#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 0.12 -1.00 3.49 1.08 -2.01 -3.31 115.11 113.49 2g4a h GLN 2 Ca 0.00 -0.21 0.08 0.00 -1.45 0.00 0.00 58.65 57.07 2g4a h GLN 2 Cb 0.00 0.08 -0.07 0.00 -0.05 0.00 0.00 27.48 27.44 2g4a h GLN 2 CO 0.00 1.08 0.64 -0.07 -0.95 0.00 0.00 178.83 179.53 2g4a h LEU 3 N 0.03 1.00 -0.32 1.46 -0.00 -1.98 -0.36 115.31 115.14 2g4a h LEU 3 Ca -0.08 0.02 0.01 0.00 -0.00 0.00 0.00 57.88 57.83 2g4a h LEU 3 Cb 1.87 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 42.32 2g4a h LEU 3 CO 0.16 0.61 0.20 0.11 -0.00 0.00 0.00 178.44 179.52 2g4a h LYS 4 N 1.12 0.40 -0.45 1.13 1.79 -2.00 0.33 116.57 118.89 2g4a h LYS 4 Ca 0.45 -0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.84 2g4a h LYS 4 Cb 0.26 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.80 2g4a h LYS 4 CO -0.20 0.27 0.08 0.45 -1.08 0.00 0.00 179.45 178.96 2g4a h HIS 5 N 0.41 0.79 -0.85 -1.35 3.86 -1.52 -2.73 115.15 113.78 2g4a h HIS 5 Ca 0.12 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2g4a h HIS 5 Cb -0.04 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.18 2g4a h HIS 5 CO -0.06 0.75 0.47 0.00 0.86 0.00 0.00 177.93 179.94 2g4a h ASN 7 N 1.18 0.44 -0.91 0.00 2.35 -0.73 -2.55 115.58 115.37 2g4a h ASN 7 Ca 0.30 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.98 2g4a h ASN 7 Cb 0.01 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.23 2g4a h ASN 7 CO -0.05 0.47 0.54 0.58 -1.65 0.00 0.00 177.43 177.33 2g4a h VAL 8 N 0.47 1.25 -0.49 2.81 2.07 -1.10 -2.23 116.25 119.03 2g4a h VAL 8 Ca 0.11 -0.55 -0.04 0.00 0.82 0.00 0.00 66.70 67.04 2g4a h VAL 8 Cb 0.23 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.95 2g4a h VAL 8 CO 0.00 0.26 0.12 0.40 0.02 0.00 0.00 177.57 178.37 2g4a h ILE 9 N 1.25 1.21 -0.64 4.57 2.04 -1.41 -2.67 117.51 121.86 2g4a h ILE 9 Ca 0.32 -0.75 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 2g4a h ILE 9 Cb -0.05 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 2g4a h ILE 9 CO -0.06 0.28 0.29 0.25 0.00 0.00 0.00 178.15 178.90 2g4a h LEU 10 N 0.71 0.86 -1.80 1.44 7.12 -1.31 -2.46 115.31 119.88 2g4a h LEU 10 Ca 0.16 -0.15 0.02 0.00 0.13 0.00 0.00 57.88 58.04 2g4a h LEU 10 Cb 0.27 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 40.16 2g4a h LEU 10 CO -0.00 0.77 0.17 0.11 -0.13 0.00 0.00 178.44 179.35 2g4a h LYS 11 N 0.89 0.26 -0.47 1.25 1.57 -1.15 -2.31 116.57 116.61 2g4a h LYS 11 Ca 0.22 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.95 2g4a h LYS 11 Cb 0.16 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2g4a h LYS 11 CO -0.02 0.17 0.16 1.49 -0.57 0.00 0.00 179.45 180.68 2g4a h GLU 12 N 0.27 0.73 -0.38 3.15 4.57 -1.31 0.39 114.58 122.00 2g4a h GLU 12 Ca 0.10 -0.15 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 2g4a h GLU 12 Cb 0.06 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.52 2g4a h GLU 12 CO -0.02 0.69 0.13 -0.07 -1.18 0.00 0.00 179.01 178.56 2g4a h LEU 13 N 0.63 0.49 0.00 1.64 3.38 -1.38 -2.29 115.31 117.78 2g4a h LEU 13 Ca 0.15 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2g4a h LEU 13 Cb 0.26 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2g4a h LEU 13 CO -0.01 0.46 -0.72 0.18 0.09 0.00 0.00 178.44 178.44 2g4a n LEU 14 N -4.37 0.61 0.00 1.67 4.77 -1.05 -3.13 117.00 115.50 2g4a n LEU 14 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2g4a n LEU 14 Cb 0.16 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2g4a n LEU 14 CO 0.37 0.07 0.36 -0.24 -1.33 0.00 0.00 177.39 176.63 2g4a n SER 15 N -1.76 0.00 0.00 -1.43 2.88 0.13 -4.90 113.62 108.54 2g4a n SER 15 Ca 0.04 0.73 0.00 0.00 -1.33 0.00 0.00 58.87 58.30 2g4a n SER 15 Cb 0.39 -0.23 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 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 -1.30 0.00 -0.12 -1.46 2.85 -1.25 -4.91 118.16 111.97 2g4a n LYS 16 Ca 0.00 0.00 -0.05 0.00 -1.05 0.00 0.00 58.31 57.21 2g4a n LYS 16 Cb 0.00 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.41 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 0.23 -0.47 -1.58 1.79 -1.91 -2.35 116.57 112.29 2g4a h LYS 17 Ca 0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2g4a h LYS 17 Cb 0.00 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 2g4a h LYS 17 CO 0.00 0.15 0.00 0.72 -1.08 0.00 0.00 179.45 179.24 2g4a n HIS 18 N -5.07 1.23 0.09 -1.35 8.25 -1.26 -4.47 115.22 112.65 2g4a n HIS 18 Ca 0.03 -0.69 -0.05 0.00 -0.26 0.00 0.00 57.72 56.74 2g4a n HIS 18 Cb 0.17 -0.27 0.12 0.00 1.12 0.00 0.00 29.99 31.13 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 3.02 0.84 -0.87 -1.41 0.00 -1.36 -2.48 119.26 116.99 2g4a h ALA 19 Ca 0.00 -0.56 0.14 0.00 0.00 0.00 0.00 54.91 54.49 2g4a h ALA 19 Cb 1.41 -0.09 -0.09 0.00 0.00 0.00 0.00 17.79 19.02 2g4a h ALA 19 CO 0.23 0.75 0.47 0.00 0.00 0.00 0.00 179.25 180.70 2g4a h ALA 20 N 1.19 1.32 -0.01 0.00 0.00 -1.78 0.23 119.26 120.20 2g4a h ALA 20 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2g4a h ALA 20 Cb 1.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2g4a h ALA 20 CO 0.10 -0.04 -0.32 0.66 0.00 0.00 0.00 179.25 179.65 2g4a n TYR 21 N -4.82 0.00 -0.07 0.00 4.01 -1.21 -4.37 117.16 110.70 2g4a n TYR 21 Ca 0.17 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.75 2g4a n TYR 21 Cb 0.42 -0.04 -0.13 0.00 -0.31 0.00 0.00 39.34 39.28 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 3.95 0.07 -0.57 -0.72 0.00 -0.51 -3.25 119.26 118.23 2g4a h ALA 22 Ca 0.00 -0.71 0.02 0.00 0.00 0.00 0.00 54.91 54.21 2g4a h ALA 22 Cb 0.69 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 2g4a h ALA 22 CO 0.00 0.23 0.38 0.11 0.00 0.00 0.00 179.25 179.97 2g4a h TRP 23 N -0.93 0.68 -0.19 0.00 5.08 -1.49 0.11 115.95 119.21 2g4a h TRP 23 Ca -0.11 0.02 -0.05 0.00 1.08 0.00 0.00 58.89 59.83 2g4a h TRP 23 Cb 1.15 -0.23 -0.00 0.00 -3.00 0.00 0.00 29.16 27.08 2g4a h TRP 23 CO 0.22 0.42 -0.09 -1.35 -1.28 0.00 0.00 178.44 176.37 2g4a h PRO 24 N 0.73 0.39 -0.00 0.12 0.11 -1.76 -2.96 132.00 128.62 2g4a h PRO 24 Ca 0.22 -0.17 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2g4a h PRO 24 Cb -0.02 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.08 2g4a h PRO 24 CO -0.05 0.68 -0.02 1.19 -0.21 0.00 0.00 178.00 179.59 2g4a n PHE 25 N -4.59 0.00 -0.07 0.65 3.01 -1.09 -3.87 117.46 111.50 2g4a n PHE 25 Ca -0.05 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.27 2g4a n PHE 25 Cb 0.31 -0.06 -0.13 0.00 -0.01 0.00 0.00 39.48 39.59 2g4a n PHE 25 CO 0.00 0.00 0.00 -0.92 1.01 0.00 0.00 176.76 176.85 2g4a h TYR 26 N 0.55 0.00 -3.01 1.38 5.03 -0.61 -2.34 116.97 117.98 2g4a h TYR 26 Ca 0.00 -0.00 -0.53 0.00 2.58 0.00 0.00 58.73 60.78 2g4a h TYR 26 Cb 0.19 -0.00 0.03 0.00 1.55 0.00 0.00 36.73 38.49 2g4a h TYR 26 CO 0.00 1.01 0.73 0.21 -1.32 0.00 0.00 178.16 178.79 2g4a s LYS 27 N -2.22 4.32 0.00 1.82 2.36 -1.21 -3.03 119.74 121.77 2g4a s LYS 27 Ca -0.19 2.09 0.00 0.00 -2.55 0.00 0.00 55.97 55.32 2g4a s LYS 27 Cb -0.03 -3.24 0.00 0.00 -1.05 0.00 0.00 37.83 33.51 2g4a s LYS 27 CO 0.69 -0.44 0.00 -0.35 1.55 0.00 0.00 175.35 176.80 2g4a n PRO 28 N 3.89 0.30 -3.82 4.03 -0.04 -1.26 -4.89 135.00 133.22 2g4a n PRO 28 Ca 0.11 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.29 2g4a n PRO 28 Cb 0.42 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.72 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 -0.64 0.89 -0.96 0.52 1.01 -1.26 -5.06 120.40 114.90 2g4a s VAL 29 Ca 0.00 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 61.02 2g4a s VAL 29 Cb 0.00 -1.26 -0.16 0.00 0.00 0.00 0.00 36.38 34.96 2g4a s VAL 29 CO 0.00 -0.10 1.93 0.47 0.00 0.00 0.00 175.10 177.39 2g4a n ASP 30 N 4.92 2.47 0.24 3.32 8.00 -1.26 -4.68 116.55 129.56 2g4a n ASP 30 Ca -0.10 -2.64 0.11 0.00 0.71 0.00 0.00 54.79 52.87 2g4a n ASP 30 Cb 0.46 -1.47 0.57 0.00 -0.02 0.00 0.00 41.12 40.67 2g4a n ASP 30 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2g4a h ALA 31 N 9.59 1.11 -0.70 2.24 0.00 -1.93 0.83 119.26 130.41 2g4a h ALA 31 Ca 0.24 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2g4a h ALA 31 Cb 0.86 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 2g4a h ALA 31 CO 1.45 0.23 0.41 0.77 0.00 0.00 0.00 179.25 182.11 2g4a h SER 32 N 0.00 0.62 0.00 0.00 0.02 -1.99 -3.38 113.55 108.82 2g4a h SER 32 Ca -0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2g4a h SER 32 Cb 0.58 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.02 2g4a h SER 32 CO 0.02 0.40 0.00 0.00 -1.14 0.00 0.00 176.83 176.12 2g4a n ALA 33 N -2.34 0.00 -1.42 3.77 0.00 -1.18 -5.05 120.51 114.29 2g4a n ALA 33 Ca 0.09 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2g4a n ALA 33 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.61 2g4a n ALA 33 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2g4a n LEU 34 N -2.14 0.00 0.00 0.00 -0.00 -0.85 -4.98 117.00 109.03 2g4a n LEU 34 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2g4a n LEU 34 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2g4a n LEU 34 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.00 2g4a n GLY 35 N 3.82 0.22 3.29 1.47 0.00 0.23 -4.23 105.19 109.99 2g4a n GLY 35 Ca 0.00 0.74 0.03 0.00 0.00 0.00 0.00 46.02 46.79 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 -0.45 0.50 0.99 1.43 -1.26 -4.92 118.68 114.97 2g4a s LEU 36 Ca 0.00 0.52 0.15 0.00 -1.03 0.00 0.00 54.13 53.77 2g4a s LEU 36 Cb 0.00 1.47 1.21 0.00 0.03 0.00 0.00 46.19 48.90 2g4a s LEU 36 CO 0.00 -0.08 2.12 -0.74 0.23 0.00 0.00 176.35 177.87 2g4a h HIS 37 N 7.53 0.10 -0.47 0.29 2.76 -1.95 -0.34 115.15 123.06 2g4a h HIS 37 Ca -0.15 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 57.93 2g4a h HIS 37 Cb 1.13 -0.03 -0.06 0.00 1.55 0.00 0.00 27.41 30.00 2g4a h HIS 37 CO 0.18 0.06 0.13 -3.47 -1.30 0.00 0.00 177.93 173.52 2g4a n ASP 38 N -4.52 4.05 -0.11 3.26 2.03 -1.26 -4.29 116.55 115.71 2g4a n ASP 38 Ca -0.01 -2.77 -0.17 0.00 0.52 0.00 0.00 54.79 52.36 2g4a n ASP 38 Cb 0.13 -0.66 -0.07 0.00 -0.72 0.00 0.00 41.12 39.81 2g4a n ASP 38 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2g4a n TYR 39 N 0.13 0.34 0.18 -0.67 9.36 -0.14 -4.03 117.16 122.34 2g4a n TYR 39 Ca 0.25 0.15 0.04 0.00 3.32 0.00 0.00 57.90 61.66 2g4a n TYR 39 Cb 1.01 -0.82 0.44 0.00 -0.63 0.00 0.00 39.34 39.35 2g4a n TYR 39 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 2g4a h HIS 40 N -1.00 0.08 -0.27 2.98 2.76 -1.75 0.60 115.15 118.55 2g4a h HIS 40 Ca -0.29 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 57.84 2g4a h HIS 40 Cb 1.17 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 30.10 2g4a h HIS 40 CO -0.19 0.28 0.07 0.22 -1.30 0.00 0.00 177.93 177.01 2g4a h ASP 41 N 0.08 0.41 0.00 3.26 3.58 -1.78 -2.27 116.42 119.70 2g4a h ASP 41 Ca 0.01 -0.22 -0.13 0.00 0.42 0.00 0.00 57.03 57.10 2g4a h ASP 41 Cb 0.40 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.32 2g4a h ASP 41 CO 0.03 0.53 -0.93 0.40 -2.88 0.00 0.00 179.24 176.39 2g4a h ILE 42 N 0.28 0.56 0.00 2.25 2.04 -1.65 -3.43 117.51 117.55 2g4a h ILE 42 Ca 0.09 -1.71 0.00 0.00 1.00 