#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gbo n GLU 3 N 0.00 0.00 0.09 0.11 4.71 -1.26 -4.53 120.64 119.75 2gbo n GLU 3 Ca 0.00 0.00 0.20 0.00 -0.01 0.00 0.00 57.16 57.35 2gbo n GLU 3 Cb 0.00 0.00 0.73 0.00 -1.01 0.00 0.00 31.44 31.16 2gbo n GLU 3 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 2gbo h GLY 4 N 0.00 0.00 0.53 0.62 0.00 -2.04 0.56 103.07 102.74 2gbo h GLY 4 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2gbo h GLY 4 CO 0.00 0.00 -0.12 -2.22 0.00 0.00 0.00 176.54 174.20 2gbo h ILE 5 N 0.00 0.72 -0.48 2.60 2.04 -1.99 -1.70 117.51 118.71 2gbo h ILE 5 Ca 0.20 -0.81 0.06 0.00 1.00 0.00 0.00 64.86 65.31 2gbo h ILE 5 Cb 1.16 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 38.31 2gbo h ILE 5 CO -0.00 0.15 0.20 0.28 0.00 0.00 0.00 178.15 178.77 2gbo h SER 6 N -0.82 0.24 -0.35 1.72 0.02 -1.83 0.21 113.55 112.74 2gbo h SER 6 Ca -0.04 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 60.98 2gbo h SER 6 Cb 0.51 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.04 2gbo h SER 6 CO 0.06 0.17 0.19 0.50 -1.14 0.00 0.00 176.83 176.61 2gbo h LYS 7 N 0.39 0.38 -0.63 3.45 3.64 -0.96 0.27 116.57 123.11 2gbo h LYS 7 Ca 0.22 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.61 2gbo h LYS 7 Cb 0.20 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 2gbo h LYS 7 CO -0.20 0.25 0.39 0.87 -2.27 0.00 0.00 179.45 178.49 2gbo h LYS 8 N 0.39 0.74 -0.24 1.90 1.57 -1.00 -0.02 116.57 119.91 2gbo h LYS 8 Ca 0.14 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2gbo h LYS 8 Cb 0.02 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 2gbo h LYS 8 CO -0.08 0.49 0.12 0.35 -0.57 0.00 0.00 179.45 179.75 2gbo h PHE 9 N 0.76 0.35 -0.66 -1.35 3.57 -0.08 -2.54 116.94 116.99 2gbo h PHE 9 Ca 0.25 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.74 2gbo h PHE 9 Cb 0.03 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 2gbo h PHE 9 CO -0.05 0.34 0.42 0.00 -2.23 0.00 0.00 178.31 176.78 2gbo h ALA 10 N 0.98 0.83 -0.19 2.41 0.00 -0.07 -0.17 119.26 123.05 2gbo h ALA 10 Ca 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2gbo h ALA 10 Cb 0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2gbo h ALA 10 CO -0.01 0.29 0.09 0.82 0.00 0.00 0.00 179.25 180.43 2gbo h ILE 11 N 0.89 1.14 -0.36 0.00 2.04 -1.00 -0.69 117.51 119.53 2gbo h ILE 11 Ca 0.24 -0.40 -0.12 0.00 1.00 0.00 0.00 64.86 65.58 2gbo h ILE 11 Cb -0.07 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 2gbo h ILE 11 CO -0.05 0.13 -0.26 0.06 0.00 0.00 0.00 178.15 178.04 2gbo h GLN 12 N 0.17 0.72 -0.54 2.37 -0.00 -1.26 -1.54 115.11 115.03 2gbo h GLN 12 Ca 0.06 -0.30 0.03 0.00 -0.00 0.00 0.00 58.65 58.44 2gbo h GLN 12 Cb 0.13 -0.03 -0.04 0.00 -0.00 0.00 0.00 27.48 27.55 2gbo h GLN 12 CO -0.01 0.90 0.32 1.25 -0.00 0.00 0.00 178.83 181.30 2gbo h LEU 13 N 0.63 0.51 -0.95 0.06 5.85 -0.95 -0.21 115.31 120.24 2gbo h LEU 13 Ca 0.08 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2gbo h LEU 13 Cb 0.76 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.64 