#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 2.16 1.09 0.03 8.01 -1.26 -5.13 118.70 123.60 1gxh s GLU 2 Ca 0.00 -2.36 -0.14 0.00 0.01 0.00 0.00 54.97 52.48 1gxh s GLU 2 Cb 0.00 -1.54 0.18 0.00 -4.31 0.00 0.00 34.13 28.46 1gxh s GLU 2 CO 0.00 -0.32 0.69 1.28 0.01 0.00 0.00 175.26 176.92 1gxh n LEU 3 N -1.22 -0.66 -4.67 1.80 4.77 -1.26 -4.91 117.00 110.84 1gxh n LEU 3 Ca -0.17 0.02 -0.64 0.00 -0.03 0.00 0.00 56.01 55.19 1gxh n LEU 3 Cb 0.67 -1.21 -0.09 0.00 -2.33 0.00 0.00 43.42 40.46 1gxh n LEU 3 CO 0.40 -3.09 1.00 0.29 -1.33 0.00 0.00 177.39 174.66 1gxh n LYS 4 N -3.64 0.17 0.16 3.23 4.01 -1.26 -4.79 118.16 116.04 1gxh n LYS 4 Ca 0.04 0.06 0.12 0.00 -0.51 0.00 0.00 58.31 58.03 1gxh n LYS 4 Cb 0.56 -1.59 0.57 0.00 -0.51 0.00 0.00 35.03 34.06 1gxh n LYS 4 CO 0.00 0.00 0.00 -0.91 -1.11 0.00 0.00 177.40 175.38 1gxh h ASN 5 N 4.68 0.00 0.00 4.39 2.35 -1.94 -3.45 115.58 121.61 1gxh h ASN 5 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1gxh h ASN 5 Cb 1.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.75 1gxh h ASN 5 CO 0.88 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 175.46 1gxh n SER 6 N -2.30 0.00 -0.17 5.81 7.64 -1.26 -4.99 113.62 118.35 1gxh n SER 6 Ca -0.00 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.02 1gxh n SER 6 Cb 0.12 0.00 0.47 0.00 -1.01 0.00 0.00 64.21 63.79 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 0.76 0.83 0.00 0.44 1.08 -1.84 0.62 117.51 119.40 1gxh h ILE 7 Ca 0.00 -0.16 0.00 0.00 -0.39 0.00 0.00 64.86 64.31 1gxh h ILE 7 Cb 0.00 0.30 0.00 0.00 -3.07 0.00 0.00 36.82 34.05 1gxh h ILE 7 CO 0.00 0.09 0.00 -0.24 -0.69 0.00 0.00 178.15 177.31 1gxh n SER 8 N -4.49 0.00 0.08 1.72 2.88 -1.24 -0.84 113.62 111.73 1gxh n SER 8 Ca 0.14 0.44 -0.20 0.00 -1.33 0.00 0.00 58.87 57.92 1gxh n SER 8 Cb 0.48 -0.48 -0.11 0.00 -0.75 0.00 0.00 64.21 63.36 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 0.77 -0.44 -3.46 1.82 -1.20 -3.32 116.42 110.60 1gxh h ASP 9 Ca 0.00 -0.69 -0.70 0.00 -0.39 0.00 0.00 57.03 55.25 1gxh h ASP 9 Cb 0.42 -0.24 -0.04 0.00 0.68 0.00 0.00 39.33 40.15 1gxh h ASP 9 CO 0.00 1.50 3.23 -1.22 -1.61 0.00 0.00 179.24 181.14 1gxh n TYR 10 N -3.77 2.63 -0.37 0.28 4.01 -0.02 -4.73 117.16 115.19 1gxh n TYR 10 Ca -0.11 -2.98 -0.13 0.00 -0.16 0.00 0.00 57.90 54.52 1gxh n TYR 10 Cb 0.94 -2.27 -0.01 0.00 -0.31 0.00 0.00 39.34 37.69 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 3.18 0.51 -0.31 -0.72 -2.24 -1.26 -3.82 114.28 109.62 1gxh n THR 11 Ca 0.68 -0.13 0.35 0.00 -2.27 0.00 0.00 64.05 62.69 1gxh n THR 11 Cb 0.26 0.00 0.74 0.00 -2.10 0.00 0.00 70.33 69.23 1gxh n THR 11 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1gxh h GLU 12 N 0.28 0.00 0.22 -0.78 5.08 -1.01 0.40 114.58 