#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 0.13 -0.79 3.49 1.08 -2.01 -3.20 115.11 113.82 2g4a h GLN 2 Ca 0.00 -0.15 0.02 0.00 -1.45 0.00 0.00 58.65 57.07 2g4a h GLN 2 Cb 0.00 0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.43 2g4a h GLN 2 CO 0.00 0.92 0.52 1.25 -0.95 0.00 0.00 178.83 180.57 2g4a h LEU 3 N 0.07 0.88 -0.69 1.46 6.46 -1.96 -2.16 115.31 119.37 2g4a h LEU 3 Ca -0.03 -0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 57.67 2g4a h LEU 3 Cb 1.50 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 41.19 2g4a h LEU 3 CO 0.13 0.62 0.28 0.50 -0.62 0.00 0.00 178.44 179.35 2g4a h LYS 4 N 1.03 1.02 -0.86 1.25 3.64 -2.00 -2.40 116.57 118.25 2g4a h LYS 4 Ca 0.30 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2g4a h LYS 4 Cb -0.05 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.56 2g4a h LYS 4 CO -0.08 0.84 0.45 0.45 -2.27 0.00 0.00 179.45 178.84 2g4a h HIS 5 N 0.97 1.20 -0.64 1.91 3.86 -1.46 -2.48 115.15 118.52 2g4a h HIS 5 Ca 0.23 -0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 59.36 2g4a h HIS 5 Cb 0.19 -0.38 -0.03 0.00 1.06 0.00 0.00 27.41 28.26 2g4a h HIS 5 CO 0.01 0.85 0.23 0.00 0.86 0.00 0.00 177.93 179.88 2g4a h ASN 7 N 0.93 0.65 -0.70 0.00 2.35 -0.98 -2.28 115.58 115.55 2g4a h ASN 7 Ca 0.21 -0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.84 2g4a h ASN 7 Cb 0.22 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 2g4a h ASN 7 CO -0.01 0.57 0.21 0.58 -1.65 0.00 0.00 177.43 177.12 2g4a h VAL 8 N 0.73 1.26 -0.39 2.81 2.07 -1.19 -2.26 116.25 119.27 2g4a h VAL 8 Ca 0.18 -0.91 -0.09 0.00 0.82 0.00 0.00 66.70 66.71 2g4a h VAL 8 Cb 0.10 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 2g4a h VAL 8 CO -0.02 0.35 -0.11 0.40 0.02 0.00 0.00 177.57 178.21 2g4a h ILE 9 N 1.06 1.25 -0.62 4.57 2.04 -1.27 -2.78 117.51 121.77 2g4a h ILE 9 Ca 0.23 -1.13 -0.08 0.00 1.00 0.00 0.00 64.86 64.88 2g4a h ILE 9 Cb 0.31 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 2g4a h ILE 9 CO -0.01 0.38 0.08 0.25 0.00 0.00 0.00 178.15 178.86 2g4a h LEU 10 N 0.63 1.00 -1.12 1.44 5.85 -1.12 -2.57 115.31 119.43 2g4a h LEU 10 Ca 0.11 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 2g4a h LEU 10 Cb 0.56 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 2g4a h LEU 10 CO 0.04 1.02 0.47 0.11 -0.34 0.00 0.00 178.44 179.74 2g4a h LYS 11 N 0.95 1.08 -0.49 1.25 1.57 -1.22 -1.97 116.57 117.74 2g4a h LYS 11 Ca 0.19 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.77 2g4a h LYS 11 Cb 0.46 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 2g4a h LYS 11 CO 0.02 0.76 -0.09 1.49 -0.57 0.00 0.00 179.45 181.06 2g4a h GLU 12 N 1.10 0.89 -0.25 3.15 4.57 -1.25 0.53 114.58 123.32 2g4a h GLU 12 Ca 0.29 -0.30 -0.09 0.00 -1.18 0.00 0.00 59.36 58.07 2g4a h GLU 12 Cb -0.04 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.47 2g4a h GLU 12 CO -0.05 0.94 -0.25 -0.07 -1.18 0.00 0.00 179.01 178.40 2g4a h LEU 13 N 0.80 0.47 0.00 1.64 3.38 -1.03 -2.87 115.31 117.70 2g4a h LEU 13 Ca 0.13 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2g4a h LEU 13 Cb 0.60 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2g4a h LEU 13 CO 0.04 0.71 -0.90 0.18 0.09 0.00 0.00 178.44 178.56 2g4a n LEU 14 N -4.13 0.63 0.00 1.67 4.77 -0.79 -2.89 117.00 116.27 2g4a n LEU 14 Ca -0.00 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2g4a n LEU 14 Cb 0.40 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2g4a n LEU 14 CO 0.42 0.02 0.21 -0.24 -1.33 0.00 0.00 177.39 176.46 2g4a n SER 15 N -2.00 0.00 0.00 -1.43 2.88 0.18 -4.84 113.62 108.41 2g4a n SER 15 Ca 0.02 0.42 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 2g4a n SER 15 Cb 0.44 