2gbo h LEU 13 CO 0.06 0.36 0.63 -0.07 -0.34 0.00 0.00 178.44 179.08 2gbo h LEU 14 N 0.63 1.09 -0.55 2.25 3.38 -0.88 0.71 115.31 121.94 2gbo h LEU 14 Ca 0.22 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.06 2gbo h LEU 14 Cb 0.03 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2gbo h LEU 14 CO -0.10 0.79 -0.05 -0.33 0.09 0.00 0.00 178.44 178.83 2gbo h GLU 15 N 1.29 1.02 -0.30 1.13 5.08 -0.94 -0.71 114.58 121.14 2gbo h GLU 15 Ca 0.35 -0.35 -0.15 0.00 -1.00 0.00 0.00 59.36 58.20 2gbo h GLU 15 Cb -0.15 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.02 2gbo h GLU 15 CO -0.08 1.04 -0.41 0.22 -1.00 0.00 0.00 179.01 178.78 2gbo h ASP 16 N 0.90 0.88 -0.90 1.42 3.58 -0.74 -2.53 116.42 119.02 2gbo h ASP 16 Ca 0.15 -0.50 0.02 0.00 0.42 0.00 0.00 57.03 57.12 2gbo h ASP 16 Cb 0.61 -0.25 -0.05 0.00 1.72 0.00 0.00 39.33 41.37 2gbo h ASP 16 CO 0.04 1.21 0.59 0.44 -2.88 0.00 0.00 179.24 178.64 2gbo h ASP 17 N 0.58 1.02 -0.47 2.28 3.32 -0.74 -1.65 116.42 120.75 2gbo h ASP 17 Ca 0.03 -0.02 0.09 0.00 0.02 0.00 0.00 57.03 57.15 2gbo h ASP 17 Cb 1.00 -0.25 -0.08 0.00 0.22 0.00 0.00 39.33 40.23 2gbo h ASP 17 CO 0.10 0.72 0.00 0.00 -1.72 0.00 0.00 179.24 178.34 2gbo h ALA 18 N 1.34 0.45 -0.74 3.45 0.00 -0.92 -1.02 119.26 121.82 2gbo h ALA 18 Ca 0.34 0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.46 2gbo h ALA 18 Cb -0.09 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 2gbo h ALA 18 CO -0.09 -0.39 0.42 0.93 0.00 0.00 0.00 179.25 180.13 2gbo h GLU 19 N 0.12 0.73 -0.82 0.00 4.39 -0.90 0.16 114.58 118.25 2gbo h GLU 19 Ca 0.24 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.87 2gbo h GLU 19 Cb 0.35 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.80 2gbo h GLU 19 CO -0.39 0.48 0.43 0.00 -1.16 0.00 0.00 179.01 178.36 2gbo h ARG 20 N 0.75 1.15 -0.21 2.33 3.08 -0.97 -2.85 114.38 117.65 2gbo h ARG 20 Ca 0.34 -0.15 -0.14 0.00 0.07 0.00 0.00 59.98 60.11 2gbo h ARG 20 Cb 0.24 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2gbo h ARG 20 CO -0.20 0.86 -0.40 0.82 -1.07 0.00 0.00 179.97 179.98 2gbo h ILE 21 N 1.15 1.32 0.00 2.04 1.08 -0.69 -2.00 117.51 120.41 2gbo h ILE 21 Ca 0.29 -1.62 0.00 0.00 -0.39 0.00 0.00 64.86 63.14 2gbo h ILE 21 Cb 0.06 1.82 0.00 0.00 -3.07 0.00 0.00 36.82 35.64 2gbo h ILE 21 CO -0.04 0.51 0.00 0.29 -0.69 0.00 0.00 178.15 178.21 2gbo n LYS 22 N -4.23 0.03 0.00 2.37 5.02 0.51 -1.39 118.16 120.47 2gbo n LYS 22 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 2gbo n LYS 22 Cb 0.54 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 2gbo n LYS 22 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2gbo n LEU 24 N 1.16 0.00 0.00 -0.35 4.77 -0.75 -0.74 117.00 121.09 2gbo n LEU 24 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 2gbo n LEU 24 Cb 0.02 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.03 2gbo n LEU 24 CO 0.00 0.00 0.75 0.40 -1.33 0.00 0.00 177.39 177.21 2gbo h ILE 25 N 0.00 1.21 -0.61 -0.08 2.04 -1.52 -1.84 117.51 116.71 2gbo h ILE 25 Ca 0.00 -0.61 0.08 0.00 1.00 0.00 