118.77 1gxh h GLU 12 Ca -0.08 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.94 1gxh h GLU 12 Cb 0.38 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.66 1gxh h GLU 12 CO 0.15 0.00 -1.58 1.15 -1.00 0.00 0.00 179.01 177.73 1gxh h THR 13 N 0.00 1.15 -0.72 1.13 2.02 -1.85 -2.78 112.91 111.87 1gxh h THR 13 Ca 0.55 -2.65 -0.07 0.00 0.77 0.00 0.00 66.41 65.01 1gxh h THR 13 Cb 2.33 2.91 -0.03 0.00 -1.74 0.00 0.00 68.15 71.62 1gxh h THR 13 CO -0.01 0.83 0.18 -0.33 0.37 0.00 0.00 175.52 176.57 1gxh h GLU 14 N 0.12 1.15 -0.69 6.66 5.08 -0.55 -0.79 114.58 125.57 1gxh h GLU 14 Ca -0.29 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 57.72 1gxh h GLU 14 Cb 2.13 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 31.20 1gxh h GLU 14 CO 0.23 1.01 0.13 0.35 -1.00 0.00 0.00 179.01 179.73 1gxh h PHE 15 N 1.09 1.20 -0.52 4.33 3.57 -1.22 -1.52 116.94 123.86 1gxh h PHE 15 Ca 0.23 -0.16 0.10 0.00 3.53 0.00 0.00 57.97 61.67 1gxh h PHE 15 Cb 0.37 -0.33 -0.09 0.00 2.79 0.00 0.00 35.95 38.69 1gxh h PHE 15 CO 0.03 0.99 -0.05 -0.22 -2.23 0.00 0.00 178.31 176.83 1gxh h LYS 16 N 1.06 0.07 -0.86 1.11 1.63 -1.16 -0.18 116.57 118.24 1gxh h LYS 16 Ca 0.21 -0.00 0.07 0.00 -0.85 0.00 0.00 60.65 60.08 1gxh h LYS 16 Cb 0.42 -0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 31.98 1gxh h LYS 16 CO 0.01 0.05 0.56 -0.22 -3.45 0.00 0.00 179.45 176.39 1gxh h LYS 17 N 0.07 0.89 0.16 1.90 3.11 -0.10 0.45 116.57 123.05 1gxh h LYS 17 Ca 0.26 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 58.04 1gxh h LYS 17 Cb 0.40 -0.20 0.00 0.00 -1.00 0.00 0.00 32.23 31.43 1gxh h LYS 17 CO -0.47 0.59 -0.08 0.97 -2.81 0.00 0.00 179.45 177.65 1gxh h ILE 18 N 0.91 0.96 0.00 2.00 2.10 -1.08 -2.53 117.51 119.88 1gxh h ILE 18 Ca 0.38 -0.64 -0.02 0.00 1.08 0.00 0.00 64.86 65.66 1gxh h ILE 18 Cb 0.28 1.35 -0.00 0.00 -1.09 0.00 0.00 36.82 37.36 1gxh h ILE 18 CO -0.14 0.15 -0.09 0.40 -1.08 0.00 0.00 178.15 177.39 1gxh h ILE 19 N -0.53 0.48 0.03 2.19 1.08 0.68 -2.26 117.51 119.18 1gxh h ILE 19 Ca -0.02 -0.41 -0.06 0.00 -0.39 0.00 0.00 64.86 63.98 1gxh h ILE 19 Cb 0.41 1.28 0.00 0.00 -3.07 0.00 0.00 36.82 35.43 1gxh h ILE 19 CO 0.04 0.08 -0.28 -0.08 -0.69 0.00 0.00 178.15 177.22 1gxh h GLU 20 N 0.00 0.06 -0.79 2.37 4.81 -0.25 -2.89 114.58 117.89 1gxh h GLU 20 Ca -0.00 -0.10 0.16 0.00 -0.13 0.00 0.00 59.36 59.29 1gxh h GLU 20 Cb 0.27 0.04 -0.15 0.00 0.63 0.00 0.00 28.75 29.53 1gxh h GLU 20 CO 0.01 1.05 -0.20 0.22 -0.73 0.00 0.00 179.01 179.36 1gxh h ASP 21 N -0.88 -0.74 0.28 1.04 3.58 -0.95 -0.83 116.42 117.91 1gxh h ASP 21 Ca -0.06 0.24 -0.01 0.00 0.42 0.00 0.00 57.03 57.61 1gxh h ASP 21 Cb 1.15 0.49 0.00 0.00 1.72 0.00 0.00 39.33 42.70 1gxh h ASP 21 CO 0.01 -0.26 -0.14 0.16 -2.88 0.00 