113.62 111.85 1gxh n SER 8 Ca 0.29 -0.26 0.07 0.00 -0.26 0.00 0.00 58.87 58.71 1gxh n SER 8 Cb 0.93 -0.07 -0.09 0.00 -0.26 0.00 0.00 64.21 64.72 1gxh n SER 8 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1gxh n ASP 9 N -1.07 0.82 -3.65 4.04 2.03 0.57 -2.69 116.55 116.60 1gxh n ASP 9 Ca 0.08 -0.72 -0.41 0.00 0.52 0.00 0.00 54.79 54.27 1gxh n ASP 9 Cb 0.05 1.11 -0.00 0.00 -0.72 0.00 0.00 41.12 41.56 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 -1.45 2.74 -0.24 -0.67 4.02 0.35 -4.70 117.16 117.22 1gxh n TYR 10 Ca 0.02 -2.81 -0.09 0.00 -0.01 0.00 0.00 57.90 55.00 1gxh n TYR 10 Cb 0.25 -1.91 -0.01 0.00 -0.02 0.00 0.00 39.34 37.65 1gxh n TYR 10 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1gxh n THR 11 N 2.55 0.11 0.03 -0.72 -2.24 -1.26 -3.78 114.28 108.98 1gxh n THR 11 Ca 0.52 -0.03 0.21 0.00 -2.27 0.00 0.00 64.05 62.49 1gxh n THR 11 Cb 0.30 0.00 0.73 0.00 -2.10 0.00 0.00 70.33 69.26 1gxh n THR 11 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1gxh h GLU 12 N 0.38 0.00 0.08 -0.78 -0.00 -1.85 0.53 114.58 112.94 1gxh h GLU 12 Ca -0.07 0.00 -0.26 0.00 -0.00 0.00 0.00 59.36 59.03 1gxh h GLU 12 Cb 0.23 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 28.99 1gxh h GLU 12 CO 0.10 0.00 -1.12 1.15 -0.00 0.00 0.00 179.01 179.14 1gxh h THR 13 N 0.00 1.41 -0.66 -1.06 2.02 -1.91 -1.97 112.91 110.73 1gxh h THR 13 Ca 0.24 -2.67 0.04 0.00 0.77 0.00 0.00 66.41 64.79 1gxh h THR 13 Cb 1.10 2.68 -0.05 0.00 -1.74 0.00 0.00 68.15 70.14 1gxh h THR 13 CO -0.00 0.79 0.40 -0.33 0.37 0.00 0.00 175.52 176.75 1gxh h GLU 14 N 0.18 0.73 -0.11 6.66 5.08 -0.23 -1.05 114.58 125.84 1gxh h GLU 14 Ca -0.13 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.12 1gxh h GLU 14 Cb 1.80 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.87 1gxh h GLU 14 CO 0.20 0.49 -0.24 0.35 -1.00 0.00 0.00 179.01 178.80 1gxh h PHE 15 N 0.76 0.20 0.10 4.33 3.57 -1.29 -1.53 116.94 123.08 1gxh h PHE 15 Ca 0.28 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.75 1gxh h PHE 15 Cb 0.09 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1gxh h PHE 15 CO -0.06 0.42 -0.13 -0.22 -2.23 0.00 0.00 178.31 176.09 1gxh h LYS 16 N 0.17 -0.26 -0.89 1.11 1.63 -0.84 -1.72 116.57 115.77 1gxh h LYS 16 Ca 0.03 0.02 0.14 0.00 -0.85 0.00 0.00 60.65 59.98 1gxh h LYS 16 Cb 0.52 0.06 -0.09 0.00 -0.60 0.00 0.00 32.23 32.12 1gxh h LYS 16 CO 0.04 -0.18 0.50 -0.22 -3.45 0.00 0.00 179.45 176.14 1gxh h LYS 17 N -0.27 0.71 0.17 1.90 3.11 -0.16 0.58 116.57 122.61 1gxh h LYS 17 Ca 0.01 -0.04 -0.01 