0.00 64.86 65.33 2gbo h ILE 25 Cb 0.00 1.57 -0.07 0.00 -0.74 0.00 0.00 36.82 37.59 2gbo h ILE 25 CO 0.00 0.16 0.27 0.03 0.00 0.00 0.00 178.15 178.61 2gbo h ARG 26 N -0.21 0.46 0.00 2.37 3.08 -1.20 0.14 114.38 119.02 2gbo h ARG 26 Ca 0.01 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 2gbo h ARG 26 Cb 0.26 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 2gbo h ARG 26 CO 0.00 0.31 -0.16 -0.97 -1.07 0.00 0.00 179.97 178.08 2gbo h ASN 27 N 0.48 0.00 0.48 7.04 -0.73 -1.75 0.18 115.58 121.28 2gbo h ASN 27 Ca 0.30 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 58.25 2gbo h ASN 27 Cb 0.32 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 38.87 2gbo h ASN 27 CO -0.26 0.16 -1.70 1.67 -0.37 0.00 0.00 177.43 176.93 2gbo n GLN 28 N -3.64 0.64 0.16 6.67 0.00 -0.71 -3.04 117.38 117.45 2gbo n GLN 28 Ca -0.01 0.17 0.05 0.00 -0.00 0.00 0.00 57.00 57.21 2gbo n GLN 28 Cb 0.28 -1.74 0.06 0.00 0.00 0.00 0.00 30.24 28.85 2gbo n GLN 28 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 2gbo h LYS 29 N 0.00 0.00 -0.58 3.69 6.56 -0.27 -2.60 116.57 123.38 2gbo h LYS 29 Ca -0.25 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.34 2gbo h LYS 29 Cb 1.77 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.43 2gbo h LYS 29 CO 0.05 0.36 0.00 0.09 -2.06 0.00 0.00 179.45 177.89 2gbo n ASN 30 N -3.18 3.30 -4.73 0.86 3.02 0.60 -4.94 115.26 110.19 2gbo n ASN 30 Ca 0.02 -2.18 -0.42 0.00 -0.03 0.00 0.00 54.58 51.98 2gbo n ASN 30 Cb 0.68 -0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 39.39 2gbo n ASN 30 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2gbo s SER 31 N -0.88 7.00 -0.16 6.41 0.15 -0.98 -4.84 113.70 120.40 2gbo s SER 31 Ca 0.37 2.24 0.11 0.00 0.70 0.00 0.00 55.95 59.37 2gbo s SER 31 Cb 0.22 -2.60 0.61 0.00 -1.71 0.00 0.00 66.02 62.54 2gbo s SER 31 CO 0.21 -0.47 1.44 0.18 1.20 0.00 0.00 173.24 175.80 2gbo n LEU 32 N 3.07 4.40 0.31 3.45 4.32 -1.26 -4.68 117.00 126.60 2gbo n LEU 32 Ca 0.07 -2.23 -0.15 0.00 -0.02 0.00 0.00 56.01 53.68 2gbo n LEU 32 Cb 0.44 -0.61 -0.08 0.00 -1.62 0.00 0.00 43.42 41.55 2gbo n LEU 32 CO 0.57 0.56 0.52 0.00 -1.22 0.00 0.00 177.39 177.82 2gbo h ILE 34 N -0.91 1.23 -0.58 0.00 1.08 -1.99 -2.57 117.51 113.77 2gbo h ILE 34 Ca -0.07 -0.47 0.08 0.00 -0.39 0.00 0.00 64.86 64.01 2gbo h ILE 34 Cb 0.74 0.03 -0.07 0.00 -3.07 0.00 0.00 36.82 34.46 2gbo h ILE 34 CO 0.04 0.23 0.22 0.28 -0.69 0.00 0.00 178.15 178.23 2gbo h SER 35 N 1.14 0.23 -0.37 1.72 0.02 -1.82 -0.46 113.55 114.01 2gbo h SER 35 Ca 0.30 0.07 -0.09 0.00 -0.84 0.00 0.00 61.79 61.23 2gbo h SER 35 Cb -0.07 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 2gbo h SER 35 CO -0.06 0.15 -0.08 1.56 -1.14 0.00 0.00 176.83 177.26 2gbo h GLN 36 N 0.41 0.80 -0.56 3.45 4.20 -0.71 0.23 115.11 122.93 2gbo h GLN 36 Ca 0.29 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 2gbo h GLN 36 Cb 0.33 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 2gbo h GLN 36 CO -0.28 0.86 0.28 0.00 -0.67 0.00 0.00 178.83 179.02 2gbo h LYS 38 N 0.75 0.93 -0.45 