#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gxf h GLN 3 N 0.00 0.00 -0.94 5.31 1.08 -2.05 -3.04 115.11 115.47 2gxf h GLN 3 Ca 0.00 0.00 0.22 0.00 -1.45 0.00 0.00 58.65 57.42 2gxf h GLN 3 Cb 0.00 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.36 2gxf h GLN 3 CO 0.00 0.37 0.62 -0.56 -0.95 0.00 0.00 178.83 178.31 2gxf h GLN 4 N -1.00 0.40 -0.17 1.46 3.07 -2.05 0.90 115.11 117.72 2gxf h GLN 4 Ca -0.07 -0.02 -0.06 0.00 0.09 0.00 0.00 58.65 58.58 2gxf h GLN 4 Cb 0.61 -0.09 -0.00 0.00 0.08 0.00 0.00 27.48 28.08 2gxf h GLN 4 CO -0.05 0.27 -0.15 -0.07 0.09 0.00 0.00 178.83 178.92 2gxf h LEU 5 N 0.42 0.42 -2.31 0.06 3.38 -2.00 0.10 115.31 115.38 2gxf h LEU 5 Ca 0.50 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2gxf h LEU 5 Cb 1.24 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 2gxf h LEU 5 CO -0.20 0.80 -0.04 0.50 0.09 0.00 0.00 178.44 179.58 2gxf h LYS 6 N 0.04 0.00 0.00 1.13 3.64 0.11 0.24 116.57 121.73 2gxf h LYS 6 Ca 0.03 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.25 2gxf h LYS 6 Cb 0.67 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 2gxf h LYS 6 CO 0.04 0.04 -0.91 -0.44 -2.27 0.00 0.00 179.45 175.91 2gxf h ASP 7 N 0.00 0.00 0.55 4.20 3.45 0.98 -3.03 116.42 122.57 2gxf h ASP 7 Ca -0.00 0.00 -0.22 0.00 0.43 0.00 0.00 57.03 57.24 2gxf h ASP 7 Cb 0.14 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.91 2gxf h ASP 7 CO 0.01 0.71 -0.98 0.40 -1.57 0.00 0.00 179.24 177.80 2gxf h ILE 8 N 0.00 1.48 0.35 0.35 2.04 0.85 -1.02 117.51 121.56 2gxf h ILE 8 Ca -0.06 -2.71 -0.02 0.00 1.00 0.00 0.00 64.86 63.07 2gxf h ILE 8 Cb 1.59 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 40.25 2gxf h ILE 8 CO 0.08 0.80 -0.17 0.40 0.00 0.00 0.00 178.15 179.26 2gxf h ILE 9 N 0.13 0.67 -0.69 -0.67 1.08 -1.07 -1.03 117.51 115.92 2gxf h ILE 9 Ca -0.07 -0.22 0.02 0.00 -0.39 0.00 0.00 64.86 64.20 2gxf h ILE 9 Cb 1.64 0.78 -0.04 0.00 -3.07 0.00 0.00 36.82 36.14 2gxf h ILE 9 CO 0.16 0.04 0.45 0.77 -0.69 0.00 0.00 178.15 178.88 2gxf h SER 10 N -0.59 0.76 -0.63 1.72 4.64 -1.57 0.27 113.55 118.15 2gxf h SER 10 Ca -0.05 -0.01 0.08 0.00 -0.47 0.00 0.00 61.79 61.34 2gxf h SER 10 Cb 0.43 -0.18 -0.07 0.00 -0.31 0.00 0.00 62.40 62.28 2gxf h SER 10 CO 0.08 0.54 0.28 0.00 -0.87 0.00 0.00 176.83 176.86 2gxf h ALA 11 N 1.27 0.83 -0.17 5.18 0.00 -1.03 0.10 119.26 125.45 2gxf h ALA 11 Ca 0.26 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 2gxf h ALA 11 Cb -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2gxf h ALA 11 CO -0.08 -0.12 -0.19 0.00 0.00 0.00 0.00 179.25 178.86 2gxf h ASP 13 N 0.07 0.48 0.17 0.00 1.82 0.04 0.30 116.42 119.29 2gxf h ASP 13 Ca 0.02 0.04 -0.22 0.00 -0.39 0.00 0.00 57.03 56.48 2gxf h ASP 13 Cb 0.75 -0.06 0.03 0.00 0.68 0.00 0.00 39.33 40.73 2gxf h ASP 13 CO 0.05 0.23 -0.99 0.25 -1.61 0.00 0.00 179.24 177.17 2gxf h LEU 14 N 0.50 0.56 -2.26 2.28 5.85 -0.68 -2.97 115.31 118.59 2gxf h LEU 14 Ca 0.43 -0.95 0.04 0.00 0.84 0.00 0.00 57.88 58.25 2gxf h LEU 14 Cb 0.93 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2gxf h LEU 14 CO -0.17 1.48 0.23 0.00 -0.34 0.00 0.00 178.44 179.64 2gxf h ALA 15 N 0.10 1.61 0.17 1.25 0.00 0.36 0.72 119.26 123.47 2gxf h ALA 15 Ca -0.17 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.41 2gxf h ALA 15 Cb 1.78 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.58 2gxf h ALA 15 CO 0.18 -0.30 -1.57 0.82 0.00 0.00 0.00 179.25 178.37 2gxf h ILE 16 N 0.00 1.13 -0.49 0.00 2.04 -1.01 -1.73 117.51 117.45 2gxf h ILE 16 Ca 0.07 -2.71 -0.12 0.00 1.00 0.00 0.00 64.86 63.10 2gxf h ILE 16 Cb 0.53 2.83 -0.02 0.00 -0.74 0.00 0.00 36.82 39.42 2gxf h ILE 16 CO -0.00 0.84 -0.17 1.56 0.00 0.00 0.00 178.15 180.38 2gxf h GLN 17 N 0.10 0.97 0.00 2.37 4.20 -0.76 -1.89 115.11 120.09 2gxf h GLN 17 Ca -0.27 