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 2g4a n SER 15 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2g4a n LYS 16 N -0.42 0.00 -0.35 -1.46 2.85 -1.25 -4.83 118.16 112.71 2g4a n LYS 16 Ca 0.00 0.00 0.15 0.00 -1.05 0.00 0.00 58.31 57.41 2g4a n LYS 16 Cb 0.00 0.00 0.36 0.00 -0.65 0.00 0.00 35.03 34.74 2g4a n LYS 16 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 2g4a h LYS 17 N 0.00 0.65 -0.10 -1.58 1.57 -1.90 -1.83 116.57 113.39 2g4a h LYS 17 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2g4a h LYS 17 Cb 0.00 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.16 2g4a h LYS 17 CO 0.00 0.43 0.00 0.72 -0.57 0.00 0.00 179.45 180.03 2g4a n HIS 18 N -4.80 0.30 0.02 -1.35 8.25 -1.26 -4.65 115.22 111.73 2g4a n HIS 18 Ca 0.25 -0.83 -0.04 0.00 -0.26 0.00 0.00 57.72 56.83 2g4a n HIS 18 Cb 0.65 -0.17 0.17 0.00 1.12 0.00 0.00 29.99 31.77 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 0.68 1.02 -0.98 -1.41 0.00 -1.19 -2.23 119.26 115.15 2g4a h ALA 19 Ca 0.00 -0.39 0.18 0.00 0.00 0.00 0.00 54.91 54.71 2g4a h ALA 19 Cb 1.01 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.59 2g4a h ALA 19 CO 0.06 0.59 0.61 0.00 0.00 0.00 0.00 179.25 180.52 2g4a h ALA 20 N 1.25 1.78 -0.01 0.00 0.00 -1.83 0.21 119.26 120.66 2g4a h ALA 20 Ca 0.05 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2g4a h ALA 20 Cb 0.77 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2g4a h ALA 20 CO 0.06 -0.11 -0.54 0.66 0.00 0.00 0.00 179.25 179.32 2g4a n TYR 21 N -4.68 0.00 -0.04 0.00 4.01 -1.13 -4.27 117.16 111.06 2g4a n TYR 21 Ca 0.22 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.79 2g4a n TYR 21 Cb 0.57 -0.09 -0.13 0.00 -0.31 0.00 0.00 39.34 39.37 2g4a n TYR 21 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2g4a h ALA 22 N 3.42 0.00 -0.50 -0.72 0.00 -0.00 -3.23 119.26 118.24 2g4a h ALA 22 Ca 0.00 -0.63 -0.03 0.00 0.00 0.00 0.00 54.91 54.24 2g4a h ALA 22 Cb 0.57 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2g4a h ALA 22 CO 0.00 0.19 0.16 0.11 0.00 0.00 0.00 179.25 179.72 2g4a h TRP 23 N -0.79 0.73 -0.39 0.00 5.08 -1.49 0.21 115.95 119.31 2g4a h TRP 23 Ca -0.08 -0.04 -0.10 0.00 1.08 0.00 0.00 58.89 59.74 2g4a h TRP 23 Cb 1.23 -0.22 -0.01 0.00 -3.00 0.00 0.00 29.16 27.16 2g4a h TRP 23 CO 0.24 0.59 -0.17 -1.00 -1.28 0.00 0.00 178.44 176.82 2g4a h PRO 24 N 0.71 0.79 -0.02 0.12 0.13 -1.74 -2.91 132.00 129.08 2g4a h PRO 24 Ca 0.17 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 2g4a h PRO 24 Cb 0.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.30 2g4a h PRO 24 CO -0.01 0.96 0.00 1.19 -0.23 0.00 0.00 178.00 179.91 2g4a n PHE 25 N -4.28 0.01 0.15 1.56 3.72 -1.14 -4.24 117.46 113.25 2g4a n PHE 25 Ca -0.02 -0.01 -0.11 0.00 -0.05 0.00 0.00 57.45 57.27 2g4a n PHE 25 Cb 0.41 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.88 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 2.31 -0.42 -3.98 1.38 5.03 -0.36 -2.38 116.97 118.55 2g4a h TYR 26 Ca 0.00 -0.01 -0.51 0.00 2.58 0.00 0.00 58.73 60.79 2g4a h TYR 26 Cb 0.49 0.14 0.07 0.00 1.55 0.00 0.00 36.73 38.98 2g4a h TYR 26 CO 0.01 -0.09 0.52 0.15 -1.32 0.00 0.00 178.16 177.42 2g4a s LYS 27 N -3.83 3.83 0.00 1.82 1.02 -1.25 -2.45 119.74 118.88 2g4a s LYS 27 Ca -0.12 1.89 0.00 0.00 0.02 0.00 0.00 55.97 57.76 2g4a s LYS 27 Cb 0.01 -2.53 0.00 0.00 -0.52 0.00 0.00 37.83 34.79 2g4a s LYS 27 CO 0.41 -0.52 0.00 -0.35 -0.92 0.00 0.00 175.35 173.97 2g4a n PRO 28 N -0.26 0.14 -3.85 -1.68 -0.04 -1.26 -4.83 135.00 123.22 2g4a n PRO 28 Ca 0.06 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.22 2g4a n PRO 28 Cb 0.47 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.79 