0.00 179.24 176.13 1gxh h ILE 22 N -0.00 0.69 -0.99 2.25 3.07 -1.64 0.41 117.51 121.31 1gxh h ILE 22 Ca 0.38 -0.73 0.05 0.00 1.55 0.00 0.00 64.86 66.11 1gxh h ILE 22 Cb 0.58 1.05 -0.06 0.00 -0.27 0.00 0.00 36.82 38.11 1gxh h ILE 22 CO -0.81 0.14 0.64 0.40 -1.05 0.00 0.00 178.15 177.46 1gxh h ILE 23 N -0.81 1.11 -0.15 0.16 1.08 -1.19 -1.60 117.51 116.12 1gxh h ILE 23 Ca -0.04 -0.41 -0.12 0.00 -0.39 0.00 0.00 64.86 63.91 1gxh h ILE 23 Cb 0.51 -0.18 0.00 0.00 -3.07 0.00 0.00 36.82 34.09 1gxh h ILE 23 CO 0.06 0.22 -0.36 0.78 -0.69 0.00 0.00 178.15 178.16 1gxh h ASN 24 N 1.19 0.57 0.00 1.72 2.35 -1.28 -3.49 115.58 116.64 1gxh h ASN 24 Ca 0.41 -0.58 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1gxh h ASN 24 Cb 0.11 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.31 1gxh h ASN 24 CO -0.16 1.04 0.00 0.00 -1.65 0.00 0.00 177.43 176.67 1gxh s GLU 26 N -2.69 4.27 0.00 0.00 2.12 -1.17 -4.51 118.70 116.72 1gxh s GLU 26 Ca 0.00 2.26 0.00 0.00 0.36 0.00 0.00 54.97 57.59 1gxh s GLU 26 Cb 0.00 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 31.37 1gxh s GLU 26 CO 0.00 -0.27 0.00 0.41 -0.54 0.00 0.00 175.26 174.86 1gxh n GLY 27 N 0.73 1.60 3.64 -1.50 0.00 -1.26 -4.91 105.19 103.50 1gxh n GLY 27 Ca 0.01 -0.77 -0.04 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.53 0.53 1.61 -1.08 -1.26 -5.08 116.67 106.86 1gxh s ASP 28 Ca 0.00 0.89 0.19 0.00 -0.52 0.00 0.00 52.55 53.11 1gxh s ASP 28 Cb 0.00 1.15 1.34 0.00 -1.46 0.00 0.00 42.92 43.95 1gxh s ASP 28 CO 0.00 -0.14 2.12 1.05 0.52 0.00 0.00 175.17 178.72 1gxh h GLU 29 N 5.72 0.00 -0.68 4.34 9.09 -1.93 -1.84 114.58 129.28 1gxh h GLU 29 Ca -0.28 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.09 1gxh h GLU 29 Cb 1.19 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.26 1gxh h GLU 29 CO 0.17 0.00 0.27 0.87 0.05 0.00 0.00 179.01 180.37 1gxh h LYS 30 N 0.00 1.00 -0.63 1.06 1.57 -1.98 -0.23 116.57 117.35 1gxh h LYS 30 Ca 0.05 -0.17 0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1gxh h LYS 30 Cb 0.22 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 1gxh h LYS 30 CO -0.00 0.81 0.42 -0.22 -0.57 0.00 0.00 179.45 179.89 1gxh h LYS 31 N 0.98 0.76 0.10 3.15 3.11 -1.75 0.10 116.57 123.03 1gxh h LYS 31 Ca 0.23 -0.05 -0.26 0.00 -2.81 0.00 0.00 60.65 57.76 1gxh h LYS 31 Cb 0.19 -0.17 0.00 0.00 -1.00 0.00 0.00 32.23 31.25 1gxh h LYS 31 CO -0.02 0.50 -1.19 1.96 -2.81 0.00 0.00 179.45 177.90 1gxh h GLN 32 N 0.79 0.26 -0.98 1.90 1.08 -1.15 -1.21 115.11 115.79 1gxh h GLN 32 Ca 0.25 -0.42 0.01 0.00 -1.45 0.00 0.00 58.65 57.04 1gxh h GLN 32 Cb 0.02 0.15 -0.05 0.00 -0.05 0.00 0.00 27.48 27.55 1gxh h GLN 32 CO -0.06 1.19 0.65 0.22 -0.95 0.00 0.00 178.83 179.87 1gxh h ASP 33 N 0.08 1.12 0.04 1.46 3.58 -0.79 0.20 116.42 122.12 1gxh h ASP 33 Ca -0.12 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.30 1gxh h ASP 33 Cb 1.91 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 42.68 1gxh h ASP 33 CO 0.19 0.81 -0.02 -0.78 -2.88 0.00 0.00 179.24 176.56 1gxh h ASP 34 N 1.32 -0.05 -0.60 2.28 3.58 -0.68 0.35 116.42 122.63 1gxh h ASP 34 Ca 0.36 -0.03 0.11 0.00 0.42 0.00 0.00 57.03 57.90 1gxh h ASP 34 Cb -0.14 0.01 -0.09 0.00 1.72 0.00 0.00 39.33 40.84 1gxh h ASP 34 CO -0.08 -0.01 0.13 -1.13 -2.88 0.00 0.00 179.24 175.27 1gxh h ASN 35 N -0.09 0.01 -0.57 2.28 -1.24 -1.09 -2.60 115.58 112.27 1gxh h ASN 35 Ca -0.01 0.11 -0.10 0.00 0.71 0.00 0.00 56.30 57.02 1gxh h ASN 35 Cb 0.07 0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.25 1gxh h ASN 35 CO 0.01 0.01 -0.03 -0.07 -1.29 0.00 0.00 177.43 176.07 1gxh h LEU 36 N 0.26 1.01 -0.01 0.34 3.38 0.11 0.46 115.31 120.86 1gxh h LEU 36 Ca 0.31 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1gxh h LEU 36 Cb 0.47 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1gxh h LEU 36 CO -0.40 1.08 -0.12 -0.08 0.09 0.00 0.00 178.44 179.02 1gxh h GLU 37 N 0.91 -0.19 -0.58 1.13 4.22 -1.29 -2.26 114.58 116.51 1gxh h GLU 37 Ca 0.16 0.01 0.05 0.00 0.08 0.00 0.00 59.36 59.66 1gxh h GLU 37 Cb 0.58 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.83 1gxh h GLU 37 CO 0.03 -0.13 0.32 1.25 -2.18 0.00 0.00 179.01 178.30 1gxh h HIS 38 N -0.20 0.58 0.00 0.92 2.76 -0.69 0.98 115.15 119.50 1gxh h HIS 38 Ca 0.05 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1gxh h HIS 38 Cb 0.26 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 29.04 1gxh h HIS 38 CO -0.19 0.29 0.00 0.35 -1.30 0.00 0.00 177.93 177.09 1gxh h PHE 39 N 0.60 0.00 0.08 5.26 3.57 -0.07 0.16 116.94 126.54 1gxh h PHE 39 Ca 0.25 0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.57 1gxh h PHE 39 Cb 0.13 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 1gxh h PHE 39 CO -0.09 0.00 -0.92 0.82 -2.23 0.00 0.00 178.31 175.89 1gxh h ILE 40 N 0.00 1.31 0.18 1.41 5.03 -0.30 -3.40 117.51 121.74 1gxh h ILE 40 Ca 0.00 -2.39 -0.01 0.00 -0.12 0.00 0.00 64.86 62.34 1gxh h ILE 40 Cb 0.11 2.92 0.00 0.00 -3.03 0.00 0.00 36.82 36.82 1gxh h ILE 40 CO 0.00 0.63 -0.09 0.28 -0.68 0.00 0.00 178.15 178.29 1gxh h SER 41 N -0.58 -0.21 -0.99 1.72 0.02 0.13 0.24 113.55 113.89 1gxh h SER 41 Ca -0.20 -0.31 0.19 0.00 -0.84 0.00 0.00 61.79 60.63 1gxh h SER 41 Cb 1.49 0.05 -0.10 0.00 0.14 0.00 0.00 62.40 63.99 1gxh h SER 41 CO 0.03 0.34 0.61 1.62 -1.14 0.00 0.00 176.83 178.29 1gxh h VAL 42 N -0.90 0.71 0.16 2.27 3.04 -1.33 -3.04 116.25 117.16 1gxh h VAL 42 Ca -0.02 -0.24 -0.33 0.00 -1.01 0.00 0.00 66.70 65.09 1gxh h VAL 42 Cb 0.50 -0.05 0.00 0.00 -2.01 0.00 0.00 31.29 29.74 