#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 1.33 1.25 2.12 8.01 -1.26 -5.14 118.70 125.01 1gxh s GLU 2 Ca 0.00 -1.12 -0.16 0.00 0.01 0.00 0.00 54.97 53.70 1gxh s GLU 2 Cb 0.00 -1.58 0.31 0.00 -4.31 0.00 0.00 34.13 28.56 1gxh s GLU 2 CO 0.00 0.38 1.00 -0.51 0.01 0.00 0.00 175.26 176.14 1gxh s LEU 3 N -1.63 0.19 0.22 1.80 1.43 -1.26 -4.93 118.68 114.49 1gxh s LEU 3 Ca 0.09 1.28 -0.32 0.00 -1.03 0.00 0.00 54.13 54.15 1gxh s LEU 3 Cb -0.10 -3.03 -0.12 0.00 0.03 0.00 0.00 46.19 42.97 1gxh s LEU 3 CO 0.04 -4.58 1.71 0.29 0.23 0.00 0.00 176.35 174.03 1gxh n LYS 4 N -5.15 2.75 0.00 1.70 4.76 -1.26 -4.87 118.16 116.09 1gxh n LYS 4 Ca 0.05 0.99 0.11 0.00 -2.87 0.00 0.00 58.31 56.60 1gxh n LYS 4 Cb 0.56 -2.83 0.55 0.00 -1.84 0.00 0.00 35.03 31.47 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 3.76 0.00 -3.64 4.39 4.05 -1.26 -4.82 115.26 117.74 1gxh n ASN 5 Ca 0.15 0.21 -0.10 0.00 0.45 0.00 0.00 54.58 55.29 1gxh n ASN 5 Cb 0.35 -0.39 -0.03 0.00 1.23 0.00 0.00 39.78 40.94 1gxh n ASN 5 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 177.26 173.77 1gxh s SER 6 N -2.78 -0.35 0.38 1.20 0.01 -1.26 -4.89 113.70 106.01 1gxh s SER 6 Ca 0.17 -0.32 0.13 0.00 1.31 0.00 0.00 55.95 57.23 1gxh s SER 6 Cb 0.15 0.59 0.94 0.00 0.21 0.00 0.00 66.02 67.91 1gxh s SER 6 CO 0.39 -1.03 1.85 0.40 0.41 0.00 0.00 173.24 175.26 1gxh h ILE 7 N 2.14 0.74 0.00 1.44 1.08 -1.85 0.20 117.51 121.26 1gxh h ILE 7 Ca -0.30 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 63.98 1gxh h ILE 7 Cb 1.27 0.13 0.00 0.00 -3.07 0.00 0.00 36.82 35.15 1gxh h ILE 7 CO 0.37 0.10 -0.45 -1.20 -0.69 0.00 0.00 178.15 176.28 1gxh n SER 8 N -4.57 0.49 0.09 1.72 7.64 -1.24 -2.16 113.62 115.60 1gxh n SER 8 Ca 0.19 -0.01 -0.06 0.00 1.01 0.00 0.00 58.87 60.00 1gxh n SER 8 Cb 0.60 0.09 -0.02 0.00 -1.01 0.00 0.00 64.21 63.87 1gxh n SER 8 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1gxh h ASP 9 N 0.00 0.08 -3.78 6.43 3.58 -1.56 -3.39 116.42 117.78 1gxh h ASP 9 Ca 0.00 -0.07 -0.47 0.00 0.42 0.00 0.00 57.03 56.91 1gxh h ASP 9 Cb 0.58 -0.03 0.18 0.00 1.72 0.00 0.00 39.33 41.78 1gxh h ASP 9 CO 0.00 0.92 0.15 -0.31 -2.88 0.00 0.00 179.24 177.12 1gxh s TYR 10 N -3.06 1.82 0.32 0.28 2.02 -0.06 -4.92 117.35 113.74 1gxh s TYR 10 Ca -0.01 1.28 0.10 0.00 -0.37 0.00 0.00 57.07 58.07 1gxh s TYR 10 Cb 0.11 -3.18 -0.05 0.00 -0.40 0.00 0.00 41.96 38.43 1gxh s TYR 10 CO 0.81 -3.08 -0.04 0.95 -1.57 0.00 0.00 175.55 172.62 1gxh s THR 11 N -2.72 2.65 0.49 -0.71 -4.23 -1.26 -2.11 115.64 107.75 1gxh s THR 11 Ca 0.66 -2.07 0.18 0.00 -1.18 0.00 0.00 61.69 59.28 1gxh s THR 11 Cb -0.21 -2.70 0.25 0.00 1.34 0.00 0.00 72.50 71.17 1gxh s THR 11 CO 0.60 -0.26 2.09 -0.08 -0.54 0.00 0.00 174.62 176.44 1gxh h GLU 12 N 