0.00 1.79 -0.91 -2.31 116.57 116.37 2gbo h LYS 38 Ca 0.19 -0.48 0.05 0.00 -2.18 0.00 0.00 60.65 58.24 2gbo h LYS 38 Cb 0.10 0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 30.71 2gbo h LYS 38 CO -0.03 1.14 0.18 0.00 -1.08 0.00 0.00 179.45 179.66 2gbo h ALA 39 N 0.80 0.55 -0.28 3.86 0.00 -0.48 -0.10 119.26 123.61 2gbo h ALA 39 Ca 0.06 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2gbo h ALA 39 Cb 0.97 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2gbo h ALA 39 CO 0.09 -0.21 0.06 0.35 0.00 0.00 0.00 179.25 179.55 2gbo h PHE 40 N 0.36 0.47 -0.87 0.00 3.57 -1.42 -1.07 116.94 117.98 2gbo h PHE 40 Ca 0.21 -0.06 0.23 0.00 3.53 0.00 0.00 57.97 61.88 2gbo h PHE 40 Cb 0.19 -0.13 -0.14 0.00 2.79 0.00 0.00 35.95 38.66 2gbo h PHE 40 CO -0.14 0.53 0.24 1.49 -2.23 0.00 0.00 178.31 178.20 2gbo h GLU 41 N 0.27 0.21 -0.50 1.11 4.81 -1.23 -0.80 114.58 118.46 2gbo h GLU 41 Ca 0.09 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.20 2gbo h GLU 41 Cb 0.30 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 2gbo h GLU 41 CO 0.00 0.14 -0.10 1.49 -0.73 0.00 0.00 179.01 179.81 2gbo h GLU 42 N 0.22 0.91 -0.59 1.92 4.81 -0.25 -2.43 114.58 119.17 2gbo h GLU 42 Ca 0.55 -0.32 0.04 0.00 -0.13 0.00 0.00 59.36 59.50 2gbo h GLU 42 Cb 1.09 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.36 2gbo h GLU 42 CO -0.64 0.96 0.33 0.28 -0.73 0.00 0.00 179.01 179.21 2gbo h VAL 43 N 0.82 1.00 -0.14 0.32 2.07 -0.35 -2.42 116.25 117.56 2gbo h VAL 43 Ca 0.13 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2gbo h VAL 43 Cb 0.62 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2gbo h VAL 43 CO 0.04 0.12 0.04 0.58 0.02 0.00 0.00 177.57 178.37 2gbo h VAL 44 N 0.64 1.19 -0.56 2.57 2.07 -0.95 0.15 116.25 121.36 2gbo h VAL 44 Ca 0.25 -0.59 0.11 0.00 0.82 0.00 0.00 66.70 67.30 2gbo h VAL 44 Cb 0.11 1.32 -0.10 0.00 -1.52 0.00 0.00 31.29 31.09 2gbo h VAL 44 CO -0.14 0.18 -0.11 0.44 0.02 0.00 0.00 177.57 177.95 2gbo h ASP 45 N 0.03 -0.46 -0.52 0.57 3.32 -1.43 -2.73 116.42 115.19 2gbo h ASP 45 Ca 0.04 0.16 -0.11 0.00 0.02 0.00 0.00 57.03 57.15 2gbo h ASP 45 Cb 0.24 0.32 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 2gbo h ASP 45 CO -0.00 -0.17 -0.09 0.74 -1.72 0.00 0.00 179.24 178.00 2gbo h THR 46 N 0.02 1.27 0.00 0.35 2.02 -1.16 0.03 112.91 115.44 2gbo h THR 46 Ca 0.27 -1.24 0.00 0.00 0.77 0.00 0.00 66.41 66.21 2gbo h THR 46 Cb 0.42 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 2gbo h THR 46 CO -0.55 0.44 0.00 0.00 0.37 0.00 0.00 175.52 175.77 2gbo n GLN 47 N -4.19 0.00 0.00 6.66 1.13 0.49 -1.87 117.38 119.59 2gbo n GLN 47 Ca 0.01 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 2gbo n GLN 47 Cb 0.39 -0.99 0.00 0.00 0.11 0.00 0.00 30.24 29.75 2gbo n GLN 47 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2gbo n TYR 49 N 0.26 0.00 -0.13 1.08 4.02 -0.00 -1.93 117.16 120.46 2gbo n TYR 49 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.78 2gbo n TYR 49 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.30 2gbo n TYR 