0.00 -2.81 0.00 0.00 60.65 57.80 1gxh h LYS 17 Cb 0.28 -0.16 0.00 0.00 -1.00 0.00 0.00 32.23 31.35 1gxh h LYS 17 CO -0.05 0.47 -0.08 0.97 -2.81 0.00 0.00 179.45 177.95 1gxh h ILE 18 N 0.74 0.88 0.00 2.00 2.10 -1.36 -0.76 117.51 121.10 1gxh h ILE 18 Ca 0.47 -0.17 -0.04 0.00 1.08 0.00 0.00 64.86 66.20 1gxh h ILE 18 Cb 0.60 0.98 -0.01 0.00 -1.09 0.00 0.00 36.82 37.31 1gxh h ILE 18 CO -0.33 0.04 -0.17 0.40 -1.08 0.00 0.00 178.15 177.02 1gxh h ILE 19 N -0.30 0.49 0.04 2.19 1.08 0.02 -2.45 117.51 118.58 1gxh h ILE 19 Ca -0.02 -0.87 -0.05 0.00 -0.39 0.00 0.00 64.86 63.53 1gxh h ILE 19 Cb 0.24 1.60 0.01 0.00 -3.07 0.00 0.00 36.82 35.59 1gxh h ILE 19 CO 0.04 0.17 -0.24 -0.08 -0.69 0.00 0.00 178.15 177.35 1gxh h GLU 20 N 0.00 0.10 -0.77 2.37 4.81 0.04 -2.94 114.58 118.19 1gxh h GLU 20 Ca -0.00 -0.15 0.13 0.00 -0.13 0.00 0.00 59.36 59.21 1gxh h GLU 20 Cb 0.58 0.05 -0.14 0.00 0.63 0.00 0.00 28.75 29.88 1gxh h GLU 20 CO 0.02 1.04 -0.32 0.22 -0.73 0.00 0.00 179.01 179.25 1gxh h ASP 21 N -0.77 -1.15 0.66 1.04 1.82 -0.65 -0.11 116.42 117.26 1gxh h ASP 21 Ca -0.04 0.26 -0.03 0.00 -0.39 0.00 0.00 57.03 56.82 1gxh h ASP 21 Cb 1.16 0.61 0.01 0.00 0.68 0.00 0.00 39.33 41.79 1gxh h ASP 21 CO 0.04 -0.29 -0.32 0.16 -1.61 0.00 0.00 179.24 177.23 1gxh h ILE 22 N -0.08 0.00 -0.74 2.25 3.07 -1.66 -0.25 117.51 120.10 1gxh h ILE 22 Ca 0.30 -0.06 0.13 0.00 1.55 0.00 0.00 64.86 66.79 1gxh h ILE 22 Cb 0.58 0.00 -0.05 0.00 -0.27 0.00 0.00 36.82 37.08 1gxh h ILE 22 CO -0.81 0.00 0.49 0.40 -1.05 0.00 0.00 178.15 177.18 1gxh h ILE 23 N -0.94 0.83 -0.14 0.16 1.08 -1.19 0.37 117.51 117.69 1gxh h ILE 23 Ca -0.09 -0.16 -0.15 0.00 -0.39 0.00 0.00 64.86 64.07 1gxh h ILE 23 Cb 0.68 0.32 0.01 0.00 -3.07 0.00 0.00 36.82 34.76 1gxh h ILE 23 CO 0.15 0.09 -0.49 0.78 -0.69 0.00 0.00 178.15 177.98 1gxh h ASN 24 N 0.47 0.67 -1.67 1.72 2.35 -1.11 -3.49 115.58 114.52 1gxh h ASN 24 Ca 0.36 -0.61 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 1gxh h ASN 24 Cb 0.74 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.91 1gxh h ASN 24 CO -0.12 1.17 0.00 0.00 -1.65 0.00 0.00 177.43 176.83 1gxh n GLU 26 N -0.83 2.15 0.00 0.00 2.13 -0.24 -4.50 120.64 119.34 1gxh n GLU 26 Ca 0.00 -1.27 0.00 0.00 0.66 0.00 0.00 57.16 56.55 1gxh n GLU 26 Cb 0.30 -2.24 0.00 0.00 0.27 0.00 0.00 31.44 29.78 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 3.15 -0.21 3.49 8.31 0.00 -1.26 -5.05 105.19 113.61 1gxh n GLY 27 Ca 0.46 0.17 -0.11 0.00 0.00 0.00 0.00 46.02 46.54 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 -2.23 -0.52 0.23 1.61 2.15 -1.26 -5.07 116.67 111.58 1gxh s ASP 28 Ca 0.00 -0.09 -0.06 0.00 0.43 0.00 0.00 52.55 52.83 1gxh s ASP 28 Cb 0.00 0.61 0.23 0.00 -0.30 0.00 0.00 42.92 43.46 1gxh s ASP 28 CO 0.00 -1.02 1.76 1.05 -0.17 0.00 0.00 175.17 176.79 1gxh h GLU 29 N 2.00 1.04 -0.23 4.34 4.11 -1.99 -3.21 114.58 120.63 1gxh h GLU 29 Ca -0.32 -0.23 -0.06 0.00 0.07 0.00 0.00 59.36 58.83 1gxh h GLU 29 Cb 1.30 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1gxh h GLU 29 CO 0.36 0.91 -0.11 0.87 0.07 0.00 0.00 179.01 181.10 1gxh h LYS 30 N 0.99 0.38 -0.75 1.06 1.79 -1.98 0.18 116.57 118.24 1gxh h LYS 30 Ca 0.21 -0.09 0.07 0.00 -2.18 0.00 0.00 60.65 58.66 1gxh h LYS 30 Cb 0.33 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 30.87 1gxh h LYS 30 CO -0.00 0.50 0.43 -0.22 -1.08 0.00 0.00 179.45 179.07 1gxh h LYS 31 N 0.36 0.75 -0.24 3.15 3.64 -1.98 0.12 116.57 122.37 1gxh h LYS 31 Ca 0.07 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.24 1gxh h LYS 31 Cb 0.42 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1gxh h LYS 31 CO 0.02 0.50 -0.52 1.96 -2.27 0.00 0.00 179.45 179.14 1gxh h GLN 32 N 0.77 0.67 -0.89 1.90 4.20 -1.11 -2.17 115.11 118.49 1gxh h GLN 32 Ca 0.34 -0.41 0.01 0.00 0.06 0.00 0.00 58.65 58.65 1gxh h GLN 32 Cb 0.22 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.00 1gxh h GLN 32 CO -0.20 1.03 0.58 0.22 -0.67 0.00 0.00 178.83 179.80 1gxh h ASP 33 N 0.53 1.00 -0.13 1.46 3.58 -0.58 0.26 116.42 122.54 1gxh h ASP 33 Ca 0.02 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.42 1gxh h ASP 33 Cb 1.08 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.88 1gxh h ASP 33 CO 0.10 0.72 -0.01 -0.78 -2.88 0.00 0.00 179.24 176.39 1gxh h ASP 34 N 1.18 0.24 -0.82 2.28 3.58 -0.72 -1.24 116.42 120.92 1gxh h ASP 34 Ca 0.33 -0.32 0.13 0.00 0.42 0.00 0.00 57.03 57.58 1gxh h ASP 34 Cb -0.10 -0.06 -0.09 0.00 1.72 0.00 0.00 39.33 40.80 1gxh h ASP 34 CO -0.08 0.50 0.43 -1.13 -2.88 0.00 0.00 179.24 176.08 1gxh h ASN 35 N -0.04 0.54 -0.37 2.28 -1.24 -1.17 -2.87 115.58 112.72 1gxh h ASN 35 Ca 0.04 0.08 -0.10 0.00 0.71 0.00 0.00 56.30 57.03 1gxh h ASN 35 Cb 0.39 -0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.41 1gxh h ASN 35 CO 0.01 0.26 -0.15 -0.07 -1.29 0.00 0.00 177.43 176.19 1gxh h LEU 36 N 0.65 0.77 -0.07 0.34 3.38 0.71 0.48 115.31 121.58 1gxh h LEU 36 Ca 0.43 -0.39 0.03 0.00 0.09 0.00 0.00 57.88 58.04 1gxh h LEU 36 Cb 0.54 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 1gxh h LEU 36 CO -0.32 0.99 -0.14 -0.08 0.09 