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.06 2gxf h GLN 17 Cb 2.07 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.80 2gxf h GLN 17 CO 0.19 1.05 0.00 0.09 -0.67 0.00 0.00 178.83 179.49 2gxf n ASN 18 N -4.13 0.00 -4.15 1.46 5.03 -0.32 -4.87 115.26 108.27 2gxf n ASN 18 Ca 0.01 -1.79 -0.35 0.00 0.87 0.00 0.00 54.58 53.32 2gxf n ASN 18 Cb 0.43 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.14 2gxf n ASN 18 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2gxf n GLU 19 N -0.56 -1.87 -3.11 3.52 1.02 -0.71 -4.85 120.64 114.08 2gxf n GLU 19 Ca 0.03 0.22 -0.33 0.00 -0.02 0.00 0.00 57.16 57.06 2gxf n GLU 19 Cb 0.01 -4.85 -0.04 0.00 -0.02 0.00 0.00 31.44 26.55 2gxf n GLU 19 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2gxf n ASP 20 N -2.41 5.09 0.06 1.62 5.75 -0.66 -4.84 116.55 121.16 2gxf n ASP 20 Ca 0.09 -3.52 0.04 0.00 -0.01 0.00 0.00 54.79 51.38 2gxf n ASP 20 Cb 0.47 -0.87 0.20 0.00 -1.03 0.00 0.00 41.12 39.89 2gxf n ASP 20 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2gxf n PHE 21 N 0.62 0.25 0.05 2.11 3.01 -1.26 -1.43 117.46 120.81 2gxf n PHE 21 Ca 0.31 0.13 -0.03 0.00 1.01 0.00 0.00 57.45 58.88 2gxf n PHE 21 Cb 0.37 -0.70 0.22 0.00 -0.01 0.00 0.00 39.48 39.35 2gxf n PHE 21 CO 0.00 0.00 0.00 0.38 1.01 0.00 0.00 176.76 178.15 2gxf h ASP 22 N 0.00 0.39 0.77 4.37 3.04 -1.92 -2.88 116.42 120.20 2gxf h ASP 22 Ca 0.00 -0.14 -0.00 0.00 -3.24 0.00 0.00 57.03 53.64 2gxf h ASP 22 Cb 0.01 -0.11 -0.00 0.00 -1.04 0.00 0.00 39.33 38.19 2gxf h ASP 22 CO 0.00 0.69 -1.23 0.35 -2.04 0.00 0.00 179.24 177.01 2gxf n THR 23 N -4.09 0.50 -0.33 1.15 -2.24 -0.51 -4.42 114.28 104.34 2gxf n THR 23 Ca -0.01 -0.54 -0.01 0.00 -2.27 0.00 0.00 64.05 61.22 2gxf n THR 23 Cb 0.43 -0.28 -0.01 0.00 -2.10 0.00 0.00 70.33 68.37 2gxf n THR 23 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2gxf n LEU 24 N -2.59 3.04 0.00 3.22 7.94 -1.09 -4.33 117.00 123.20 2gxf n LEU 24 Ca -0.01 -1.47 0.00 0.00 -1.11 0.00 0.00 56.01 53.42 2gxf n LEU 24 Cb 0.56 -0.67 0.00 0.00 0.53 0.00 0.00 43.42 43.84 2gxf n LEU 24 CO 0.41 0.60 0.00 0.59 -1.11 0.00 0.00 177.39 177.89 2gxf n ASN 26 N 1.86 0.00 -0.08 1.96 5.03 -1.26 -4.05 115.26 118.72 2gxf n ASN 26 Ca 0.04 0.00 0.11 0.00 0.87 0.00 0.00 54.58 55.60 2gxf n ASN 26 Cb 0.32 -0.55 0.03 0.00 -1.02 0.00 0.00 39.78 38.56 2gxf n ASN 26 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2gxf n TYR 27 N -0.75 0.00 -3.97 3.10 4.01 -1.26 -4.94 117.16 113.34 2gxf n TYR 27 Ca 0.00 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.48 2gxf n TYR 27 Cb 0.00 -0.08 -0.04 0.00 -0.31 0.00 0.00 39.34 38.92 2gxf n TYR 27 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2gxf s TYR 28 N -2.90 3.41 0.87 -0.72 2.02 -1.26 0.21 117.35 118.99 2gxf s TYR 28 Ca 0.11 0.10 -0.13 0.00 -0.37 0.00 0.00 57.07 56.78 2gxf s TYR 28 Cb 0.17 -1.64 0.15 0.00 -0.40 0.00 0.00 41.96 40.24 2gxf s TYR 28 CO 0.76 0.52 1.22 -1.54 -1.57 0.00 0.00 175.55 174.95 2gxf s SER 29 N -3.15 3.78 0.11 2.29 1.04 0.51 -4.70 113.70 113.58 2gxf s SER 29 Ca 0.34 0.37 -0.08 0.00 0.48 0.00 0.00 55.95 57.05 2gxf s SER 29 Cb -0.11 -0.63 -0.15 0.00 0.10 0.00 0.00 66.02 65.23 2gxf s SER 29 CO 0.27 -2.31 1.26 -0.08 0.98 0.00 0.00 173.24 173.37 2gxf h GLU 30 N -1.27 0.55 -0.60 4.02 4.57 -1.98 -3.27 114.58 116.59 2gxf h GLU 30 Ca -0.44 -0.58 -0.11 0.00 -1.18 0.00 0.00 59.36 57.06 2gxf h GLU 30 Cb 1.27 0.16 -0.06 0.00 -0.16 0.00 0.00 28.75 29.96 2gxf h GLU 30 CO 0.48 1.20 0.12 -0.40 -1.18 0.00 0.00 179.01 179.23 2gxf n ASP 31 N -3.80 4.98 -4.55 1.04 5.75 -1.26 -2.07 116.55 116.64 2gxf n ASP 31 Ca -0.08 -3.11 -0.29 0.00 -0.01 0.00 0.00 54.79 51.29 2gxf n ASP 31 Cb 0.85 -0.69 0.22 0.00 -1.03 0.00 0.00 41.12 40.46 2gxf n ASP 31 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gxf n ALA 32 N 0.05 -2.10 -2.85 2.12 