#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 1.06 -0.71 5.31 1.08 -1.95 -2.71 115.11 117.20 2g4a h GLN 2 Ca 0.00 -0.25 0.05 0.00 -1.45 0.00 0.00 58.65 57.00 2g4a h GLN 2 Cb 0.00 -0.14 -0.04 0.00 -0.05 0.00 0.00 27.48 27.24 2g4a h GLN 2 CO 0.00 0.94 0.46 -0.07 -0.95 0.00 0.00 178.83 179.21 2g4a h LEU 3 N 1.01 0.69 -0.44 1.46 -0.00 -1.97 -2.19 115.31 113.87 2g4a h LEU 3 Ca 0.21 -0.00 0.01 0.00 -0.00 0.00 0.00 57.88 58.09 2g4a h LEU 3 Cb 0.36 -0.15 -0.02 0.00 -0.00 0.00 0.00 40.66 40.84 2g4a h LEU 3 CO 0.00 0.46 0.29 0.50 -0.00 0.00 0.00 178.44 179.69 2g4a h LYS 4 N 0.79 0.57 -0.56 1.13 1.63 -1.93 -1.78 116.57 116.43 2g4a h LYS 4 Ca 0.29 -0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 60.02 2g4a h LYS 4 Cb 0.16 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 2g4a h LYS 4 CO -0.09 0.38 0.19 0.45 -3.45 0.00 0.00 179.45 176.93 2g4a h HIS 5 N 0.59 0.89 -0.91 1.91 3.86 -1.43 -2.68 115.15 117.38 2g4a h HIS 5 Ca 0.16 -0.08 0.06 0.00 -1.16 0.00 0.00 60.37 59.35 2g4a h HIS 5 Cb -0.06 -0.26 -0.06 0.00 1.06 0.00 0.00 27.41 28.09 2g4a h HIS 5 CO -0.05 0.74 0.59 0.00 0.86 0.00 0.00 177.93 180.08 2g4a h ASN 7 N 1.06 0.63 -0.44 0.00 -0.26 -0.99 -2.40 115.58 113.17 2g4a h ASN 7 Ca 0.39 -0.08 -0.10 0.00 -0.56 0.00 0.00 56.30 55.96 2g4a h ASN 7 Cb 0.17 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.25 2g4a h ASN 7 CO -0.14 0.58 -0.08 0.58 -1.06 0.00 0.00 177.43 177.31 2g4a h VAL 8 N 0.69 1.26 -0.80 2.81 2.07 -1.09 -2.69 116.25 118.50 2g4a h VAL 8 Ca 0.17 -1.18 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 2g4a h VAL 8 Cb 0.15 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 2g4a h VAL 8 CO -0.01 0.41 0.43 0.40 0.02 0.00 0.00 177.57 178.82 2g4a h ILE 9 N 0.81 1.24 -0.53 4.57 2.04 -1.12 -2.49 117.51 122.03 2g4a h ILE 9 Ca 0.14 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 2g4a h ILE 9 Cb 0.60 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 2g4a h ILE 9 CO 0.04 0.27 0.21 0.25 0.00 0.00 0.00 178.15 178.92 2g4a h LEU 10 N 1.11 0.73 -0.86 1.44 7.12 -1.32 -1.64 115.31 121.90 2g4a h LEU 10 Ca 0.28 -0.17 0.04 0.00 0.13 0.00 0.00 57.88 58.16 2g4a h LEU 10 Cb 0.05 -0.19 -0.05 0.00 -0.53 0.00 0.00 40.66 39.94 2g4a h LEU 10 CO -0.04 0.70 0.55 0.11 -0.13 0.00 0.00 178.44 179.63 2g4a h LYS 11 N 0.72 1.03 -0.49 1.25 1.57 -1.19 -1.58 116.57 117.87 2g4a h LYS 11 Ca 0.18 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.77 2g4a h LYS 11 Cb 0.19 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2g4a h LYS 11 CO -0.01 0.68 -0.19 1.49 -0.57 0.00 0.00 179.45 180.85 2g4a h GLU 12 N 1.06 0.98 -0.24 3.15 4.57 -1.20 -1.86 114.58 121.04 2g4a h GLU 12 Ca 0.35 -0.40 -0.03 0.00 -1.18 0.00 0.00 59.36 58.10 2g4a h GLU 12 Cb 0.03 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 2g4a h GLU 12 CO -0.12 1.08 0.04 -0.07 -1.18 0.00 0.00 179.01 178.75 2g4a h LEU 13 N 0.86 0.31 -1.31 1.64 3.38 -0.67 -1.69 115.31 117.82 2g4a h LEU 13 Ca 0.12 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2g4a h LEU 13 Cb 0.76 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2g4a h LEU 13 CO 0.06 0.34 0.00 0.18 0.09 0.00 0.00 178.44 179.11 2g4a n LEU 14 N -4.38 2.02 0.00 1.67 4.77 -0.65 -1.72 117.00 118.71 2g4a n LEU 14 Ca 0.00 -0.70 0.00 0.00 -0.03 0.00 0.00 56.01 55.28 2g4a n LEU 14 Cb 0.17 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2g4a n LEU 14 CO 0.37 0.35 0.00 -0.24 -1.33 0.00 0.00 177.39 176.54 2g4a n SER 15 N 0.58 0.00 0.08 -1.43 2.88 -0.63 -4.78 113.62 110.32 2g4a n SER 15 Ca 0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 2g4a n SER 15 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2g4a n SER 