1gxh h VAL 42 CO 0.04 0.13 -1.68 0.74 -1.01 0.00 0.00 177.57 175.78 1gxh h THR 43 N 0.70 1.00 0.00 3.17 2.02 -1.71 -2.98 112.91 115.11 1gxh h THR 43 Ca 0.55 -2.61 0.00 0.00 0.77 0.00 0.00 66.41 65.12 1gxh h THR 43 Cb 0.95 2.74 0.00 0.00 -1.74 0.00 0.00 68.15 70.11 1gxh h THR 43 CO -0.33 0.83 0.00 -0.62 0.37 0.00 0.00 175.52 175.78 1gxh n GLU 44 N -3.52 -0.78 -2.12 6.66 1.02 0.82 -4.93 120.64 117.79 1gxh n GLU 44 Ca -0.22 0.16 -0.43 0.00 -0.02 0.00 0.00 57.16 56.66 1gxh n GLU 44 Cb 1.06 -4.19 -0.03 0.00 -0.02 0.00 0.00 31.44 28.27 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 -0.84 2.00 0.27 -0.32 2.46 -1.25 -4.88 115.29 112.74 1gxh s HIS 45 Ca 0.00 0.64 -0.04 0.00 0.47 0.00 0.00 55.06 56.13 1gxh s HIS 45 Cb 0.00 -4.19 0.35 0.00 -0.13 0.00 0.00 32.58 28.61 1gxh s HIS 45 CO 0.00 -2.59 1.93 -1.00 -2.47 0.00 0.00 174.74 170.61 1gxh h PRO 46 N 12.21 1.21 0.00 2.88 0.13 -1.92 -0.52 132.00 145.99 1gxh h PRO 46 Ca -0.31 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 64.73 1gxh h PRO 46 Cb 1.15 -0.27 -0.00 0.00 0.13 0.00 0.00 31.00 32.00 1gxh h PRO 46 CO 1.06 0.80 -0.10 0.77 -0.23 0.00 0.00 178.00 180.31 1gxh h SER 47 N 1.25 0.00 0.00 1.44 0.02 -2.00 -3.47 113.55 110.79 1gxh h SER 47 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1gxh h SER 47 Cb -0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.47 1gxh h SER 47 CO -0.10 0.10 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 1gxh n GLY 48 N -0.76 2.96 0.14 -3.77 0.00 -0.21 -1.74 105.19 101.81 1gxh n GLY 48 Ca -0.02 0.19 0.08 0.00 0.00 0.00 0.00 46.02 46.27 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 4.05 0.39 -0.36 1.61 7.64 -1.26 -2.04 113.62 123.66 1gxh n SER 49 Ca 0.00 0.63 0.06 0.00 1.01 0.00 0.00 58.87 60.57 1gxh n SER 49 Cb 0.00 -0.63 0.22 0.00 -1.01 0.00 0.00 64.21 62.79 1gxh n SER 49 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1gxh h ASP 50 N 0.00 0.91 0.53 6.43 3.32 -1.70 -0.77 116.42 125.13 1gxh h ASP 50 Ca 0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1gxh h ASP 50 Cb 0.29 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.70 1gxh h ASP 50 CO 0.00 0.50 0.00 0.18 -1.72 0.00 0.00 179.24 178.20 1gxh n LEU 51 N -4.62 0.00 -0.08 1.55 4.32 -0.86 -0.20 117.00 117.11 1gxh n LEU 51 Ca 0.18 0.48 -0.09 0.00 -0.02 0.00 0.00 56.01 56.55 1gxh n LEU 51 Cb 0.32 -0.48 -0.09 0.00 -1.62 0.00 0.00 43.42 41.56 1gxh n LEU 51 CO 0.28 -0.21 -1.00 -0.38 -1.22 0.00 0.00 177.39 174.85 1gxh n ILE 52 N -1.48 0.94 -0.07 -0.08 5.41 -0.64 -4.56 119.36 118.88 1gxh n ILE 52 Ca 0.04 -0.45 -0.07 0.00 1.00 0.00 0.00 62.75 63.27 1gxh n ILE 52 Cb 0.18 -0.91 -0.11 0.00 -0.71 0.00 0.00 39.64 38.10 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 -2.78 0.00 -2.93 1.39 