0.00 0.00 178.44 178.98 1gxh h GLU 37 N 0.55 -0.20 -0.60 1.13 4.22 -1.51 -2.47 114.58 115.70 1gxh h GLU 37 Ca 0.09 0.01 0.04 0.00 0.08 0.00 0.00 59.36 59.58 1gxh h GLU 37 Cb 0.69 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 1gxh h GLU 37 CO 0.05 -0.13 0.34 1.25 -2.18 0.00 0.00 179.01 178.34 1gxh h HIS 38 N -0.20 0.64 0.00 0.92 2.76 -0.91 0.22 115.15 118.57 1gxh h HIS 38 Ca 0.07 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.26 1gxh h HIS 38 Cb 0.30 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.06 1gxh h HIS 38 CO -0.23 0.34 0.00 0.35 -1.30 0.00 0.00 177.93 177.08 1gxh h PHE 39 N 0.66 0.00 0.12 5.26 3.57 -0.03 0.63 116.94 127.16 1gxh h PHE 39 Ca 0.26 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 1gxh h PHE 39 Cb 0.10 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.84 1gxh h PHE 39 CO -0.07 0.00 -0.06 0.82 -2.23 0.00 0.00 178.31 176.77 1gxh h ILE 40 N 0.00 0.46 0.43 1.41 5.03 -0.51 -3.39 117.51 120.94 1gxh h ILE 40 Ca 0.00 -1.14 -0.01 0.00 -0.12 0.00 0.00 64.86 63.58 1gxh h ILE 40 Cb 0.25 0.82 -0.01 0.00 -3.03 0.00 0.00 36.82 34.85 1gxh h ILE 40 CO 0.00 0.14 -0.38 -1.28 -0.68 0.00 0.00 178.15 175.95 1gxh h SER 41 N -1.00 -1.04 -0.17 1.72 0.87 0.16 0.25 113.55 114.34 1gxh h SER 41 Ca -0.02 0.08 -0.10 0.00 -1.23 0.00 0.00 61.79 60.52 1gxh h SER 41 Cb 0.35 0.33 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 1gxh h SER 41 CO 0.03 -0.52 -0.21 -0.37 -0.53 0.00 0.00 176.83 175.22 1gxh h VAL 42 N -0.80 1.26 -0.25 2.23 -1.51 -1.50 -3.25 116.25 112.42 1gxh h VAL 42 Ca -0.05 -1.26 -0.16 0.00 -1.23 0.00 0.00 66.70 64.00 1gxh h VAL 42 Cb 0.68 1.25 -0.01 0.00 -2.13 0.00 0.00 31.29 31.09 1gxh h VAL 42 CO -0.02 0.41 -0.49 0.74 -1.23 0.00 0.00 177.57 176.97 1gxh h THR 43 N 0.54 1.30 0.00 7.19 2.02 -1.60 -3.32 112.91 119.03 1gxh h THR 43 Ca 0.08 -1.70 0.00 0.00 0.77 0.00 0.00 66.41 65.56 1gxh h THR 43 Cb 0.66 1.63 0.00 0.00 -1.74 0.00 0.00 68.15 68.70 1gxh h THR 43 CO 0.05 0.54 0.00 1.21 0.37 0.00 0.00 175.52 177.69 1gxh n GLU 44 N -4.00 -0.44 -2.26 6.66 2.13 0.03 -4.94 120.64 117.82 1gxh n GLU 44 Ca -0.03 0.11 -0.43 0.00 0.66 0.00 0.00 57.16 57.47 1gxh n GLU 44 Cb 0.58 -4.27 -0.02 0.00 0.27 0.00 0.00 31.44 28.00 1gxh n GLU 44 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1gxh s HIS 45 N -1.45 2.37 0.23 4.31 2.46 -1.26 -4.91 115.29 117.03 1gxh s HIS 45 Ca 0.00 0.69 -0.07 0.00 0.47 0.00 0.00 55.06 56.15 1gxh s HIS 45 Cb 0.00 -3.97 0.26 0.00 -0.13 0.00 0.00 32.58 28.74 1gxh s HIS 45 CO 0.00 -2.36 1.87 -1.00 -2.47 0.00 