15 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2g4a n LYS 16 N 0.00 0.00 -0.27 -1.46 5.02 -1.26 -4.69 118.16 115.49 2g4a n LYS 16 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 2g4a n LYS 16 Cb 0.00 0.00 0.25 0.00 -0.02 0.00 0.00 35.03 35.26 2g4a n LYS 16 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 2g4a h LYS 17 N 0.00 0.98 -0.00 1.97 2.10 -1.93 -1.24 116.57 118.44 2g4a h LYS 17 Ca 0.00 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 2g4a h LYS 17 Cb 0.00 -0.22 0.00 0.00 -0.90 0.00 0.00 32.23 31.11 2g4a h LYS 17 CO 0.00 0.65 -0.47 0.72 -2.00 0.00 0.00 179.45 178.35 2g4a n HIS 18 N -4.47 0.00 -0.06 0.07 8.25 -1.26 -4.14 115.22 113.62 2g4a n HIS 18 Ca 0.12 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.44 2g4a n HIS 18 Cb 0.15 -0.15 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 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 3.34 0.51 -0.74 -1.41 0.00 -0.35 -2.14 119.26 118.47 2g4a h ALA 19 Ca 0.00 -0.52 0.22 0.00 0.00 0.00 0.00 54.91 54.61 2g4a h ALA 19 Cb 0.53 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2g4a h ALA 19 CO 0.00 0.68 0.55 0.00 0.00 0.00 0.00 179.25 180.49 2g4a h ALA 20 N 0.75 2.68 0.00 0.00 0.00 -1.70 0.18 119.26 121.17 2g4a h ALA 20 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2g4a h ALA 20 Cb 1.16 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2g4a h ALA 20 CO 0.12 -0.94 -1.76 0.66 0.00 0.00 0.00 179.25 177.33 2g4a n TYR 21 N -4.24 0.00 0.08 0.00 4.02 -1.18 -4.40 117.16 111.44 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 0.83 -0.38 -0.14 0.00 -0.02 0.00 0.00 39.34 39.63 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 2.24 0.21 -0.31 -0.72 0.00 -0.07 -3.26 119.26 117.35 2g4a h ALA 22 Ca 0.00 -1.05 -0.11 0.00 0.00 0.00 0.00 54.91 53.74 2g4a h ALA 22 Cb 0.88 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2g4a h ALA 22 CO 0.00 1.08 -0.28 0.11 0.00 0.00 0.00 179.25 180.16 2g4a h TRP 23 N 0.07 0.71 -0.18 0.00 5.08 -1.08 -1.32 115.95 119.24 2g4a h TRP 23 Ca -0.23 -0.17 -0.08 0.00 1.08 0.00 0.00 58.89 59.50 2g4a h TRP 23 Cb 2.02 -0.17 -0.00 0.00 -3.00 0.00 0.00 29.16 28.01 2g4a h TRP 23 CO 0.07 0.84 -0.20 -1.35 -1.28 0.00 0.00 178.44 176.51 2g4a h PRO 24 N 0.54 0.45 -0.00 0.12 0.11 -1.77 -3.04 132.00 128.41 2g4a h PRO 24 Ca 0.07 -0.24 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2g4a h PRO 24 Cb 0.75 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2g4a h PRO 24 CO 0.06 0.82 -0.00 1.19 -0.21 0.00 0.00 178.00 179.86 2g4a n PHE 25 N -4.47 0.00 0.03 0.65 3.72 -1.22 -3.93 117.46 112.24 2g4a n PHE 25 Ca -0.06 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.28 2g4a n PHE 25 Cb 0.40 -0.11 -0.04 0.00 -0.94 0.00 0.00 39.48 38.79 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 0.06 -0.16 -1.80 1.38 5.03 -1.11 -2.58 116.97 117.78 2g4a h TYR 26 Ca 0.00 -0.00 -0.65 0.00 2.58 0.00 0.00 58.73 60.65 2g4a h TYR 26 Cb 0.12 0.05 0.09 0.00 1.55 0.00 0.00 36.73 38.55 2g4a h TYR 26 CO 0.00 0.10 0.05 1.63 -1.32 0.00 0.00 178.16 178.63 2g4a n LYS 27 N -4.87 0.87 -0.77 1.82 5.02 -1.24 -1.41 118.16 117.58 2g4a n LYS 27 Ca -0.05 0.31 -0.10 0.00 -2.02 0.00 0.00 58.31 56.45 2g4a n LYS 27 Cb 0.17 -1.67 0.07 0.00 -0.02 0.00 0.00 35.03 33.57 2g4a n LYS 27 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2g4a n PRO 28 N 1.33 -0.34 -3.64 1.97 -0.04 -1.26 -4.72 135.00 128.30 2g4a n PRO 28 Ca 0.15 -0.77 -0.27 0.00 -0.04 0.00 0.00 63.50 62.57 2g4a n PRO 28 Cb 0.25 -0.45 -0.10 0.00 -0.04 0.00 0.00 33.50 33.16 2g4a n PRO 28 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2g4a n VAL 29 N -2.54 1.24 -2.54 0.52 0.31 -1.26 -5.03 118.33 