0.00 -1.23 -4.46 120.51 112.03 2gxf n ALA 32 Ca 0.33 -0.94 -0.18 0.00 0.00 0.00 0.00 53.44 52.65 2gxf n ALA 32 Cb 1.24 -2.07 -0.15 0.00 0.00 0.00 0.00 19.45 18.47 2gxf n ALA 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2gxf s VAL 33 N -2.50 0.62 -0.07 0.00 -7.23 0.15 -1.35 120.40 110.03 2gxf s VAL 33 Ca 0.68 -0.31 0.02 0.00 -1.81 0.00 0.00 61.98 60.56 2gxf s VAL 33 Cb -0.24 -0.54 0.01 0.00 0.56 0.00 0.00 36.38 36.17 2gxf s VAL 33 CO 0.62 0.19 -0.11 -0.22 -0.31 0.00 0.00 175.10 175.27 2gxf s LEU 34 N -0.01 1.58 -0.46 1.32 1.98 -0.09 -1.60 118.68 121.39 2gxf s LEU 34 Ca 0.00 -0.29 -0.22 0.00 -2.89 0.00 0.00 54.13 50.74 2gxf s LEU 34 Cb -0.05 -0.80 0.03 0.00 0.66 0.00 0.00 46.19 46.03 2gxf s LEU 34 CO -0.00 0.01 0.74 -0.69 -1.89 0.00 0.00 176.35 174.52 2gxf s VAL 35 N 0.78 4.70 -0.04 1.68 1.01 -0.38 -0.75 120.40 127.39 2gxf s VAL 35 Ca -0.12 0.22 -0.24 0.00 0.00 0.00 0.00 61.98 61.83 2gxf s VAL 35 Cb -0.15 -4.31 -0.22 0.00 0.00 0.00 0.00 36.38 31.69 2gxf s VAL 35 CO 0.02 -0.74 1.07 0.58 0.00 0.00 0.00 175.10 176.04 2gxf h VAL 36 N 5.94 1.52 -2.62 2.92 2.07 -1.93 -3.42 116.25 120.73 2gxf h VAL 36 Ca -0.25 -1.81 0.01 0.00 0.82 0.00 0.00 66.70 65.46 2gxf h VAL 36 Cb 1.09 2.65 -0.14 0.00 -1.52 0.00 0.00 31.29 33.36 2gxf h VAL 36 CO 0.96 0.50 0.29 -1.59 0.02 0.00 0.00 177.57 177.74 2gxf s LYS 37 N -3.32 1.11 0.05 1.57 0.00 -1.26 -5.08 119.74 112.81 2gxf s LYS 37 Ca -0.16 -0.30 -0.38 0.00 0.00 0.00 0.00 55.97 55.13 2gxf s LYS 37 Cb 0.01 0.51 -0.18 0.00 0.00 0.00 0.00 37.83 38.17 2gxf s LYS 37 CO 0.73 -0.46 1.12 -2.30 0.00 0.00 0.00 175.35 174.44 2gxf n PRO 38 N -0.12 0.45 -2.75 1.78 -0.02 -1.26 -4.61 135.00 128.47 2gxf n PRO 38 Ca -0.15 0.16 -0.02 0.00 -2.02 0.00 0.00 63.50 61.47 2gxf n PRO 38 Cb 0.63 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 2gxf n PRO 38 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gxf n GLY 39 N 1.89 -1.13 3.65 -1.23 0.00 -1.26 -5.24 105.19 101.86 2gxf n GLY 39 Ca 0.19 0.59 -0.01 0.00 0.00 0.00 0.00 46.02 46.78 2gxf n GLY 39 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gxf s ILE 41 N -2.78 0.00 -0.12 -0.61 -4.36 -1.26 -5.12 121.20 106.95 2gxf s ILE 41 Ca 0.07 0.00 0.01 0.00 -0.26 0.00 0.00 60.65 60.46 2gxf s ILE 41 Cb -0.02 -1.00 -0.01 0.00 1.25 0.00 0.00 42.46 42.68 2gxf s ILE 41 CO 0.63 0.00 -0.14 0.00 0.24 0.00 0.00 174.94 175.67 2gxf s ALA 42 N -1.04 2.59 -0.08 2.27 0.00 0.07 -4.95 121.76 120.62 2gxf s ALA 42 Ca 0.10 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.19 2gxf s ALA 42 Cb -0.01 -1.16 -0.01 0.00 0.00 0.00 0.00 23.12 21.94 2gxf s ALA 42 CO -0.08 0.28 -0.18 1.03 0.00 0.00 0.00 175.76 176.80 2gxf s ARG 43 N 0.25 2.86 0.00 0.00 0.52 -1.26 -0.92 118.95 120.39 2gxf s ARG 43 Ca -0.09 -0.78 0.00 0.00 -0.52 0.00 0.00 55.73 54.33 2gxf s ARG 43 Cb -0.16 -2.38 0.00 0.00 0.52 0.00 0.00 34.95 32.93 2gxf s ARG 43 CO 0.05 0.37 0.00 0.41 0.02 0.00 0.00 175.30 176.15 2gxf n GLY 44 N 3.03 -0.02 0.37 -3.53 0.00 -0.46 -4.02 105.19 100.56 2gxf n GLY 44 Ca -0.18 -1.54 0.07 0.00 0.00 0.00 0.00 46.02 44.38 2gxf n GLY 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gxf h LYS 45 N 0.00 0.91 0.55 1.61 1.57 -1.63 -2.21 116.57 117.37 2gxf h LYS 45 Ca 0.00 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2gxf h LYS 45 Cb 0.00 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.11 2gxf h LYS 45 CO 0.00 0.60 -0.27 1.49 -0.57 0.00 0.00 179.45 180.70 2gxf h GLU 46 N 0.93 -0.72 -0.88 3.15 4.81 -1.88 -0.90 114.58 119.10 2gxf h GLU 46 Ca 0.46 0.05 0.11 0.00 -0.13 0.00 0.00 59.36 59.84 2gxf h GLU 46 Cb 0.46 0.16 -0.07 0.00 0.63 0.00 0.00 28.75 29.94 2gxf h GLU 46 CO -0.22 -0.41 0.57 0.93 -0.73 0.00 0.00 179.01 179.15 2gxf h GLU 47 N -0.97 0.79 -0.32 1.92 5.08 -1.66 -1.41 114.58 118.00 2gxf h GLU 47 Ca -0.08 