#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g4a h GLN 2 N 0.00 0.96 -0.68 5.31 1.08 -1.98 -2.07 115.11 117.72 2g4a h GLN 2 Ca 0.00 -0.09 -0.02 0.00 -1.45 0.00 0.00 58.65 57.09 2g4a h GLN 2 Cb 0.00 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.20 2g4a h GLN 2 CO 0.00 0.68 0.35 1.25 -0.95 0.00 0.00 178.83 180.16 2g4a h LEU 3 N 0.97 0.86 -0.44 1.46 6.46 -1.91 -2.61 115.31 120.11 2g4a h LEU 3 Ca 0.25 -0.08 -0.05 0.00 -0.12 0.00 0.00 57.88 57.88 2g4a h LEU 3 Cb -0.01 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 39.68 2g4a h LEU 3 CO -0.05 0.72 0.06 0.50 -0.62 0.00 0.00 178.44 179.06 2g4a h LYS 4 N 0.96 0.73 -0.89 1.25 3.64 -1.81 -2.93 116.57 117.52 2g4a h LYS 4 Ca 0.24 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2g4a h LYS 4 Cb 0.07 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.76 2g4a h LYS 4 CO -0.03 0.76 0.59 0.45 -2.27 0.00 0.00 179.45 178.95 2g4a h HIS 5 N 0.59 1.12 -0.98 1.91 3.86 -1.20 -2.10 115.15 118.36 2g4a h HIS 5 Ca 0.13 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.41 2g4a h HIS 5 Cb 0.39 -0.38 -0.06 0.00 1.06 0.00 0.00 27.41 28.43 2g4a h HIS 5 CO 0.03 0.71 0.64 0.00 0.86 0.00 0.00 177.93 180.16 2g4a h ASN 7 N 1.23 0.97 -0.96 0.00 2.35 -1.25 -2.39 115.58 115.52 2g4a h ASN 7 Ca 0.39 -0.04 0.05 0.00 -0.55 0.00 0.00 56.30 56.15 2g4a h ASN 7 Cb 0.01 -0.24 -0.06 0.00 0.05 0.00 0.00 38.32 38.07 2g4a h ASN 7 CO -0.12 0.72 0.62 0.58 -1.65 0.00 0.00 177.43 177.58 2g4a h VAL 8 N 1.13 1.11 -0.50 2.81 2.07 -1.25 -0.55 116.25 121.07 2g4a h VAL 8 Ca 0.30 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 67.35 2g4a h VAL 8 Cb -0.10 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.50 2g4a h VAL 8 CO -0.06 0.21 0.01 0.40 0.02 0.00 0.00 177.57 178.15 2g4a h ILE 9 N 1.16 1.24 -0.09 4.57 2.04 -1.29 -1.17 117.51 123.97 2g4a h ILE 9 Ca 0.40 -1.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.23 2g4a h ILE 9 Cb 0.11 0.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 2g4a h ILE 9 CO -0.15 0.36 -0.05 0.25 0.00 0.00 0.00 178.15 178.55 2g4a h LEU 10 N 0.77 0.20 -0.14 1.44 5.85 -0.87 -1.68 115.31 120.89 2g4a h LEU 10 Ca 0.15 -0.43 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 2g4a h LEU 10 Cb 0.45 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2g4a h LEU 10 CO 0.02 0.59 0.03 0.07 -0.34 0.00 0.00 178.44 178.80 2g4a h LYS 11 N -0.19 0.22 -0.67 1.25 2.10 -1.09 -2.16 116.57 116.03 2g4a h LYS 11 Ca 0.02 -0.06 0.03 0.00 -2.00 0.00 0.00 60.65 58.64 2g4a h LYS 11 Cb 0.52 -0.03 -0.04 0.00 -0.90 0.00 0.00 32.23 31.78 2g4a h LYS 11 CO 0.01 0.39 0.45 1.49 -2.00 0.00 0.00 179.45 179.79 2g4a h GLU 12 N 0.02 0.81 -0.34 0.07 4.57 -1.28 0.54 114.58 118.96 2g4a h GLU 12 Ca 0.04 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 58.07 2g4a h GLU 12 Cb 0.27 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 2g4a h GLU 12 CO 0.00 0.54 -0.22 -0.07 -1.18 0.00 0.00 179.01 178.08 2g4a h LEU 13 N 0.84 0.67 -0.52 1.64 3.38 -1.08 -2.78 115.31 117.46 2g4a h LEU 13 Ca 0.26 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2g4a h LEU 13 Cb 0.02 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2g4a h LEU 13 CO -0.07 0.88 -0.17 -0.11 0.09 0.00 0.00 178.44 179.06 2g4a n LEU 14 N -4.12 0.98 0.05 1.67 0.00 -0.71 -3.73 117.00 111.14 2g4a n LEU 14 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 56.01 55.74 2g4a n LEU 14 Cb 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 43.42 43.72 2g4a n LEU 14 CO 0.43 0.18 0.29 -1.28 0.00 0.00 0.00 177.39 177.01 2g4a h SER 15 N 1.27 -0.11 0.00 1.96 0.87 -0.62 -3.49 113.55 113.43 2g4a h SER 15 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2g4a h SER 15 Cb 0.46 