109.02 2g4a n VAL 29 Ca 0.06 -4.69 -0.41 0.00 -0.01 0.00 0.00 64.34 59.29 2g4a n VAL 29 Cb 0.21 -2.07 -0.02 0.00 -0.91 0.00 0.00 33.84 31.05 2g4a n VAL 29 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2g4a s ASP 30 N -1.50 6.59 0.46 4.52 1.11 -1.26 -4.80 116.67 121.79 2g4a s ASP 30 Ca 0.31 -1.94 0.14 0.00 0.18 0.00 0.00 52.55 51.24 2g4a s ASP 30 Cb 0.04 -2.58 1.07 0.00 1.07 0.00 0.00 42.92 42.52 2g4a s ASP 30 CO -0.13 -1.42 2.04 0.00 1.18 0.00 0.00 175.17 176.84 2g4a h ALA 31 N 8.72 1.98 -0.14 5.23 0.00 -1.96 -1.00 119.26 132.09 2g4a h ALA 31 Ca 0.32 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.08 2g4a h ALA 31 Cb 0.94 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2g4a h ALA 31 CO 1.43 -0.06 -0.52 1.03 0.00 0.00 0.00 179.25 181.14 2g4a h SER 32 N 0.32 0.44 -0.04 0.00 0.87 -1.92 0.90 113.55 114.12 2g4a h SER 32 Ca 0.18 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 2g4a h SER 32 Cb 0.32 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.15 2g4a h SER 32 CO -0.04 0.88 -0.06 0.00 -0.53 0.00 0.00 176.83 177.07 2g4a h ALA 33 N 1.13 0.06 -0.08 6.23 0.00 -1.61 -3.40 119.26 121.59 2g4a h ALA 33 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2g4a h ALA 33 Cb 1.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2g4a h ALA 33 CO 0.09 -0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.51 2g4a n LEU 34 N -4.73 0.05 0.00 0.00 4.77 -0.76 -5.06 117.00 111.28 2g4a n LEU 34 Ca -0.08 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 2g4a n LEU 34 Cb 0.32 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 2g4a n LEU 34 CO 0.36 -0.49 0.00 0.61 -1.33 0.00 0.00 177.39 176.54 2g4a n GLY 35 N 1.85 0.28 3.12 -0.72 0.00 0.30 -5.08 105.19 104.95 2g4a n GLY 35 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2g4a n GLY 35 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2g4a s LEU 36 N 0.00 5.54 0.26 0.99 2.34 -1.18 -4.89 118.68 121.73 2g4a s LEU 36 Ca 0.00 -3.29 0.07 0.00 0.06 0.00 0.00 54.13 50.98 2g4a s LEU 36 Cb 0.00 -1.92 0.33 0.00 -0.56 0.00 0.00 46.19 44.04 2g4a s LEU 36 CO 0.00 -0.29 1.60 -0.74 -1.06 0.00 0.00 176.35 175.86 2g4a h HIS 37 N 6.58 0.17 -0.51 3.48 2.76 -2.00 -3.21 115.15 122.42 2g4a h HIS 37 Ca 0.08 -0.06 0.06 0.00 -2.20 0.00 0.00 60.37 58.25 2g4a h HIS 37 Cb 0.89 -0.03 -0.05 0.00 1.55 0.00 0.00 27.41 29.76 2g4a h HIS 37 CO 0.75 0.69 0.21 -0.44 -1.30 0.00 0.00 177.93 177.83 2g4a h ASP 38 N 0.10 0.24 -0.60 3.26 3.32 -1.98 0.74 116.42 121.51 2g4a h ASP 38 Ca -0.00 0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.15 2g4a h ASP 38 Cb 1.06 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 2g4a h ASP 38 CO 0.08 0.17 0.40 0.22 -1.72 0.00 0.00 179.24 178.39 2g4a h TYR 39 N 0.40 0.62 0.00 4.55 3.20 -1.98 0.10 116.97 123.87 2g4a h TYR 39 Ca 0.24 0.02 -0.22 0.00 3.14 0.00 0.00 58.73 61.90 2g4a h TYR 39 Cb 0.23 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.26 2g4a h TYR 39 CO -0.14 0.35 -1.33 1.25 -1.64 0.00 0.00 178.16 176.64 2g4a h HIS 40 N 0.63 0.00 -0.14 -3.82 2.76 -1.34 -2.86 115.15 110.38 2g4a h HIS 40 Ca 0.25 0.00 -0.23 0.00 -2.20 0.00 0.00 60.37 58.19 2g4a h HIS 40 Cb 0.19 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.17 2g4a h HIS 40 CO -0.00 0.86 -0.81 0.22 -1.30 0.00 0.00 177.93 176.90 2g4a h ASP 41 N 0.00 0.95 0.06 3.26 1.82 0.12 -1.35 116.42 121.28 2g4a h ASP 41 Ca -0.16 -0.64 -0.00 0.00 -0.39 0.00 0.00 57.03 55.84 2g4a h ASP 41 Cb 1.79 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 41.52 2g4a h ASP 41 CO 0.08 1.44 -0.03 0.40 -1.61 0.00 0.00 179.24 179.53 2g4a h ILE 42 N 0.53 0.00 0.10 2.25 2.04 -0.96 -3.41 117.51 118.06 2g4a h ILE 42 Ca -0.06 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 2g4a h ILE 42 Cb 1.44 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 2g4a h ILE 42 CO 0.17 0.00 -0.05 0.40 0.00 0.00 0.00 178.15 178.67 2g4a h ILE 43 N -0.96 0.53 0.00 -0.67 2.04 -1.68 -3.47 117.51 113.30 2g4a h ILE 43 Ca -0.01 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.64 2g4a h ILE 43 Cb 0.06 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2g4a h ILE 43 CO 0.01 0.16 0.00 1.17 0.00 0.00 0.00 178.15 179.50 2g4a n LYS 44 N -4.84 0.00 -3.08 2.37 4.81 -0.51 -4.82 118.16 112.10 2g4a n LYS 44 Ca -0.05 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.12 2g4a n LYS 44 Cb 0.18 -0.56 -0.05 0.00 0.02 0.00 0.00 35.03 34.62 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 -0.91 3.94 -2.16 5.64 8.25 -1.26 -5.00 115.22 123.72 2g4a n HIS 45 Ca 0.00 -4.04 -0.42 0.00 -0.26 0.00 0.00 57.72 53.01 2g4a n HIS 45 Cb 0.00 -0.52 -0.03 0.00 1.12 0.00 0.00 29.99 30.56 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 -3.19 4.33 0.11 -0.41 0.04 -1.26 -5.02 135.00 129.59 2g4a s PRO 46 Ca 0.46 2.09 0.05 0.00 0.04 0.00 0.00 61.00 63.65 2g4a s PRO 46 Cb 0.24 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 31.52 2g4a s PRO 46 CO -0.10 -0.40 -0.14 -1.64 0.04 0.00 0.00 177.00 174.76 2g4a s MET 47 N 0.75 0.95 0.11 4.56 -1.94 -1.26 -5.00 119.30 117.47 2g4a s MET 47 Ca 0.63 -1.15 -0.08 0.00 -1.71 0.00 0.00 55.69 53.37 2g4a s MET 47 Cb -0.37 -0.84 -0.01 0.00 2.01 0.00 0.00 34.83 35.62 2g4a s MET 47 CO 0.33 0.17 0.21 0.16 -0.01 0.00 0.00 175.02 175.88 2g4a s ASP 48 N -2.26 0.10 0.35 3.03 -4.77 -1.26 -4.89 116.67 106.97 2g4a s ASP 48 Ca 0.06 -0.74 0.09 0.00 -3.30 0.00 0.00 52.55 48.66 2g4a s ASP 48 Cb -0.06 0.37 0.64 0.00 -1.09 0.00 0.00 42.92 42.78 2g4a s ASP 48 CO 0.02 -0.78 1.81 0.25 0.70 0.00 0.00 175.17 177.17 2g4a h LEU 49 N 2.69 0.17 -0.92 2.11 6.46 -1.57 -2.97 115.31 121.27 2g4a h LEU 49 Ca -0.33 -0.05 0.05 0.00 -0.12 0.00 0.00 57.88 57.42 2g4a h LEU 49 Cb 1.21 -0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 41.03 2g4a h LEU 49 CO 0.54 0.48 0.59 0.28 -0.62 0.00 0.00 178.44 179.70 2g4a h SER 50 N 0.15 0.96 -0.58 1.25 0.02 -1.44 -1.47 113.55 112.44 2g4a h SER 50 Ca 0.02 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.89 2g4a h SER 50 Cb 0.63 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 2g4a h SER 50 CO 0.05 0.63 0.02 0.74 -1.14 0.00 0.00 176.83 177.13 2g4a h THR 51 N 1.11 1.26 -0.69 -2.27 2.02 -1.80 -2.83 112.91 109.71 2g4a h THR 51 Ca 0.39 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 2g4a h THR 51 Cb 0.10 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 2g4a h THR 51 CO -0.15 0.40 0.38 0.58 0.37 0.00 0.00 175.52 177.10 2g4a h VAL 52 N 0.90 1.20 -0.63 3.16 2.07 -1.33 -2.31 116.25 119.32 2g4a h VAL 52 Ca 0.17 -0.49 0.03 0.00 0.82 0.00 0.00 66.70 67.22 2g4a h VAL 52 Cb 0.52 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 2g4a h VAL 52 CO 0.03 0.22 0.38 0.50 0.02 0.00 0.00 177.57 178.72 2g4a h LYS 53 N 0.95 0.73 -0.28 1.57 3.11 -1.05 -0.02 116.57 121.58 2g4a h LYS 53 Ca 0.24 -0.04 -0.08 0.00 -2.81 0.00 0.00 60.65 57.96 2g4a h LYS 53 Cb 0.01 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 31.06 2g4a h LYS 53 CO -0.04 0.48 -0.18 0.00 -2.81 0.00 0.00 179.45 176.90 2g4a h ARG 54 N 0.75 0.51 -0.19 1.90 2.47 -1.37 -1.57 114.38 116.88 2g4a h ARG 54 Ca 0.25 -0.17 -0.06 0.00 -1.26 0.00 0.00 59.98 58.75 2g4a h ARG 54 Cb 0.03 -0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.30 2g4a h ARG 54 CO -0.11 0.67 -0.11 0.87 0.56 0.00 0.00 179.97 181.86 2g4a h LYS 55 N 0.46 0.41 -0.22 0.04 1.57 -0.82 -2.34 116.57 115.67 2g4a h