0.00 174.74 170.78 1gxh h PRO 46 N 10.14 0.97 -0.87 2.88 0.13 -1.93 -0.37 132.00 142.96 1gxh h PRO 46 Ca -0.30 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1gxh h PRO 46 Cb 1.13 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1gxh h PRO 46 CO 1.02 0.65 0.00 0.43 -0.23 0.00 0.00 178.00 179.86 1gxh n SER 47 N -4.59 0.87 -4.52 1.44 7.64 -1.26 -4.89 113.62 108.31 1gxh n SER 47 Ca 0.10 -1.83 -0.54 0.00 1.01 0.00 0.00 58.87 57.61 1gxh n SER 47 Cb 0.11 -0.43 -0.08 0.00 -1.01 0.00 0.00 64.21 62.79 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 0.06 0.57 0.00 0.23 0.00 -0.15 -1.02 105.19 104.89 1gxh n GLY 48 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 46.02 46.98 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 7.93 0.00 0.07 1.61 2.88 -1.26 -4.87 113.62 119.98 1gxh n SER 49 Ca 0.37 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.91 1gxh n SER 49 Cb 0.16 0.00 0.28 0.00 -0.75 0.00 0.00 64.21 63.91 1gxh n SER 49 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1gxh h ASP 50 N 0.00 0.34 0.92 -3.46 3.32 -1.46 -0.12 116.42 115.96 1gxh h ASP 50 Ca 0.00 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1gxh h ASP 50 Cb 0.00 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.46 1gxh h ASP 50 CO 0.00 0.57 0.00 0.18 -1.72 0.00 0.00 179.24 178.27 1gxh n LEU 51 N -4.17 0.49 -0.12 1.55 7.99 -1.24 -0.44 117.00 121.06 1gxh n LEU 51 Ca -0.00 0.59 -0.26 0.00 -0.01 0.00 0.00 56.01 56.32 1gxh n LEU 51 Cb 0.35 -0.48 -0.11 0.00 -0.11 0.00 0.00 43.42 43.07 1gxh n LEU 51 CO 0.40 -0.33 -1.04 -0.38 -1.51 0.00 0.00 177.39 174.53 1gxh n ILE 52 N -2.01 1.53 -0.03 -0.08 5.41 -0.80 -4.55 119.36 118.84 1gxh n ILE 52 Ca 0.04 -0.23 -0.12 0.00 1.00 0.00 0.00 62.75 63.44 1gxh n ILE 52 Cb 0.29 -1.95 -0.14 0.00 -0.71 0.00 0.00 39.64 37.13 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 -4.32 0.93 -2.76 1.39 4.01 -0.12 -4.52 117.16 111.77 1gxh n TYR 53 Ca -0.45 0.29 -0.23 0.00 -0.16 0.00 0.00 57.90 57.36 1gxh n TYR 53 Cb 0.80 -1.16 -0.01 0.00 -0.31 0.00 0.00 39.34 38.66 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 -3.12 2.84 -2.58 -0.72 4.01 0.42 -5.06 117.16 112.95 1gxh n TYR 54 Ca -0.23 -3.45 -0.35 0.00 -0.16 0.00 0.00 57.90 53.71 1gxh n TYR 54 Cb 1.06 -0.31 -0.04 0.00 -0.31 0.00 0.00 39.34 39.74 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 -3.30 3.95 0.26 -0.72 0.04 -1.23 -4.74 135.00 129.25 1gxh s PRO 55 Ca 0.44 1.37 0.01 0.00 0.04 0.00 0.00 61.00 62.86 1gxh s PRO 55 Cb 0.36 -2.23 -0.05 0.00 0.04 0.00 0.00 34.50 