4.01 -0.39 -4.76 117.16 111.70 1gxh n TYR 53 Ca -0.26 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.29 1gxh n TYR 53 Cb 0.86 -0.67 -0.01 0.00 -0.31 0.00 0.00 39.34 39.21 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 -2.56 1.59 -1.24 -0.72 4.01 0.72 -5.06 117.16 113.90 1gxh n TYR 54 Ca -0.23 -3.53 -0.29 0.00 -0.16 0.00 0.00 57.90 53.69 1gxh n TYR 54 Cb 0.93 -0.39 0.18 0.00 -0.31 0.00 0.00 39.34 39.76 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 -2.94 0.29 0.00 -0.72 0.04 -1.18 -4.68 135.00 125.82 1gxh s PRO 55 Ca 0.40 0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.80 1gxh s PRO 55 Cb 0.37 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 33.17 1gxh s PRO 55 CO -0.08 -2.79 0.00 -0.85 0.04 0.00 0.00 177.00 173.32 1gxh n GLU 56 N -4.19 1.71 0.00 4.56 0.00 -1.26 -5.00 120.64 116.45 1gxh n GLU 56 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.22 1gxh n GLU 56 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.02 1gxh n GLU 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1gxh n GLY 57 N 2.13 2.94 1.83 -1.84 0.00 -1.26 -0.64 105.19 108.36 1gxh n GLY 57 Ca 0.00 -0.21 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 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 2.08 4.81 -3.53 1.61 4.13 -1.26 -4.86 115.26 118.24 1gxh n ASN 58 Ca 0.00 -3.77 -0.38 0.00 1.68 0.00 0.00 54.58 52.10 1gxh n ASN 58 Cb 0.00 -0.63 -0.03 0.00 -1.54 0.00 0.00 39.78 37.59 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 -0.92 4.46 0.00 6.41 5.15 0.19 -3.12 115.26 127.43 1gxh n ASN 59 Ca 0.46 -2.65 0.00 0.00 -0.60 0.00 0.00 54.58 51.79 1gxh n ASN 59 Cb 0.94 -1.38 0.00 0.00 -0.53 0.00 0.00 39.78 38.81 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 5.77 0.00 -0.04 1.20 5.75 -1.26 -4.38 116.55 123.59 1gxh n ASP 60 Ca 0.54 0.00 -0.13 0.00 -0.01 0.00 0.00 54.79 55.19 1gxh n ASP 60 Cb 0.32 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.33 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 0.28 -3.60 6.12 0.00 -1.96 -3.48 103.07 100.42 1gxh h GLY 61 Ca 0.00 -0.30 0.27 0.00 0.00 0.00 0.00 47.33 47.30 1gxh h GLY 61 CO 0.00 0.27 0.82 -0.56 0.00 0.00 0.00 176.54 177.07 1gxh s SER 62 N -6.05 -0.12 0.00 0.19 0.01 -1.26 -5.02 113.70 101.45 1gxh s SER 62 Ca -0.15 -0.02 0.10 0.00 1.31 0.00 0.00 55.95 57.19 1gxh s SER 62 Cb 0.04 0.14 0.59 0.00 0.21 0.00 0.00 66.02 67.00 1gxh s SER 62 CO 0.73 -0.23 1.11 -0.81 0.41 0.00 0.00 173.24 174.45 1gxh n PRO 63 N -0.16 0.27 -0.05 12.44 -0.04 -1.26 -0.93 135.00 145.27 1gxh n PRO 63 Ca -0.01 0.06 0.10 0.00 -0.04 0.00 0.00 63.50 63.61 1gxh n PRO 63 Cb 0.59 -1.50 0.49 0.00 -0.04 0.00 0.00 33.50 33.04 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 0.41 0.00 0.54 4.39 -1.99 0.22 