LYS 55 Ca 0.08 -0.19 -0.08 0.00 -1.87 0.00 0.00 60.65 58.59 2g4a h LYS 55 Cb 0.58 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 2g4a h LYS 55 CO 0.04 0.72 -0.23 0.00 -0.57 0.00 0.00 179.45 179.41 2g4a h MET 56 N 0.10 0.41 0.00 3.15 -0.00 -0.94 0.53 114.93 118.17 2g4a h MET 56 Ca 0.04 -0.14 -0.07 0.00 -0.00 0.00 0.00 59.70 59.53 2g4a h MET 56 Cb 0.60 -0.03 -0.01 0.00 -0.00 0.00 0.00 31.60 32.16 2g4a h MET 56 CO 0.03 0.61 -0.33 0.93 -0.00 0.00 0.00 176.91 178.15 2g4a h GLU 57 N 0.37 0.00 -0.04 -0.10 4.39 -1.22 -2.62 114.58 115.36 2g4a h GLU 57 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2g4a h GLU 57 Cb 0.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2g4a h GLU 57 CO 0.04 0.33 0.00 0.09 -1.16 0.00 0.00 179.01 178.31 2g4a n ASN 58 N -3.71 3.00 -2.00 1.42 3.02 -0.89 -4.96 115.26 111.15 2g4a n ASN 58 Ca -0.01 -1.99 -0.15 0.00 -0.03 0.00 0.00 54.58 52.40 2g4a n ASN 58 Cb 0.43 -0.01 0.02 0.00 -0.61 0.00 0.00 39.78 39.61 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 1.34 -2.96 0.19 3.52 0.63 -0.24 -4.91 116.66 114.23 2g4a n ARG 59 Ca 0.14 0.61 0.05 0.00 -0.92 0.00 0.00 57.85 57.72 2g4a n ARG 59 Cb 0.60 -4.83 0.35 0.00 0.45 0.00 0.00 32.46 29.03 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 -0.80 0.00 -3.31 6.15 3.58 -0.28 -3.37 116.42 118.39 2g4a h ASP 60 Ca -0.35 0.00 -0.76 0.00 0.42 0.00 0.00 57.03 56.35 2g4a h ASP 60 Cb 1.24 0.00 -0.23 0.00 1.72 0.00 0.00 39.33 42.06 2g4a h ASP 60 CO 0.38 0.39 0.38 -0.31 -2.88 0.00 0.00 179.24 177.20 2g4a s TYR 61 N -3.77 3.56 -0.88 0.28 2.02 -1.26 -4.85 117.35 112.45 2g4a s TYR 61 Ca -0.01 -1.81 0.04 0.00 -0.37 0.00 0.00 57.07 54.92 2g4a s TYR 61 Cb 0.12 -3.99 0.22 0.00 -0.40 0.00 0.00 41.96 37.91 2g4a s TYR 61 CO 0.70 -1.17 0.86 2.89 -1.57 0.00 0.00 175.55 177.26 2g4a n ARG 62 N 4.84 2.02 -3.70 -0.62 1.85 -1.26 -4.83 116.66 114.96 2g4a n ARG 62 Ca 0.18 -0.84 -0.13 0.00 -1.00 0.00 0.00 57.85 56.06 2g4a n ARG 62 Cb 0.47 -1.67 -0.07 0.00 -1.05 0.00 0.00 32.46 30.14 2g4a n ARG 62 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2g4a s ASP 63 N -0.26 -0.24 0.01 2.89 1.01 -1.26 -5.06 116.67 113.76 2g4a s ASP 63 Ca 0.15 0.00 -0.15 0.00 0.71 0.00 0.00 52.55 53.26 2g4a s ASP 63 Cb 0.11 0.39 -0.35 0.00 1.01 0.00 0.00 42.92 44.08 2g4a s ASP 63 CO 0.05 -0.60 0.93 0.00 0.21 0.00 0.00 175.17 175.76 2g4a h ALA 64 N 3.26 -0.10 -0.74 5.23 0.00 -1.96 -3.20 119.26 121.74 2g4a h ALA 64 Ca -0.31 -0.91 0.01 0.00 0.00 0.00 0.00 54.91 53.70 2g4a h ALA 64 Cb 1.19 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 19.18 2g4a h ALA 64 CO 0.43 0.75 0.49 1.96 0.00 0.00 0.00 179.25 182.88 2g4a h GLN 65 N 0.13 0.98 -0.44 0.00 1.08 -1.99 -1.88 115.11 112.98 2g4a h GLN 65 Ca -0.27 -0.06 -0.09 0.00 -1.45 0.00 0.00 58.65 56.77 2g4a h GLN 65 Cb 2.15 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 29.35 2g4a h GLN 65 CO 0.26 0.65 -0.08 0.93 -0.95 0.00 0.00 178.83 179.64 2g4a h GLU 66 N 1.01 0.84 -0.76 1.46 4.39 -1.99 -1.41 114.58 118.12 2g4a h GLU 66 Ca 0.27 -0.31 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 2g4a h GLU 66 Cb -0.11 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 2g4a h GLU 66 CO -0.06 0.93 0.32 0.35 -1.16 0.00 0.00 179.01 179.40 2g4a h PHE 67 N 0.67 1.14 -0.42 4.33 3.04 -1.45 -2.71 116.94 121.55 2g4a h PHE 67 Ca 0.12 -0.08 -0.12 0.00 3.98 0.00 0.00 57.97 61.86 2g4a h PHE 67 Cb 0.61 -0.34 -0.01 0.00 2.56 0.00 0.00 35.95 38.76 2g4a h PHE 67 CO 0.05 0.86 -0.22 0.00 -2.02 0.00 0.00 178.31 176.98 2g4a h ALA 68 N 1.16 0.60 -0.86 2.41 0.00 -1.26 -3.02 119.26 118.29 2g4a h ALA 68 Ca 0.26 -0.38 0.08 0.00 0.00 0.00 0.00 54.91 54.87 2g4a h ALA 68 Cb 0.19 