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 2g4a h SER 15 CO 0.00 -0.04 0.00 2.29 -0.53 0.00 0.00 176.83 178.55 2g4a n LYS 16 N -2.56 0.00 -0.28 2.24 2.85 -1.25 -4.93 118.16 114.23 2g4a n LYS 16 Ca -0.02 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.32 2g4a n LYS 16 Cb 0.05 0.00 0.23 0.00 -0.65 0.00 0.00 35.03 34.66 2g4a n LYS 16 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2g4a h LYS 17 N 0.00 0.45 -0.38 -1.58 1.63 -1.87 -1.19 116.57 113.63 2g4a h LYS 17 Ca 0.00 -0.03 -0.17 0.00 -0.85 0.00 0.00 60.65 59.60 2g4a h LYS 17 Cb 0.00 -0.10 -0.10 0.00 -0.60 0.00 0.00 32.23 31.42 2g4a h LYS 17 CO 0.00 0.30 -0.02 0.72 -3.45 0.00 0.00 179.45 177.00 2g4a n HIS 18 N -4.99 1.20 -0.03 1.91 8.25 -1.26 -4.67 115.22 115.63 2g4a n HIS 18 Ca 0.17 -1.50 -0.02 0.00 -0.26 0.00 0.00 57.72 56.11 2g4a n HIS 18 Cb 0.49 -0.49 0.23 0.00 1.12 0.00 0.00 29.99 31.33 2g4a n HIS 18 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2g4a h ALA 19 N 1.13 1.22 -0.82 -1.41 0.00 -1.29 -0.86 119.26 117.22 2g4a h ALA 19 Ca 0.21 -0.26 0.12 0.00 0.00 0.00 0.00 54.91 54.98 2g4a h ALA 19 Cb 1.71 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 19.29 2g4a h ALA 19 CO 0.41 0.51 0.53 0.00 0.00 0.00 0.00 179.25 180.70 2g4a h ALA 20 N 1.38 1.84 -0.01 0.00 0.00 -1.83 -0.63 119.26 120.00 2g4a h ALA 20 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2g4a h ALA 20 Cb 0.46 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2g4a h ALA 20 CO 0.02 -0.03 -0.65 0.66 0.00 0.00 0.00 179.25 179.26 2g4a n TYR 21 N -4.52 0.00 -0.01 0.00 4.02 -1.06 -4.35 117.16 111.25 2g4a n TYR 21 Ca 0.15 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.87 2g4a n TYR 21 Cb 0.40 -0.01 -0.13 0.00 -0.02 0.00 0.00 39.34 39.58 2g4a n TYR 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2g4a h ALA 22 N 3.56 -0.00 -0.43 -0.72 0.00 0.33 -3.22 119.26 118.79 2g4a h ALA 22 Ca 0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 54.91 54.24 2g4a h ALA 22 Cb 0.66 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2g4a h ALA 22 CO 0.00 0.20 -0.17 0.11 0.00 0.00 0.00 179.25 179.40 2g4a h TRP 23 N -0.48 0.91 -0.46 0.00 5.08 -1.65 0.31 115.95 119.66 2g4a h TRP 23 Ca -0.07 -0.19 -0.10 0.00 1.08 0.00 0.00 58.89 59.62 2g4a h TRP 23 Cb 1.25 -0.22 -0.02 0.00 -3.00 0.00 0.00 29.16 27.17 2g4a h TRP 23 CO 0.20 0.92 -0.11 -1.00 -1.28 0.00 0.00 178.44 177.17 2g4a h PRO 24 N 0.72 0.83 -0.05 0.12 0.13 -1.76 -2.98 132.00 129.01 2g4a h PRO 24 Ca 0.11 -0.28 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 2g4a h PRO 24 Cb 0.67 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.74 2g4a h PRO 24 CO 0.05 0.90 0.00 1.19 -0.23 0.00 0.00 178.00 179.91 2g4a n PHE 25 N -4.16 0.03 0.53 1.56 3.72 -1.20 -4.53 117.46 113.40 2g4a n PHE 25 Ca 0.01 -0.01 -0.21 0.00 -0.05 0.00 0.00 57.45 57.19 2g4a n PHE 25 Cb 0.37 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.81 2g4a n PHE 25 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2g4a h TYR 26 N 4.50 -1.27 -3.12 1.38 5.03 -0.20 -0.87 116.97 122.41 2g4a h TYR 26 Ca 0.00 -0.03 -0.64 0.00 2.58 0.00 0.00 58.73 60.64 2g4a h TYR 26 Cb 0.96 0.42 -0.08 0.00 1.55 0.00 0.00 36.73 39.58 2g4a h TYR 26 CO 0.01 -0.79 -0.58 0.15 -1.32 0.00 0.00 178.16 175.64 2g4a s LYS 27 N -5.98 3.01 0.03 1.82 1.02 -1.26 -1.81 119.74 116.56 2g4a s LYS 27 Ca -0.20 -0.60 -0.00 0.00 0.02 0.00 0.00 55.97 55.18 2g4a s LYS 27 Cb 0.02 -2.81 0.01 0.00 -0.52 0.00 0.00 37.83 34.53 2g4a s LYS 27 CO 0.60 0.59 0.04 -0.35 -0.92 0.00 0.00 175.35 175.31 2g4a n PRO 28 N 0.59 -0.20 -3.61 -1.68 -0.04 -1.26 -4.89 135.00 123.91 2g4a n PRO 28 Ca -0.09 -0.06 -0.40 0.00 -0.04 0.00 0.00 63.50 62.92 2g4a n PRO 28 Cb 0.52 -0.04 -0.09 0.00 -0.04 0.00 0.00 33.50 33.85 2g4a n PRO 28 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2g4a s VAL 29 N -1.08 4.02 -1.10 0.52 1.01 -1.26 -5.01 120.40 117.51 2g4a s VAL 29 Ca 0.02 -2.00 -0.25 0.00 0.00 0.00 0.00 61.98 59.75 2g4a s VAL 29 Cb -0.00 -3.66 -0.15 0.00 0.00 0.00 0.00 36.38 32.57 2g4a s VAL 29 CO 0.01 -0.78 2.05 -1.81 0.00 0.00 0.00 175.10 174.57 2g4a s ASP 30 N 2.26 4.26 0.48 3.32 1.11 -1.26 -4.74 116.67 122.11 2g4a s ASP 30 Ca 0.08 -1.19 0.18 0.00 0.18 0.00 0.00 52.55 51.81 2g4a s ASP 30 Cb -0.24 -2.59 1.21 0.00 1.07 0.00 0.00 42.92 42.37 2g4a s ASP 30 CO -0.02 -3.85 2.01 0.00 1.18 0.00 0.00 175.17 174.49 2g4a h ALA 31 N 10.85 2.20 0.02 5.23 0.00 -1.95 0.76 119.26 136.36 2g4a h ALA 31 Ca 0.11 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2g4a h ALA 31 Cb 0.97 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.74 2g4a h ALA 31 CO 1.12 -0.32 -0.24 1.03 0.00 0.00 0.00 179.25 180.85 2g4a h SER 32 N 0.19 0.18 0.05 0.00 0.87 -1.85 0.41 113.55 113.40 2g4a h SER 32 Ca 0.22 -0.85 -0.00 0.00 -1.23 0.00 0.00 61.79 59.93 2g4a h SER 32 Cb 0.63 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2g4a h SER 32 CO -0.04 1.01 -0.02 0.00 -0.53 0.00 0.00 176.83 177.25 2g4a h ALA 33 N 0.17 -0.06 0.81 6.23 0.00 -1.85 -3.37 119.26 121.18 2g4a h ALA 33 Ca -0.03 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 2g4a h ALA 33 Cb 1.06 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.89 2g4a h ALA 33 CO 0.05 -0.19 -0.39 1.25 0.00 0.00 0.00 179.25 179.96 2g4a h LEU 34 N -0.74 -0.92 0.00 0.00 5.85 0.35 -3.49 115.31 116.36 2g4a h LEU 34 Ca -0.01 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2g4a h LEU 34 Cb 0.63 0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.90 2g4a h LEU 34 CO 0.01 -0.56 0.00 0.61 -0.34 0.00 0.00 178.44 178.16 2g4a n GLY 35 N -0.99 0.09 2.72 3.75 0.00 -0.94 -5.05 105.19 104.76 2g4a n GLY 35 Ca -0.13 -0.35 -0.20 0.00 0.00 0.00 0.00 46.02 45.33 2g4a n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g4a s LEU 36 N 0.00 0.02 -0.07 0.99 1.43 0.14 -5.01 118.68 116.18 2g4a s LEU 36 Ca 0.00 -0.27 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 2g4a s LEU 36 Cb 0.00 0.21 -0.25 0.00 0.03 0.00 0.00 46.19 46.18 2g4a s LEU 36 CO 0.00 -0.32 0.57 -0.74 0.23 0.00 0.00 176.35 176.09 2g4a h HIS 37 N 8.35 0.22 -0.10 0.29 2.76 -2.01 -3.36 115.15 121.30 2g4a h HIS 37 Ca -0.16 -0.16 -0.11 0.00 -2.20 0.00 0.00 60.37 57.74 2g4a h HIS 37 Cb 1.15 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 30.09 2g4a h HIS 37 CO 0.17 1.33 -0.42 -0.44 -1.30 0.00 0.00 177.93 177.27 2g4a h ASP 38 N 0.03 0.23 -0.77 3.26 3.32 -1.97 -2.85 116.42 117.67 2g4a h ASP 38 Ca -0.33 -0.10 0.10 0.00 0.02 0.00 0.00 57.03 56.72 2g4a h ASP 38 Cb 2.02 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 41.43 2g4a h ASP 38 CO 0.09 0.63 0.41 0.22 -1.72 0.00 0.00 179.24 178.86 2g4a h TYR 39 N 0.18 0.73 0.00 4.55 5.03 -1.98 0.46 116.97 125.94 2g4a h TYR 39 Ca 0.02 0.03 -0.11 0.00 2.58 0.00 0.00 58.73 61.24 2g4a h TYR 39 Cb 0.82 -0.21 -0.02 0.00 1.55 0.00 0.00 36.73 38.87 2g4a h TYR 39 CO 0.01 0.27 -0.53 1.25 -1.32 0.00 0.00 178.16 177.85 2g4a h HIS 40 N 0.68 0.00 0.07 -3.82 2.76 -1.72 -1.50 115.15 111.62 2g4a h HIS 40 Ca 0.38 0.00 -0.18 0.00 -2.20 0.00 0.00 60.37 58.37 2g4a h HIS 40 Cb 0.39 0.00 0.02 0.00 1.55 0.00 0.00 27.41 29.36 2g4a h HIS 40 CO -0.09 0.53 -0.75 -0.44 -1.30 0.00 0.00 177.93 175.88 2g4a h ASP 41 N 0.00 0.53 0.10 3.26 5.19 -0.96 -2.03 116.42 122.51 2g4a h ASP 41 Ca -0.01 -0.85 -0.01 0.00 -0.62 0.00 0.00 57.03 55.55 2g4a h ASP 41 Cb 1.29 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.64 2g4a h ASP 41 CO 0.07 1.33 -0.05 0.40 -3.12 0.00 0.00 179.24 177.87 2g4a h ILE 42 N -0.19 0.64 0.06 0.35 2.04 -0.23 -3.41 117.51 116.77 2g4a h ILE 42 Ca -0.11 -1.27 -0.00 0.00 1.00 0.00 0.00 64.86 64.48 2g4a h ILE 42 Cb 1.51 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 38.73 2g4a h ILE 42 CO 0.14 0.19 -0.03 0.40 0.00 0.00 0.00 178.15 178.86 2g4a h ILE 43 N -0.98 0.00 0.00 -0.67 2.04 -1.45 -3.47 117.51 112.98 2g4a h ILE 43 Ca -0.01 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.93 2g4a h ILE 43 Cb 0.42 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2g4a h ILE 43 CO 0.02 0.00 0.00 1.17 0.00 0.00 0.00 178.15 179.34 2g4a n LYS 44 N -4.76 0.00 -3.80 2.37 3.00 -0.76 -4.86 118.16 109.34 2g4a n LYS 44 Ca -0.01 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.01 2g4a n LYS 44 Cb 0.03 -0.40 -0.13 0.00 0.00 0.00 0.00 35.03 34.53 2g4a n LYS 44 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 2g4a s HIS 45 N -0.26 2.63 -0.63 5.64 2.46 -1.26 -5.00 115.29 118.87 2g4a s HIS 45 Ca 0.00 -2.85 -0.26 0.00 0.47 0.00 0.00 55.06 52.42 2g4a s HIS 45 Cb 0.00 -2.28 -0.04 0.00 -0.13 0.00 0.00 32.58 30.13 2g4a s HIS 45 CO 0.00 -0.72 2.00 -1.25 -2.47 0.00 0.00 174.74 172.30 2g4a s PRO 46 N -0.26 2.47 -0.00 2.88 0.04 -1.26 -4.97 135.00 133.90 2g4a s PRO 46 Ca 0.20 0.64 -0.15 0.00 0.04 0.00 0.00 61.00 61.74 2g4a s PRO 46 Cb -0.18 -4.53 -0.06 0.00 0.04 0.00 0.00 34.50 29.77 2g4a s PRO 46 CO -0.05 -2.99 0.40 -1.64 0.04 0.00 0.00 177.00 172.76 2g4a s MET 47 N 7.35 3.91 0.17 4.56 -1.94 -1.26 -4.97 119.30 127.12 2g4a s MET 47 Ca 0.74 0.40 -0.15 0.00 -1.71 0.00 0.00 55.69 54.98 2g4a s MET 47 Cb -0.13 -3.22 0.02 0.00 2.01 0.00 0.00 34.83 33.51 2g4a s MET 47 CO 0.18 0.69 0.42 0.16 -0.01 0.00 0.00 175.02 176.46 2g4a s ASP 48 N -1.06 -0.16 0.32 3.03 -4.77 -1.26 -4.80 116.67 107.97 2g4a s ASP 48 Ca 0.24 -0.56 -0.00 0.00 -3.30 0.00 0.00 52.55 48.93 2g4a s ASP 48 Cb -0.17 0.51 0.53 0.00 -1.09 0.00 0.00 42.92 42.70 2g4a s ASP 48 CO 0.13 -0.95 1.98 -0.07 0.70 0.00 0.00 175.17 176.96 2g4a h LEU 49 N 2.35 0.86 -1.16 2.11 4.07 -1.10 -1.94 115.31 120.50 2g4a h LEU 49 Ca -0.31 -0.02 0.04 0.00 0.08 0.00 0.00 57.88 57.67 2g4a h LEU 49 Cb 1.25 -0.21 -0.05 0.00 1.08 0.00 0.00 40.66 42.72 2g4a h LEU 49 CO 0.43 0.62 0.58 0.28 -1.08 0.00 0.00 178.44 179.27 2g4a h SER 50 N 1.01 0.93 -0.20 -0.43 0.02 -1.59 -0.92 113.55 112.36 2g4a h SER 50 Ca 0.28 -0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 61.08 2g4a h SER 50 Cb -0.09 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.24 2g4a h SER 50 CO -0.07 0.63 -0.42 0.74 -1.14 0.00 0.00 176.83 176.58 2g4a h THR 51 N 1.08 1.29 -0.64 -2.27 2.02 -1.67 -2.86 112.91 109.86 2g4a h THR 51 Ca 0.36 -1.60 -0.04 0.00 0.77 0.00 0.00 66.41 65.90 2g4a h THR 51 Cb 0.06 1.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 2g4a h THR 51 CO -0.11 0.52 0.24 0.58 0.37 0.00 0.00 175.52 177.12 2g4a h VAL 52 N 0.61 1.24 -0.90 3.16 2.07 -0.88 -2.75 116.25 118.81 2g4a h VAL 52 Ca 0.05 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.80 2g4a h VAL 52 Cb 0.97 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 2g4a h VAL 52 CO 0.09 0.30 0.57 0.50 0.02 0.00 0.00 177.57 179.05 2g4a h LYS 53 N 0.91 1.20 -0.41 1.57 1.63 -1.14 -1.92 116.57 118.42 2g4a h LYS 53 Ca 0.21 -0.09 0.04 0.00 -0.85 0.00 0.00 60.65 59.96 2g4a h LYS 53 Cb 0.23 -0.26 -0.02 0.00 -0.60 0.00 0.00 32.23 31.58 2g4a h LYS 53 CO -0.01 0.82 0.28 0.00 -3.45 0.00 0.00 179.45 177.08 2g4a h ARG 54 N 1.23 0.37 -0.15 1.90 2.47 -1.25 -1.90 114.38 117.04 2g4a h ARG 54 Ca 0.33 -0.02 -0.15 0.00 -1.26 0.00 0.00 59.98 58.87 2g4a h ARG 54 Cb -0.09 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.15 2g4a h ARG 54 CO -0.07 0.25 -0.49 0.87 