0.00 0.00 64.86 64.24 2g4a h ILE 42 Cb 0.27 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 2g4a h ILE 42 CO -0.00 0.19 0.00 -0.38 0.00 0.00 0.00 178.15 177.96 2g4a n ILE 43 N -4.51 0.00 0.00 -0.67 2.08 0.21 -4.88 119.36 111.58 2g4a n ILE 43 Ca -0.22 1.08 0.00 0.00 0.56 0.00 0.00 62.75 64.17 2g4a n ILE 43 Cb 0.51 -2.02 0.00 0.00 -0.75 0.00 0.00 39.64 37.37 2g4a n ILE 43 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 2g4a n LYS 44 N -1.77 0.00 -3.19 0.38 0.00 -0.85 -4.71 118.16 108.03 2g4a n LYS 44 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 58.31 58.10 2g4a n LYS 44 Cb 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 35.03 34.86 2g4a n LYS 44 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2g4a n HIS 45 N -0.05 0.23 -2.34 5.64 8.25 -1.26 -5.01 115.22 120.67 2g4a n HIS 45 Ca 0.00 -3.73 -0.36 0.00 -0.26 0.00 0.00 57.72 53.37 2g4a n HIS 45 Cb 0.00 -0.40 -0.01 0.00 1.12 0.00 0.00 29.99 30.70 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 -1.98 3.70 -0.01 -0.41 0.04 -1.26 -5.00 135.00 130.07 2g4a s PRO 46 Ca 0.38 1.62 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2g4a s PRO 46 Cb 0.27 -2.25 0.02 0.00 0.04 0.00 0.00 34.50 32.57 2g4a s PRO 46 CO -0.09 -0.57 0.01 -1.64 0.04 0.00 0.00 177.00 174.76 2g4a s MET 47 N -2.93 0.03 0.24 4.56 -1.94 -1.26 -5.12 119.30 112.87 2g4a s MET 47 Ca 0.66 0.10 0.09 0.00 -1.71 0.00 0.00 55.69 54.83 2g4a s MET 47 Cb -0.24 -0.20 -0.04 0.00 2.01 0.00 0.00 34.83 36.35 2g4a s MET 47 CO 0.29 -0.10 0.01 0.16 -0.01 0.00 0.00 175.02 175.37 2g4a s ASP 48 N 0.68 4.67 0.43 3.03 -4.77 -1.26 -4.90 116.67 114.54 2g4a s ASP 48 Ca -0.06 -0.54 0.13 0.00 -3.30 0.00 0.00 52.55 48.78 2g4a s ASP 48 Cb -0.08 -0.93 0.94 0.00 -1.09 0.00 0.00 42.92 41.75 2g4a s ASP 48 CO -0.02 0.03 1.96 0.25 0.70 0.00 0.00 175.17 178.09 2g4a h LEU 49 N 2.12 0.04 -1.04 2.11 5.85 -1.48 -2.77 115.31 120.13 2g4a h LEU 49 Ca -0.46 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.33 2g4a h LEU 49 Cb 1.23 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.19 2g4a h LEU 49 CO 0.59 0.23 0.64 -1.28 -0.34 0.00 0.00 178.44 178.28 2g4a h SER 50 N 0.04 1.00 -0.43 1.25 0.87 -1.80 -0.06 113.55 114.41 2g4a h SER 50 Ca 0.01 0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.46 2g4a h SER 50 Cb 0.37 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 2g4a h SER 50 CO 0.03 0.63 -0.20 0.74 -0.53 0.00 0.00 176.83 177.49 2g4a h THR 51 N 1.13 1.28 -0.69 2.23 2.02 -1.82 -2.22 112.91 114.84 2g4a h THR 51 Ca 0.43 -1.35 -0.04 0.00 0.77 0.00 0.00 66.41 66.21 2g4a h THR 51 Cb 0.20 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 2g4a h THR 51 CO -0.17 0.46 0.26 0.58 0.37 0.00 0.00 175.52 177.02 2g4a h VAL 52 N 0.73 1.25 -0.53 3.16 2.07 -1.33 -1.09 116.25 120.51 2g4a h VAL 52 Ca 0.10 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 2g4a h VAL 52 Cb 0.77 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2g4a h VAL 52 CO 0.06 0.32 0.24 0.50 0.02 0.00 0.00 177.57 178.70 2g4a h LYS 53 N 0.99 0.77 -0.47 1.57 3.11 -0.96 -2.54 116.57 119.05 2g4a h LYS 53 Ca 0.23 -0.12 -0.06 0.00 -2.81 0.00 0.00 60.65 57.89 2g4a h LYS 53 Cb 0.23 -0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 31.31 2g4a h LYS 53 CO -0.02 0.65 0.06 -0.09 -2.81 0.00 0.00 179.45 177.25 2g4a h ARG 54 N 0.71 0.73 -0.48 1.90 1.12 -1.13 -2.81 114.38 114.42 2g4a h ARG 54 Ca 0.18 -0.16 0.01 0.00 -1.11 0.00 0.00 59.98 58.90 2g4a h ARG 54 Cb 0.15 -0.10 -0.03 0.00 -0.01 0.00 0.00 29.97 29.98 2g4a h ARG 54 CO -0.02 0.70 0.30 0.87 -3.11 0.00 0.00 179.97 178.71 2g4a h LYS 55 N 0.70 0.59 -0.30 0.20 1.57 -0.80 -1.75 116.57 116.78 2g4a h LYS 55 Ca 0.15 