#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1myf s LEU 2 N 0.00 2.28 0.76 1.34 1.02 -1.26 -5.04 118.68 117.78 1myf s LEU 2 Ca 0.00 -0.44 -0.11 0.00 0.02 0.00 0.00 54.13 53.60 1myf s LEU 2 Cb 0.00 -1.44 0.05 0.00 0.02 0.00 0.00 46.19 44.82 1myf s LEU 2 CO 0.00 0.24 1.08 -0.44 0.02 0.00 0.00 176.35 177.25 1myf s SER 3 N -0.11 4.76 0.28 2.29 0.01 -1.26 -4.76 113.70 114.91 1myf s SER 3 Ca -0.04 1.48 0.03 0.00 1.31 0.00 0.00 55.95 58.72 1myf s SER 3 Cb -0.14 -2.26 0.65 0.00 0.21 0.00 0.00 66.02 64.48 1myf s SER 3 CO 0.04 -1.82 1.77 -0.33 0.41 0.00 0.00 173.24 173.31 1myf h GLU 4 N -0.98 0.68 0.13 12.44 5.08 -2.00 0.11 114.58 130.04 1myf h GLU 4 Ca -0.46 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1myf h GLU 4 Cb 1.24 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1myf h GLU 4 CO 0.57 0.45 -0.06 0.78 -1.00 0.00 0.00 179.01 179.75 1myf h GLY 5 N 0.70 -0.19 0.78 -3.84 0.00 -1.99 0.11 103.07 98.64 1myf h GLY 5 Ca 0.53 0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.97 1myf h GLY 5 CO -0.38 -0.07 0.35 0.83 0.00 0.00 0.00 176.54 177.28 1myf h GLU 6 N -0.23 0.66 -0.27 4.80 5.08 -1.65 0.36 114.58 123.33 1myf h GLU 6 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1myf h GLU 6 Cb 0.18 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1myf h GLU 6 CO 0.03 0.44 0.18 -1.49 -1.00 0.00 0.00 179.01 177.16 1myf h TRP 7 N 0.68 0.34 -0.54 4.33 -0.00 -0.60 0.35 115.95 120.51 1myf h TRP 7 Ca 0.26 0.01 0.04 0.00 -0.00 0.00 0.00 58.89 59.20 1myf h TRP 7 Cb 0.10 -0.11 -0.04 0.00 -0.00 0.00 0.00 29.16 29.10 1myf h TRP 7 CO -0.07 0.21 0.30 1.96 -0.00 0.00 0.00 178.44 180.84 1myf h GLN 8 N 0.36 0.56 0.03 0.49 4.20 -0.07 0.13 115.11 120.81 1myf h GLN 8 Ca 0.10 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.79 1myf h GLN 8 Cb -0.04 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.60 1myf h GLN 8 CO -0.02 0.37 -0.09 -0.07 -0.67 0.00 0.00 178.83 178.34 1myf h LEU 9 N 0.57 -0.26 -0.16 1.46 -0.00 -0.73 0.12 115.31 116.32 1myf h LEU 9 Ca 0.23 0.04 0.05 0.00 -0.00 0.00 0.00 57.88 58.20 1myf h LEU 9 Cb 0.10 0.11 -0.06 0.00 -0.00 0.00 0.00 40.66 40.81 1myf h LEU 9 CO -0.14 -0.14 -0.20 0.58 -0.00 0.00 0.00 178.44 178.54 1myf h VAL 10 N -0.18 0.48 -0.86 1.22 2.07 -0.24 0.38 116.25 119.13 1myf h VAL 10 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1myf h VAL 10 Cb 0.20 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 1myf h VAL 10 CO -0.07 0.00 0.55 -0.07 0.02 0.00 0.00 177.57 178.00 1myf h LEU 11 N -0.25 1.00 0.32 2.57 3.38 -0.56 0.24 115.31 122.01 1myf h LEU 11 Ca 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1myf h LEU 11 Cb 0.41 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1myf h LEU 11 CO -0.30 0.74 -0.18 -0.74 0.09 0.00 0.00 178.44 178.05 1myf h HIS 12 N 1.17 -0.46 -0.68 1.13 -0.00 0.73 0.16 115.15 117.20 1myf h HIS 12 Ca 0.31 -0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.70 1myf h HIS 12 Cb -0.11 0.16 -0.04 0.00 -0.00 0.00 0.00 27.41 27.42 1myf h HIS 12 CO 0.00 -0.28 0.43 0.28 -0.00 0.00 0.00 177.93 178.36 1myf h VAL 13 N -0.47 1.10 -0.21 5.26 2.07 -0.55 -2.72 116.25 120.73 1myf h VAL 13 Ca -0.04 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.11 1myf h VAL 13 Cb 0.38 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1myf h VAL 13 CO 0.05 0.15 -0.24 -0.25 0.02 0.00 0.00 177.57 177.31 1myf h TRP 14 N 0.84 0.43 -0.82 1.57 2.91 -0.23 0.11 115.95 120.75 1myf h TRP 14 Ca 0.27 -0.08 0.13 0.00 1.13 0.00 0.00 58.89 60.34 1myf h TRP 14 Cb 0.00 -0.11 -0.06 0.00 -0.51 0.00 0.00 29.16 