114.58 118.14 1gxh h GLU 64 Ca 0.00 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 1gxh h GLU 64 Cb 0.03 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 28.59 1gxh h GLU 64 CO 0.00 0.27 -0.01 0.00 -1.16 0.00 0.00 179.01 178.11 1gxh h ALA 65 N 1.72 1.12 0.17 3.43 0.00 -1.35 0.46 119.26 124.80 1gxh h ALA 65 Ca 0.24 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.84 1gxh h ALA 65 Cb 0.41 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.23 1gxh h ALA 65 CO -0.06 0.01 -1.33 0.28 0.00 0.00 0.00 179.25 178.15 1gxh h VAL 66 N 0.00 1.33 -0.64 0.00 2.07 -1.15 -2.66 116.25 115.20 1gxh h VAL 66 Ca -0.00 -2.67 -0.05 0.00 0.82 0.00 0.00 66.70 64.80 1gxh h VAL 66 Cb 0.08 2.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.70 1gxh h VAL 66 CO 0.00 0.80 0.20 0.40 0.02 0.00 0.00 177.57 179.00 1gxh h ILE 67 N 0.18 1.25 0.00 4.57 5.03 -0.77 0.37 117.51 128.14 1gxh h ILE 67 Ca -0.20 -0.84 0.00 0.00 -0.12 0.00 0.00 64.86 63.70 1gxh h ILE 67 Cb 2.01 0.59 0.00 0.00 -3.03 0.00 0.00 36.82 36.39 1gxh h ILE 67 CO 0.24 0.32 0.00 0.29 -0.68 0.00 0.00 178.15 178.33 1gxh n LYS 68 N -4.37 0.00 0.18 2.37 5.02 -0.02 -1.40 118.16 119.93 1gxh n LYS 68 Ca 0.04 0.56 0.13 0.00 -2.02 0.00 0.00 58.31 57.02 1gxh n LYS 68 Cb 0.21 -1.04 0.59 0.00 -0.02 0.00 0.00 35.03 34.77 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 0.00 1.97 3.07 -0.74 0.58 114.58 119.46 1gxh h GLU 69 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 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 0.00 -0.89 -1.40 0.00 0.00 179.01 176.72 1gxh n ILE 70 N -2.45 0.00 -0.13 3.13 -0.00 0.11 -1.18 119.36 118.84 1gxh n ILE 70 Ca 0.01 0.95 0.12 0.00 -0.00 0.00 0.00 62.75 63.83 1gxh n ILE 70 Cb 0.20 -1.87 0.46 0.00 -0.00 0.00 0.00 39.64 38.43 1gxh n ILE 70 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.55 177.05 1gxh h LYS 71 N 0.00 0.49 -0.06 0.38 3.11 0.24 0.98 116.57 121.70 1gxh h LYS 71 Ca 0.00 -0.03 -0.07 0.00 -2.81 0.00 0.00 60.65 57.75 1gxh h LYS 71 Cb 0.00 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 31.12 1gxh h LYS 71 CO 0.00 0.32 -0.22 0.93 -2.81 0.00 0.00 179.45 177.67 1gxh h GLU 72 N 0.50 0.25 -0.27 1.90 3.07 -0.06 -1.06 114.58 118.91 1gxh h GLU 72 Ca 0.32 -0.19 0.06 0.00 -0.50 0.00 0.00 59.36 59.04 1gxh h GLU 72 Cb 0.56 0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 28.46 1gxh h GLU 72 CO -0.10 0.83 -0.09 2.35 -1.40 0.00 0.00 179.01 180.60 1gxh h TRP 73 N -0.28 -0.20 0.32 4.33 7.01 -0.46 0.10 115.95 126.78 1gxh h TRP 73 Ca -0.01 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 1gxh h TRP 73 Cb 0.86 0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 28.03 1gxh h TRP 73 CO 0.13 -0.14 -0.31 0.00 -2.79 0.00 0.00 178.44 175.33 1gxh h ARG 74 N -0.03 -0.63 -0.35 2.65 2.47 -0.79 -0.13 114.38 117.57 1gxh h ARG 74 Ca 0.13 0.04 -0.09 0.00 -1.26 0.00 0.00 59.98 58.81 1gxh h ARG 74 Cb 0.23 0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.68 1gxh h ARG 74 CO -0.30 -0.42 -0.16 0.00 0.56 0.00 0.00 179.97 179.66 1gxh h ALA 75 N -0.11 1.07 -0.38 0.04 0.00 -0.94 0.20 119.26 119.14 1gxh h ALA 75 Ca -0.02 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1gxh h ALA 75 Cb 0.60 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1gxh h ALA 75 CO -0.06 0.57 0.22 0.00 0.00 0.00 0.00 179.25 179.98 1gxh h ALA 76 N 1.25 0.48 0.00 0.00 0.00 -0.62 -0.70 119.26 119.67 1gxh h ALA 76 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1gxh h ALA 76 Cb 0.60 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1gxh h ALA 76 CO 0.04 -0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.37 1gxh n ASN 77 N -4.77 0.00 -0.56 0.00 3.02 -0.08 -4.87 115.26 108.00 1gxh n ASN 77 Ca -0.00 -0.95 -0.07 0.00 -0.03 0.00 0.00 54.58 53.53 1gxh n ASN 77 Cb 0.06 0.00 -0.03 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 0.12 0.93 3.83 7.41 0.00 -0.27 -5.01 105.19 112.19 1gxh n GLY 78 Ca 0.05 -0.51 -0.22 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 -2.41 2.87 0.10 1.61 1.02 0.63 -4.96 119.74 118.59 1gxh s LYS 79 Ca 0.00 -1.12 -0.31 0.00 0.02 0.00 0.00 55.97 54.56 1gxh s LYS 79 Cb 0.00 -2.54 -0.08 0.00 -0.52 0.00 0.00 37.83 34.69 1gxh s LYS 79 CO 0.00 0.32 1.52 -1.12 -0.92 0.00 0.00 175.35 175.16 1gxh s SER 80 N -3.88 6.69 0.65 2.83 0.01 -1.26 -3.14 113.70 115.60 1gxh s SER 80 Ca 0.35 2.43 0.00 0.00 1.31 0.00 0.00 55.95 60.04 1gxh s SER 80 Cb -0.07 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.58 1gxh s SER 80 CO 0.25 -0.78 0.00 0.61 0.41 0.00 0.00 173.24 173.73 1gxh n GLY 81 N 3.75 -1.31 0.00 3.44 0.00 -1.26 -4.69 105.19 105.12 1gxh n GLY 81 Ca 0.14 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.55 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 -1.42 -2.19 -0.79 1.61 3.01 -1.24 -3.60 117.46 112.84 1gxh n PHE 82 Ca 0.00 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.12 1gxh n PHE 82 Cb 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 39.48 39.59 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 -1.17 -0.72 -0.89 -1.08 3.00 -1.25 -4.79 118.16 111.25 1gxh n LYS 83 Ca 0.00 -0.19 -0.22 0.00 -0.00 0.00 0.00 58.31 57.91 1gxh n LYS 83 Cb 0.00 -1.63 -0.06 0.00 0.00 0.00 0.00 35.03 33.34 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 -1.04 2.31 0.00 1.64 7.27 -1.26 -4.71 117.38 121.59 1gxh n GLN 84 Ca 0.03 -1.40 0.00 0.00 0.07 0.00 0.00 57.00 55.70 1gxh n GLN 84 Cb 0.59 -2.33 0.00 0.00 2.41 0.00 0.00 30.24 30.90 1gxh n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54