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 2g4a h ALA 68 CO -0.02 0.58 0.56 0.00 0.00 0.00 0.00 179.25 180.36 2g4a h ALA 69 N 0.82 1.63 -0.64 0.00 0.00 -1.05 -1.52 119.26 118.51 2g4a h ALA 69 Ca 0.09 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2g4a h ALA 69 Cb 0.79 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2g4a h ALA 69 CO 0.06 0.21 0.13 0.22 0.00 0.00 0.00 179.25 179.87 2g4a h ASP 70 N 0.88 1.00 -0.26 0.00 1.82 -1.36 -1.86 116.42 116.64 2g4a h ASP 70 Ca 0.39 -0.25 -0.03 0.00 -0.39 0.00 0.00 57.03 56.75 2g4a h ASP 70 Cb 0.34 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.08 2g4a h ASP 70 CO -0.16 0.99 0.04 0.58 -1.61 0.00 0.00 179.24 179.08 2g4a h VAL 71 N 0.96 1.23 -0.37 2.25 2.07 -1.23 -1.48 116.25 119.69 2g4a h VAL 71 Ca 0.20 -0.78 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 2g4a h VAL 71 Cb 0.40 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 2g4a h VAL 71 CO 0.01 0.25 0.10 0.03 0.02 0.00 0.00 177.57 177.98 2g4a h ARG 72 N 0.25 0.54 -0.16 1.57 3.08 -1.27 -1.17 114.38 117.22 2g4a h ARG 72 Ca 0.08 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 2g4a h ARG 72 Cb 0.33 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 2g4a h ARG 72 CO 0.01 0.49 -0.27 1.25 -1.07 0.00 0.00 179.97 180.38 2g4a h LEU 73 N 0.53 0.51 -0.36 3.04 5.85 -1.13 -2.15 115.31 121.60 2g4a h LEU 73 Ca 0.13 -0.54 -0.03 0.00 0.84 0.00 0.00 57.88 58.28 2g4a h LEU 73 Cb 0.19 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2g4a h LEU 73 CO -0.01 0.95 0.11 -0.03 -0.34 0.00 0.00 178.44 179.12 2g4a h MET 74 N 0.09 0.56 -0.37 1.25 4.05 -1.05 -0.96 114.93 118.50 2g4a h MET 74 Ca 0.01 -0.12 -0.05 0.00 -0.28 0.00 0.00 59.70 59.26 2g4a h MET 74 Cb 0.85 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.55 2g4a h MET 74 CO 0.06 0.58 0.02 0.74 0.23 0.00 0.00 176.91 178.54 2g4a h PHE 75 N 0.43 0.59 -0.11 1.39 -1.00 -1.27 -1.66 116.94 115.30 2g4a h PHE 75 Ca 0.11 -0.06 -0.18 0.00 2.81 0.00 0.00 57.97 60.66 2g4a h PHE 75 Cb 0.26 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.64 2g4a h PHE 75 CO 0.01 0.56 -0.68 0.77 -1.61 0.00 0.00 178.31 177.36 2g4a h SER 76 N 0.54 0.52 -0.16 2.17 0.02 -1.14 -2.28 113.55 113.22 2g4a h SER 76 Ca 0.12 -0.32 -0.05 0.00 -0.84 0.00 0.00 61.79 60.70 2g4a h SER 76 Cb 0.32 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 2g4a h SER 76 CO 0.01 1.05 -0.09 0.78 -1.14 0.00 0.00 176.83 177.43 2g4a h ASN 77 N 0.32 0.37 -0.50 3.07 2.35 -0.79 -2.27 115.58 118.12 2g4a h ASN 77 Ca -0.02 -0.42 -0.05 0.00 -0.55 0.00 0.00 56.30 55.26 2g4a h ASN 77 Cb 1.24 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.49 2g4a h ASN 77 CO 0.12 0.71 0.13 0.00 -1.65 0.00 0.00 177.43 176.73 2g4a h TYR 79 N 0.69 0.97 -0.13 0.00 5.03 -1.43 0.35 116.97 122.46 2g4a h TYR 79 Ca 0.16 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.41 2g4a h TYR 79 Cb 0.32 -0.31 -0.01 0.00 1.55 0.00 0.00 36.73 38.29 2g4a h TYR 79 CO 0.02 0.71 0.02 0.87 -1.32 0.00 0.00 178.16 178.46 2g4a h LYS 80 N 0.97 0.21 -0.03 1.82 1.57 -1.20 -3.13 116.57 116.78 2g4a h LYS 80 Ca 0.24 -0.06 -0.17 0.00 -1.87 0.00 0.00 60.65 58.79 2g4a h LYS 80 Cb 0.11 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2g4a h LYS 80 CO -0.03 0.41 -0.73 -0.92 -0.57 0.00 0.00 179.45 177.61 2g4a h TYR 81 N -0.01 0.27 -3.50 -1.35 3.20 -1.27 -3.39 116.97 110.91 2g4a h TYR 81 Ca 0.04 -0.13 -0.68 0.00 3.14 0.00 0.00 58.73 61.11 2g4a h TYR 81 Cb 0.30 -0.04 -0.37 0.00 1.54 0.00 0.00 36.73 38.15 2g4a h TYR 81 CO 0.02 0.85 -0.51 -0.80 -1.64 0.00 0.00 178.16 176.08 2g4a s ASN 82 N -6.90 4.91 0.63 -2.11 0.01 0.12 -5.10 114.94 106.50 2g4a s ASN 82 Ca -0.03 -2.70 -0.18 0.00 -0.71 0.00 0.00 52.86 49.24 2g4a s ASN 82 Cb 0.11 -1.76 -0.04 0.00 0.41 0.00 0.00 41.25 39.97 2g4a s ASN 82 CO 0.81 -0.36 0.83 -2.65 -1.51 0.00 0.00 177.10 174.22 2g4a n PRO 83 N 3.63 0.68 -1.84 -0.60 -0.02 -1.22 -4.43 135.00 131.21 2g4a n PRO 83 Ca 0.05 0.27 -0.43 0.00 -2.02 0.00 0.00 63.50 61.38 2g4a n PRO 83 Cb 0.37 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.77 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 -2.73 3.60 0.00 0.52 0.04 -1.26 -4.22 135.00 130.95 2g4a s PRO 84 Ca 0.74 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.74 2g4a s PRO 84 Cb -0.40 -4.19 0.00 0.00 0.04 0.00 0.00 34.50 29.95 2g4a s PRO 84 CO 0.50 -1.55 0.00 -3.47 0.04 0.00 0.00 177.00 172.51 2g4a n ASP 85 N 9.52 0.00 -4.80 6.66 2.03 -1.26 -5.14 116.55 123.56 2g4a n ASP 85 Ca 0.23 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 55.21 2g4a n ASP 85 Cb 0.44 0.01 0.01 0.00 -0.72 0.00 0.00 41.12 40.86 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 -1.49 2.99 0.42 -0.67 3.76 -1.26 -4.94 115.29 114.10 2g4a s HIS 86 Ca 0.00 1.51 0.10 0.00 -0.15 0.00 0.00 55.06 56.52 2g4a s HIS 86 Cb 0.00 -3.01 0.94 0.00 1.11 0.00 0.00 32.58 31.62 2g4a s HIS 86 CO 0.00 -1.11 2.03 0.22 -0.85 0.00 0.00 174.74 175.03 2g4a h ASP 87 N 0.46 0.41 -0.76 1.40 1.82 -2.01 -1.68 116.42 116.06 2g4a h ASP 87 Ca -0.47 -0.00 0.04 0.00 -0.39 0.00 0.00 57.03 56.21 2g4a h ASP 87 Cb 1.22 -0.09 -0.04 0.00 0.68 0.00 0.00 39.33 41.09 2g4a h ASP 87 CO 0.57 0.28 0.50 1.62 -1.61 0.00 0.00 179.24 180.61 2g4a h VAL 88 N 0.48 1.10 -0.50 2.25 3.04 -2.00 -1.98 116.25 118.63 2g4a h VAL 88 Ca 0.20 -0.31 -0.05 0.00 -1.01 0.00 0.00 66.70 65.53 2g4a h VAL 88 Cb 0.19 0.12 -0.02 0.00 -2.01 0.00 0.00 31.29 29.56 2g4a h VAL 88 CO -0.05 0.16 0.13 0.58 -1.01 0.00 0.00 177.57 177.39 2g4a h VAL 89 N 0.90 1.24 -0.21 1.51 2.07 -1.66 -2.62 116.25 117.47 2g4a h VAL 89 Ca 0.31 -0.82 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 2g4a h VAL 89 Cb 0.09 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2g4a h VAL 89 CO -0.09 0.30 -0.06 0.00 0.02 0.00 0.00 177.57 177.73 2g4a h ALA 90 N 1.00 1.50 -0.55 1.67 0.00 -1.39 -2.41 119.26 119.09 2g4a h ALA 90 Ca 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2g4a h ALA 90 Cb 0.31 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2g4a h ALA 90 CO -0.00 0.35 0.36 0.52 0.00 0.00 0.00 179.25 180.48 2g4a h MET 91 N 0.31 0.72 -0.37 0.00 2.86 -1.00 -2.38 114.93 115.08 2g4a h MET 91 Ca 0.07 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.55 2g4a h MET 91 Cb 0.32 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 2g4a h MET 91 CO 0.01 0.48 -0.21 0.00 1.06 0.00 0.00 176.91 178.26 2g4a h ALA 92 N 1.66 0.52 -0.97 6.32 0.00 -1.35 -2.85 119.26 122.59 2g4a h ALA 92 Ca 0.20 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2g4a h ALA 92 Cb -0.08 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.54 2g4a h ALA 92 CO -0.04 0.48 0.62 -0.09 0.00 0.00 0.00 179.25 180.21 2g4a h ARG 93 N 0.58 1.30 -0.38 0.00 2.43 -1.39 -0.42 114.38 116.51 2g4a h ARG 93 Ca 0.08 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 2g4a h ARG 93 Cb 0.76 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 2g4a h ARG 93 CO 0.06 0.88 -0.07 0.87 -1.51 0.00 0.00 179.97 180.20 2g4a h LYS 94 N 1.33 0.63 -0.03 0.20 1.57 -1.41 -2.77 116.57 116.09 2g4a h LYS 94 Ca 0.35 -0.17 -0.18 0.00 -1.87 0.00 0.00 60.65 58.78 2g4a h LYS 94 Cb -0.11 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 2g4a h LYS 94 CO -0.07 0.70 -0.77 1.25 -0.57 0.00 0.00 179.45 179.99 2g4a h LEU 95 N 0.59 0.29 -0.89 2.94 5.85 -1.15 -3.17 115.31 119.77 2g4a h LEU 95 Ca 0.11 -0.20 0.07 0.00 