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.09 2gxf h GLU 47 Cb 0.64 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2gxf h GLU 47 CO 0.12 0.53 -0.38 0.82 -1.00 0.00 0.00 179.01 179.10 2gxf h ILE 48 N 0.82 1.28 -0.10 3.13 2.04 -1.35 -1.66 117.51 121.66 2gxf h ILE 48 Ca 0.42 -1.55 -0.00 0.00 1.00 0.00 0.00 64.86 64.72 2gxf h ILE 48 Cb 0.49 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2gxf h ILE 48 CO -0.18 0.51 0.05 0.50 0.00 0.00 0.00 178.15 179.02 2gxf h LYS 49 N 0.63 0.15 -0.54 2.37 3.64 -0.14 -2.42 116.57 120.25 2gxf h LYS 49 Ca 0.05 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.45 2gxf h LYS 49 Cb 0.93 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.68 2gxf h LYS 49 CO 0.09 0.22 0.30 0.87 -2.27 0.00 0.00 179.45 178.65 2gxf h LYS 50 N 0.04 0.56 -0.56 1.90 1.57 -1.22 -1.71 116.57 117.15 2gxf h LYS 50 Ca 0.04 -0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 2gxf h LYS 50 Cb 0.12 -0.13 -0.07 0.00 0.08 0.00 0.00 32.23 32.23 2gxf h LYS 50 CO -0.00 0.37 0.18 0.00 -0.57 0.00 0.00 179.45 179.42 2gxf h ALA 51 N 1.27 0.69 -0.50 3.86 0.00 -1.06 0.19 119.26 123.71 2gxf h ALA 51 Ca 0.23 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 2gxf h ALA 51 Cb 0.10 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2gxf h ALA 51 CO -0.14 -0.23 0.05 0.74 0.00 0.00 0.00 179.25 179.66 2gxf h PHE 52 N 0.34 0.92 -0.63 0.00 0.04 -1.06 -0.48 116.94 116.06 2gxf h PHE 52 Ca 0.28 -0.14 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 2gxf h PHE 52 Cb 0.35 -0.25 -0.03 0.00 2.20 0.00 0.00 35.95 38.22 2gxf h PHE 52 CO -0.19 0.85 0.36 0.82 -0.60 0.00 0.00 178.31 179.55 2gxf h ILE 53 N 0.72 1.19 0.89 -0.55 2.04 -0.65 -1.02 117.51 120.13 2gxf h ILE 53 Ca 0.15 -0.47 -0.04 0.00 1.00 0.00 0.00 64.86 65.49 2gxf h ILE 53 Cb 0.45 0.36 0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2gxf h ILE 53 CO 0.02 0.21 -0.43 0.74 0.00 0.00 0.00 178.15 178.69 2gxf h THR 54 N 0.86 0.00 0.00 -0.27 2.02 -0.35 -2.74 112.91 112.43 2gxf h THR 54 Ca 0.22 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.30 2gxf h THR 54 Cb 0.02 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.43 2gxf h THR 54 CO -0.04 0.00 0.00 2.30 0.37 0.00 0.00 175.52 178.15 2gxf n ILE 55 N -5.50 0.04 -0.12 3.11 -5.35 -0.22 -3.99 119.36 107.33 2gxf n ILE 55 Ca -0.15 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.24 2gxf n ILE 55 Cb 0.47 -0.42 -0.01 0.00 -1.74 0.00 0.00 39.64 37.94 2gxf n ILE 55 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2gxf h ALA 56 N 1.81 0.49 0.00 -1.28 0.00 -0.85 -3.30 119.26 116.12 2gxf h ALA 56 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2gxf h ALA 56 Cb 0.42 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2gxf h ALA 56 CO 0.00 0.04 -1.51 0.27 0.00 0.00 0.00 179.25 178.06 2gxf n ASN 57 N -4.72 1.78 -0.96 0.00 0.23 -1.26 -4.43 115.26 105.91 2gxf n ASN 57 Ca -0.00 -0.09 -0.01 0.00 -0.53 0.00 0.00 54.58 53.95 2gxf n ASN 57 Cb 0.11 1.55 0.07 0.00 -2.08 0.00 0.00 39.78 39.42 2gxf n ASN 57 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2gxf n TYR 58 N -1.90 0.50 -3.67 -2.53 4.19 -1.25 -4.61 117.16 107.90 2gxf n TYR 58 Ca -0.02 -0.38 -0.17 0.00 3.31 0.00 0.00 57.90 60.64 2gxf n TYR 58 Cb 0.34 -0.26 -0.16 0.00 0.49 0.00 0.00 39.34 39.74 2gxf n TYR 58 CO 0.00 0.00 0.00 -0.06 0.91 0.00 0.00 176.86 177.71 2gxf s PHE 59 N -1.11 -0.13 -1.16 2.98 0.40 -1.24 -5.00 117.98 112.72 2gxf s PHE 59 Ca 0.11 0.53 -0.18 0.00 -0.60 0.00 0.00 56.93 56.80 2gxf s PHE 59 Cb 0.09 -0.30 0.11 0.00 0.51 0.00 0.00 43.02 43.43 2gxf s PHE 59 CO 0.03 -0.25 1.49 1.21 0.70 0.00 0.00 175.22 178.40 2gxf s ASN 60 N 2.21 6.83 0.00 1.36 2.47 -1.26 -4.95 114.94 121.60 2gxf s ASN 60 Ca 0.03 -2.39 0.00 0.00 0.42 0.00 0.00 52.86 50.91 2gxf s ASN 60 Cb -0.12 -2.49 0.00 0.00 -1.45 0.00 0.00 41.25 37.19 2gxf