1.92 0.00 0.00 3.99 4.81 -1.91 -0.93 114.58 122.46 1gxh h GLU 12 Ca -0.42 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.54 1gxh h GLU 12 Cb 1.25 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 1gxh h GLU 12 CO 0.65 0.09 -2.15 2.41 -0.73 0.00 0.00 179.01 179.28 1gxh n THR 13 N -4.26 1.10 -0.29 0.32 -1.04 -1.26 -2.32 114.28 106.53 1gxh n THR 13 Ca -0.03 -0.76 -0.06 0.00 -2.04 0.00 0.00 64.05 61.16 1gxh n THR 13 Cb 0.17 -0.44 0.06 0.00 -1.82 0.00 0.00 70.33 68.30 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 1.17 -0.62 -2.82 5.08 -1.94 -0.56 114.58 114.89 1gxh h GLU 14 Ca -0.38 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 57.71 1gxh h GLU 14 Cb 1.91 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 30.94 1gxh h GLU 14 CO 0.03 0.95 0.14 0.35 -1.00 0.00 0.00 179.01 179.48 1gxh h PHE 15 N 1.14 1.03 -0.45 4.33 3.57 -1.26 -0.88 116.94 124.43 1gxh h PHE 15 Ca 0.26 -0.11 0.08 0.00 3.53 0.00 0.00 57.97 61.73 1gxh h PHE 15 Cb 0.22 -0.29 -0.07 0.00 2.79 0.00 0.00 35.95 38.60 1gxh h PHE 15 CO 0.02 0.85 0.05 -0.22 -2.23 0.00 0.00 178.31 176.78 1gxh h LYS 16 N 0.94 0.17 -0.70 1.11 1.63 -1.03 -1.16 116.57 117.53 1gxh h LYS 16 Ca 0.20 -0.01 0.14 0.00 -0.85 0.00 0.00 60.65 60.13 1gxh h LYS 16 Cb 0.35 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.90 1gxh h LYS 16 CO 0.00 0.11 0.47 -0.22 -3.45 0.00 0.00 179.45 176.36 1gxh h LYS 17 N 0.17 0.35 -0.10 1.90 3.11 0.33 0.60 116.57 122.95 1gxh h LYS 17 Ca 0.22 -0.02 -0.11 0.00 -2.81 0.00 0.00 60.65 57.93 1gxh h LYS 17 Cb 0.30 -0.08 0.00 0.00 -1.00 0.00 0.00 32.23 31.45 1gxh h LYS 17 CO -0.32 0.23 -0.35 0.97 -2.81 0.00 0.00 179.45 177.17 1gxh h ILE 18 N 0.36 1.39 -0.10 2.00 2.10 -1.01 -2.24 117.51 120.02 1gxh h ILE 18 Ca 0.34 -1.69 -0.12 0.00 1.08 0.00 0.00 64.86 64.46 1gxh h ILE 18 Cb 0.81 2.19 -0.01 0.00 -1.09 0.00 0.00 36.82 38.72 1gxh h ILE 18 CO -0.09 0.50 -0.48 0.40 -1.08 0.00 0.00 178.15 177.39 1gxh h ILE 19 N -0.02 1.34 0.22 2.19 1.08 0.10 -2.84 117.51 119.57 1gxh h ILE 19 Ca -0.02 -1.70 -0.34 0.00 -0.39 0.00 0.00 64.86 62.41 1gxh h ILE 19 Cb 0.98 1.80 0.02 0.00 -3.07 0.00 0.00 36.82 36.56 1gxh h ILE 19 CO 0.07 0.51 -1.59 -0.33 -0.69 0.00 0.00 178.15 176.12 1gxh h GLU 20 N 0.21 0.46 -0.57 2.37 5.08 0.02 -2.97 114.58 119.18 1gxh h GLU 20 Ca 0.01 -0.78 0.10 0.00 -1.00 0.00 0.00 59.36 57.69 1gxh h GLU 20 Cb 0.93 0.29 -0.11 0.00 0.50 0.00 0.00 28.75 30.36 1gxh h GLU 20 CO 0.08 1.37 -0.33 0.22 -1.00 0.00 0.00 179.01 179.35 1gxh h ASP 21 N 0.12 -1.13 0.85 1.42 1.82 -1.35 -0.44 116.42 117.72 1gxh h ASP 21 Ca -0.29 0.22 -0.04 0.00 -0.39 0.00 0.00 57.03 56.53 1gxh h ASP 21 Cb 2.13 0.56 0.01 0.00 0.68 0.00 0.00 39.33 42.71 1gxh h ASP 21 CO 0.23 -0.30 -0.41 0.16 -1.61 0.00 0.00 179.24 