28.48 1myf h TRP 14 CO -0.04 0.60 0.54 0.00 -1.03 0.00 0.00 178.44 178.51 1myf h ALA 15 N 1.41 1.91 -0.30 2.65 0.00 -0.35 0.26 119.26 124.83 1myf h ALA 15 Ca 0.05 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1myf h ALA 15 Cb 0.61 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1myf h ALA 15 CO 0.04 -0.12 -0.14 0.87 0.00 0.00 0.00 179.25 179.90 1myf h LYS 16 N 0.61 0.63 0.53 0.00 1.57 -0.77 0.50 116.57 119.64 1myf h LYS 16 Ca 0.40 -0.27 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 1myf h LYS 16 Cb 0.70 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 1myf h LYS 16 CO -0.16 0.85 -0.46 0.28 -0.57 0.00 0.00 179.45 179.39 1myf h VAL 17 N 0.39 0.00 -0.97 0.50 2.07 -0.86 -2.80 116.25 114.58 1myf h VAL 17 Ca 0.07 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.74 1myf h VAL 17 Cb 0.66 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.34 1myf h VAL 17 CO 0.04 0.00 0.61 -0.08 0.02 0.00 0.00 177.57 178.17 1myf h GLU 18 N -0.97 0.78 -0.58 1.57 4.57 -0.51 0.16 114.58 119.60 1myf h GLU 18 Ca -0.07 -0.05 0.11 0.00 -1.18 0.00 0.00 59.36 58.17 1myf h GLU 18 Cb 0.83 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 29.21 1myf h GLU 18 CO -0.02 0.52 0.39 0.00 -1.18 0.00 0.00 179.01 178.72 1myf h ALA 19 N 1.59 2.10 -1.83 2.92 0.00 -0.62 -2.89 119.26 120.53 1myf h ALA 19 Ca 0.51 -0.01 -0.50 0.00 0.00 0.00 0.00 54.91 54.91 1myf h ALA 19 Cb 0.74 -0.06 -0.41 0.00 0.00 0.00 0.00 17.79 18.06 1myf h ALA 19 CO -0.29 -0.23 -0.99 -3.47 0.00 0.00 0.00 179.25 174.27 1myf n ASP 20 N -4.46 2.43 0.02 0.00 2.03 0.31 -4.95 116.55 111.92 1myf n ASP 20 Ca 0.10 -3.23 -0.10 0.00 0.52 0.00 0.00 54.79 52.08 1myf n ASP 20 Cb 0.41 -0.57 -0.04 0.00 -0.72 0.00 0.00 41.12 40.21 1myf n ASP 20 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1myf h VAL 21 N 2.12 0.43 -0.44 5.18 3.04 -0.63 0.25 116.25 126.20 1myf h VAL 21 Ca 0.10 0.00 0.09 0.00 -1.01 0.00 0.00 66.70 65.88 1myf h VAL 21 Cb 0.88 0.43 -0.09 0.00 -2.01 0.00 0.00 31.29 30.49 1myf h VAL 21 CO 0.63 0.00 -0.18 0.00 -1.01 0.00 0.00 177.57 177.01 1myf h ALA 22 N 0.60 0.17 0.56 3.17 0.00 -1.89 0.34 119.26 122.21 1myf h ALA 22 Ca 0.09 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 1myf h ALA 22 Cb 0.45 0.45 0.01 0.00 0.00 0.00 0.00 17.79 18.70 1myf h ALA 22 CO -0.28 -0.52 -0.27 0.78 0.00 0.00 0.00 179.25 178.96 1myf h GLY 23 N -0.08 -0.78 0.43 0.00 0.00 -1.72 0.34 103.07 101.26 1myf h GLY 23 Ca 0.21 0.29 0.06 0.00 0.00 0.00 0.00 47.33 47.89 1myf h GLY 23 CO -0.50 -0.28 -0.00 0.45 0.00 0.00 0.00 176.54 176.21 1myf h HIS 24 N -0.80 -0.02 -0.17 5.60 3.86 -0.76 0.66 115.15 123.51 1myf h HIS 24 Ca -0.08 0.03 0.05 0.00 -1.16 0.00 0.00 60.37 59.21 1myf h HIS 24 Cb 0.60 0.06 -0.07 0.00 1.06 0.00 0.00 27.41 29.06 1myf h HIS 24 CO -0.03 -0.07 -0.33 0.78 0.86 0.00 0.00 177.93 179.15 1myf h GLY 25 N 0.10 -0.43 0.84 2.45 0.00 -0.10 0.27 103.07 106.20 1myf h GLY 25 Ca 0.17 0.41 -0.04 0.00 0.00 0.00 0.00 47.33 47.87 1myf h GLY 25 CO -0.29 -0.22 -0.40 1.46 0.00 0.00 0.00 176.54 177.09 1myf h GLN 26 N -0.38 -1.08 -0.86 4.80 4.20 -0.27 -2.52 115.11 118.99 1myf h GLN 26 Ca 0.11 0.07 0.17 0.00 0.06 0.00 0.00 58.65 59.06 1myf h GLN 26 Cb 0.55 0.25 -0.16 0.00 0.30 0.00 0.00 27.48 28.42 1myf h GLN 26 CO -0.39 -0.72 -0.24 0.22 -0.67 0.00 0.00 178.83 177.03 1myf h ASP 27 N -1.23 -0.89 -0.14 1.46 1.82 -0.62 0.25 116.42 117.07 1myf h ASP 27 Ca -0.11 0.26 0.02 0.00 -0.39 0.00 0.00 57.03 56.80 1myf h ASP 27 Cb 0.86 0.56 -0.02 0.00 0.68 0.00 0.00 39.33 41.42 1myf h ASP 27 CO 0.19 -0.29 0.03 0.40 -1.61 0.00 0.00 179.24 177.96 1myf h ILE 28 N -0.01 0.95 -0.12 2.25 2.04 -0.41 0.18 117.51 122.38 1myf h ILE 28 Ca 0.40 -0.03 -0.02 0.00 1.00 0.00 0.00 64.86 66.21 1myf h ILE 28 Cb 0.63 0.