49 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2gbo h GLY 50 N 0.00 0.82 0.75 2.72 0.00 -1.63 0.74 103.07 106.46 2gbo h GLY 50 Ca 0.00 -0.70 -0.02 0.00 0.00 0.00 0.00 47.33 46.61 2gbo h GLY 50 CO 0.00 0.64 -0.01 -2.75 0.00 0.00 0.00 176.54 174.42 2gbo h PHE 51 N 0.55 0.25 -0.99 5.60 3.57 -1.65 -2.69 116.94 121.59 2gbo h PHE 51 Ca 0.09 -0.05 0.09 0.00 3.53 0.00 0.00 57.97 61.63 2gbo h PHE 51 Cb 0.66 -0.06 -0.07 0.00 2.79 0.00 0.00 35.95 39.27 2gbo h PHE 51 CO 0.05 0.49 0.63 1.03 -2.23 0.00 0.00 178.31 178.29 2gbo h SER 52 N -0.07 0.97 -0.77 0.41 0.87 -1.78 -0.31 113.55 112.88 2gbo h SER 52 Ca 0.03 0.02 0.06 0.00 -1.23 0.00 0.00 61.79 60.68 2gbo h SER 52 Cb 0.40 -0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 62.13 2gbo h SER 52 CO 0.01 0.58 0.46 -0.09 -0.53 0.00 0.00 176.83 177.26 2gbo h ARG 53 N 1.08 0.82 -0.47 2.24 9.65 -0.60 -1.70 114.38 125.40 2gbo h ARG 53 Ca 0.45 -0.05 -0.06 0.00 -1.10 0.00 0.00 59.98 59.22 2gbo h ARG 53 Cb 0.30 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 28.68 2gbo h ARG 53 CO -0.20 0.54 0.05 1.96 2.80 0.00 0.00 179.97 185.12 2gbo h GLN 54 N 0.84 0.79 -0.32 0.20 1.08 -0.86 -0.25 115.11 116.60 2gbo h GLN 54 Ca 0.34 -0.22 0.07 0.00 -1.45 0.00 0.00 58.65 57.38 2gbo h GLN 54 Cb 0.18 -0.09 -0.06 0.00 -0.05 0.00 0.00 27.48 27.46 2gbo h GLN 54 CO -0.18 0.82 -0.11 0.28 -0.95 0.00 0.00 178.83 178.69 2gbo h VAL 55 N 0.66 0.62 -0.53 -0.54 2.07 -0.71 0.39 116.25 118.20 2gbo h VAL 55 Ca 0.14 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.70 2gbo h VAL 55 Cb 0.42 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 2gbo h VAL 55 CO 0.01 0.00 0.27 0.74 0.02 0.00 0.00 177.57 178.62 2gbo h THR 56 N -0.04 0.96 -0.63 2.57 2.02 -1.12 -0.92 112.91 115.75 2gbo h THR 56 Ca 0.16 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 2gbo h THR 56 Cb 0.28 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 2gbo h THR 56 CO -0.35 0.10 0.34 0.22 0.37 0.00 0.00 175.52 176.20 2gbo h TYR 57 N 0.53 0.88 -0.66 3.16 3.20 -0.69 -1.00 116.97 122.38 2gbo h TYR 57 Ca 0.23 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.04 2gbo h TYR 57 Cb 0.13 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 38.09 2gbo h TYR 57 CO -0.10 0.63 0.25 0.00 -1.64 0.00 0.00 178.16 177.30 2gbo h ALA 58 N 1.16 1.19 -0.50 1.82 0.00 -0.49 -1.93 119.26 120.51 2gbo h ALA 58 Ca 0.22 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2gbo h ALA 58 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2gbo h ALA 58 CO -0.03 0.58 0.03 1.15 0.00 0.00 0.00 179.25 180.98 2gbo h THR 59 N 0.96 1.26 -0.31 0.00 2.02 -0.70 -1.25 112.91 114.90 2gbo h THR 59 Ca 0.22 -1.02 0.01 0.00 0.77 0.00 0.00 66.41 66.39 2gbo h THR 59 Cb 0.21 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 2gbo h THR 59 CO -0.02 0.36 0.20 0.03 0.37 0.00 0.00 175.52 176.47 2gbo h ARG 60 N 0.73 0.36 0.00 6.66 2.47 -0.58 -2.20 114.38 121.82 2gbo h ARG 60 Ca 0.15 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.84 2gbo h ARG 60 Cb 0.47 