s ASN 60 CO -0.05 -1.07 0.00 1.41 -3.72 0.00 0.00 177.10 173.67 2gxf n HIS 61 N 7.29 0.00 -4.19 0.43 8.25 -1.26 -4.56 115.22 121.18 2gxf n HIS 61 Ca 0.38 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.50 2gxf n HIS 61 Cb 0.46 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.54 2gxf n HIS 61 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2gxf n HIS 62 N 0.00 -1.69 -1.25 4.41 8.25 -1.26 -4.83 115.22 118.84 2gxf n HIS 62 Ca 0.00 0.78 -0.07 0.00 -0.26 0.00 0.00 57.72 58.17 2gxf n HIS 62 Cb 0.00 -3.06 0.23 0.00 1.12 0.00 0.00 29.99 28.28 2gxf n HIS 62 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2gxf n ILE 63 N -4.39 2.73 -3.80 1.59 -0.00 -1.26 -4.97 119.36 109.26 2gxf n ILE 63 Ca -0.01 -2.21 -0.25 0.00 -0.00 0.00 0.00 62.75 60.28 2gxf n ILE 63 Cb 0.53 -0.35 -0.02 0.00 -0.00 0.00 0.00 39.64 39.80 2gxf n ILE 63 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 176.55 177.10 2gxf n VAL 64 N -0.85 -1.14 -1.68 1.39 3.14 -1.26 -4.73 118.33 113.20 2gxf n VAL 64 Ca 0.39 -0.34 -0.44 0.00 -2.96 0.00 0.00 64.34 60.99 2gxf n VAL 64 Cb 1.23 -1.01 -0.04 0.00 -1.06 0.00 0.00 33.84 32.96 2gxf n VAL 64 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 2gxf n PRO 65 N -3.38 2.58 -3.10 1.45 -0.04 -1.26 -4.91 135.00 126.34 2gxf n PRO 65 Ca -0.13 0.94 -0.41 0.00 -0.04 0.00 0.00 63.50 63.86 2gxf n PRO 65 Cb 0.39 -2.82 -0.06 0.00 -0.04 0.00 0.00 33.50 30.97 2gxf n PRO 65 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2gxf s THR 66 N 3.15 4.98 0.28 0.52 2.01 0.13 -4.89 115.64 121.81 2gxf s THR 66 Ca 0.85 1.16 -0.30 0.00 0.31 0.00 0.00 61.69 63.71 2gxf s THR 66 Cb -0.55 -3.94 -0.12 0.00 0.01 0.00 0.00 72.50 67.89 2gxf s THR 66 CO 0.42 0.03 1.49 1.67 -0.69 0.00 0.00 174.62 177.54 2gxf n GLN 67 N 5.67 2.39 0.00 4.92 -0.06 -1.26 0.15 117.38 129.19 2gxf n GLN 67 Ca -0.00 0.85 0.00 0.00 -2.00 0.00 0.00 57.00 55.85 2gxf n GLN 67 Cb 0.49 -2.56 0.00 0.00 -4.06 0.00 0.00 30.24 24.10 2gxf n GLN 67 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2gxf n GLY 68 N 1.98 6.15 2.19 1.69 0.00 0.39 -4.77 105.19 112.83 2gxf n GLY 68 Ca 0.09 -1.74 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 2gxf n GLY 68 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2gxf n LYS 69 N 0.00 -1.42 -3.59 1.61 4.81 -1.26 -4.55 118.16 113.76 2gxf n LYS 69 Ca 0.00 -0.60 -0.16 0.00 -0.87 0.00 0.00 58.31 56.68 2gxf n LYS 69 Cb 0.00 -1.10 -0.07 0.00 0.02 0.00 0.00 35.03 33.88 2gxf n LYS 69 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2gxf s ILE 71 N -1.65 0.00 -0.13 3.15 1.01 -0.54 -0.46 121.20 122.59 2gxf s ILE 71 Ca 0.27 -0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.93 2gxf s ILE 71 Cb -0.05 -0.97 0.02 0.00 0.01 0.00 0.00 42.46 41.46 2gxf s ILE 71 CO 0.23 -0.01 -0.16 -0.76 0.00 0.00 0.00 174.94 174.24 2gxf s LEU 72 N -0.38 1.79 -0.42 2.97 1.02 -1.26 -0.49 118.68 121.91 2gxf s LEU 72 Ca -0.05 -0.48 -0.04 0.00 0.02 0.00 0.00 54.13 53.58 2gxf s LEU 72 Cb -0.03 -1.19 0.11 0.00 0.02 0.00 0.00 46.19 45.11 2gxf s LEU 72 CO 0.05 0.01 0.23 -0.76 0.02 0.00 0.00 176.35 175.89 2gxf s LEU 73 N 1.10 5.30 -0.15 1.79 1.43 0.15 -4.97 118.68 123.33 2gxf s LEU 73 Ca -0.03 -1.98 -0.13 0.00 -1.03 0.00 0.00 54.13 50.95 2gxf s LEU 73 Cb -0.14 -1.86 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 2gxf s LEU 73 CO -0.04 -0.56 0.29 -0.70 0.23 0.00 0.00 176.35 175.56 2gxf s GLU 74 N 1.19 4.19 -0.51 1.70 2.12 -1.26 0.13 118.70 126.25 2gxf s GLU 74 Ca 0.07 0.10 0.07 0.00 0.36 0.00 0.00 54.97 55.57 2gxf s GLU 74 Cb -0.23 -3.40 0.28 0.00 0.26 0.00 0.00 34.13 31.04 2gxf s GLU 74 CO -0.03 0.29 0.72 0.00 -0.54 0.00 0.00 175.26 175.70 2gxf n ALA 75 N 3.39 3.39 -0.87 6.30 0.00 -0.53 -5.01 120.51 127.18 2gxf n ALA 75 Ca -0.12 -4.15 0.00 0.00 0.00 0.00 0.00 53.44 49.16 2gxf n ALA 75 Cb 0.52 