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 -0.84 1.97 -1.17 0.52 1.01 -1.26 -5.03 120.40 115.60 2g4a s VAL 29 Ca 0.00 -2.79 -0.21 0.00 0.00 0.00 0.00 61.98 58.98 2g4a s VAL 29 Cb 0.00 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 34.01 2g4a s VAL 29 CO 0.00 -0.81 1.76 -1.81 0.00 0.00 0.00 175.10 174.23 2g4a s ASP 30 N 0.21 6.10 0.47 3.32 1.01 -1.26 -4.73 116.67 121.79 2g4a s ASP 30 Ca 0.16 -1.83 0.15 0.00 0.71 0.00 0.00 52.55 51.73 2g4a s ASP 30 Cb -0.24 -2.58 1.08 0.00 1.01 0.00 0.00 42.92 42.19 2g4a s ASP 30 CO -0.02 -1.92 2.04 0.00 0.21 0.00 0.00 175.17 175.48 2g4a h ALA 31 N 9.02 1.79 -0.20 5.23 0.00 -1.96 0.64 119.26 133.78 2g4a h ALA 31 Ca 0.30 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.90 2g4a h ALA 31 Cb 0.93 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.70 2g4a h ALA 31 CO 1.36 0.16 -0.64 0.77 0.00 0.00 0.00 179.25 180.90 2g4a h SER 32 N 0.02 0.91 0.00 0.00 0.02 -1.87 -0.31 113.55 112.30 2g4a h SER 32 Ca 0.00 -0.59 -0.00 0.00 -0.84 0.00 0.00 61.79 60.36 2g4a h SER 32 Cb 0.21 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 2g4a h SER 32 CO 0.02 1.34 -0.00 0.00 -1.14 0.00 0.00 176.83 177.04 2g4a h ALA 33 N 0.59 0.00 0.46 3.77 0.00 -1.80 -3.40 119.26 118.88 2g4a h ALA 33 Ca -0.02 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 2g4a h ALA 33 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2g4a h ALA 33 CO 0.14 0.00 -0.22 -0.07 0.00 0.00 0.00 179.25 179.09 2g4a h LEU 34 N -1.00 -0.52 0.00 0.00 3.38 0.15 -3.49 115.31 113.83 2g4a h LEU 34 Ca -0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2g4a h LEU 34 Cb 0.59 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2g4a h LEU 34 CO -0.00 -0.24 0.00 0.61 0.09 0.00 0.00 178.44 178.90 2g4a n GLY 35 N -0.23 0.27 2.65 0.83 0.00 -0.22 -5.03 105.19 103.46 2g4a n GLY 35 Ca -0.08 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.13 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 2.52 0.20 0.99 1.43 -0.66 -4.93 118.68 118.22 2g4a s LEU 36 Ca 0.00 -2.77 -0.01 0.00 -1.03 0.00 0.00 54.13 50.32 2g4a s LEU 36 Cb 0.00 -0.93 0.14 0.00 0.03 0.00 0.00 46.19 45.43 2g4a s LEU 36 CO 0.00 -0.24 1.50 0.45 0.23 0.00 0.00 176.35 178.30 2g4a h HIS 37 N 6.45 0.57 0.00 0.29 3.86 -1.99 -2.99 115.15 121.34 2g4a h HIS 37 Ca 0.06 -0.22 -0.06 0.00 -1.16 0.00 0.00 60.37 59.00 2g4a h HIS 37 Cb 0.91 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.27 2g4a h HIS 37 CO 0.47 0.93 -0.26 -0.44 0.86 0.00 0.00 177.93 179.48 2g4a h ASP 38 N 0.33 0.00 -0.29 2.45 5.19 -1.98 -2.30 116.42 119.82 2g4a h ASP 38 Ca -0.00 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.31 2g4a h ASP 38 Cb 1.14 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.63 2g4a h ASP 38 CO 0.11 0.26 -0.13 0.22 -3.12 0.00 0.00 179.24 176.58 2g4a h TYR 39 N 0.00 0.79 0.00 4.55 5.03 -1.94 -1.24 116.97 124.17 2g4a h TYR 39 Ca -0.00 -0.15 -0.12 0.00 2.58 0.00 0.00 58.73 61.04 2g4a h TYR 39 Cb 0.58 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.64 2g4a h TYR 39 CO 0.00 0.81 -0.63 1.25 -1.32 0.00 0.00 178.16 178.28 2g4a h HIS 40 N 0.65 0.00 -0.02 -3.82 2.76 -1.54 -1.98 115.15 111.20 2g4a h HIS 40 Ca 0.11 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.16 2g4a h HIS 40 Cb 0.60 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.57 2g4a h HIS 40 CO 0.03 0.53 -0.43 -0.44 -1.30 0.00 0.00 177.93 176.32 2g4a h ASP 41 N 0.00 0.41 0.06 3.26 3.32 -1.18 -1.82 116.42 120.47 2g4a h ASP 41 Ca -0.02 -0.74 -0.00 0.00 0.02 0.00 0.00 57.03 56.29 2g4a h ASP 41 Cb 1.43 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2g4a h ASP 41 CO 0.07 1.10 -0.03 0.40 -1.72 0.00 0.00 179.24 179.05 2g4a h ILE 42 N -0.23 0.72 0.15 0.35 