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1myf h ILE 28 CO -0.89 0.02 -0.01 -0.07 0.00 0.00 0.00 178.15 177.19 1myf h LEU 29 N 0.09 0.21 -0.58 1.44 3.38 -0.46 0.66 115.31 120.06 1myf h LEU 29 Ca 0.06 -0.34 0.08 0.00 0.09 0.00 0.00 57.88 57.77 1myf h LEU 29 Cb 0.05 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 1myf h LEU 29 CO -0.08 0.50 0.23 0.40 0.09 0.00 0.00 178.44 179.59 1myf h ILE 30 N -0.08 0.82 0.17 1.22 1.08 -0.33 0.14 117.51 120.53 1myf h ILE 30 Ca 0.03 -0.15 -0.01 0.00 -0.39 0.00 0.00 64.86 64.34 1myf h ILE 30 Cb 0.40 0.35 0.00 0.00 -3.07 0.00 0.00 36.82 34.50 1myf h ILE 30 CO 0.01 0.08 -0.08 -0.09 -0.69 0.00 0.00 178.15 177.37 1myf h ARG 31 N 0.43 -0.23 -0.14 2.37 9.65 -0.53 -0.17 114.38 125.77 1myf h ARG 31 Ca 0.29 0.02 0.05 0.00 -1.10 0.00 0.00 59.98 59.23 1myf h ARG 31 Cb 0.31 0.05 -0.06 0.00 -1.39 0.00 0.00 29.97 28.88 1myf h ARG 31 CO -0.27 0.02 -0.33 1.25 2.80 0.00 0.00 179.97 183.43 1myf h LEU 32 N -0.45 -1.04 0.23 3.80 5.85 -0.22 0.84 115.31 124.32 1myf h LEU 32 Ca -0.02 0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.86 1myf h LEU 32 Cb 0.35 0.44 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 1myf h LEU 32 CO 0.04 -0.37 -0.40 -0.26 -0.34 0.00 0.00 178.44 177.11 1myf h PHE 33 N -0.40 -1.12 -0.59 1.25 0.04 -0.69 0.18 116.94 115.61 1myf h PHE 33 Ca 0.10 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.89 1myf h PHE 33 Cb 0.56 0.46 -0.03 0.00 2.20 0.00 0.00 35.95 39.14 1myf h PHE 33 CO -0.42 -0.53 0.38 0.87 -0.60 0.00 0.00 178.31 178.02 1myf h LYS 34 N -0.71 0.78 -0.16 1.51 1.57 -0.72 -2.76 116.57 116.08 1myf h LYS 34 Ca -0.00 -0.05 -0.17 0.00 -1.87 0.00 0.00 60.65 58.56 1myf h LYS 34 Cb 0.69 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.83 1myf h LYS 34 CO -0.17 0.52 -0.56 0.77 -0.57 0.00 0.00 179.45 179.45 1myf h SER 35 N 0.80 0.77 -3.58 0.86 0.02 -0.51 -3.41 113.55 108.51 1myf h SER 35 Ca 0.22 -0.61 -0.61 0.00 -0.84 0.00 0.00 61.79 59.95 1myf h SER 35 Cb -0.08 -0.22 -0.40 0.00 0.14 0.00 0.00 62.40 61.83 1myf h SER 35 CO -0.05 1.24 -0.72 -1.00 -1.14 0.00 0.00 176.83 175.16 1myf s HIS 36 N -3.83 2.17 0.32 3.45 3.76 0.62 -5.01 115.29 116.78 1myf s HIS 36 Ca -0.12 -2.55 0.10 0.00 -0.15 0.00 0.00 55.06 52.34 1myf s HIS 36 Cb 0.07 -2.02 0.96 0.00 1.11 0.00 0.00 32.58 32.71 1myf s HIS 36 CO 0.86 -0.77 1.66 -1.35 -0.85 0.00 0.00 174.74 174.28 1myf h PRO 37 N 6.63 0.27 -0.63 8.40 0.11 -1.78 0.75 132.00 145.76 1myf h PRO 37 Ca -0.01 -0.02 0.16 0.00 0.11 0.00 0.00 66.00 66.25 1myf h PRO 37 Cb 0.92 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.93 1myf h PRO 37 CO 0.51 0.18 0.44 1.05 -0.21 0.00 0.00 178.00 179.98 1myf h GLU 38 N 0.28 0.11 0.00 1.05 9.09 -1.95 0.87 114.58 124.04 1myf h GLU 38 Ca 0.67 -0.01 -0.11 0.00 0.05 0.00 0.00 59.36 59.96 1myf h GLU 38 Cb 1.48 -0.03 -0.02 0.00 -1.65 0.00 0.00 28.75 28.54 1myf h GLU 38 CO -0.63 0.08 -0.53 1.79 0.05 0.00 0.00 179.01 179.76 1myf h THR 39 N 0.12 1.25 0.21 -1.06 1.35 -1.18 -3.05 112.91 110.55 1myf h THR 39 Ca 0.30 -1.92 -0.34 0.00 -0.55 0.00 0.00 66.41 63.91 1myf h THR 39 Cb 1.04 2.07 0.02 0.00 -1.73 0.00 0.00 68.15 69.55 1myf h THR 39 CO -0.04 0.52 -1.61 0.25 -0.25 0.00 0.00 175.52 174.40 1myf h LEU 40 N 0.00 0.69 -1.99 3.87 7.12 -0.97 -3.25 115.31 120.77 1myf h LEU 40 Ca -0.01 -0.87 0.11 0.00 0.13 0.00 0.00 57.88 57.24 1myf h LEU 40 Cb 1.03 -0.22 -0.02 0.00 -0.53 0.00 0.00 40.66 40.92 1myf h LEU 40 CO 0.07 1.71 0.27 -0.33 -0.13 0.00 0.00 178.44 180.03 1myf h GLU 41 N 0.12 0.01 -0.33 1.25 4.39 -1.02 -2.97 114.58 116.02 1myf h GLU 41 Ca -0.29 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.40 1myf h GLU 41 Cb 2.12 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.75 1myf h GLU 41 CO 0.22 0.00 0.17 -0.22 -1.16 0.00 0.00 179.01 178.03 1myf h LYS 42 N 0.01 0.47 -6.13 2.33 1.63 -1.56 -3.40 116.57 109.92 1myf h LYS 42 Ca 0.18 -0.06 -0.59 0.00 -0.85 0.00 0.00 60.65 59.33 1myf h LYS 42 Cb 0.71 -0.09 -0.10 0.00 -0.60 0.00 0.00 32.23 32.15 1myf h LYS 42 CO -0.00 0.41 0.75 -0.06 -3.45 0.00 0.00 179.45 177.10 1myf s PHE 43 N -5.80 2.68 0.27 1.91 0.40 -1.13 -4.93 117.98 111.37 1myf s PHE 43 Ca -0.13 0.10 -0.03 0.00 -0.60 0.00 0.00 56.93 56.27 1myf s PHE 43 Cb 0.09 -4.29 0.57 0.00 0.51 0.00 0.00 43.02 39.90 1myf s PHE 43 CO 0.73 -1.52 1.64 0.22 0.70 0.00 0.00 175.22 176.99 1myf h ASP 44 N 9.47 -0.21 0.58 1.36 3.58 -1.85 0.31 116.42 129.67 1myf h ASP 44 Ca -0.26 0.20 -0.04 0.00 0.42 0.00 0.00 57.03 57.35 1myf h ASP 44 Cb 1.07 0.32 -0.01 0.00 1.72 0.00 0.00 39.33 42.43 1myf h ASP 44 CO 1.15 -0.18 -0.21 0.03 -2.88 0.00 0.00 179.24 177.15 1myf h ARG 45 N 0.14 0.00 0.08 0.28 3.08 -1.94 -3.15 114.38 112.88 1myf h ARG 45 Ca 0.48 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 60.16 1myf h ARG 45 Cb 0.91 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.93 1myf h ARG 45 CO -0.68 0.21 -2.17 1.19 -1.07 0.00 0.00 179.97 177.46 1myf n PHE 46 N -3.61 0.82 -0.36 3.04 3.72 0.37 -4.32 117.46 117.12 1myf n PHE 46 Ca -0.01 0.17 0.33 0.00 -0.05 0.00 0.00 57.45 57.89 1myf n PHE 46 Cb 0.35 -1.11 0.60 0.00 -0.94 0.00 0.00 39.48 38.38 1myf n PHE 46 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1myf h LYS 47 N 0.05 0.05 -0.93 -1.08 3.11 -0.46 0.12 116.57 117.42 1myf h LYS 47 Ca -0.48 -0.00 0.21 0.00 -2.81 0.00 0.00 60.65 57.57 1myf h LYS 47 Cb 1.99 -0.01 -0.07 0.00 -1.00 0.00 0.00 32.23 33.13 1myf h LYS 47 CO 0.03 0.03 0.61 1.12 -2.81 0.00 0.00 179.45 178.43 1myf h HIS 48 N 0.05 0.58 -0.49 1.91 2.07 -1.74 -0.82 115.15 116.71 1myf h HIS 48 Ca 0.84 0.02 -0.70 0.00 -2.85 0.00 0.00 60.37 57.67 1myf h HIS 48 Cb 2.32 -0.17 -0.04 0.00 2.57 0.00 0.00 27.41 32.08 1myf h HIS 48 CO -0.01 0.14 3.17 1.28 -3.07 0.00 0.00 177.93 179.44 1myf n LEU 49 N -4.53 8.20 -0.31 6.12 4.77 0.03 -4.79 117.00 126.49 1myf n LEU 49 Ca 0.20 -4.55 0.16 0.00 -0.03 0.00 0.00 56.01 51.80 1myf n LEU 49 Cb 0.72 -1.50 0.34 0.00 -2.33 0.00 0.00 43.42 40.65 1myf n LEU 49 CO 0.30 1.93 0.96 0.50 -1.33 0.00 0.00 177.39 179.75 1myf h LYS 50 N 5.01 0.19 -2.88 3.23 3.64 -1.36 -1.59 116.57 122.81 1myf h LYS 50 Ca 0.75 -0.01 -0.47 0.00 -1.27 0.00 0.00 60.65 59.65 1myf h LYS 50 Cb 0.35 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 1myf h LYS 50 CO 1.68 0.12 2.50 -2.37 -2.27 0.00 0.00 179.45 179.12 1myf n THR 51 N -5.23 3.43 -3.87 1.00 5.66 -1.26 -4.70 114.28 109.30 1myf n THR 51 Ca 0.24 -1.98 -0.32 0.00 -3.05 0.00 0.00 64.05 58.95 1myf n THR 51 Cb 0.77 -2.32 0.01 0.00 -1.55 0.00 0.00 70.33 67.24 1myf n THR 51 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1myf n GLU 52 N 3.47 -0.60 -1.74 1.09 4.71 -1.00 -4.17 120.64 122.40 1myf n GLU 52 Ca 0.60 0.08 -0.01 0.00 -0.01 0.00 0.00 57.16 57.81 1myf n GLU 52 Cb 0.35 -1.61 -0.01 0.00 -1.01 0.00 0.00 31.44 29.16 1myf n GLU 52 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1myf n ALA 53 N -3.56 -3.05 -0.50 0.62 0.00 -0.63 -4.56 120.51 108.83 1myf n ALA 53 Ca -0.13 0.63 -0.03 0.00 0.00 0.00 0.00 53.44 53.91 1myf n ALA 53 Cb 0.45 -1.29 -0.04 0.00 0.00 0.00 0.00 19.45 18.57 1myf n ALA 53 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1myf n GLU 54 N 0.62 1.01 -3.88 0.00 1.02 -1.26 -4.62 120.64 113.52 1myf n GLU 54 Ca -0.10 -0.23 -0.29 0.00 -0.02 0.00 0.00 57.16 56.52 1myf n GLU 54 Cb 0.15 -1.34 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 1myf n GLU 54 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 1myf n MET 55 N 1.91 -2.30 0.00 3.49 0.00 -1.26 -4.83 117.12 114.12 1myf n MET 55 Ca 0.10 0.38 0.00 0.00 -0.00 0.00 0.00 57.70 58.18 1myf n MET 55 Cb 0.49 -4.20 0.00 0.00 0.00 0.00 0.00 33.22 29.51 1myf n MET 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1myf n LYS 56 N -4.39 0.00 -3.81 2.12 5.02 -1.26 -5.05 118.16 110.79 1myf n LYS 56 Ca -0.22 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.82 1myf n LYS 56 Cb 0.65 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.64 1myf n LYS 56 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1myf n ALA 57 N -1.80 -1.83 -4.38 7.82 0.00 -1.26 -4.90 120.51 114.17 1myf n ALA 57 Ca 0.00 -0.32 -0.25 0.00 0.00 0.00 0.00 53.44 52.87 1myf n ALA 57 Cb 0.00 -1.10 -0.07 0.00 0.00 0.00 0.00 19.45 18.28 1myf n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1myf n SER 58 N -1.21 0.95 0.00 0.00 2.88 -1.26 -4.54 113.62 110.44 1myf n SER 58 Ca -0.12 -3.04 0.00 0.00 -1.33 0.00 0.00 58.87 54.37 1myf n SER 58 Cb 0.37 1.06 0.00 0.00 -0.75 0.00 0.00 64.21 64.89 1myf n SER 58 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1myf n GLU 59 N -0.83 0.00 -0.12 -1.46 0.00 -1.26 -3.44 120.64 113.53 1myf n GLU 59 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 57.16 57.02 1myf n GLU 59 Cb 0.57 0.00 0.04 0.00 0.00 0.00 0.00 31.44 32.05 1myf n GLU 59 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 1myf h ASP 60 N 0.00 0.92 -0.91 4.31 1.82 -1.99 -0.74 116.42 119.83 1myf h ASP 60 Ca 0.00 -0.35 0.04 0.00 -0.39 0.00 0.00 57.03 56.33 1myf h ASP 60 Cb 0.00 -0.25 -0.06 0.00 0.68 0.00 0.00 39.33 39.70 1myf h ASP 60 CO 0.00 1.11 0.59 0.25 -1.61 0.00 0.00 179.24 179.57 1myf h LEU 61 N 0.77 0.96 0.42 2.28 5.85 -1.79 -0.05 115.31 123.76 1myf h LEU 61 Ca 0.10 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1myf h LEU 61 Cb 0.79 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1myf h LEU 61 CO 0.07 0.65 -0.20 0.50 -0.34 0.00 0.00 178.44 179.11 1myf h LYS 62 N 1.12 -0.54 -0.48 1.25 3.64 -1.68 0.26 116.57 120.14 1myf h LYS 62 Ca 0.37 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.88 1myf h LYS 62 Cb 0.05 0.12 -0.09 0.00 -0.41 0.00 0.00 32.23 31.90 1myf h LYS 62 CO -0.13 -0.31 -0.08 0.87 -2.27 0.00 0.00 179.45 177.53 1myf h LYS 63 N -0.67 0.03 0.18 1.90 1.57 -0.62 0.15 116.57 119.11 1myf h LYS 63 Ca -0.06 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1myf h LYS 63 Cb 0.49 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1myf h LYS 63 CO 0.09 0.02 -0.09 1.25 -0.57 0.00 0.00 179.45 180.16 1myf h HIS 64 N 0.03 -0.22 -0.91 -1.35 2.76 -0.77 -2.30 115.15 112.40 1myf h HIS 64 Ca 0.24 -0.01 0.24 0.00 -2.20 0.00 0.00 60.37 58.64 1myf h HIS 64 Cb 0.36 0.07 -0.13 0.00 1.55 0.00 0.00 27.41 29.26 1myf h HIS 64 CO -0.38 0.10 0.37 0.78 -1.30 0.00 0.00 177.93 177.51 1myf h GLY 65 N -0.57 1.56 0.76 5.26 0.00 -0.10 0.26 103.07 110.24 1myf h GLY 65 Ca -0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1myf h GLY 65 CO 0.04 -0.33 -0.08 -2.08 0.00 0.00 0.00 176.54 174.09 1myf h VAL 66 N 0.33 0.92 -0.54 4.60 2.07 -0.96 0.61 116.25 123.29 1myf h