32.63 1gxh s PRO 55 CO -0.12 -0.30 0.11 -1.21 0.04 0.00 0.00 177.00 175.51 1gxh s GLU 56 N -3.02 1.41 2.77 4.56 2.02 -1.26 -4.97 118.70 120.21 1gxh s GLU 56 Ca 0.64 -1.77 0.00 0.00 0.02 0.00 0.00 54.97 53.86 1gxh s GLU 56 Cb -0.17 -0.18 0.00 0.00 0.10 0.00 0.00 34.13 33.88 1gxh s GLU 56 CO 0.21 -0.33 0.00 0.41 0.02 0.00 0.00 175.26 175.58 1gxh n GLY 57 N -0.46 -0.04 1.28 -1.39 0.00 -1.26 -2.24 105.19 101.08 1gxh n GLY 57 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.54 4.09 -3.63 1.61 4.13 -1.26 -4.53 115.26 114.14 1gxh n ASN 58 Ca 0.00 -2.16 -0.41 0.00 1.68 0.00 0.00 54.58 53.69 1gxh n ASN 58 Cb 0.00 -0.80 -0.03 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 1.05 3.64 0.00 6.41 5.15 -0.95 -2.99 115.26 127.57 1gxh n ASN 59 Ca 0.00 -2.73 0.00 0.00 -0.60 0.00 0.00 54.58 51.25 1gxh n ASN 59 Cb 0.48 -1.40 0.00 0.00 -0.53 0.00 0.00 39.78 38.33 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 6.42 0.00 0.08 1.20 5.75 -1.26 -4.55 116.55 124.19 1gxh n ASP 60 Ca 0.52 0.00 -0.10 0.00 -0.01 0.00 0.00 54.79 55.21 1gxh n ASP 60 Cb 0.37 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.35 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 0.10 -3.69 6.12 0.00 -1.93 -3.47 103.07 100.20 1gxh h GLY 61 Ca 0.00 -0.25 0.21 0.00 0.00 0.00 0.00 47.33 47.29 1gxh h GLY 61 CO 0.00 0.22 0.72 -0.45 0.00 0.00 0.00 176.54 177.03 1gxh s SER 62 N -6.85 -0.20 0.18 0.19 0.15 -1.26 -5.01 113.70 100.90 1gxh s SER 62 Ca -0.01 0.01 0.11 0.00 0.70 0.00 0.00 55.95 56.77 1gxh s SER 62 Cb 0.09 0.21 0.62 0.00 -1.71 0.00 0.00 66.02 65.23 1gxh s SER 62 CO 0.84 -0.33 1.32 -0.81 1.20 0.00 0.00 173.24 175.46 1gxh n PRO 63 N -0.10 0.07 0.28 5.44 -0.04 -1.26 -0.97 135.00 138.42 1gxh n PRO 63 Ca -0.02 0.56 0.11 0.00 -0.04 0.00 0.00 63.50 64.10 1gxh n PRO 63 Cb 0.59 -1.79 0.76 0.00 -0.04 0.00 0.00 33.50 33.02 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 0.00 0.00 0.54 4.39 -1.97 -0.15 114.58 117.39 1gxh h GLU 64 Ca 0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1gxh h GLU 64 Cb 0.09 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 1gxh h GLU 64 CO 0.00 0.00 -0.19 0.00 -1.16 0.00 0.00 179.01 177.66 1gxh h ALA 65 N 2.00 1.46 0.18 3.43 0.00 -1.38 0.51 119.26 125.46 1gxh h ALA 65 Ca 0.00 -0.18 -0.32 0.00 0.00 0.00 0.00 54.91 54.42 1gxh h ALA 65 Cb 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1gxh h ALA 65 CO -0.00 0.24 -1.54 0.28 0.00 0.00 0.00 179.25 178.23 1gxh h VAL 66 N 0.00 1.07 -0.33 0.00 2.07 -1.27 -2.81 116.25 114.98 1gxh h VAL 66 Ca -0.00 -2.52 -0.06 0.00 0.82 0.00 0.00 66.70 64.94 1gxh h VAL 66 Cb 0.40 2.