2.04 -1.34 -3.40 117.51 115.80 2g4a h ILE 42 Ca -0.05 -1.39 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 2g4a h ILE 42 Cb 1.15 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 2g4a h ILE 42 CO 0.09 0.23 -0.07 0.40 0.00 0.00 0.00 178.15 178.79 2g4a h ILE 43 N -0.98 0.00 0.00 -0.67 1.08 -1.53 -3.47 117.51 111.94 2g4a h ILE 43 Ca -0.01 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.17 2g4a h ILE 43 Cb 0.44 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.19 2g4a h ILE 43 CO 0.01 0.00 0.00 1.17 -0.69 0.00 0.00 178.15 178.64 2g4a n LYS 44 N -3.37 0.00 -3.37 2.37 4.81 -0.68 -4.82 118.16 113.10 2g4a n LYS 44 Ca -0.03 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.16 2g4a n LYS 44 Cb 0.08 -0.64 -0.08 0.00 0.02 0.00 0.00 35.03 34.41 2g4a n LYS 44 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2g4a n HIS 45 N -1.29 1.27 -2.07 5.64 8.25 -1.26 -5.02 115.22 120.74 2g4a n HIS 45 Ca 0.00 -3.80 -0.42 0.00 -0.26 0.00 0.00 57.72 53.24 2g4a n HIS 45 Cb 0.00 -0.36 -0.03 0.00 1.12 0.00 0.00 29.99 30.72 2g4a n HIS 45 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2g4a s PRO 46 N -1.47 4.26 -0.00 -0.41 0.04 -1.26 -5.01 135.00 131.15 2g4a s PRO 46 Ca 0.35 2.18 0.06 0.00 0.04 0.00 0.00 61.00 63.63 2g4a s PRO 46 Cb 0.12 -3.36 -0.02 0.00 0.04 0.00 0.00 34.50 31.28 2g4a s PRO 46 CO -0.10 -0.57 -0.17 -1.64 0.04 0.00 0.00 177.00 174.56 2g4a s MET 47 N 1.70 1.36 0.16 4.56 -1.94 -1.26 -5.02 119.30 118.85 2g4a s MET 47 Ca 0.68 -0.67 0.00 0.00 -1.71 0.00 0.00 55.69 53.99 2g4a s MET 47 Cb -0.38 -1.34 -0.04 0.00 2.01 0.00 0.00 34.83 35.08 2g4a s MET 47 CO 0.30 0.36 0.05 0.16 -0.01 0.00 0.00 175.02 175.88 2g4a s ASP 48 N -0.56 0.65 0.33 3.03 -4.77 -1.26 -4.91 116.67 109.18 2g4a s ASP 48 Ca 0.06 -1.22 0.04 0.00 -3.30 0.00 0.00 52.55 48.13 2g4a s ASP 48 Cb -0.07 0.23 0.59 0.00 -1.09 0.00 0.00 42.92 42.58 2g4a s ASP 48 CO -0.00 -0.68 1.88 0.25 0.70 0.00 0.00 175.17 177.32 2g4a h LEU 49 N 2.76 0.54 -1.18 2.11 5.85 -1.52 -2.53 115.31 121.34 2g4a h LEU 49 Ca -0.36 -0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.31 2g4a h LEU 49 Cb 1.21 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.05 2g4a h LEU 49 CO 0.60 0.58 0.56 0.28 -0.34 0.00 0.00 178.44 180.12 2g4a h SER 50 N 0.56 0.91 0.19 1.25 0.02 -1.71 -1.39 113.55 113.38 2g4a h SER 50 Ca 0.12 -0.01 -0.18 0.00 -0.84 0.00 0.00 61.79 60.89 2g4a h SER 50 Cb 0.29 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 2g4a h SER 50 CO 0.00 0.62 -0.68 0.74 -1.14 0.00 0.00 176.83 176.37 2g4a h THR 51 N 1.05 1.36 -0.45 -2.27 2.02 -1.76 -3.10 112.91 109.77 2g4a h THR 51 Ca 0.34 -2.04 -0.06 0.00 0.77 0.00 0.00 66.41 65.42 2g4a h THR 51 Cb 0.04 2.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.45 2g4a h THR 51 CO -0.10 0.62 0.04 0.58 0.37 0.00 0.00 175.52 177.02 2g4a h VAL 52 N 0.32 1.22 -0.72 3.16 2.07 -1.07 -2.67 116.25 118.55 2g4a h VAL 52 Ca -0.02 -0.88 -0.05 0.00 0.82 0.00 0.00 66.70 66.58 2g4a h VAL 52 Cb 1.25 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.83 2g4a h VAL 52 CO 0.12 0.31 0.27 0.50 0.02 0.00 0.00 177.57 178.80 2g4a h LYS 53 N 0.68 1.09 -0.28 1.57 3.64 -1.21 -2.22 116.57 119.83 2g4a h LYS 53 Ca 0.14 -0.21 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 2g4a h LYS 53 Cb 0.36 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2g4a h LYS 53 CO 0.01 0.90 -0.07 0.00 -2.27 0.00 0.00 179.45 178.02 2g4a h ARG 54 N 1.04 0.45 -0.26 1.90 3.08 -1.42 -1.44 114.38 117.73 2g4a h ARG 54 Ca 0.24 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.13 2g4a h ARG 54 Cb 0.23 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2g4a h ARG 54 CO -0.02 0.54 -0.05 0.87 -1.07 0.00 0.00 