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 2g4a h LYS 55 Cb 0.34 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2g4a h LYS 55 CO 0.01 0.39 0.10 0.52 -0.57 0.00 0.00 179.45 179.90 2g4a h MET 56 N 0.61 0.42 -0.02 3.15 2.86 -1.23 0.55 114.93 121.26 2g4a h MET 56 Ca 0.19 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.65 2g4a h MET 56 Cb -0.02 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.54 2g4a h MET 56 CO -0.07 0.37 -0.58 0.93 1.06 0.00 0.00 176.91 178.62 2g4a h GLU 57 N 0.42 0.06 -0.03 1.72 4.39 -1.16 -2.99 114.58 116.99 2g4a h GLU 57 Ca 0.10 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.77 2g4a h GLU 57 Cb 0.12 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2g4a h GLU 57 CO -0.01 0.62 -0.14 0.09 -1.16 0.00 0.00 179.01 178.41 2g4a n ASN 58 N -3.86 2.71 -2.19 1.42 3.02 -0.73 -4.96 115.26 110.66 2g4a n ASN 58 Ca -0.02 -1.85 -0.16 0.00 -0.03 0.00 0.00 54.58 52.52 2g4a n ASN 58 Cb 0.58 0.14 0.02 0.00 -0.61 0.00 0.00 39.78 39.92 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 0.94 -3.37 0.05 3.52 0.63 0.15 -4.90 116.66 113.67 2g4a n ARG 59 Ca 0.13 0.66 0.02 0.00 -0.92 0.00 0.00 57.85 57.74 2g4a n ARG 59 Cb 0.56 -4.99 0.38 0.00 0.45 0.00 0.00 32.46 28.87 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 -0.94 0.39 -2.17 6.15 1.82 -0.52 -3.36 116.42 117.79 2g4a h ASP 60 Ca -0.38 -0.05 -0.63 0.00 -0.39 0.00 0.00 57.03 55.58 2g4a h ASP 60 Cb 1.26 -0.10 -0.14 0.00 0.68 0.00 0.00 39.33 41.04 2g4a h ASP 60 CO 0.41 0.41 0.94 -0.31 -1.61 0.00 0.00 179.24 179.07 2g4a s TYR 61 N -5.09 2.74 -0.51 0.28 2.02 -1.26 -4.84 117.35 110.69 2g4a s TYR 61 Ca -0.07 -0.84 0.04 0.00 -0.37 0.00 0.00 57.07 55.83 2g4a s TYR 61 Cb 0.16 -4.43 0.27 0.00 -0.40 0.00 0.00 41.96 37.56 2g4a s TYR 61 CO 0.74 -1.72 1.09 2.89 -1.57 0.00 0.00 175.55 176.98 2g4a n ARG 62 N 7.82 2.01 -3.58 -0.62 1.85 -1.26 -4.85 116.66 118.04 2g4a n ARG 62 Ca 0.15 -1.09 -0.07 0.00 -1.00 0.00 0.00 57.85 55.84 2g4a n ARG 62 Cb 0.48 -1.63 -0.04 0.00 -1.05 0.00 0.00 32.46 30.23 2g4a n ARG 62 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 2g4a s ASP 63 N -0.09 -0.25 0.14 2.89 2.15 -1.26 -5.05 116.67 115.19 2g4a s ASP 63 Ca 0.20 0.16 -0.05 0.00 0.43 0.00 0.00 52.55 53.28 2g4a s ASP 63 Cb 0.16 0.23 -0.07 0.00 -0.30 0.00 0.00 42.92 42.94 2g4a s ASP 63 CO 0.05 -0.32 1.33 0.00 -0.17 0.00 0.00 175.17 176.06 2g4a h ALA 64 N 2.22 0.41 -1.00 3.66 0.00 -1.97 -3.21 119.26 119.36 2g4a h ALA 64 Ca -0.15 -0.66 0.05 0.00 0.00 0.00 0.00 54.91 54.14 2g4a h ALA 64 Cb 1.18 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 2g4a h ALA 64 CO 0.27 0.77 0.65 1.96 0.00 0.00 0.00 179.25 182.91 2g4a h GLN 65 N 0.30 1.20 -0.64 0.00 7.50 -1.99 -1.40 115.11 120.07 2g4a h GLN 65 Ca -0.07 -0.07 -0.04 0.00 0.50 0.00 0.00 58.65 58.97 2g4a h GLN 65 Cb 1.48 -0.27 -0.03 0.00 0.05 0.00 0.00 27.48 28.72 2g4a h GLN 65 CO 0.15 0.79 0.23 0.93 -1.50 0.00 0.00 178.83 179.44 2g4a h GLU 66 N 1.23 0.97 -0.18 1.46 4.39 -1.97 0.37 114.58 120.85 2g4a h GLU 66 Ca 0.41 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.91 2g4a h GLU 66 Cb 0.06 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 2g4a h GLU 66 CO -0.14 0.84 0.07 0.35 -1.16 0.00 0.00 179.01 178.96 2g4a h PHE 67 N 0.91 0.28 -0.68 4.33 3.57 -1.40 -2.12 116.94 121.83 2g4a h PHE 67 Ca 0.21 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 2g4a h PHE 67 Cb 0.24 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 2g4a h PHE 67 CO 0.02 0.35 0.20 0.00 -2.23 0.00 0.00 178.31 176.65 2g4a h ALA 68 N 0.90 0.90 -0.69 2.41 0.00 -1.15 -2.61 119.26 119.02 2g4a h ALA 68 Ca 0.06 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.78 2g4a h ALA 