0.84 0.00 0.00 57.88 58.70 2g4a h LEU 95 Cb 0.47 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.35 2g4a h LEU 95 CO 0.02 0.95 0.55 -0.61 -0.34 0.00 0.00 178.44 179.01 2g4a h GLN 96 N 0.15 0.95 -0.27 1.25 4.15 -0.81 -1.29 115.11 119.24 2g4a h GLN 96 Ca -0.03 -0.06 -0.13 0.00 0.77 0.00 0.00 58.65 59.20 2g4a h GLN 96 Cb 1.35 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.82 2g4a h GLN 96 CO 0.12 0.63 -0.39 -0.44 -1.93 0.00 0.00 178.83 176.82 2g4a h ASP 97 N 0.97 0.66 -0.43 -0.69 5.19 -1.55 -2.12 116.42 118.45 2g4a h ASP 97 Ca 0.40 -0.29 -0.04 0.00 -0.62 0.00 0.00 57.03 56.48 2g4a h ASP 97 Cb 0.23 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 39.54 2g4a h ASP 97 CO -0.19 0.97 0.12 0.58 -3.12 0.00 0.00 179.24 177.60 2g4a h VAL 98 N 0.52 1.22 -0.22 -1.35 2.07 -1.30 -1.58 116.25 115.61 2g4a h VAL 98 Ca 0.05 -0.75 -0.12 0.00 0.82 0.00 0.00 66.70 66.69 2g4a h VAL 98 Cb 0.90 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 2g4a h VAL 98 CO 0.08 0.27 -0.37 0.15 0.02 0.00 0.00 177.57 177.72 2g4a h PHE 99 N 0.55 0.58 -0.38 1.57 3.57 -1.24 -2.94 116.94 118.66 2g4a h PHE 99 Ca 0.14 -0.16 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 2g4a h PHE 99 Cb 0.28 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 2g4a h PHE 99 CO 0.01 0.80 -0.02 1.49 -2.23 0.00 0.00 178.31 178.36 2g4a h GLU 100 N 0.42 0.69 -0.85 1.11 4.81 -1.19 -0.33 114.58 119.23 2g4a h GLU 100 Ca 0.04 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.04 2g4a h GLU 100 Cb 0.84 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.12 2g4a h GLU 100 CO 0.07 0.80 0.52 0.35 -0.73 0.00 0.00 179.01 180.02 2g4a h PHE 101 N 0.50 1.10 -0.00 0.92 3.57 -1.25 -2.14 116.94 119.64 2g4a h PHE 101 Ca 0.10 0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.43 2g4a h PHE 101 Cb 0.50 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 2g4a h PHE 101 CO 0.04 0.72 -0.81 0.00 -2.23 0.00 0.00 178.31 176.04 2g4a h ARG 102 N 1.16 0.10 0.00 1.11 2.47 -1.39 -3.11 114.38 114.72 2g4a h ARG 102 Ca 0.31 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 58.93 2g4a h ARG 102 Cb -0.07 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.28 2g4a h ARG 102 CO -0.06 0.85 0.00 -0.92 0.56 0.00 0.00 179.97 180.40 2g4a h TYR 103 N 0.06 0.00 0.02 3.04 3.20 -0.38 -0.68 116.97 122.22 2g4a h TYR 103 Ca -0.02 0.00 -0.22 0.00 3.14 0.00 0.00 58.73 61.62 2g4a h TYR 103 Cb 1.41 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.66 2g4a h TYR 103 CO 0.01 0.00 -1.08 0.00 -1.64 0.00 0.00 178.16 175.45 2g4a h ALA 104 N 2.03 0.35 0.00 1.82 0.00 -1.43 -3.33 119.26 118.69 2g4a h ALA 104 Ca 0.00 -0.95 -0.11 0.00 0.00 0.00 0.00 54.91 53.86 2g4a h ALA 104 Cb 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2g4a h ALA 104 CO 0.00 1.24 -1.42 1.63 0.00 0.00 0.00 179.25 180.70 2g4a n LYS 105 N -3.35 0.62 -0.17 0.00 5.02 -0.79 -4.32 118.16 115.17 2g4a n LYS 105 Ca -0.02 0.13 -0.02 0.00 -2.02 0.00 0.00 58.31 56.37 2g4a n LYS 105 Cb 0.96 -1.76 0.08 0.00 -0.02 0.00 0.00 35.03 34.29 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 0.35 -0.65 1.97 4.05 -1.25 -3.15 114.93 116.25 2g4a h MET 106 Ca -0.12 -0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.35 2g4a h MET 106 Cb 1.37 -0.08 -0.09 0.00 -0.80 0.00 0.00 31.60 32.00 2g4a h MET 106 CO 0.02 0.23 -0.51 -1.35 0.23 0.00 0.00 176.91 175.54 2g4a h PRO 107 N 0.36 -0.16 0.00 0.39 0.11 -1.75 -3.46 132.00 127.49 2g4a h PRO 107 Ca 0.26 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.38 2g4a h PRO 107 Cb 0.30 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.45 2g4a h PRO 107 CO -0.27 -0.10 0.00 -0.25 -0.21 0.00 0.00 178.00 177.16