0.56 0.00 0.00 179.97 181.09 2g4a h LYS 55 N 0.38 0.61 -0.65 0.04 6.56 -1.21 -2.93 116.57 119.37 2g4a h LYS 55 Ca 0.17 -0.44 -0.02 0.00 -1.06 0.00 0.00 60.65 59.30 2g4a h LYS 55 Cb 0.21 0.08 -0.03 0.00 -0.57 0.00 0.00 32.23 31.91 2g4a h LYS 55 CO -0.04 1.06 0.32 0.52 -2.06 0.00 0.00 179.45 179.25 2g4a h MET 56 N 0.26 0.92 0.00 3.15 2.86 -0.99 0.57 114.93 121.71 2g4a h MET 56 Ca -0.02 -0.12 -0.06 0.00 -2.06 0.00 0.00 59.70 57.44 2g4a h MET 56 Cb 1.11 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 2g4a h MET 56 CO 0.10 0.71 -0.30 1.05 1.06 0.00 0.00 176.91 179.54 2g4a h GLU 57 N 0.92 0.00 -0.03 1.72 4.11 -1.39 -2.78 114.58 117.13 2g4a h GLU 57 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.66 2g4a h GLU 57 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2g4a h GLU 57 CO -0.03 0.30 0.00 0.09 0.07 0.00 0.00 179.01 179.44 2g4a n ASN 58 N -3.46 3.00 -2.13 3.06 3.02 -0.80 -4.96 115.26 113.00 2g4a n ASN 58 Ca 0.00 -2.00 -0.16 0.00 -0.03 0.00 0.00 54.58 52.39 2g4a n ASN 58 Cb 0.47 -0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.66 2g4a n ASN 58 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 2g4a n ARG 59 N 1.35 -3.03 0.15 3.52 0.63 0.47 -4.91 116.66 114.83 2g4a n ARG 59 Ca 0.14 0.68 -0.00 0.00 -0.92 0.00 0.00 57.85 57.74 2g4a n ARG 59 Cb 0.60 -5.02 0.24 0.00 0.45 0.00 0.00 32.46 28.73 2g4a n ARG 59 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 2g4a h ASP 60 N -0.79 0.04 -3.13 6.15 3.58 -0.27 -3.37 116.42 118.63 2g4a h ASP 60 Ca -0.38 -0.02 -0.74 0.00 0.42 0.00 0.00 57.03 56.31 2g4a h ASP 60 Cb 1.27 -0.01 -0.22 0.00 1.72 0.00 0.00 39.33 42.09 2g4a h ASP 60 CO 0.41 0.55 0.47 -0.31 -2.88 0.00 0.00 179.24 177.49 2g4a s TYR 61 N -3.86 3.47 -1.22 0.28 2.02 -1.26 -4.85 117.35 111.93 2g4a s TYR 61 Ca -0.02 -1.73 0.04 0.00 -0.37 0.00 0.00 57.07 54.99 2g4a s TYR 61 Cb 0.13 -4.05 0.19 0.00 -0.40 0.00 0.00 41.96 37.83 2g4a s TYR 61 CO 0.75 -1.23 0.92 2.89 -1.57 0.00 0.00 175.55 177.31 2g4a n ARG 62 N 5.18 1.77 -3.58 -0.62 0.00 -1.26 -4.86 116.66 113.28 2g4a n ARG 62 Ca 0.19 -0.72 -0.05 0.00 -0.00 0.00 0.00 57.85 57.27 2g4a n ARG 62 Cb 0.48 -1.50 -0.02 0.00 -0.00 0.00 0.00 32.46 31.42 2g4a n ARG 62 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2g4a s ASP 63 N -0.47 -0.19 0.24 2.89 -1.08 -1.26 -4.92 116.67 111.88 2g4a s ASP 63 Ca 0.13 -0.05 0.12 0.00 -0.52 0.00 0.00 52.55 52.23 2g4a s ASP 63 Cb 0.09 0.24 0.15 0.00 -1.46 0.00 0.00 42.92 41.94 2g4a s ASP 63 CO 0.05 -0.40 1.48 0.00 0.52 0.00 0.00 175.17 176.82 2g4a h ALA 64 N 2.00 0.69 -1.00 3.66 0.00 -1.89 -3.20 119.26 119.52 2g4a h ALA 64 Ca -0.17 -0.61 0.06 0.00 0.00 0.00 0.00 54.91 54.19 2g4a h ALA 64 Cb 1.20 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 2g4a h ALA 64 CO 0.26 0.84 0.65 1.96 0.00 0.00 0.00 179.25 182.96 2g4a h GLN 65 N 0.00 1.15 -0.13 0.00 7.50 -1.98 0.41 115.11 122.06 2g4a h GLN 65 Ca -0.01 -0.07 -0.18 0.00 0.50 0.00 0.00 58.65 58.89 2g4a h GLN 65 Cb 1.36 -0.26 0.01 0.00 0.05 0.00 0.00 27.48 28.64 2g4a h GLN 65 CO 0.09 0.76 -0.62 1.49 -1.50 0.00 0.00 178.83 179.05 2g4a h GLU 66 N 1.19 0.65 -0.14 1.46 4.81 -1.98 -2.41 114.58 118.15 2g4a h GLU 66 Ca 0.42 -0.53 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 2g4a h GLU 66 Cb 0.14 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 2g4a h GLU 66 CO -0.16 1.15 0.03 0.35 -0.73 0.00 0.00 179.01 179.64 2g4a h PHE 67 N 0.32 0.25 -0.37 0.92 3.04 -1.44 -2.15 116.94 117.50 2g4a h PHE 67 Ca -0.04 -0.03 0.02 0.00 3.98 0.00 0.00 57.97 61.90 2g4a h PHE 67 Cb 1.26 -0.07 -0.03 0.00 2.56 0.00 0.00 35.95 39.67 2g4a h PHE 67 CO 0.10 0.39 0.20 0.00 -2.02 0.00 0.00 178.31 176.98 2g4a h ALA 68 N 0.82 0.46 -0.66 2.41 0.00 -0.26 -2.12 119.26 119.90 2g4a h ALA 68 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2g4a h ALA 68 Cb 0.27 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2g4a h ALA 68 CO 0.00 -0.16 0.44 0.00 0.00 0.00 0.00 179.25 179.53 2g4a h ALA 69 N 1.18 1.54 -0.74 0.00 0.00 -1.38 -1.92 119.26 117.95 2g4a h ALA 69 Ca 0.15 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2g4a h ALA 69 Cb 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2g4a h ALA 69 CO -0.09 0.43 0.29 -0.44 0.00 0.00 0.00 179.25 179.43 2g4a h ASP 70 N 0.89 1.03 -0.45 0.00 5.19 -0.76 -2.57 116.42 119.74 2g4a h ASP 70 Ca 0.24 -0.18 -0.04 0.00 -0.62 0.00 0.00 57.03 56.44 2g4a h ASP 70 Cb -0.09 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.14 2g4a h ASP 70 CO -0.05 0.92 0.14 0.58 -3.12 0.00 0.00 179.24 177.71 2g4a h VAL 71 N 1.07 1.22 -0.85 -1.35 2.07 -0.80 -2.75 116.25 114.86 2g4a h VAL 71 Ca 0.25 -0.75 0.06 0.00 0.82 0.00 0.00 66.70 67.08 2g4a h VAL 71 Cb 0.22 0.85 -0.06 0.00 -1.52 0.00 0.00 31.29 30.79 2g4a h VAL 71 CO -0.02 0.27 0.52 -0.09 0.02 0.00 0.00 177.57 178.27 2g4a h ARG 72 N 0.60 0.92 -0.56 1.57 1.12 -1.15 -1.44 114.38 115.44 2g4a h ARG 72 Ca 0.15 -0.06 -0.02 0.00 -1.11 0.00 0.00 59.98 58.94 2g4a h ARG 72 Cb 0.27 -0.21 -0.03 0.00 -0.01 0.00 0.00 29.97 30.00 2g4a h ARG 72 CO -0.00 0.61 0.29 1.25 -3.11 0.00 0.00 179.97 179.00 2g4a h LEU 73 N 0.94 0.72 -0.87 3.80 5.85 -1.30 0.29 115.31 124.74 2g4a h LEU 73 Ca 0.37 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 2g4a h LEU 73 Cb 0.19 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2g4a h LEU 73 CO -0.18 0.63 0.51 -0.03 -0.34 0.00 0.00 178.44 179.02 2g4a h MET 74 N 0.75 1.20 -0.18 1.25 4.05 -1.10 0.11 114.93 121.01 2g4a h MET 74 Ca 0.19 -0.12 -0.08 0.00 -0.28 0.00 0.00 59.70 59.42 2g4a h MET 74 Cb 0.09 -0.24 -0.00 0.00 -0.80 0.00 0.00 31.60 30.64 2g4a h MET 74 CO -0.03 0.85 -0.19 0.74 0.23 0.00 0.00 176.91 178.52 2g4a h PHE 75 N 1.21 0.54 -0.18 1.39 -1.00 -0.94 -2.78 116.94 115.17 2g4a h PHE 75 Ca 0.31 -0.16 -0.07 0.00 2.81 0.00 0.00 57.97 60.86 2g4a h PHE 75 Cb -0.02 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.42 2g4a h PHE 75 CO 0.00 0.82 -0.20 0.66 -1.61 0.00 0.00 178.31 177.98 2g4a h SER 76 N 0.10 0.29 -0.19 2.17 4.64 -0.74 -1.64 113.55 118.18 2g4a h SER 76 Ca 0.03 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.25 2g4a h SER 76 Cb 0.73 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 2g4a h SER 76 CO 0.05 0.51 0.05 0.78 -0.87 0.00 0.00 176.83 177.35 2g4a h ASN 77 N 0.28 0.29 -0.37 4.97 2.35 -0.74 0.36 115.58 122.73 2g4a h ASN 77 Ca 0.05 -0.23 -0.07 0.00 -0.55 0.00 0.00 56.30 55.49 2g4a h ASN 77 Cb 0.52 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 2g4a h ASN 77 CO 0.03 0.45 -0.06 0.00 -1.65 0.00 0.00 177.43 176.20 2g4a h TYR 79 N 0.49 0.98 -0.04 0.00 -1.99 -1.25 0.41 116.97 115.56 2g4a h TYR 79 Ca 0.10 -0.08 -0.13 0.00 2.00 0.00 0.00 58.73 60.62 2g4a h TYR 79 Cb 0.56 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 38.98 2g4a h TYR 79 CO 0.05 0.78 -0.56 0.87 -0.00 0.00 0.00 178.16 179.30 2g4a h LYS 80 N 0.89 0.13 0.00 4.88 1.57 -0.85 -3.35 116.57 119.84 2g4a h LYS 80 Ca 0.21 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2g4a h LYS 80 Cb 0.23 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 2g4a h LYS 80 CO -0.01 0.66 -0.11 -0.92 -0.57 0.00 0.00 179.45 178.49 2g4a h TYR 81 N 0.10 0.00 -3.51 -1.35 3.20 -0.76 -3.44 116.97 111.21 2g4a h TYR 81 Ca -0.00 0.00 -0.71 0.00 3.14 0.00 0.00 58.73 61.15 2g4a h TYR 81 Cb 1.02 0.00 -0.25 0.00 1.54 0.00 0.00 36.73 39.04 2g4a h TYR 81 CO 0.01 0.04 -0.47 -0.80 -1.64 0.00 0.00 178.16 175.29 2g4a s ASN 82 N -5.61 5.78 0.65 -2.11 