177.31 1gxh h ILE 22 N -0.17 0.10 -0.88 2.25 3.07 -1.61 0.15 117.51 120.42 1gxh h ILE 22 Ca 0.23 -0.09 0.05 0.00 1.55 0.00 0.00 64.86 66.60 1gxh h ILE 22 Cb 0.55 0.11 -0.06 0.00 -0.27 0.00 0.00 36.82 37.15 1gxh h ILE 22 CO -0.66 0.00 0.58 0.40 -1.05 0.00 0.00 178.15 177.42 1gxh h ILE 23 N -1.22 1.09 0.37 0.16 2.04 -1.31 -2.01 117.51 116.63 1gxh h ILE 23 Ca -0.12 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 1gxh h ILE 23 Cb 0.88 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1gxh h ILE 23 CO 0.19 0.19 -0.18 0.78 0.00 0.00 0.00 178.15 179.13 1gxh h ASN 24 N 1.03 -0.42 0.00 1.72 2.35 -1.14 -3.49 115.58 115.63 1gxh h ASN 24 Ca 0.37 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1gxh h ASN 24 Cb 0.14 0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.62 1gxh h ASN 24 CO -0.13 -0.11 0.00 0.00 -1.65 0.00 0.00 177.43 175.55 1gxh n GLU 26 N 0.00 1.74 -0.76 0.00 2.13 0.38 -4.79 120.64 119.34 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 0.00 -2.35 0.00 0.00 0.27 0.00 0.00 31.44 29.36 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 3.73 1.99 0.38 8.31 0.00 -1.26 -4.87 105.19 113.47 1gxh n GLY 27 Ca 0.37 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.50 0.00 0.00 1.61 2.03 -1.26 -4.96 116.55 113.47 1gxh n ASP 28 Ca 0.00 -1.53 0.00 0.00 0.52 0.00 0.00 54.79 53.78 1gxh n ASP 28 Cb 0.00 -0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.29 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 0.00 0.00 0.14 -0.67 1.02 -1.26 -4.56 120.64 115.31 1gxh n GLU 29 Ca 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1gxh n GLU 29 Cb 0.61 -0.23 0.27 0.00 -0.02 0.00 0.00 31.44 32.06 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 0.10 -0.27 3.49 1.79 -1.98 0.68 116.57 120.38 1gxh h LYS 30 Ca 0.00 -0.05 -0.05 0.00 -2.18 0.00 0.00 60.65 58.38 1gxh h LYS 30 Cb 0.00 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.63 1gxh h LYS 30 CO 0.00 0.52 -0.04 -0.22 -1.08 0.00 0.00 179.45 178.63 1gxh h LYS 31 N 0.08 0.41 0.17 3.15 3.11 -1.91 -0.78 116.57 120.80 1gxh h LYS 31 Ca 0.00 -0.09 -0.34 0.00 -2.81 0.00 0.00 60.65 57.42 1gxh h LYS 31 Cb 0.81 -0.06 0.01 0.00 -1.00 0.00 0.00 32.23 31.99 1gxh h LYS 31 CO 0.06 0.47 -1.68 1.96 -2.81 0.00 0.00 179.45 177.45 1gxh h GLN 32 N 0.40 0.37 -0.97 1.90 4.20 -1.36 -2.00 115.11 117.65 1gxh h GLN 32 Ca 0.09 -0.63 0.08 0.00 0.06 0.00 0.00 58.65 58.25 1gxh h GLN 32 Cb 0.32 0.24 -0.07 0.00 0.30 0.00 0.00 27.48 28.27 1gxh h GLN 32 CO 0.01 1.27 0.61 0.22 -0.67 0.00 0.00 178.83 180.28 1gxh h ASP 33 N 0.10 0.94 -0.05 1.46 3.58 -0.98 -0.24 116.42 121.23 1gxh h ASP 33 Ca -0.32 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.16 1gxh h ASP 33 Cb 2.09 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 