179.97 180.24 2g4a h LYS 55 N 0.43 0.49 -0.30 0.04 6.56 -1.14 -1.79 116.57 120.85 2g4a h LYS 55 Ca 0.09 -0.18 -0.07 0.00 -1.06 0.00 0.00 60.65 59.43 2g4a h LYS 55 Cb 0.40 -0.03 -0.02 0.00 -0.57 0.00 0.00 32.23 32.01 2g4a h LYS 55 CO 0.02 0.69 -0.12 0.52 -2.06 0.00 0.00 179.45 178.51 2g4a h MET 56 N 0.24 0.51 0.00 3.15 2.86 -1.19 0.76 114.93 121.26 2g4a h MET 56 Ca 0.07 -0.15 -0.09 0.00 -2.06 0.00 0.00 59.70 57.47 2g4a h MET 56 Cb 0.51 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 2g4a h MET 56 CO 0.02 0.63 -0.45 0.93 1.06 0.00 0.00 176.91 179.10 2g4a h GLU 57 N 0.48 0.00 -0.03 1.72 5.08 -1.13 -2.70 114.58 118.00 2g4a h GLU 57 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2g4a h GLU 57 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2g4a h GLU 57 CO 0.03 0.45 -0.08 0.09 -1.00 0.00 0.00 179.01 178.50 2g4a n ASN 58 N -3.79 2.77 -2.74 1.42 3.02 -0.68 -4.96 115.26 110.30 2g4a n ASN 58 Ca -0.01 -1.89 -0.19 0.00 -0.03 0.00 0.00 54.58 52.46 2g4a n ASN 58 Cb 0.50 0.08 0.05 0.00 -0.61 0.00 0.00 39.78 39.80 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 1.07 -5.23 0.18 3.52 0.63 0.96 -4.89 116.66 112.88 2g4a n ARG 59 Ca 0.13 0.70 0.03 0.00 -0.92 0.00 0.00 57.85 57.80 2g4a n ARG 59 Cb 0.57 -5.24 0.32 0.00 0.45 0.00 0.00 32.46 28.56 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 -1.67 0.00 -1.10 6.15 1.82 0.04 -3.31 116.42 118.36 2g4a h ASP 60 Ca -0.45 0.00 -0.63 0.00 -0.39 0.00 0.00 57.03 55.57 2g4a h ASP 60 Cb 1.30 0.00 -0.26 0.00 0.68 0.00 0.00 39.33 41.05 2g4a h ASP 60 CO 0.46 0.43 0.81 -1.22 -1.61 0.00 0.00 179.24 178.11 2g4a n TYR 61 N -3.84 2.82 0.00 0.28 4.02 -1.26 -4.90 117.16 114.29 2g4a n TYR 61 Ca -0.01 -2.67 0.00 0.00 -0.01 0.00 0.00 57.90 55.21 2g4a n TYR 61 Cb 0.48 -1.32 0.00 0.00 -0.02 0.00 0.00 39.34 38.48 2g4a n TYR 61 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2g4a n ARG 62 N -0.54 0.00 -3.55 -0.72 1.74 -1.25 -4.46 116.66 107.88 2g4a n ARG 62 Ca 0.55 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.54 2g4a n ARG 62 Cb 0.56 -0.40 -0.03 0.00 -1.02 0.00 0.00 32.46 31.56 2g4a n ARG 62 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2g4a s ASP 63 N 0.00 -0.34 0.15 0.55 -1.08 -1.26 -5.03 116.67 109.66 2g4a s ASP 63 Ca 0.00 0.18 -0.00 0.00 -0.52 0.00 0.00 52.55 52.21 2g4a s ASP 63 Cb 0.00 0.32 -0.04 0.00 -1.46 0.00 0.00 42.92 41.73 2g4a s ASP 63 CO 0.00 -0.44 1.35 0.00 0.52 0.00 0.00 175.17 176.59 2g4a h ALA 64 N 2.25 0.45 -0.71 3.66 0.00 -1.92 -3.16 119.26 119.85 2g4a h ALA 64 Ca -0.19 -0.72 0.01 0.00 0.00 0.00 0.00 54.91 54.02 2g4a h ALA 64 Cb 1.20 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2g4a h ALA 64 CO 0.30 0.87 0.47 1.96 0.00 0.00 0.00 179.25 182.85 2g4a h GLN 65 N 0.16 0.92 -0.47 0.00 7.50 -1.96 -0.43 115.11 120.84 2g4a h GLN 65 Ca -0.06 -0.06 -0.14 0.00 0.50 0.00 0.00 58.65 58.90 2g4a h GLN 65 Cb 1.54 -0.21 -0.01 0.00 0.05 0.00 0.00 27.48 28.85 2g4a h GLN 65 CO 0.15 0.61 -0.24 0.93 -1.50 0.00 0.00 178.83 178.77 2g4a h GLU 66 N 0.94 0.98 -0.30 1.46 4.39 -1.88 -1.86 114.58 118.31 2g4a h GLU 66 Ca 0.26 -0.43 -0.07 0.00 0.34 0.00 0.00 59.36 59.46 2g4a h GLU 66 Cb -0.09 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 2g4a h GLU 66 CO -0.06 1.10 -0.08 0.35 -1.16 0.00 0.00 179.01 179.16 2g4a h PHE 67 N 0.84 0.66 -0.61 4.33 3.57 -1.36 -2.48 116.94 121.88 2g4a h PHE 67 Ca 0.10 -0.15 -0.04 0.00 3.53 0.00 0.00 57.97 61.42 2g4a h PHE 67 Cb 0.82 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 2g4a h PHE 67 CO 0.05 0.78 0.21 0.00 -2.23 0.00 0.00 178.31 177.13 2g4a h ALA 68 N 0.78 1.22 -0.39 2.41 0.00 -1.07 -2.22 119.26 120.00 2g4a h ALA 68 Ca 0.07 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 