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.99 1gxh h VAL 66 CO 0.03 0.80 -0.04 0.40 0.02 0.00 0.00 177.57 178.78 1gxh h ILE 67 N -0.03 1.21 -0.12 4.57 5.03 -0.97 0.78 117.51 127.99 1gxh h ILE 67 Ca -0.30 -0.87 0.01 0.00 -0.12 0.00 0.00 64.86 63.58 1gxh h ILE 67 Cb 1.99 1.00 -0.02 0.00 -3.03 0.00 0.00 36.82 36.76 1gxh h ILE 67 CO 0.16 0.29 -0.15 0.11 -0.68 0.00 0.00 178.15 177.89 1gxh h LYS 68 N 0.51 -0.10 -0.14 2.37 1.57 -0.09 0.32 116.57 121.01 1gxh h LYS 68 Ca 0.10 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.93 1gxh h LYS 68 Cb 0.39 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1gxh h LYS 68 CO 0.02 -0.07 0.19 0.93 -0.57 0.00 0.00 179.45 179.95 1gxh h GLU 69 N -0.10 0.00 0.12 3.15 4.39 -0.66 0.46 114.58 121.94 1gxh h GLU 69 Ca 0.02 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 1gxh h GLU 69 Cb 0.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1gxh h GLU 69 CO -0.16 0.00 -0.06 0.82 -1.16 0.00 0.00 179.01 178.45 1gxh h ILE 70 N 0.00 0.14 -0.71 3.13 5.03 -0.59 0.20 117.51 124.71 1gxh h ILE 70 Ca 0.07 -0.97 0.15 0.00 -0.12 0.00 0.00 64.86 63.99 1gxh h ILE 70 Cb 0.45 0.25 -0.13 0.00 -3.03 0.00 0.00 36.82 34.37 1gxh h ILE 70 CO -0.00 0.04 -0.08 0.11 -0.68 0.00 0.00 178.15 177.55 1gxh h LYS 71 N -1.03 0.05 0.08 2.37 1.57 0.12 0.94 116.57 120.67 1gxh h LYS 71 Ca -0.02 -0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.62 1gxh h LYS 71 Cb 0.20 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.50 1gxh h LYS 71 CO 0.03 0.03 -0.66 0.93 -0.57 0.00 0.00 179.45 179.21 1gxh h GLU 72 N 0.05 0.16 -0.31 3.15 4.39 -0.23 -0.55 114.58 121.25 1gxh h GLU 72 Ca 0.37 -0.27 0.07 0.00 0.34 0.00 0.00 59.36 59.86 1gxh h GLU 72 Cb 0.61 0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 29.30 1gxh h GLU 72 CO -0.68 1.13 -0.12 2.35 -1.16 0.00 0.00 179.01 180.54 1gxh h TRP 73 N -0.63 -0.28 0.09 4.33 7.01 -0.91 0.96 115.95 126.52 1gxh h TRP 73 Ca -0.14 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 60.89 1gxh h TRP 73 Cb 1.41 0.17 0.00 0.00 -2.10 0.00 0.00 29.16 28.64 1gxh h TRP 73 CO 0.21 -0.19 -0.05 0.00 -2.79 0.00 0.00 178.44 175.62 1gxh h ARG 74 N -0.06 -0.12 -0.33 2.65 2.47 -0.76 -0.50 114.38 117.72 1gxh h ARG 74 Ca 0.16 0.01 -0.11 0.00 -1.26 0.00 0.00 59.98 58.77 1gxh h ARG 74 Cb 0.30 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.64 1gxh h ARG 74 CO -0.36 -0.05 -0.26 0.00 0.56 0.00 0.00 179.97 179.87 1gxh h ALA 75 N 0.74 0.93 -0.32 0.04 