68 Cb 0.20 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 2g4a h ALA 68 CO -0.00 0.59 0.43 0.00 0.00 0.00 0.00 179.25 180.26 2g4a h ALA 69 N 1.09 0.91 -0.52 0.00 0.00 -0.79 -0.80 119.26 119.15 2g4a h ALA 69 Ca 0.22 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2g4a h ALA 69 Cb 0.32 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2g4a h ALA 69 CO -0.00 0.18 0.13 -0.44 0.00 0.00 0.00 179.25 179.11 2g4a h ASP 70 N 0.82 0.74 -0.18 0.00 5.19 -1.17 -0.72 116.42 121.10 2g4a h ASP 70 Ca 0.28 -0.13 -0.05 0.00 -0.62 0.00 0.00 57.03 56.51 2g4a h ASP 70 Cb 0.05 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 39.36 2g4a h ASP 70 CO -0.12 0.73 -0.09 0.58 -3.12 0.00 0.00 179.24 177.22 2g4a h VAL 71 N 0.77 1.31 -0.74 -1.35 2.07 -0.99 -1.18 116.25 116.14 2g4a h VAL 71 Ca 0.17 -1.14 -0.06 0.00 0.82 0.00 0.00 66.70 66.49 2g4a h VAL 71 Cb 0.29 1.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 2g4a h VAL 71 CO -0.00 0.34 0.23 0.03 0.02 0.00 0.00 177.57 178.19 2g4a h ARG 72 N 0.07 1.15 -0.31 1.57 3.08 -1.00 -1.43 114.38 117.51 2g4a h ARG 72 Ca 0.04 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.80 2g4a h ARG 72 Cb 0.57 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 2g4a h ARG 72 CO 0.03 0.98 0.02 1.25 -1.07 0.00 0.00 179.97 181.17 2g4a h LEU 73 N 1.10 0.52 -0.24 3.04 6.46 -1.10 0.57 115.31 125.66 2g4a h LEU 73 Ca 0.24 -0.29 -0.00 0.00 -0.12 0.00 0.00 57.88 57.70 2g4a h LEU 73 Cb 0.31 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.09 2g4a h LEU 73 CO -0.01 0.68 0.14 -0.03 -0.62 0.00 0.00 178.44 178.60 2g4a h MET 74 N 0.34 0.33 -0.39 1.25 4.05 -1.06 -1.37 114.93 118.08 2g4a h MET 74 Ca 0.09 -0.04 -0.11 0.00 -0.28 0.00 0.00 59.70 59.37 2g4a h MET 74 Cb 0.40 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.12 2g4a h MET 74 CO 0.01 0.29 -0.19 0.74 0.23 0.00 0.00 176.91 177.99 2g4a h PHE 75 N 0.28 0.85 -0.53 1.39 -1.00 -1.23 -2.87 116.94 113.83 2g4a h PHE 75 Ca 0.08 -0.18 -0.04 0.00 2.81 0.00 0.00 57.97 60.65 2g4a h PHE 75 Cb 0.05 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.38 2g4a h PHE 75 CO -0.04 0.88 0.17 0.77 -1.61 0.00 0.00 178.31 178.49 2g4a h SER 76 N 0.67 0.72 -0.21 2.17 0.02 -0.62 -2.37 113.55 113.93 2g4a h SER 76 Ca 0.10 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 2g4a h SER 76 Cb 0.69 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2g4a h SER 76 CO 0.05 0.68 0.08 0.78 -1.14 0.00 0.00 176.83 177.28 2g4a h ASN 77 N 0.77 0.28 -0.64 3.07 2.35 -1.03 -1.51 115.58 118.87 2g4a h ASN 77 Ca 0.18 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 2g4a h ASN 77 Cb 0.21 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.48 2g4a h ASN 77 CO -0.01 0.37 0.33 0.00 -1.65 0.00 0.00 177.43 176.47 2g4a h TYR 79 N 0.93 -0.82 -0.10 0.00 5.03 -1.22 -1.71 116.97 119.08 2g4a h TYR 79 Ca 0.23 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.50 2g4a h TYR 79 Cb 0.07 0.27 -0.01 0.00 1.55 0.00 0.00 36.73 38.61 2g4a h TYR 79 CO 0.01 -0.51 -0.05 0.87 -1.32 0.00 0.00 178.16 177.16 2g4a h LYS 80 N -1.22 0.14 -0.45 1.82 1.79 -1.27 -2.52 116.57 114.86 2g4a h LYS 80 Ca -0.09 -0.02 -0.12 0.00 -2.18 0.00 0.00 60.65 58.24 2g4a h LYS 80 Cb 0.68 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.29 2g4a h LYS 80 CO 0.15 0.20 -0.18 -0.92 -1.08 0.00 0.00 179.45 177.62 2g4a h TYR 81 N 0.14 1.05 -2.90 -1.35 3.20 -0.73 -3.43 116.97 112.95 2g4a h TYR 81 Ca 0.03 -0.25 -0.35 0.00 3.14 0.00 0.00 58.73 61.30 2g4a h TYR 81 Cb 0.18 -0.25 -0.37 0.00 1.54 0.00 0.00 36.73 37.83 2g4a h TYR 81 CO 0.00 1.04 -0.67 1.21 -1.64 0.00 0.00 178.16 178.10 2g4a s ASN 82 N -6.60 1.43 1.02 -2.11 3.84 -0.65 -5.07 114.94 106.80 