2g4a h ALA 68 Cb 0.57 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2g4a h ALA 68 CO 0.03 0.56 -0.09 0.00 0.00 0.00 0.00 179.25 179.75 2g4a h ALA 69 N 1.34 1.10 -0.25 0.00 0.00 -1.24 -1.85 119.26 118.36 2g4a h ALA 69 Ca 0.21 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 2g4a h ALA 69 Cb 0.22 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2g4a h ALA 69 CO -0.01 0.56 -0.40 -0.44 0.00 0.00 0.00 179.25 178.95 2g4a h ASP 70 N 0.63 0.64 -0.33 0.00 3.32 -1.01 -2.63 116.42 117.03 2g4a h ASP 70 Ca 0.11 -0.29 -0.14 0.00 0.02 0.00 0.00 57.03 56.74 2g4a h ASP 70 Cb 0.53 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 2g4a h ASP 70 CO 0.03 0.97 -0.32 0.58 -1.72 0.00 0.00 179.24 178.78 2g4a h VAL 71 N 0.50 1.29 -0.47 -1.35 2.07 -1.17 -2.67 116.25 114.44 2g4a h VAL 71 Ca 0.04 -1.49 -0.02 0.00 0.82 0.00 0.00 66.70 66.05 2g4a h VAL 71 Cb 0.92 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 2g4a h VAL 71 CO 0.08 0.49 0.21 -0.09 0.02 0.00 0.00 177.57 178.27 2g4a h ARG 72 N 0.58 0.67 -0.38 1.57 2.43 -1.30 -1.84 114.38 116.12 2g4a h ARG 72 Ca 0.05 -0.09 -0.10 0.00 -0.81 0.00 0.00 59.98 59.04 2g4a h ARG 72 Cb 0.90 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 2g4a h ARG 72 CO 0.08 0.54 -0.14 1.25 -1.51 0.00 0.00 179.97 180.19 2g4a h LEU 73 N 0.67 0.78 -0.74 3.80 5.85 -1.36 -1.19 115.31 123.12 2g4a h LEU 73 Ca 0.17 -0.39 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 2g4a h LEU 73 Cb 0.11 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2g4a h LEU 73 CO -0.02 0.99 0.26 -0.03 -0.34 0.00 0.00 178.44 179.30 2g4a h MET 74 N 0.56 1.13 -0.36 1.25 4.05 -1.11 0.10 114.93 120.54 2g4a h MET 74 Ca 0.09 -0.23 -0.15 0.00 -0.28 0.00 0.00 59.70 59.13 2g4a h MET 74 Cb 0.68 -0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 31.30 2g4a h MET 74 CO 0.05 0.94 -0.37 0.74 0.23 0.00 0.00 176.91 178.50 2g4a h PHE 75 N 1.08 1.00 -0.04 1.39 0.04 -1.27 -2.78 116.94 116.36 2g4a h PHE 75 Ca 0.24 -0.29 -0.13 0.00 2.80 0.00 0.00 57.97 60.59 2g4a h PHE 75 Cb 0.27 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 2g4a h PHE 75 CO 0.02 1.08 -0.56 1.03 -0.60 0.00 0.00 178.31 179.28 2g4a h SER 76 N 0.70 0.14 -0.37 2.17 0.87 -0.99 -2.70 113.55 113.36 2g4a h SER 76 Ca 0.06 -0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 60.50 2g4a h SER 76 Cb 0.94 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.84 2g4a h SER 76 CO 0.09 0.67 0.05 0.78 -0.53 0.00 0.00 176.83 177.89 2g4a h ASN 77 N 0.10 0.61 -0.58 6.23 2.35 -0.86 -1.33 115.58 122.10 2g4a h ASN 77 Ca -0.00 -0.27 -0.08 0.00 -0.55 0.00 0.00 56.30 55.40 2g4a h ASN 77 Cb 1.02 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 39.20 2g4a h ASN 77 CO 0.08 0.73 0.07 0.00 -1.65 0.00 0.00 177.43 176.66 2g4a h TYR 79 N 0.94 0.57 -0.60 0.00 0.05 -1.35 -0.11 116.97 116.47 2g4a h TYR 79 Ca 0.18 -0.09 -0.06 0.00 0.05 0.00 0.00 58.73 58.81 2g4a h TYR 79 Cb 0.45 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 38.01 2g4a h TYR 79 CO 0.03 0.64 0.13 0.87 -1.05 0.00 0.00 178.16 178.78 2g4a h LYS 80 N 0.33 0.95 0.39 4.88 1.79 -1.11 -3.25 116.57 120.55 2g4a h LYS 80 Ca 0.09 -0.22 -0.02 0.00 -2.18 0.00 0.00 60.65 58.32 2g4a h LYS 80 Cb 0.40 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 2g4a h LYS 80 CO 0.01 0.86 -0.19 -0.92 -1.08 0.00 0.00 179.45 178.14 2g4a h TYR 81 N 0.91 -0.48 -3.30 -1.35 5.03 -0.91 -3.44 116.97 113.43 2g4a h TYR 81 Ca 0.19 -0.01 -0.67 0.00 2.58 0.00 0.00 58.73 60.82 2g4a h TYR 81 Cb 0.36 0.16 -0.32 0.00 1.55 0.00 0.00 36.73 38.48 2g4a h TYR 81 CO 0.02 -0.19 -0.84 -0.80 -1.32 0.00 0.00 178.16 175.03 2g4a s ASN 82 N -4.99 3.36 0.87 -2.11 -0.87 -0.06 -5.09 114.94 106.04 