42.97 1gxh h ASP 33 CO 0.18 0.57 0.03 -0.78 -2.88 0.00 0.00 179.24 176.35 1gxh h ASP 34 N 1.05 0.06 -0.59 2.28 1.82 -1.05 -0.18 116.42 119.81 1gxh h ASP 34 Ca 0.44 -0.07 0.09 0.00 -0.39 0.00 0.00 57.03 57.10 1gxh h ASP 34 Cb 0.29 -0.02 -0.07 0.00 0.68 0.00 0.00 39.33 40.21 1gxh h ASP 34 CO -0.21 0.12 0.21 -1.13 -1.61 0.00 0.00 179.24 176.62 1gxh h ASN 35 N 0.00 0.20 -0.68 2.28 -1.24 -1.19 -2.97 115.58 111.97 1gxh h ASN 35 Ca 0.02 0.08 -0.08 0.00 0.71 0.00 0.00 56.30 57.03 1gxh h ASN 35 Cb 0.07 0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.15 1gxh h ASN 35 CO -0.00 0.12 0.11 -0.07 -1.29 0.00 0.00 177.43 176.30 1gxh h LEU 36 N 0.39 1.08 0.10 0.34 3.38 0.80 0.52 115.31 121.92 1gxh h LEU 36 Ca 0.30 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1gxh h LEU 36 Cb 0.36 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1gxh h LEU 36 CO -0.30 1.06 -0.21 -0.08 0.09 0.00 0.00 178.44 179.00 1gxh h GLU 37 N 1.05 -0.38 -0.85 1.13 4.22 -1.48 -2.48 114.58 115.79 1gxh h GLU 37 Ca 0.21 0.03 -0.01 0.00 0.08 0.00 0.00 59.36 59.67 1gxh h GLU 37 Cb 0.44 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 1gxh h GLU 37 CO 0.01 -0.25 0.51 1.25 -2.18 0.00 0.00 179.01 178.35 1gxh h HIS 38 N -0.39 1.13 0.00 0.92 2.76 -0.74 0.13 115.15 118.96 1gxh h HIS 38 Ca 0.03 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.19 1gxh h HIS 38 Cb 0.42 -0.37 -0.00 0.00 1.55 0.00 0.00 27.41 29.01 1gxh h HIS 38 CO -0.21 0.75 -0.04 0.35 -1.30 0.00 0.00 177.93 177.49 1gxh h PHE 39 N 1.18 0.00 0.09 5.26 3.57 -0.00 0.13 116.94 127.16 1gxh h PHE 39 Ca 0.31 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.80 1gxh h PHE 39 Cb -0.04 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.70 1gxh h PHE 39 CO 0.01 0.04 -0.04 0.82 -2.23 0.00 0.00 178.31 176.90 1gxh h ILE 40 N 0.00 1.07 0.66 1.41 5.03 -0.43 -3.39 117.51 121.86 1gxh h ILE 40 Ca -0.00 -1.40 -0.03 0.00 -0.12 0.00 0.00 64.86 63.31 1gxh h ILE 40 Cb 0.17 1.86 -0.00 0.00 -3.03 0.00 0.00 36.82 35.82 1gxh h ILE 40 CO 0.01 0.30 -0.40 -1.28 -0.68 0.00 0.00 178.15 176.10 1gxh h SER 41 N -0.85 -1.00 -0.53 1.72 0.87 0.17 -0.21 113.55 113.71 1gxh h SER 41 Ca -0.01 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.57 1gxh h SER 41 Cb 0.59 0.29 -0.03 0.00 -0.44 0.00 0.00 62.40 62.81 1gxh h SER 41 CO 0.02 -0.62 0.21 -0.37 -0.53 0.00 0.00 176.83 175.54 1gxh h VAL 42 N -0.99 1.21 -0.05 2.23 -1.51 -1.53 -3.27 116.25 112.35 1gxh h VAL 42 Ca -0.09 -0.68 -0.21 0.00 -1.23 0.00 0.00 66.70 64.49 1gxh h VAL 42 Cb 0.79 0.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.50 1gxh h VAL 42 CO 0.09 0.27 -0.83 0.74 -1.23 0.00 0.00 177.57 176.61 1gxh h THR 43 N 0.82 1.37 0.00 7.19 2.02 -1.63 -3.02 112.91 119.66 1gxh h THR 43 Ca 0.19 -2.24 0.00 0.00 0.77 0.00 0.00 66.41 65.13 1gxh h THR 43 Cb 0.19 2.