2g4a s ASN 82 Ca -0.12 -0.13 -0.13 0.00 0.21 0.00 0.00 52.86 52.69 2g4a s ASN 82 Cb 0.11 0.14 0.15 0.00 -0.55 0.00 0.00 41.25 41.11 2g4a s ASN 82 CO 0.85 -0.30 0.76 -2.65 -2.79 0.00 0.00 177.10 172.97 2g4a n PRO 83 N 5.31 -1.07 -1.77 0.43 -0.02 -1.22 -4.48 135.00 132.18 2g4a n PRO 83 Ca -0.05 -0.27 -0.42 0.00 -2.02 0.00 0.00 63.50 60.74 2g4a n PRO 83 Cb 0.50 -2.10 -0.03 0.00 -0.02 0.00 0.00 33.50 31.85 2g4a n PRO 83 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2g4a s PRO 84 N -4.15 3.05 -0.04 0.52 0.02 -1.26 -4.61 135.00 128.53 2g4a s PRO 84 Ca 0.63 1.66 0.01 0.00 0.02 0.00 0.00 61.00 63.32 2g4a s PRO 84 Cb -0.22 -4.34 0.04 0.00 0.02 0.00 0.00 34.50 30.01 2g4a s PRO 84 CO 0.63 -2.19 0.54 -3.47 -0.33 0.00 0.00 177.00 172.18 2g4a n ASP 85 N 11.75 -0.19 -3.48 2.53 2.03 -1.26 -5.11 116.55 122.82 2g4a n ASP 85 Ca 0.28 -0.98 -0.02 0.00 0.52 0.00 0.00 54.79 54.59 2g4a n ASP 85 Cb 0.47 0.08 0.02 0.00 -0.72 0.00 0.00 41.12 40.97 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 0.01 0.06 0.19 -0.67 3.76 -1.26 -5.04 115.29 112.34 2g4a s HIS 86 Ca 0.01 -0.38 0.06 0.00 -0.15 0.00 0.00 55.06 54.59 2g4a s HIS 86 Cb 0.05 0.66 0.07 0.00 1.11 0.00 0.00 32.58 34.47 2g4a s HIS 86 CO -0.01 -0.76 1.43 0.22 -0.85 0.00 0.00 174.74 174.77 2g4a h ASP 87 N 2.00 0.14 0.08 1.40 3.58 -1.99 -3.05 116.42 118.56 2g4a h ASP 87 Ca -0.26 -0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2g4a h ASP 87 Cb 1.21 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 42.21 2g4a h ASP 87 CO 0.35 0.89 -0.07 0.58 -2.88 0.00 0.00 179.24 178.10 2g4a h VAL 88 N 0.06 0.83 -0.24 2.25 2.07 -1.99 0.19 116.25 119.41 2g4a h VAL 88 Ca -0.02 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2g4a h VAL 88 Cb 1.42 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 2g4a h VAL 88 CO 0.12 0.00 0.09 0.58 0.02 0.00 0.00 177.57 178.37 2g4a h VAL 89 N -0.17 1.18 -0.55 2.57 2.07 -1.90 -2.76 116.25 116.69 2g4a h VAL 89 Ca 0.00 -0.56 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 2g4a h VAL 89 Cb 0.16 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 2g4a h VAL 89 CO -0.02 0.18 0.33 0.00 0.02 0.00 0.00 177.57 178.08 2g4a h ALA 90 N 0.92 1.55 -0.75 1.67 0.00 -1.41 -2.22 119.26 119.01 2g4a h ALA 90 Ca 0.08 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2g4a h ALA 90 Cb 0.21 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2g4a h ALA 90 CO -0.00 0.40 0.50 0.52 0.00 0.00 0.00 179.25 180.66 2g4a h MET 91 N 0.76 0.98 -0.54 0.00 2.86 -0.35 -2.11 114.93 116.52 2g4a h MET 91 Ca 0.20 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.68 2g4a h MET 91 Cb -0.03 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.39 2g4a h MET 91 CO -0.04 0.65 -0.05 0.00 1.06 0.00 0.00 176.91 178.54 2g4a h ALA 92 N 1.28 0.74 -0.94 6.32 0.00 -1.20 -2.78 119.26 122.67 2g4a h ALA 92 Ca 0.28 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2g4a h ALA 92 Cb -0.11 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.43 2g4a h ALA 92 CO -0.06 0.60 0.62 -0.09 0.00 0.00 0.00 179.25 180.32 2g4a h ARG 93 N 0.87 1.17 -0.50 0.00 1.12 -1.01 0.38 114.38 116.40 2g4a h ARG 93 Ca 0.15 -0.07 -0.10 0.00 -1.11 0.00 0.00 59.98 58.85 2g4a h ARG 93 Cb 0.60 -0.26 -0.02 0.00 -0.01 0.00 0.00 29.97 30.28 2g4a h ARG 93 CO 0.04 0.77 -0.09 0.87 -3.11 0.00 0.00 179.97 178.45 2g4a h LYS 94 N 1.20 0.92 -0.20 0.20 1.57 -1.24 -2.99 116.57 116.04 2g4a h LYS 94 Ca 0.37 -0.32 -0.19 0.00 -1.87 0.00 0.00 60.65 58.64 2g4a h LYS 94 Cb -0.02 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.22 2g4a h LYS 94 CO -0.11 0.97 -0.64 -0.07 -0.57 0.00 0.00 179.45 179.03 2g4a h LEU 95 N 0.83 0.82 -1.05 2.94 3.38 -1.12 -3.17 