2g4a s ASN 82 Ca -0.11 -0.51 -0.10 0.00 -1.57 0.00 0.00 52.86 50.56 2g4a s ASN 82 Cb 0.01 -1.48 0.12 0.00 -0.02 0.00 0.00 41.25 39.88 2g4a s ASN 82 CO 0.38 0.13 1.12 -2.84 -2.57 0.00 0.00 177.10 173.32 2g4a s PRO 83 N 0.51 1.41 -0.40 -0.60 0.02 -1.25 -4.31 135.00 130.38 2g4a s PRO 83 Ca -0.13 1.34 -0.29 0.00 0.02 0.00 0.00 61.00 61.94 2g4a s PRO 83 Cb -0.17 -1.79 0.01 0.00 0.02 0.00 0.00 34.50 32.57 2g4a s PRO 83 CO 0.05 -2.29 1.47 -1.25 -0.33 0.00 0.00 177.00 174.65 2g4a s PRO 84 N -4.75 3.53 0.00 5.54 0.05 -1.26 -4.30 135.00 133.81 2g4a s PRO 84 Ca 0.65 1.00 0.00 0.00 0.05 0.00 0.00 61.00 62.69 2g4a s PRO 84 Cb -0.20 -4.05 0.00 0.00 0.05 0.00 0.00 34.50 30.29 2g4a s PRO 84 CO 0.57 -1.62 0.00 -3.47 0.05 0.00 0.00 177.00 172.53 2g4a n ASP 85 N 9.07 0.00 -4.28 6.66 2.03 -1.26 -5.10 116.55 123.67 2g4a n ASP 85 Ca 0.17 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 55.22 2g4a n ASP 85 Cb 0.48 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.84 2g4a n ASP 85 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2g4a n HIS 86 N 0.00 0.57 0.09 -0.67 8.25 -1.26 -5.02 115.22 117.18 2g4a n HIS 86 Ca 0.00 -2.07 -0.06 0.00 -0.26 0.00 0.00 57.72 55.33 2g4a n HIS 86 Cb 0.00 -0.30 -0.00 0.00 1.12 0.00 0.00 29.99 30.80 2g4a n HIS 86 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 2g4a h ASP 87 N 0.91 0.10 0.13 0.41 3.58 -1.99 -2.99 116.42 116.58 2g4a h ASP 87 Ca -0.34 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.02 2g4a h ASP 87 Cb 1.07 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.09 2g4a h ASP 87 CO 0.56 0.91 -0.06 0.58 -2.88 0.00 0.00 179.24 178.34 2g4a h VAL 88 N 0.04 0.92 -0.55 2.25 2.07 -1.98 -0.77 116.25 118.23 2g4a h VAL 88 Ca -0.02 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 2g4a h VAL 88 Cb 1.49 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.25 2g4a h VAL 88 CO 0.12 0.04 0.26 0.58 0.02 0.00 0.00 177.57 178.58 2g4a h VAL 89 N -0.24 1.21 -0.26 2.57 2.07 -1.89 -2.40 116.25 117.30 2g4a h VAL 89 Ca -0.02 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 2g4a h VAL 89 Cb 0.19 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 2g4a h VAL 89 CO 0.03 0.24 0.10 0.00 0.02 0.00 0.00 177.57 177.96 2g4a h ALA 90 N 1.09 1.69 -0.61 1.67 0.00 -1.39 -1.87 119.26 119.85 2g4a h ALA 90 Ca 0.19 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2g4a h ALA 90 Cb 0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2g4a h ALA 90 CO -0.02 0.25 0.20 0.52 0.00 0.00 0.00 179.25 180.20 2g4a h MET 91 N 0.37 0.91 -0.31 0.00 2.86 -0.62 -2.33 114.93 115.80 2g4a h MET 91 Ca 0.09 -0.17 -0.15 0.00 -2.06 0.00 0.00 59.70 57.41 2g4a h MET 91 Cb 0.08 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.59 2g4a h MET 91 CO -0.01 0.78 -0.41 0.00 1.06 0.00 0.00 176.91 178.33 2g4a h ALA 92 N 1.33 0.47 -0.43 6.32 0.00 -1.17 -2.95 119.26 122.83 2g4a h ALA 92 Ca 0.20 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2g4a h ALA 92 Cb 0.24 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2g4a h ALA 92 CO -0.01 0.58 0.16 -0.09 0.00 0.00 0.00 179.25 179.89 2g4a h ARG 93 N 0.60 0.61 -0.29 0.00 2.43 -1.22 -0.35 114.38 116.16 2g4a h ARG 93 Ca 0.04 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.03 2g4a h ARG 93 Cb 1.00 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 2g4a h ARG 93 CO 0.10 0.51 -0.21 0.87 -1.51 0.00 0.00 179.97 179.72 2g4a h LYS 94 N 0.61 0.54 -0.00 0.20 1.57 -1.35 -2.85 116.57 115.28 2g4a h LYS 94 Ca 0.15 -0.20 -0.19 0.00 -1.87 0.00 0.00 60.65 58.54 2g4a h LYS 94 Cb 0.13 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 2g4a h LYS 94 CO -0.01 0.72 -0.86 -0.07 -0.57 0.00 0.00 179.45 178.66 2g4a h LEU 95 N 0.48 