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.82 1gxh h THR 43 CO -0.02 0.68 0.00 -0.62 0.37 0.00 0.00 175.52 175.93 1gxh n GLU 44 N -3.81 -0.57 -2.08 6.66 1.02 -0.14 -4.93 120.64 116.79 1gxh n GLU 44 Ca -0.06 0.13 -0.42 0.00 -0.02 0.00 0.00 57.16 56.79 1gxh n GLU 44 Cb 0.77 -4.47 -0.03 0.00 -0.02 0.00 0.00 31.44 27.69 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 -0.95 1.92 0.28 -0.32 2.46 -1.26 -4.87 115.29 112.55 1gxh s HIS 45 Ca 0.00 0.65 -0.04 0.00 0.47 0.00 0.00 55.06 56.15 1gxh s HIS 45 Cb 0.00 -4.17 0.37 0.00 -0.13 0.00 0.00 32.58 28.65 1gxh s HIS 45 CO 0.00 -2.64 1.95 -1.00 -2.47 0.00 0.00 174.74 170.58 1gxh h PRO 46 N 12.69 1.19 0.00 2.88 0.13 -1.93 -0.17 132.00 146.80 1gxh h PRO 46 Ca -0.31 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 64.72 1gxh h PRO 46 Cb 1.15 -0.27 -0.00 0.00 0.13 0.00 0.00 31.00 32.01 1gxh h PRO 46 CO 1.07 0.79 -0.11 0.77 -0.23 0.00 0.00 178.00 180.29 1gxh h SER 47 N 1.23 0.00 0.00 1.44 0.02 -2.00 -3.47 113.55 110.77 1gxh h SER 47 Ca 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 1gxh h SER 47 Cb -0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.41 1gxh h SER 47 CO -0.07 0.11 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 1gxh n GLY 48 N -0.49 2.80 0.17 -3.77 0.00 -0.08 -1.77 105.19 102.06 1gxh n GLY 48 Ca -0.01 0.22 0.08 0.00 0.00 0.00 0.00 46.02 46.31 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 3.71 0.39 -0.33 1.61 7.64 -1.26 -1.86 113.62 123.52 1gxh n SER 49 Ca 0.00 0.60 0.12 0.00 1.01 0.00 0.00 58.87 60.60 1gxh n SER 49 Cb 0.00 -0.56 0.33 0.00 -1.01 0.00 0.00 64.21 62.97 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 0.76 0.68 6.43 3.58 -1.72 -0.42 116.42 125.73 1gxh h ASP 50 Ca 0.00 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.52 1gxh h ASP 50 Cb 0.50 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.48 1gxh h ASP 50 CO 0.00 0.33 0.00 -0.07 -2.88 0.00 0.00 179.24 176.62 1gxh h LEU 51 N 0.77 0.00 0.00 2.28 3.38 -1.62 0.13 115.31 120.26 1gxh h LEU 51 Ca 0.52 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 58.16 1gxh h LEU 51 Cb 0.79 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 1gxh h LEU 51 CO -0.29 0.00 -2.25 -0.38 0.09 0.00 0.00 178.44 175.61 1gxh n ILE 52 N -2.50 1.25 -0.01 1.22 5.41 -0.33 -4.57 119.36 119.82 1gxh n ILE 52 Ca 0.01 -0.72 0.00 0.00 1.00 0.00 0.00 62.75 63.04 1gxh n ILE 52 Cb 0.22 -0.64 -0.02 0.00 -0.71 0.00 0.00 39.64 38.49 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 -2.75 0.00 -2.91 1.39 4.01 -0.32 -4.80 117.16 111.78 1gxh n TYR 53 Ca -0.31 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.23 1gxh n TYR 53 Cb 1.06 -0.07 -0.02 0.00 -0.31 0.00 0.00 39.34 40.01 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 -1.82 1.88 -1.27 -0.72 4.01 0.45 -5.05 117.16 114.64 1gxh n TYR 54 Ca -0.02 -3.56 -0.30 0.00 -0.16 0.00 0.00 57.90 53.87 1gxh n TYR 54 Cb 0.30 -0.38 0.13 0.00 -0.31 0.00 0.00 39.34 39.08 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 -3.01 1.38 0.19 -0.72 0.04 -1.21 -4.69 135.00 126.99 1gxh s PRO 55 Ca 0.41 0.77 -0.03 0.00 0.04 0.00 0.00 61.00 62.19 1gxh s PRO 55 Cb 0.36 -1.83 0.05 0.00 0.04 0.00 0.00 34.50 33.12 1gxh s PRO 55 CO -0.09 -2.14 0.13 0.39 0.04 0.00 0.00 177.00 175.33 1gxh n GLU 56 N -3.81 -2.01 -0.00 4.56 -0.58 -1.26 -4.97 120.64 112.56 1gxh n GLU 56 Ca 0.07 -0.22 0.08 0.00 -0.42 0.00 0.00 57.16 56.67 1gxh n GLU 56 Cb 0.56 -0.25 -0.11 0.00 -0.57 0.00 0.00 31.44 31.06 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 0.02 -0.66 0.10 0.62 0.00 -1.26 -3.62 105.19 100.39 1gxh n GLY 57 Ca 0.02 -0.42 0.10 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.81 0.50 -4.48 1.61 5.15 -1.26 -4.90 115.26 110.07 1gxh n ASN 58 Ca -0.01 0.64 -0.23 0.00 -0.60 0.00 0.00 54.58 54.38 1gxh n ASN 58 Cb 0.36 -0.74 -0.10 0.00 -0.53 0.00 0.00 39.78 38.77 1gxh n ASN 58 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1gxh s ASN 59 N -3.94 3.14 0.00 1.20 2.47 -1.24 -4.81 114.94 111.76 1gxh s ASN 59 Ca 0.04 -1.22 0.00 0.00 0.42 0.00 0.00 52.86 52.10 1gxh s ASN 59 Cb 0.09 -0.24 0.00 0.00 -1.45 0.00 0.00 41.25 39.65 1gxh s ASN 59 CO 0.34 -0.32 0.00 -0.67 -3.72 0.00 0.00 177.10 172.72 1gxh n ASP 60 N -0.69 0.00 0.26 -4.21 2.03 -1.26 -4.72 116.55 107.95 1gxh n ASP 60 Ca -0.05 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.40 1gxh n ASP 60 Cb 0.64 0.00 0.63 0.00 -0.72 0.00 0.00 41.12 41.67 1gxh n ASP 60 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1gxh h GLY 61 N 0.00 0.00 -3.49 0.27 0.00 -1.97 -3.45 103.07 94.43 1gxh h GLY 61 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 47.33 47.46 1gxh h GLY 61 CO 0.00 0.00 0.55 -0.56 0.00 0.00 0.00 176.54 176.53 1gxh s SER 62 N -5.91 -0.32 0.61 0.19 0.01 -1.26 -5.01 113.70 102.01 1gxh s SER 62 Ca 0.00 0.02 0.40 0.00 1.31 0.00 0.00 55.95 57.69 1gxh s SER 62 Cb 0.10 0.34 2.11 0.00 0.21 0.00 0.00 66.02 68.78 1gxh s SER 62 CO 0.58 -0.54 2.23 1.55 0.41 0.00 0.00 173.24 177.47 1gxh h PRO 63 N 2.03 0.00 -0.86 12.44 0.13 -1.95 -2.18 132.00 141.61 1gxh h PRO 63 Ca -0.20 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.95 1gxh h PRO 63 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 1gxh h PRO 63 CO 0.29 0.00 0.57 0.93 -0.23 0.00 0.00 178.00 179.56 1gxh h GLU 64 N 0.00 1.12 -0.02 0.86 4.39 -1.99 -0.75 114.58 118.20 1gxh h GLU 64 Ca 0.00 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1gxh