VAL 66 Ca 0.58 -0.50 0.11 0.00 0.82 0.00 0.00 66.70 67.71 1myf h VAL 66 Cb 1.16 1.22 -0.10 0.00 -1.52 0.00 0.00 31.29 32.06 1myf h VAL 66 CO -0.58 0.12 -0.07 0.74 0.02 0.00 0.00 177.57 177.80 1myf h THR 67 N -0.48 0.51 0.89 2.57 2.02 -0.27 0.19 112.91 118.34 1myf h THR 67 Ca -0.02 -0.02 -0.04 0.00 0.77 0.00 0.00 66.41 67.09 1myf h THR 67 Cb 0.37 0.45 0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1myf h THR 67 CO 0.04 0.01 -0.43 0.58 0.37 0.00 0.00 175.52 176.09 1myf h VAL 68 N 0.05 0.02 -0.92 3.16 2.07 -0.46 -1.42 116.25 118.75 1myf h VAL 68 Ca 0.27 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.68 1myf h VAL 68 Cb 0.42 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.16 1myf h VAL 68 CO -0.51 0.00 0.61 -0.07 0.02 0.00 0.00 177.57 177.62 1myf h LEU 69 N -1.31 1.05 -0.85 2.57 3.38 -0.67 -1.47 115.31 118.01 1myf h LEU 69 Ca -0.12 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1myf h LEU 69 Cb 0.92 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 1myf h LEU 69 CO 0.20 0.76 0.54 0.74 0.09 0.00 0.00 178.44 180.77 1myf h THR 70 N 1.24 1.23 0.52 0.22 2.02 -0.51 0.60 112.91 118.24 1myf h THR 70 Ca 0.34 -0.46 -0.03 0.00 0.77 0.00 0.00 66.41 67.03 1myf h THR 70 Cb -0.14 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 66.27 1myf h THR 70 CO -0.07 0.23 -0.25 0.00 0.37 0.00 0.00 175.52 175.79 1myf h ALA 71 N 1.30 -0.70 -0.23 6.16 0.00 -0.50 0.19 119.26 125.47 1myf h ALA 71 Ca 0.31 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1myf h ALA 71 Cb -0.09 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1myf h ALA 71 CO -0.06 -0.79 0.16 1.25 0.00 0.00 0.00 179.25 179.80 1myf h LEU 72 N -0.90 0.25 0.22 0.00 5.85 -1.19 -2.39 115.31 117.14 1myf h LEU 72 Ca -0.07 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1myf h LEU 72 Cb 0.61 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1myf h LEU 72 CO 0.12 0.18 -0.11 1.23 -0.34 0.00 0.00 178.44 179.52 1myf h GLY 73 N 0.29 -0.31 0.46 3.75 0.00 0.42 -0.24 103.07 107.44 1myf h GLY 73 Ca 0.09 0.11 0.10 0.00 0.00 0.00 0.00 47.33 47.63 1myf h GLY 73 CO -0.02 -0.11 0.40 0.00 0.00 0.00 0.00 176.54 176.81 1myf h ALA 74 N 0.40 1.08 0.30 3.60 0.00 -0.65 0.25 119.26 124.24 1myf h ALA 74 Ca -0.03 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1myf h ALA 74 Cb 0.28 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1myf h ALA 74 CO 0.05 -0.00 -0.19 0.82 0.00 0.00 0.00 179.25 179.93 1myf h ILE 75 N 0.67 0.61 -0.41 0.00 2.04 -1.04 0.83 117.51 120.21 1myf h ILE 75 Ca 0.38 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.26 1myf h ILE 75 Cb 0.40 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1myf h ILE 75 CO -0.27 0.00 0.23 -0.07 0.00 0.00 0.00 178.15 178.04 1myf h LEU 76 N -0.47 0.35 -0.85 1.44 3.38 -0.47 -2.59 115.31 116.10 1myf h LEU 76 Ca -0.03 0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1myf h LEU 76 Cb 0.39 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 1myf h LEU 76 CO 0.03 0.25 0.54 0.50 0.09 0.00 0.00 178.44 179.85 1myf h LYS 77 N 0.46 1.00 0.00 1.13 1.63 -0.11 -0.06 116.57 120.62 1myf h LYS 77 Ca 0.17 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 1myf h LYS 77 Cb 0.04 -0.23 0.00 0.00 -0.60 0.00 0.00 32.23 31.44 1myf h LYS 77 CO -0.10 0.66 0.00 1.63 -3.45 0.00 0.00 179.45 178.20 1myf n LYS 78 N -4.57 0.57 -3.87 1.90 5.02 0.25 -4.90 118.16 112.55 1myf n LYS 78 Ca 0.11 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.12 1myf n LYS 78 Cb 0.11 -1.21 -0.03 0.00 -0.02 0.00 0.00 35.03 33.89 1myf n LYS 78 