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 2gbo h ARG 60 CO 0.02 0.24 -0.31 1.28 0.56 0.00 0.00 179.97 181.76 2gbo n LEU 61 N -4.49 0.60 0.00 3.04 4.77 -0.78 -4.92 117.00 115.21 2gbo n LEU 61 Ca 0.02 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 2gbo n LEU 61 Cb 0.10 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2gbo n LEU 61 CO 0.35 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 2gbo n GLY 62 N 1.38 0.68 0.26 -0.72 0.00 -0.83 -4.96 105.19 100.99 2gbo n GLY 62 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 2gbo n GLY 62 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2gbo h ILE 63 N 0.00 1.28 -3.67 -0.61 2.04 -1.48 -3.41 117.51 111.66 2gbo h ILE 63 Ca 0.00 -1.52 -0.67 0.00 1.00 0.00 0.00 64.86 63.67 2gbo h ILE 63 Cb 0.00 1.38 -0.18 0.00 -0.74 0.00 0.00 36.82 37.28 2gbo h ILE 63 CO 0.00 0.50 -0.74 -0.76 0.00 0.00 0.00 178.15 177.15 2gbo s LEU 64 N -8.81 2.99 0.77 1.44 1.43 -1.09 -4.98 118.68 110.44 2gbo s LEU 64 Ca -0.10 -0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 52.58 2gbo s LEU 64 Cb 0.12 -1.76 0.05 0.00 0.03 0.00 0.00 46.19 44.63 2gbo s LEU 64 CO 0.86 0.23 1.10 0.42 0.23 0.00 0.00 176.35 179.19 2gbo s THR 65 N -1.07 3.12 0.24 5.49 -4.23 -1.26 -4.31 115.64 113.61 2gbo s THR 65 Ca 0.18 0.36 -0.05 0.00 -1.18 0.00 0.00 61.69 61.01 2gbo s THR 65 Cb -0.11 -3.20 0.20 0.00 1.34 0.00 0.00 72.50 70.73 2gbo s THR 65 CO 0.10 -0.47 1.78 0.78 -0.54 0.00 0.00 174.62 176.26 2gbo h ASN 66 N -0.96 0.52 -0.50 3.99 2.35 -1.98 -0.96 115.58 118.04 2gbo h ASN 66 Ca -0.46 0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.32 2gbo h ASN 66 Cb 1.27 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 39.59 2gbo h ASN 66 CO 0.61 0.28 0.19 0.44 -1.65 0.00 0.00 177.43 177.30 2gbo h ASP 67 N 0.65 0.70 -0.01 5.81 3.32 -1.98 0.14 116.42 125.04 2gbo h ASP 67 Ca 0.39 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.29 2gbo h ASP 67 Cb 0.45 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 2gbo h ASP 67 CO -0.29 0.69 -0.14 -0.33 -1.72 0.00 0.00 179.24 177.45 2gbo h GLU 68 N 0.67 -0.22 -0.54 3.56 5.08 -1.79 0.20 114.58 121.55 2gbo h GLU 68 Ca 0.17 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.61 2gbo h GLU 68 Cb 0.21 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 2gbo h GLU 68 CO -0.01 -0.15 0.23 0.78 -1.00 0.00 0.00 179.01 178.86 2gbo h GLY 69 N -0.23 0.74 1.07 -3.84 0.00 -1.06 -1.89 103.07 97.86 2gbo h GLY 69 Ca 0.05 -0.14 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 2gbo h GLY 69 CO -0.14 0.05 0.04 0.84 0.00 0.00 0.00 176.54 177.33 2gbo h HIS 70 N 0.44 1.14 0.16 5.60 -0.00 -0.61 -2.70 115.15 119.18 2gbo h HIS 70 Ca 0.25 -0.18 0.01 0.00 -0.00 0.00 0.00 60.37 60.45 2gbo h HIS 70 Cb 0.24 -0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 27.33 2gbo h HIS 70 CO -0.14 0.99 -0.19 -0.09 -0.00 0.00 0.00 177.93 178.50 2gbo h ARG 71 N 0.96 -0.39 -0.35 5.26 2.43 -0.16 0.18 114.38 122.31 2gbo h ARG 71 Ca 0.18 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.44 2gbo h ARG 71 Cb 0.51 