0.25 -0.96 2.94 3.38 -1.20 -3.22 115.31 116.98 2g4a h LEU 95 Ca 0.08 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 2g4a h LEU 95 Cb 0.64 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2g4a h LEU 95 CO 0.05 1.00 0.32 -0.61 0.09 0.00 0.00 178.44 179.28 2g4a h GLN 96 N 0.11 1.06 -0.62 1.13 4.15 -0.88 -1.10 115.11 118.97 2g4a h GLN 96 Ca -0.04 -0.17 -0.08 0.00 0.77 0.00 0.00 58.65 59.13 2g4a h GLN 96 Cb 1.48 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.96 2g4a h GLN 96 CO 0.13 0.84 0.07 -0.44 -1.93 0.00 0.00 178.83 177.50 2g4a h ASP 97 N 1.05 1.01 -0.33 -0.69 3.32 -1.54 -2.13 116.42 117.11 2g4a h ASP 97 Ca 0.25 -0.28 -0.12 0.00 0.02 0.00 0.00 57.03 56.90 2g4a h ASP 97 Cb 0.16 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 2g4a h ASP 97 CO -0.03 1.04 -0.23 0.58 -1.72 0.00 0.00 179.24 178.88 2g4a h VAL 98 N 0.96 1.27 -0.67 -1.35 2.07 -1.49 -2.74 116.25 114.31 2g4a h VAL 98 Ca 0.18 -1.37 -0.07 0.00 0.82 0.00 0.00 66.70 66.26 2g4a h VAL 98 Cb 0.48 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 2g4a h VAL 98 CO 0.02 0.46 0.12 0.15 0.02 0.00 0.00 177.57 178.34 2g4a h PHE 99 N 0.72 1.15 -0.81 1.57 3.57 -1.04 -2.29 116.94 119.81 2g4a h PHE 99 Ca 0.09 -0.15 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 2g4a h PHE 99 Cb 0.77 -0.32 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 2g4a h PHE 99 CO 0.04 0.96 0.45 1.49 -2.23 0.00 0.00 178.31 179.02 2g4a h GLU 100 N 1.02 1.12 -0.41 1.11 4.81 -1.27 0.94 114.58 121.90 2g4a h GLU 100 Ca 0.21 -0.12 -0.09 0.00 -0.13 0.00 0.00 59.36 59.22 2g4a h GLU 100 Cb 0.42 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 2g4a h GLU 100 CO 0.01 0.81 -0.13 0.74 -0.73 0.00 0.00 179.01 179.72 2g4a h PHE 101 N 1.12 0.82 0.01 0.92 0.04 -1.25 -2.83 116.94 115.76 2g4a h PHE 101 Ca 0.29 -0.15 -0.20 0.00 2.80 0.00 0.00 57.97 60.71 2g4a h PHE 101 Cb 0.01 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 2g4a h PHE 101 CO 0.00 0.83 -0.89 0.00 -0.60 0.00 0.00 178.31 177.65 2g4a h ARG 102 N 0.67 0.16 0.00 1.51 -0.00 -1.03 -3.13 114.38 112.57 2g4a h ARG 102 Ca 0.11 -0.19 -0.01 0.00 -0.50 0.00 0.00 59.98 59.39 2g4a h ARG 102 Cb 0.60 0.06 -0.00 0.00 0.00 0.00 0.00 29.97 30.62 2g4a h ARG 102 CO 0.04 0.95 -0.07 -0.92 0.00 0.00 0.00 179.97 179.97 2g4a h TYR 103 N 0.09 0.00 -0.17 3.04 3.20 -0.58 -1.42 116.97 121.12 2g4a h TYR 103 Ca -0.04 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.69 2g4a h TYR 103 Cb 1.53 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.79 2g4a h TYR 103 CO 0.03 0.07 -0.48 0.00 -1.64 0.00 0.00 178.16 176.14 2g4a h ALA 104 N 1.93 0.85 -0.00 1.82 0.00 -1.45 -2.96 119.26 119.44 2g4a h ALA 104 Ca -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2g4a h ALA 104 Cb 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2g4a h ALA 104 CO 0.01 0.66 -0.47 1.63 0.00 0.00 0.00 179.25 181.08 2g4a n LYS 105 N -3.98 0.03 0.12 0.00 5.02 -0.74 -4.21 118.16 114.40 2g4a n LYS 105 Ca -0.02 -0.02 -0.13 0.00 -2.02 0.00 0.00 58.31 56.13 2g4a n LYS 105 Cb 0.55 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 34.00 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 0.04 -0.35 -6.57 1.97 4.05 -1.11 -3.40 114.93 109.55 2g4a h MET 106 Ca 0.00 0.02 -0.59 0.00 -0.28 0.00 0.00 59.70 58.85 2g4a h MET 106 Cb 0.50 0.08 0.11 0.00 -0.80 0.00 0.00 31.60 31.49 2g4a h MET 106 CO 0.00 -0.23 0.25 -2.30 0.23 0.00 0.00 176.91 174.85 2g4a n PRO 107 N -5.31 1.59 0.00 0.39 -0.02 -1.26 -5.05 135.00 125.35 2g4a n PRO 107 Ca -0.07 0.56 0.05 0.00 -2.02 0.00 0.00 63.50 62.01 2g4a n PRO 107 Cb 0.22 -2.01 0.28 0.00 -0.02 0.00 0.00 33.50 31.97 2g4a n PRO 107 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01