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1myf n LYS 79 N -0.71 -0.70 0.00 1.97 2.85 -0.04 -1.00 118.16 120.54 1myf n LYS 79 Ca 0.06 -0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 1myf n LYS 79 Cb 0.03 -1.89 0.00 0.00 -0.65 0.00 0.00 35.03 32.52 1myf n LYS 79 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1myf n GLY 80 N -1.91 1.94 2.61 2.58 0.00 -1.26 -5.00 105.19 104.15 1myf n GLY 80 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1myf n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1myf n HIS 81 N -0.28 2.93 0.00 1.61 8.25 -0.17 -4.87 115.22 122.69 1myf n HIS 81 Ca 0.00 -2.94 0.00 0.00 -0.26 0.00 0.00 57.72 54.52 1myf n HIS 81 Cb 0.00 -2.27 0.00 0.00 1.12 0.00 0.00 29.99 28.84 1myf n HIS 81 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1myf n HIS 82 N 4.14 0.00 -1.57 4.41 8.25 -1.26 -0.70 115.22 128.50 1myf n HIS 82 Ca 0.58 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.85 1myf n HIS 82 Cb 0.32 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.35 1myf n HIS 82 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1myf n GLU 83 N 0.00 -1.30 0.00 -0.41 2.13 -1.26 -1.62 120.64 118.17 1myf n GLU 83 Ca 0.00 1.15 0.00 0.00 0.66 0.00 0.00 57.16 58.97 1myf n GLU 83 Cb 0.00 -5.45 0.00 0.00 0.27 0.00 0.00 31.44 26.26 1myf n GLU 83 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1myf n ALA 84 N 1.23 0.00 0.07 4.31 0.00 0.13 -4.10 120.51 122.15 1myf n ALA 84 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1myf n ALA 84 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1myf n ALA 84 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1myf n GLU 85 N -1.00 0.00 0.00 0.00 1.02 -0.64 -5.05 120.64 114.97 1myf n GLU 85 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1myf n GLU 85 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1myf n GLU 85 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1myf n LEU 86 N -2.89 0.00 -0.13 -4.62 0.00 -0.99 -4.82 117.00 103.55 1myf n LEU 86 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 56.01 55.99 1myf n LEU 86 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 43.42 43.41 1myf n LEU 86 CO 0.00 0.00 0.17 0.29 0.00 0.00 0.00 177.39 177.85 1myf n LYS 87 N 0.00 -0.11 -0.30 1.96 5.02 -1.26 0.05 118.16 123.53 1myf n LYS 87 Ca 0.00 0.49 0.01 0.00 -2.02 0.00 0.00 58.31 56.79 1myf n LYS 87 Cb 0.00 -0.72 0.21 0.00 -0.02 0.00 0.00 35.03 34.50 1myf n LYS 87 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1myf h PRO 88 N 0.00 1.08 -0.11 1.97 0.11 -1.99 0.22 132.00 133.28 1myf h PRO 88 Ca 0.08 -0.06 -0.23 0.00 0.11 0.00 0.00 66.00 65.90 1myf h PRO 88 Cb 0.16 -0.24 0.01 0.00 0.11 0.00 0.00 31.00 31.04 1myf h PRO 88 CO -0.31 0.71 -0.83 1.25 -0.21 0.00 0.00 178.00 178.62 1myf h LEU 89 N 1.11 0.86 -0.30 2.35 6.46 -0.79 -1.88 115.31 123.13 1myf h LEU 89 Ca 0.35 -0.59 0.03 0.00 -0.12 0.00 0.00 57.88 57.55 1myf h LEU 89 Cb 0.02 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.66 1myf h LEU 89 CO -0.10 1.39 0.11 0.00 -0.62 0.00 0.00 178.44 179.21 1myf h ALA 90 N 0.59 0.34 -0.24 1.25 0.00 -0.49 -1.90 119.26 118.81 1myf h ALA 90 Ca -0.07 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.93 1myf h ALA 90 Cb 1.46 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.21 1myf h ALA 90 CO 0.16 -0.30 -0.06 0.37 0.00 0.00 0.00 179.25 179.43 1myf h GLN 91 N 0.24 -0.00 0.77 0.00 4.15 -0.45 0.38 115.11 120.19 1myf h GLN 91 Ca 0.13 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.52 1myf h GLN 91 Cb 0.10 0.00 0.01 0.00 0.21 0.00 0.00 27.48 27.80 1myf h