0.01 0.14 -5.08 114.94 108.71 2g4a s ASN 82 Ca -0.04 -1.18 -0.18 0.00 -0.71 0.00 0.00 52.86 50.76 2g4a s ASN 82 Cb 0.00 -2.04 -0.02 0.00 0.41 0.00 0.00 41.25 39.61 2g4a s ASN 82 CO 0.07 -0.46 1.12 -2.65 -1.51 0.00 0.00 177.10 173.66 2g4a n PRO 83 N 5.01 0.90 -1.76 -0.60 -0.02 -1.26 -4.39 135.00 132.89 2g4a n PRO 83 Ca -0.11 0.36 -0.43 0.00 -2.02 0.00 0.00 63.50 61.30 2g4a n PRO 83 Cb 0.45 -2.35 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 2g4a n PRO 83 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2g4a s PRO 84 N -3.18 3.63 0.02 0.52 0.04 -1.26 -4.48 135.00 130.29 2g4a s PRO 84 Ca 0.79 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.95 2g4a s PRO 84 Cb -0.38 -4.22 0.00 0.00 0.04 0.00 0.00 34.50 29.94 2g4a s PRO 84 CO 0.44 -1.53 0.00 -3.47 0.04 0.00 0.00 177.00 172.48 2g4a n ASP 85 N 9.51 -0.22 -4.61 6.66 2.03 -1.26 -5.09 116.55 123.57 2g4a n ASP 85 Ca 0.24 0.05 -0.26 0.00 0.52 0.00 0.00 54.79 55.34 2g4a n ASP 85 Cb 0.44 0.59 0.11 0.00 -0.72 0.00 0.00 41.12 41.55 2g4a n ASP 85 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2g4a s HIS 86 N -2.00 2.08 0.34 -0.67 3.76 -1.26 -4.99 115.29 112.54 2g4a s HIS 86 Ca 0.00 0.14 0.09 0.00 -0.15 0.00 0.00 55.06 55.15 2g4a s HIS 86 Cb 0.00 -3.38 0.60 0.00 1.11 0.00 0.00 32.58 30.91 2g4a s HIS 86 CO 0.00 -1.85 1.78 0.22 -0.85 0.00 0.00 174.74 174.03 2g4a h ASP 87 N -0.85 0.14 -0.58 1.40 3.58 -1.99 -3.09 116.42 115.03 2g4a h ASP 87 Ca -0.42 -0.05 0.08 0.00 0.42 0.00 0.00 57.03 57.07 2g4a h ASP 87 Cb 1.28 -0.04 -0.07 0.00 1.72 0.00 0.00 39.33 42.22 2g4a h ASP 87 CO 0.47 0.50 0.22 1.62 -2.88 0.00 0.00 179.24 179.17 2g4a h VAL 88 N 0.12 0.80 -0.15 2.25 3.04 -1.99 0.23 116.25 120.55 2g4a h VAL 88 Ca 0.01 -0.14 -0.03 0.00 -1.01 0.00 0.00 66.70 65.53 2g4a h VAL 88 Cb 0.70 0.35 -0.00 0.00 -2.01 0.00 0.00 31.29 30.32 2g4a h VAL 88 CO 0.05 0.08 -0.02 0.58 -1.01 0.00 0.00 177.57 177.25 2g4a h VAL 89 N 0.41 1.28 -0.24 1.51 2.07 -1.89 -2.98 116.25 116.42 2g4a h VAL 89 Ca 0.29 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2g4a h VAL 89 Cb 0.33 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 2g4a h VAL 89 CO -0.28 0.27 0.15 0.00 0.02 0.00 0.00 177.57 177.74 2g4a h ALA 90 N 0.73 1.82 -0.92 1.67 0.00 -1.39 -1.98 119.26 119.18 2g4a h ALA 90 Ca 0.04 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2g4a h ALA 90 Cb 0.43 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 2g4a h ALA 90 CO 0.01 0.17 0.60 0.52 0.00 0.00 0.00 179.25 180.55 2g4a h MET 91 N 0.33 1.22 -0.58 0.00 2.86 -0.41 -1.92 114.93 116.43 2g4a h MET 91 Ca 0.09 -0.08 -0.04 0.00 -2.06 0.00 0.00 59.70 57.61 2g4a h MET 91 Cb -0.03 -0.27 -0.02 0.00 0.06 0.00 0.00 31.60 31.34 2g4a h MET 91 CO -0.02 0.81 0.19 0.00 1.06 0.00 0.00 176.91 178.96 2g4a h ALA 92 N 1.33 0.75 -0.94 6.32 0.00 -1.31 -2.27 119.26 123.15 2g4a h ALA 92 Ca 0.34 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2g4a h ALA 92 Cb -0.13 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.39 2g4a h ALA 92 CO -0.07 0.41 0.57 -0.09 0.00 0.00 0.00 179.25 180.07 2g4a h ARG 93 N 0.81 1.27 -0.55 0.00 2.43 -1.28 -1.60 114.38 115.46 2g4a h ARG 93 Ca 0.19 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 2g4a h ARG 93 Cb 0.26 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 2g4a h ARG 93 CO -0.01 0.88 0.06 0.87 -1.51 0.00 0.00 179.97 180.27 2g4a h LYS 94 N 1.29 0.93 -0.45 0.20 1.57 -1.12 -2.79 116.57 116.20 2g4a h LYS 94 Ca 0.34 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 2g4a h LYS 94 Cb -0.07 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2g4a h LYS 94 CO -0.06 0.91 0.08 -0.07 -0.57 0.00 0.00 179.45 179.74 2g4a h LEU 95 N 0.82 0.64 -0.28 2.94 3.38 -0.97 -2.87 115.31 118.96 2g4a h LEU 95 Ca 0.16 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2g4a h LEU 95 Cb 0.45 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2g4a h LEU 95 CO 0.02 0.66 0.18 -0.61 0.09 0.00 0.00 178.44 178.77 2g4a h GLN 96 N 0.67 0.35 -0.87 1.13 4.15 -1.04 0.38 115.11 119.88 2g4a h GLN 96 Ca 0.15 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.58 2g4a h GLN 96 Cb 0.30 -0.08 -0.05 0.00 0.21 0.00 0.00 27.48 27.85 2g4a h GLN 96 CO 0.00 0.23 0.56 0.22 -1.93 0.00 0.00 178.83 177.91 2g4a h ASP 97 N 0.36 0.93 -0.14 -0.69 3.58 -1.33 -1.65 116.42 117.48 2g4a h ASP 97 Ca 0.10 -0.01 -0.14 0.00 0.42 0.00 0.00 57.03 57.40 2g4a h ASP 97 Cb -0.03 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.80 2g4a h ASP 97 CO -0.03 0.64 -0.40 0.58 -2.88 0.00 0.00 179.24 177.15 2g4a h VAL 98 N 1.09 1.29 -0.80 2.25 2.07 -1.28 -2.99 116.25 117.88 2g4a h VAL 98 Ca 0.34 -1.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.27 2g4a h VAL 98 Cb 0.00 1.51 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 2g4a h VAL 98 CO -0.11 0.51 0.44 0.15 0.02 0.00 0.00 177.57 178.57 2g4a h PHE 99 N 0.56 1.10 -0.67 1.57 3.57 -0.30 -2.27 116.94 120.50 2g4a h PHE 99 Ca 0.05 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 2g4a h PHE 99 Cb 0.93 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 2g4a h PHE 99 CO 0.04 0.76 0.24 1.49 -2.23 0.00 0.00 178.31 178.61 2g4a h GLU 100 N 1.12 1.00 -0.91 1.11 4.81 -1.19 -2.37 114.58 118.16 2g4a h GLU 100 Ca 0.28 -0.18 0.05 0.00 -0.13 0.00 0.00 59.36 59.38 2g4a h GLU 100 Cb 0.03 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.19 2g4a h GLU 100 CO -0.05 0.83 0.59 0.74 -0.73 0.00 0.00 179.01 180.40 2g4a h PHE 101 N 0.97 1.08 -0.05 0.92 -1.00 -1.27 -1.31 116.94 116.28 2g4a h PHE 101 Ca 0.22 0.03 -0.13 0.00 2.81 0.00 0.00 57.97 60.89 2g4a h PHE 101 Cb 0.23 -0.36 -0.01 0.00 3.61 0.00 0.00 35.95 39.42 2g4a h PHE 101 CO 0.02 0.60 -0.58 0.00 -1.61 0.00 0.00 178.31 176.74 2g4a h ARG 102 N 1.09 0.15 -0.45 1.51 -0.00 -1.30 -3.06 114.38 112.32 2g4a h ARG 102 Ca 0.37 -0.10 0.09 0.00 -0.50 0.00 0.00 59.98 59.84 2g4a h ARG 102 Cb 0.09 0.01 -0.02 0.00 0.00 0.00 0.00 29.97 30.05 2g4a h ARG 102 CO -0.12 0.69 0.31 -0.92 0.00 0.00 0.00 179.97 179.93 2g4a h TYR 103 N 0.12 0.22 -0.48 3.04 5.03 -0.74 0.22 116.97 124.38 2g4a h TYR 103 Ca -0.00 0.01 -0.10 0.00 2.58 0.00 0.00 58.73 61.21 2g4a h TYR 103 Cb 1.06 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 39.25 2g4a h TYR 103 CO 0.01 0.11 -0.10 0.00 -1.32 0.00 0.00 178.16 176.86 2g4a h ALA 104 N 1.77 0.66 0.00 1.82 0.00 -1.45 -2.91 119.26 119.15 2g4a h ALA 104 Ca 0.21 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2g4a h ALA 104 Cb 0.55 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2g4a h ALA 104 CO -0.04 0.55 -0.32 1.63 0.00 0.00 0.00 179.25 181.07 2g4a n LYS 105 N -4.24 0.07 0.12 0.00 5.02 -0.58 -4.23 118.16 114.33 2g4a n LYS 105 Ca 0.00 0.03 -0.14 0.00 -2.02 0.00 0.00 58.31 56.18 2g4a n LYS 105 Cb 0.38 -1.56 -0.07 0.00 -0.02 0.00 0.00 35.03 33.76 2g4a n LYS 105 CO 0.00 0.00 0.00 1.98 -0.52 0.00 0.00 177.40 178.86 2g4a h MET 106 N 0.00 -0.62 -6.75 1.97 4.05 -0.40 -3.42 114.93 109.76 2g4a h MET 106 Ca 0.00 0.04 -0.54 0.00 -0.28 0.00 0.00 59.70 58.92 2g4a h MET 106 Cb 0.56 0.14 0.08 0.00 -0.80 0.00 0.00 31.60 31.59 2g4a h MET 106 CO 0.00 -0.41 0.83 -0.35 0.23 0.00 0.00 176.91 177.20 2g4a n PRO 107 N -5.46 2.56 0.00 0.39 -0.04 -1.26 -4.81 135.00 126.38 2g4a n PRO 107 Ca -0.07 0.91 0.00 0.00 -0.04 0.00 0.00 63.50 64.30 2g4a n PRO 107 Cb 0.37 -2.67 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 2g4a n PRO 107 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99