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2gxf n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gxf n GLY 76 N 0.72 0.51 0.09 0.00 0.00 -1.26 -3.36 105.19 101.89 2gxf n GLY 76 Ca 0.27 0.56 -0.10 0.00 0.00 0.00 0.00 46.02 46.75 2gxf n GLY 76 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2gxf h ASP 77 N 0.00 0.15 -1.21 1.61 -0.00 -1.96 -3.46 116.42 111.55 2gxf h ASP 77 Ca 0.00 -0.00 -0.53 0.00 -0.00 0.00 0.00 57.03 56.49 2gxf h ASP 77 Cb 0.00 -0.03 -0.04 0.00 -0.00 0.00 0.00 39.33 39.25 2gxf h ASP 77 CO 0.00 0.11 -0.37 0.42 -0.00 0.00 0.00 179.24 179.40 2gxf s THR 78 N -6.18 2.26 -0.12 2.25 -4.23 -1.21 -2.35 115.64 106.06 2gxf s THR 78 Ca -0.13 -1.44 -0.05 0.00 -1.18 0.00 0.00 61.69 58.88 2gxf s THR 78 Cb 0.08 -2.70 0.06 0.00 1.34 0.00 0.00 72.50 71.27 2gxf s THR 78 CO 0.68 0.00 0.27 -0.69 -0.54 0.00 0.00 174.62 174.35 2gxf s VAL 79 N -2.60 -0.21 -0.33 2.29 1.01 0.13 -1.45 120.40 119.26 2gxf s VAL 79 Ca 0.43 0.19 -0.15 0.00 0.00 0.00 0.00 61.98 62.45 2gxf s VAL 79 Cb -0.02 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 2gxf s VAL 79 CO 0.25 0.08 0.36 -0.22 0.00 0.00 0.00 175.10 175.57 2gxf s LEU 80 N 1.77 4.34 -0.22 3.92 2.96 0.12 -1.71 118.68 129.85 2gxf s LEU 80 Ca -0.05 -0.12 -0.10 0.00 -0.22 0.00 0.00 54.13 53.65 2gxf s LEU 80 Cb -0.11 -2.35 -0.05 0.00 0.50 0.00 0.00 46.19 44.19 2gxf s LEU 80 CO -0.09 -0.30 0.13 -0.69 -1.32 0.00 0.00 176.35 174.08 2gxf s VAL 81 N 2.02 5.19 -0.75 1.68 1.01 0.12 -0.68 120.40 129.00 2gxf s VAL 81 Ca 0.12 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.18 2gxf s VAL 81 Cb -0.16 -3.40 0.19 0.00 0.00 0.00 0.00 36.38 33.01 2gxf s VAL 81 CO 0.11 0.38 0.61 -0.76 0.00 0.00 0.00 175.10 175.45 2gxf s LEU 82 N 0.83 5.56 -0.22 3.92 1.43 0.35 -1.08 118.68 129.47 2gxf s LEU 82 Ca 0.07 -3.14 -0.19 0.00 -1.03 0.00 0.00 54.13 49.84 2gxf s LEU 82 Cb -0.13 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 2gxf s LEU 82 CO 0.02 -0.33 0.54 -0.55 0.23 0.00 0.00 176.35 176.27 2gxf s SER 83 N 0.61 6.54 -0.12 2.29 0.15 -0.93 -1.47 113.70 120.77 2gxf s SER 83 Ca 0.21 0.65 -0.12 0.00 0.70 0.00 0.00 55.95 57.39 2gxf s SER 83 Cb -0.15 -2.30 -0.05 0.00 -1.71 0.00 0.00 66.02 61.82 2gxf s SER 83 CO -0.07 -0.25 0.25 -1.58 1.20 0.00 0.00 173.24 172.79 2gxf s GLN 84 N 1.97 3.95 -0.12 5.44 0.74 0.40 -1.05 119.66 130.98 2gxf s GLN 84 Ca 0.24 0.05 0.03 0.00 0.05 0.00 0.00 55.36 55.73 2gxf s GLN 84 Cb -0.16 -3.32 0.01 0.00 1.10 0.00 0.00 33.01 30.65 2gxf s GLN 84 CO 0.09 0.49 -0.22 0.99 -0.55 0.00 0.00 175.29 176.10 2gxf s THR 85 N -0.29 1.99 0.02 -0.34 2.01 -0.26 -0.46 115.64 118.32 2gxf s THR 85 Ca 0.16 -0.96 -0.15 0.00 0.31 0.00 0.00 61.69 61.06 2gxf s THR 85 Cb -0.13 -1.75 -0.06 0.00 0.01 0.00 0.00 72.50 70.57 2gxf s THR 85 CO 0.05 0.54 0.44 -0.76 -0.69 0.00 0.00 174.62 174.20 2gxf s LEU 86 N 0.66 4.47 -0.10 4.42 1.43 0.12 0.43 118.68 130.10 2gxf s LEU 86 Ca -0.11 1.00 -0.15 0.00 -1.03 0.00 0.00 54.13 53.84 2gxf s LEU 86 Cb -0.16 -2.68 -0.27 0.00 0.03 0.00 0.00 46.19 43.10 2gxf s LEU 86 CO 0.02 0.30 0.54 0.25 0.23 0.00 0.00 176.35 177.69 2gxf h LEU 87 N 4.57 0.40 0.00 1.79 5.85 -1.93 0.40 115.31 126.39 2gxf h LEU 87 Ca -0.51 -0.86 -0.10 0.00 0.84 0.00 0.00 57.88 57.24 2gxf h LEU 87 Cb 1.22 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 2gxf h LEU 87 CO 0.62 1.66 -1.49 0.47 -0.34 0.00 0.00 178.44 179.36 2gxf n ASP 88 N -3.86 3.09 -4.08 1.25 9.92 -1.26 -4.77 116.55 116.85 2gxf n ASP 88 Ca -0.26 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 53.92 2gxf n ASP 88 Cb 0.93 0.87 -0.09 0.00 -0.64 0.00 0.00 41.12 42.18 2gxf n ASP 88 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 2gxf s GLU 99 N -2.29 0.83 -0.26 -1.24 -1.05 -1.26 -4.95 118.70 108.49 2gxf s GLU 99 Ca -0.04 -1.28 -0.03 0.00 -0.15 0.00 0.00 54.97 53.48 2gxf s GLU 