0.00 -0.85 0.20 119.26 120.00 1gxh h ALA 75 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1gxh h ALA 75 Cb 0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1gxh h ALA 75 CO 0.02 0.61 0.20 0.00 0.00 0.00 0.00 179.25 180.09 1gxh h ALA 76 N 1.13 0.41 0.00 0.00 0.00 -0.64 -1.11 119.26 119.05 1gxh h ALA 76 Ca 0.08 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1gxh h ALA 76 Cb 0.74 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1gxh h ALA 76 CO 0.06 -0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.29 1gxh n ASN 77 N -4.84 0.00 -1.42 0.00 3.02 -0.21 -4.88 115.26 106.92 1gxh n ASN 77 Ca -0.01 -1.00 -0.13 0.00 -0.03 0.00 0.00 54.58 53.41 1gxh n ASN 77 Cb 0.04 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.20 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 0.29 0.04 3.98 7.41 0.00 -0.42 -5.02 105.19 111.48 1gxh n GLY 78 Ca 0.09 -0.35 -0.22 0.00 0.00 0.00 0.00 46.02 45.54 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 -4.44 2.19 0.27 1.61 -0.14 0.62 -4.99 119.74 114.86 1gxh s LYS 79 Ca 0.00 -0.95 -0.29 0.00 -1.36 0.00 0.00 55.97 53.36 1gxh s LYS 79 Cb 0.00 -2.43 -0.10 0.00 -1.68 0.00 0.00 37.83 33.62 1gxh s LYS 79 CO 0.00 -1.01 1.27 -1.54 -0.76 0.00 0.00 175.35 173.31 1gxh s SER 80 N -4.56 6.91 0.28 2.83 1.04 -1.26 -4.47 113.70 114.47 1gxh s SER 80 Ca 0.61 2.51 0.00 0.00 0.48 0.00 0.00 55.95 59.55 1gxh s SER 80 Cb -0.08 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.41 1gxh s SER 80 CO 0.41 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 174.78 1gxh n GLY 81 N 1.44 -1.13 0.00 7.32 0.00 -1.26 -4.79 105.19 106.76 1gxh n GLY 81 Ca 0.02 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.44 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 -0.66 -1.13 -0.90 1.61 3.72 -1.25 -3.27 117.46 115.58 1gxh n PHE 82 Ca 0.00 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.04 1gxh n PHE 82 Cb 0.00 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.62 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 -0.38 -0.37 -1.95 -1.08 3.00 -1.10 -4.67 118.16 111.61 1gxh n LYS 83 Ca 0.00 -0.10 -0.42 0.00 -0.00 0.00 0.00 58.31 57.79 1gxh n LYS 83 Cb 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 35.03 33.73 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 0.78 3.15 0.00 1.64 7.27 -1.26 -4.73 117.38 124.23 1gxh n GLN 84 Ca 0.00 -2.95 0.00 0.00 0.07 0.00 0.00 57.00 54.13 1gxh n GLN 84 Cb 0.62 -3.15 0.00 0.00 2.41 0.00 0.00 30.24 30.13 1gxh n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54