h GLU 64 Cb 0.10 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.50 1gxh h GLU 64 CO 0.00 0.74 0.02 0.00 -1.16 0.00 0.00 179.01 178.61 1gxh h ALA 65 N 1.33 1.51 0.13 3.43 0.00 -1.71 0.19 119.26 124.13 1gxh h ALA 65 Ca 0.32 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.94 1gxh h ALA 65 Cb -0.10 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.71 1gxh h ALA 65 CO -0.08 -0.03 -1.26 0.28 0.00 0.00 0.00 179.25 178.17 1gxh h VAL 66 N 0.00 1.32 -0.62 0.00 2.07 -1.29 -2.15 116.25 115.58 1gxh h VAL 66 Ca 0.01 -2.57 -0.05 0.00 0.82 0.00 0.00 66.70 64.91 1gxh h VAL 66 Cb 0.05 2.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.54 1gxh h VAL 66 CO -0.00 0.77 0.18 0.40 0.02 0.00 0.00 177.57 178.94 1gxh h ILE 67 N 0.23 1.25 -0.04 4.57 5.03 -0.82 0.13 117.51 127.85 1gxh h ILE 67 Ca -0.18 -0.87 0.00 0.00 -0.12 0.00 0.00 64.86 63.69 1gxh h ILE 67 Cb 1.93 0.64 -0.01 0.00 -3.03 0.00 0.00 36.82 36.36 1gxh h ILE 67 CO 0.23 0.33 -0.03 0.11 -0.68 0.00 0.00 178.15 178.11 1gxh h LYS 68 N 0.89 -0.01 0.00 2.37 1.57 -0.81 0.32 116.57 120.90 1gxh h LYS 68 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1gxh h LYS 68 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1gxh h LYS 68 CO -0.00 -0.00 0.00 0.93 -0.57 0.00 0.00 179.45 179.80 1gxh h GLU 69 N -0.01 0.00 0.27 3.15 3.07 -0.38 0.50 114.58 121.18 1gxh h GLU 69 Ca 0.01 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 1gxh h GLU 69 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1gxh h GLU 69 CO -0.04 0.00 -0.13 0.82 -1.40 0.00 0.00 179.01 178.26 1gxh h ILE 70 N 0.00 0.00 -0.70 3.13 5.03 -0.64 -0.32 117.51 124.00 1gxh h ILE 70 Ca 0.00 -0.61 0.15 0.00 -0.12 0.00 0.00 64.86 64.28 1gxh h ILE 70 Cb 0.30 0.00 -0.13 0.00 -3.03 0.00 0.00 36.82 33.96 1gxh h ILE 70 CO 0.00 0.00 -0.09 0.11 -0.68 0.00 0.00 178.15 177.49 1gxh h LYS 71 N -0.97 0.05 0.02 2.37 1.57 0.93 0.98 116.57 121.51 1gxh h LYS 71 Ca -0.04 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1gxh h LYS 71 Cb 0.28 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1gxh h LYS 71 CO 0.06 0.03 -0.01 1.49 -0.57 0.00 0.00 179.45 180.45 1gxh h GLU 72 N 0.05 -0.03 -0.26 3.15 4.57 -0.14 0.34 114.58 122.26 1gxh h GLU 72 Ca 0.36 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.60 1gxh h GLU 72 Cb 0.59 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.13 1gxh h GLU 72 CO -0.67 0.50 -0.10 2.35 -1.18 0.00 0.00 179.01 179.90 1gxh h TRP 73 N -0.58 -0.25 0.23 0.92 7.01 -0.88 0.80 115.95 123.20 1gxh h TRP 73 Ca -0.00 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.03 1gxh h TRP 73 Cb 0.54 0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 27.73 1gxh h TRP 73 CO 0.11 -0.17 -0.23 0.00 -2.79 0.00 0.00 178.44 175.37 1gxh h ARG 74 