99 Cb 0.03 0.26 0.08 0.00 -0.44 0.00 0.00 34.13 34.06 2gxf s GLU 99 CO 0.32 -0.23 0.09 0.50 0.95 0.00 0.00 175.26 176.90 2gxf s ARG 100 N -3.97 0.48 -0.50 -4.83 3.52 0.17 -4.94 118.95 108.88 2gxf s ARG 100 Ca 0.15 -0.64 -0.21 0.00 -0.13 0.00 0.00 55.73 54.91 2gxf s ARG 100 Cb 0.07 -1.77 0.05 0.00 -1.56 0.00 0.00 34.95 31.73 2gxf s ARG 100 CO -0.04 -0.87 0.72 1.03 -0.81 0.00 0.00 175.30 175.33 2gxf s ARG 101 N 1.87 3.22 0.33 5.12 0.52 -1.26 -1.10 118.95 127.66 2gxf s ARG 101 Ca 0.06 -0.59 0.07 0.00 -0.52 0.00 0.00 55.73 54.75 2gxf s ARG 101 Cb -0.17 -4.05 -0.01 0.00 0.52 0.00 0.00 34.95 31.24 2gxf s ARG 101 CO -0.22 -1.24 0.44 0.00 0.02 0.00 0.00 175.30 174.30 2gxf s ALA 102 N 3.04 4.18 -0.17 2.13 0.00 -0.22 -3.62 121.76 127.10 2gxf s ALA 102 Ca 0.21 -1.49 -0.01 0.00 0.00 0.00 0.00 51.96 50.67 2gxf s ALA 102 Cb -0.16 -1.59 0.05 0.00 0.00 0.00 0.00 23.12 21.42 2gxf s ALA 102 CO 0.16 -0.03 -0.01 0.95 0.00 0.00 0.00 175.76 176.83 2gxf s THR 103 N -2.20 0.83 0.17 0.00 -4.23 -0.93 -2.19 115.64 107.09 2gxf s THR 103 Ca 0.44 -0.58 0.08 0.00 -1.18 0.00 0.00 61.69 60.45 2gxf s THR 103 Cb -0.09 -1.15 -0.04 0.00 1.34 0.00 0.00 72.50 72.56 2gxf s THR 103 CO 0.30 -0.02 -0.08 -0.31 -0.54 0.00 0.00 174.62 173.97 2gxf s TYR 104 N 1.74 2.69 -0.13 3.99 2.02 -0.25 -2.88 117.35 124.52 2gxf s TYR 104 Ca -0.00 -0.20 -0.01 0.00 -0.37 0.00 0.00 57.07 56.49 2gxf s TYR 104 Cb -0.16 -1.32 0.03 0.00 -0.40 0.00 0.00 41.96 40.11 2gxf s TYR 104 CO -0.07 0.50 -0.05 0.08 -1.57 0.00 0.00 175.55 174.44 2gxf s VAL 105 N -1.64 0.93 0.10 0.71 1.01 0.11 0.14 120.40 121.75 2gxf s VAL 105 Ca 0.25 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 61.91 2gxf s VAL 105 Cb -0.09 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 2gxf s VAL 105 CO 0.16 0.22 -0.04 -0.36 0.00 0.00 0.00 175.10 175.08 2gxf s PHE 106 N 1.73 2.90 -0.09 5.22 0.40 -0.70 -0.46 117.98 126.98 2gxf s PHE 106 Ca 0.03 -0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.29 2gxf s PHE 106 Cb -0.14 -1.50 0.02 0.00 0.51 0.00 0.00 43.02 41.92 2gxf s PHE 106 CO -0.08 0.46 -0.09 0.21 0.70 0.00 0.00 175.22 176.43 2gxf s LYS 107 N -2.29 1.48 -0.31 0.44 2.20 -0.24 -0.69 119.74 120.33 2gxf s LYS 107 Ca 0.24 -0.28 -0.29 0.00 -0.36 0.00 0.00 55.97 55.28 2gxf s LYS 107 Cb -0.11 -1.43 0.01 0.00 -1.51 0.00 0.00 37.83 34.79 2gxf s LYS 107 CO 0.17 -0.15 1.16 0.21 -0.36 0.00 0.00 175.35 176.38 2gxf s LYS 108 N 1.29 4.02 0.69 4.03 2.20 -0.99 -1.80 119.74 129.18 2gxf s LYS 108 Ca -0.03 1.15 -0.12 0.00 -0.36 0.00 0.00 55.97 56.61 2gxf s LYS 108 Cb -0.14 -3.79 0.16 0.00 -1.51 0.00 0.00 37.83 32.56 2gxf s LYS 108 CO -0.03 -0.97 0.81 0.27 -0.36 0.00 0.00 175.35 175.06 2gxf n ASN 109 N 7.12 -0.58 -0.25 1.43 6.94 -1.10 -4.87 115.26 123.97 2gxf n ASN 109 Ca 0.13 -1.17 -0.03 0.00 -0.02 0.00 0.00 54.58 53.49 2gxf n ASN 109 Cb 0.47 -0.66 0.09 0.00 -2.36 0.00 0.00 39.78 37.32 2gxf n ASN 109 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2gxf h ALA 110 N -2.09 0.92 0.00 -2.53 0.00 -1.96 -1.41 119.26 112.20 2gxf h ALA 110 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2gxf h ALA 110 Cb 0.78 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2gxf h ALA 110 CO 0.19 0.17 0.01 1.04 0.00 0.00 0.00 179.25 180.66 2gxf n GLN 111 N -4.70 0.06 -0.67 0.00 3.00 -1.26 -4.81 117.38 109.01 2gxf n GLN 111 Ca 0.08 0.56 0.00 0.00 -0.01 0.00 0.00 57.00 57.63 2gxf n GLN 111 Cb 0.11 -1.71 0.00 0.00 0.00 0.00 0.00 30.24 28.64 2gxf n GLN 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2gxf n GLY 112 N -1.41 0.70 3.69 1.08 0.00 -0.53 -5.04 105.19 103.68 2gxf n GLY 112 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2gxf n GLY 112 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2gxf s GLU 113 N -0.33 4.12 -0.23 1.61 -1.05 -1.26 -4.86 118.70 116.70 2gxf s GLU 113 Ca 