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 30.08 2gbo h ARG 71 CO 0.02 -0.26 -0.07 -0.07 -1.51 0.00 0.00 179.97 178.08 2gbo h LEU 72 N -0.40 -0.29 -0.94 3.80 3.38 -1.28 0.20 115.31 119.78 2gbo h LEU 72 Ca 0.01 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2gbo h LEU 72 Cb 0.39 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 2gbo h LEU 72 CO -0.07 -0.10 0.45 -0.07 0.09 0.00 0.00 178.44 178.74 2gbo h LEU 73 N 0.02 1.08 -1.14 1.67 3.38 -1.29 -1.73 115.31 117.30 2gbo h LEU 73 Ca 0.17 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2gbo h LEU 73 Cb 0.26 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2gbo h LEU 73 CO -0.35 0.88 0.36 -1.28 0.09 0.00 0.00 178.44 178.14 2gbo h SER 74 N 1.20 0.86 -0.49 -0.43 0.87 0.41 -0.35 113.55 115.62 2gbo h SER 74 Ca 0.30 -0.07 -0.07 0.00 -1.23 0.00 0.00 61.79 60.72 2gbo h SER 74 Cb 0.05 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.77 2gbo h SER 74 CO -0.05 0.70 0.04 0.44 -0.53 0.00 0.00 176.83 177.44 2gbo h ASP 75 N 0.96 0.81 -0.51 6.23 3.32 0.22 -1.07 116.42 126.38 2gbo h ASP 75 Ca 0.24 -0.28 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 2gbo h ASP 75 Cb 0.05 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 2gbo h ASP 75 CO -0.04 0.89 0.15 -0.07 -1.72 0.00 0.00 179.24 178.45 2gbo h LEU 76 N 0.70 0.76 -0.92 1.55 3.38 -1.23 -1.89 115.31 117.68 2gbo h LEU 76 Ca 0.14 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.94 2gbo h LEU 76 Cb 0.45 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 2gbo h LEU 76 CO 0.02 0.78 0.59 -0.08 0.09 0.00 0.00 178.44 179.84 2gbo h GLU 77 N 0.70 1.10 -0.49 1.13 4.81 -0.89 -1.77 114.58 119.18 2gbo h GLU 77 Ca 0.16 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 2gbo h GLU 77 Cb 0.30 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2gbo h GLU 77 CO -0.00 0.73 0.09 -0.09 -0.73 0.00 0.00 179.01 179.00 2gbo h ARG 78 N 1.13 0.81 -0.73 1.92 2.43 -1.01 -2.80 114.38 116.13 2gbo h ARG 78 Ca 0.37 -0.21 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2gbo h ARG 78 Cb 0.04 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 2gbo h ARG 78 CO -0.13 0.80 0.49 1.49 -1.51 0.00 0.00 179.97 181.11 2gbo h GLU 79 N 0.69 0.96 -0.27 0.20 4.57 -1.02 -1.91 114.58 117.80 2gbo h GLU 79 Ca 0.15 -0.06 0.03 0.00 -1.18 0.00 0.00 59.36 58.31 2gbo h GLU 79 Cb 0.38 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.74 2gbo h GLU 79 CO 0.01 0.64 0.18 -0.07 -1.18 0.00 0.00 179.01 178.59 2gbo h LEU 80 N 0.99 0.19 -3.46 1.64 3.38 -1.13 0.16 115.31 117.09 2gbo h LEU 80 Ca 0.27 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.11 2gbo h LEU 80 Cb -0.11 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.52 2gbo h LEU 80 CO -0.06 0.13 0.17 0.59 0.09 0.00 0.00 178.44 179.36 2gbo n ASN 81 N -4.49 4.85 0.00 -0.43 3.02 -0.87 -5.12 115.26 112.22 2gbo n ASN 81 Ca 0.02 -3.02 0.00 0.00 -0.03 0.00 0.00 54.58 51.55 2gbo n ASN 81 Cb 0.18 -0.71 0.00 0.00 -0.61 0.00 0.00 39.78 38.64 2gbo n ASN 81 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64