N -0.06 -0.47 -0.37 2.65 2.47 -0.70 0.03 114.38 117.92 1gxh h ARG 74 Ca 0.13 0.03 -0.10 0.00 -1.26 0.00 0.00 59.98 58.79 1gxh h ARG 74 Cb 0.26 0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.67 1gxh h ARG 74 CO -0.30 -0.31 -0.17 0.00 0.56 0.00 0.00 179.97 179.75 1gxh h ALA 75 N 0.21 1.01 -0.33 0.04 0.00 -0.59 0.23 119.26 119.83 1gxh h ALA 75 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1gxh h ALA 75 Cb 0.45 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1gxh h ALA 75 CO -0.05 0.59 0.21 0.00 0.00 0.00 0.00 179.25 180.00 1gxh h ALA 76 N 1.20 0.42 0.00 0.00 0.00 -0.69 -0.90 119.26 119.28 1gxh h ALA 76 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1gxh h ALA 76 Cb 0.63 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1gxh h ALA 76 CO 0.04 -0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.28 1gxh n ASN 77 N -4.85 0.00 -0.94 0.00 3.02 -0.02 -4.88 115.26 107.60 1gxh n ASN 77 Ca -0.01 -1.03 -0.12 0.00 -0.03 0.00 0.00 54.58 53.39 1gxh n ASN 77 Cb 0.03 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.15 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 0.19 1.22 3.92 7.41 0.00 -0.34 -5.01 105.19 112.58 1gxh n GLY 78 Ca 0.06 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.11 3.54 0.42 1.61 -0.14 0.70 -4.97 119.74 117.79 1gxh s LYS 79 Ca 0.00 -0.29 -0.25 0.00 -1.36 0.00 0.00 55.97 54.06 1gxh s LYS 79 Cb 0.00 -2.81 -0.08 0.00 -1.68 0.00 0.00 37.83 33.26 1gxh s LYS 79 CO 0.00 0.37 1.26 -1.54 -0.76 0.00 0.00 175.35 174.67 1gxh s SER 80 N -3.19 6.28 0.31 2.83 1.04 -1.26 -3.71 113.70 116.00 1gxh s SER 80 Ca 0.39 2.54 0.00 0.00 0.48 0.00 0.00 55.95 59.37 1gxh s SER 80 Cb -0.11 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.38 1gxh s SER 80 CO 0.29 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 174.26 1gxh n GLY 81 N 0.64 -0.93 1.45 7.32 0.00 -1.26 -4.75 105.19 107.66 1gxh n GLY 81 Ca 0.05 -1.63 -0.13 0.00 0.00 0.00 0.00 46.02 44.31 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 -0.64 -3.20 -1.45 1.61 3.01 -1.23 -3.65 117.46 111.90 1gxh n PHE 82 Ca 0.00 -0.40 -0.44 0.00 1.01 0.00 0.00 57.45 57.61 1gxh n PHE 82 Cb 0.00 -0.50 -0.01 0.00 -0.01 0.00 0.00 39.48 38.96 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 -3.13 0.49 -4.16 -1.08 3.00 -0.90 -4.86 118.16 107.52 1gxh n LYS 83 Ca 0.06 0.17 -0.34 0.00 -0.00 0.00 0.00 58.31 58.20 1gxh n LYS 83 Cb 0.25 -1.36 -0.13 0.00 0.00 0.00 0.00 35.03 33.79 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 -1.32 3.51 0.00 1.64 0.74 -1.26 -4.73 119.66 118.24 1gxh s GLN 84 Ca 0.62 -0.58 0.12 0.00 0.05 0.00 0.00 55.36 55.58 1gxh s GLN 84 Cb -0.73 -2.97 0.74 0.00 1.10 0.00 0.00 33.01 31.15 1gxh s GLN 84 CO 0.58 0.00 1.17 0.41 -0.55 0.00 0.00 175.29 176.91