115.31 117.93 2g4a h LEU 95 Ca 0.14 -0.48 0.10 0.00 0.09 0.00 0.00 57.88 57.72 2g4a h LEU 95 Cb 0.62 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 41.06 2g4a h LEU 95 CO 0.04 1.25 0.63 1.56 0.09 0.00 0.00 178.44 182.01 2g4a h GLN 96 N 0.52 1.00 -0.64 1.13 4.20 -0.84 0.60 115.11 121.08 2g4a h GLN 96 Ca -0.01 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 2g4a h GLN 96 Cb 1.24 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.76 2g4a h GLN 96 CO 0.13 0.66 0.21 -0.44 -0.67 0.00 0.00 178.83 178.73 2g4a h ASP 97 N 1.03 0.92 -0.22 1.46 3.32 -1.50 -1.85 116.42 119.58 2g4a h ASP 97 Ca 0.46 -0.20 -0.10 0.00 0.02 0.00 0.00 57.03 57.21 2g4a h ASP 97 Cb 0.37 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 2g4a h ASP 97 CO -0.22 0.88 -0.24 0.58 -1.72 0.00 0.00 179.24 178.52 2g4a h VAL 98 N 0.92 1.32 -0.83 -1.35 2.07 -1.30 -3.03 116.25 114.05 2g4a h VAL 98 Ca 0.21 -1.41 0.06 0.00 0.82 0.00 0.00 66.70 66.37 2g4a h VAL 98 Cb 0.28 1.74 -0.06 0.00 -1.52 0.00 0.00 31.29 31.73 2g4a h VAL 98 CO -0.01 0.44 0.52 0.15 0.02 0.00 0.00 177.57 178.68 2g4a h PHE 99 N 0.23 0.96 -0.80 1.57 3.57 -0.82 -1.26 116.94 120.39 2g4a h PHE 99 Ca 0.03 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.58 2g4a h PHE 99 Cb 0.80 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 2g4a h PHE 99 CO 0.08 0.49 0.52 1.49 -2.23 0.00 0.00 178.31 178.66 2g4a h GLU 100 N 0.95 1.01 -0.45 1.11 4.57 -1.31 0.51 114.58 120.97 2g4a h GLU 100 Ca 0.36 -0.06 -0.12 0.00 -1.18 0.00 0.00 59.36 58.36 2g4a h GLU 100 Cb 0.15 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 2g4a h GLU 100 CO -0.16 0.67 -0.21 0.74 -1.18 0.00 0.00 179.01 178.86 2g4a h PHE 101 N 1.04 1.03 -0.04 0.92 0.04 -1.25 -2.85 116.94 115.83 2g4a h PHE 101 Ca 0.31 -0.24 -0.21 0.00 2.80 0.00 0.00 57.97 60.63 2g4a h PHE 101 Cb -0.05 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 37.85 2g4a h PHE 101 CO -0.02 1.02 -0.84 0.00 -0.60 0.00 0.00 178.31 177.87 2g4a h ARG 102 N 0.78 0.41 0.00 1.51 2.47 -0.79 -3.11 114.38 115.65 2g4a h ARG 102 Ca 0.11 -0.39 -0.02 0.00 -1.26 0.00 0.00 59.98 58.42 2g4a h ARG 102 Cb 0.76 0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 29.18 2g4a h ARG 102 CO 0.06 1.05 -0.07 -0.92 0.56 0.00 0.00 179.97 180.65 2g4a h TYR 103 N 0.26 0.00 -0.02 3.04 3.20 0.09 -0.68 116.97 122.85 2g4a h TYR 103 Ca -0.06 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.64 2g4a h TYR 103 Cb 1.45 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.71 2g4a h TYR 103 CO 0.05 0.07 -0.75 0.00 -1.64 0.00 0.00 178.16 175.89 2g4a h ALA 104 N 1.93 0.68 0.00 1.82 0.00 -1.43 -3.21 119.26 119.05 2g4a h ALA 104 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2g4a h ALA 104 Cb 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2g4a h ALA 104 CO 0.01 0.84 -0.92 1.63 0.00 0.00 0.00 179.25 180.81 2g4a n LYS 105 N -3.74 0.51 -0.16 0.00 4.76 -0.79 -4.26 118.16 114.47 2g4a n LYS 105 Ca -0.03 0.11 -0.02 0.00 -2.87 0.00 0.00 58.31 55.50 2g4a n LYS 105 Cb 0.72 -1.78 0.07 0.00 -1.84 0.00 0.00 35.03 32.20 2g4a n LYS 105 CO 0.00 0.00 0.00 1.98 -1.37 0.00 0.00 177.40 178.01 2g4a h MET 106 N 0.00 0.15 -7.04 1.97 4.05 -1.15 -3.42 114.93 109.49 2g4a h MET 106 Ca 0.00 -0.01 -0.55 0.00 -0.28 0.00 0.00 59.70 58.86 2g4a h MET 106 Cb 0.92 -0.03 0.13 0.00 -0.80 0.00 0.00 31.60 31.82 2g4a h MET 106 CO 0.00 0.10 0.63 -2.14 0.23 0.00 0.00 176.91 175.72 2g4a s PRO 107 N -6.15 3.22 0.00 0.39 0.02 -1.26 -5.00 135.00 126.22 2g4a s PRO 107 Ca -0.13 2.27 0.32 0.00 0.02 0.00 0.00 61.00 63.47 2g4a s PRO 107 Cb 0.16 -2.32 1.81 0.00 0.02 0.00 0.00 34.50 34.17 2g4a s PRO 107 CO 0.73 -1.14 2.17 -3.47 -0.33 0.00 0.00 177.00 174.96