0.00 -0.26 -0.29 0.00 -0.15 0.00 0.00 54.97 54.27 2gxf s GLU 113 Cb 0.00 -3.44 -0.01 0.00 -0.44 0.00 0.00 34.13 30.24 2gxf s GLU 113 CO 0.00 0.20 1.29 -1.58 0.95 0.00 0.00 175.26 176.12 2gxf s TRP 114 N 0.64 2.75 0.28 4.83 0.52 -1.26 -2.70 118.94 124.00 2gxf s TRP 114 Ca 0.07 0.94 0.07 0.00 0.02 0.00 0.00 56.10 57.20 2gxf s TRP 114 Cb -0.12 -3.69 -0.03 0.00 -1.15 0.00 0.00 33.47 28.47 2gxf s TRP 114 CO 0.01 -1.74 0.26 -0.51 0.02 0.00 0.00 176.95 174.99 2gxf s LEU 115 N 3.94 3.83 -0.04 2.99 1.43 -0.74 -4.89 118.68 125.20 2gxf s LEU 115 Ca 0.56 -0.27 -0.16 0.00 -1.03 0.00 0.00 54.13 53.22 2gxf s LEU 115 Cb -0.19 -2.41 -0.05 0.00 0.03 0.00 0.00 46.19 43.57 2gxf s LEU 115 CO 0.19 -0.15 0.44 0.00 0.23 0.00 0.00 176.35 177.06 2gxf n VAL 117 N 2.57 0.45 -3.79 0.00 0.31 0.40 -0.36 118.33 117.90 2gxf n VAL 117 Ca -0.11 -0.19 -0.27 0.00 -0.01 0.00 0.00 64.34 63.76 2gxf n VAL 117 Cb 0.52 -0.79 -0.17 0.00 -0.91 0.00 0.00 33.84 32.49 2gxf n VAL 117 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2gxf s ILE 118 N -2.16 0.67 -0.50 2.52 1.01 -1.07 0.35 121.20 122.03 2gxf s ILE 118 Ca -0.09 -0.42 -0.02 0.00 0.00 0.00 0.00 60.65 60.12 2gxf s ILE 118 Cb 0.03 -0.99 0.13 0.00 0.01 0.00 0.00 42.46 41.64 2gxf s ILE 118 CO 0.20 0.01 0.30 -0.62 0.00 0.00 0.00 174.94 174.82 2gxf s ASP 119 N 1.82 5.20 -0.60 3.58 -1.08 -0.62 -0.71 116.67 124.25 2gxf s ASP 119 Ca 0.01 -2.40 0.04 0.00 -0.52 0.00 0.00 52.55 49.69 2gxf s ASP 119 Cb -0.15 -1.83 0.15 0.00 -1.46 0.00 0.00 42.92 39.63 2gxf s ASP 119 CO -0.07 -0.46 0.36 0.21 0.52 0.00 0.00 175.17 175.73 2gxf s ASN 120 N 1.28 4.51 0.00 -0.34 2.47 -1.14 -1.25 114.94 120.47 2gxf s ASN 120 Ca 0.12 -3.38 0.05 0.00 0.42 0.00 0.00 52.86 50.08 2gxf s ASN 120 Cb -0.22 -1.62 0.30 0.00 -1.45 0.00 0.00 41.25 38.26 2gxf s ASN 120 CO -0.04 -0.17 0.71 -1.54 -3.72 0.00 0.00 177.10 172.35 2gxf n SER 121 N 2.62 0.00 -0.01 -4.21 3.41 -1.26 -1.90 113.62 112.26 2gxf n SER 121 Ca 0.11 -0.25 0.10 0.00 -0.26 0.00 0.00 58.87 58.57 2gxf n SER 121 Cb 0.33 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.13 2gxf n SER 121 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2gxf n TYR 122 N -0.89 0.00 -4.86 7.33 4.02 -1.26 -4.34 117.16 117.15 2gxf n TYR 122 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 2gxf n TYR 122 Cb 0.02 -0.48 0.00 0.00 -0.02 0.00 0.00 39.34 38.86 2gxf n TYR 122 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2gxf n GLY 123 N 1.37 1.57 0.00 2.72 0.00 -0.80 -2.16 105.19 107.88 2gxf n GLY 123 Ca -0.04 -0.58 0.07 0.00 0.00 0.00 0.00 46.02 45.47 2gxf n GLY 123 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gxf n THR 124 N 0.00 0.74 0.28 2.61 -2.24 -1.26 -2.53 114.28 111.87 2gxf n THR 124 Ca 0.00 0.18 0.15 0.00 -2.27 0.00 0.00 64.05 62.12 2gxf n THR 124 Cb 0.00 -0.93 0.78 0.00 -2.10 0.00 0.00 70.33 68.08 2gxf n THR 124 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2gxf h ASP 125 N 0.00 0.00 -0.79 3.42 3.45 -1.74 -2.05 116.42 118.70 2gxf h ASP 125 Ca 0.00 0.00 0.15 0.00 0.43 0.00 0.00 57.03 57.61 2gxf h ASP 125 Cb 0.19 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 38.91 2gxf h ASP 125 CO 0.00 0.08 0.52 0.25 -1.57 0.00 0.00 179.24 178.53 2gxf h LEU 126 N 0.00 0.45 0.81 1.55 5.85 -1.63 -2.48 115.31 119.85 2gxf h LEU 126 Ca -0.00 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2gxf h LEU 126 Cb 0.35 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.32 2gxf h LEU 126 CO 0.01 0.23 -0.39 0.40 -0.34 0.00 0.00 178.44 178.35 2gxf h ILE 127 N 0.47 0.00 0.00 4.05 2.04 -1.63 -3.50 117.51 118.95 2gxf h ILE 127 Ca 0.39 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 66.08 2gxf h ILE 127 Cb 0.84 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 2gxf h ILE 127 CO -0.14 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.62