GLN 91 CO -0.14 -0.00 -0.38 0.66 -1.93 0.00 0.00 178.83 177.04 1myf h SER 92 N -0.00 -0.90 0.11 -0.69 4.64 -1.14 0.25 113.55 115.82 1myf h SER 92 Ca 0.11 0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1myf h SER 92 Cb 0.18 0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1myf h SER 92 CO -0.24 -0.64 -0.01 0.45 -0.87 0.00 0.00 176.83 175.52 1myf h HIS 93 N -1.05 0.00 0.03 4.77 3.86 -1.21 0.12 115.15 121.67 1myf h HIS 93 Ca -0.11 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.10 1myf h HIS 93 Cb 0.81 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.28 1myf h HIS 93 CO -0.03 0.01 -0.01 0.00 0.86 0.00 0.00 177.93 178.76 1myf h ALA 94 N 1.99 -0.32 -0.20 2.45 0.00 0.16 -3.20 119.26 120.13 1myf h ALA 94 Ca -0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1myf h ALA 94 Cb 0.07 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1myf h ALA 94 CO 0.00 -0.32 -0.29 1.79 0.00 0.00 0.00 179.25 180.43 1myf h THR 95 N -0.10 1.33 0.00 0.00 1.35 -0.77 -2.03 112.91 112.69 1myf h THR 95 Ca -0.00 -1.50 -0.38 0.00 -0.55 0.00 0.00 66.41 63.97 1myf h THR 95 Cb 0.03 1.84 -0.07 0.00 -1.73 0.00 0.00 68.15 68.22 1myf h THR 95 CO 0.01 0.46 -2.43 0.29 -0.25 0.00 0.00 175.52 173.60 1myf n LYS 96 N -4.35 0.64 0.00 4.72 5.02 0.34 -4.60 118.16 119.94 1myf n LYS 96 Ca -0.06 0.13 0.10 0.00 -2.02 0.00 0.00 58.31 56.47 1myf n LYS 96 Cb 0.47 -1.51 0.59 0.00 -0.02 0.00 0.00 35.03 34.56 1myf n LYS 96 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1myf n HIS 97 N -3.20 0.00 -0.22 2.13 8.25 -0.81 -4.82 115.22 116.55 1myf n HIS 97 Ca -0.44 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.02 1myf n HIS 97 Cb 0.99 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.10 1myf n HIS 97 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1myf n LYS 98 N -0.82 0.00 0.00 -0.41 3.00 -1.24 -4.97 118.16 113.72 1myf n LYS 98 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.46 1myf n LYS 98 Cb 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 35.03 34.84 1myf n LYS 98 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1myf n ILE 99 N -0.16 0.00 -1.56 3.15 5.41 -0.76 -4.83 119.36 120.61 1myf n ILE 99 Ca 0.00 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.33 1myf n ILE 99 Cb 0.06 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.00 1myf n ILE 99 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1myf n PRO 100 N 0.00 1.12 -0.04 0.38 -0.04 -1.26 -4.55 135.00 130.61 1myf n PRO 100 Ca 0.00 0.40 -0.01 0.00 -0.04 0.00 0.00 63.50 63.85 1myf n PRO 100 Cb 0.00 -1.85 -0.01 0.00 -0.04 0.00 0.00 33.50 31.60 1myf n PRO 100 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1myf n ILE 101 N -0.47 -0.07 0.00 0.52 -0.00 -1.26 -4.44 119.36 113.64 1myf n ILE 101 Ca 0.10 1.54 0.00 0.00 -0.00 0.00 0.00 62.75 64.39 1myf n ILE 101 Cb 0.38 -2.03 0.00 0.00 -0.00 0.00 0.00 39.64 37.98 1myf n ILE 101 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1myf n LYS 102 N -3.20 0.00 -0.19 0.38 4.81 -1.26 -0.79 118.16 117.91 1myf n LYS 102 Ca 0.00 0.00 0.23 0.00 -0.87 0.00 0.00 58.31 57.67 1myf n LYS 102 Cb 0.03 0.00 0.61 0.00 0.02 0.00 0.00 35.03 35.69 1myf n LYS 102 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 1myf h TYR 103 N 0.00 0.27 0.00 5.64 0.05 -1.98 0.10 116.97 121.05 1myf h TYR 103 Ca 0.00 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.75 1myf h TYR 103 Cb 0.00 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.65 1myf h TYR 103 CO 0.00 0.07 -0.18 -0.07 -1.05 0.00 0.00 178.16 176.93 1myf h LEU 104 N 0.20 0.00 -0.46 3.88 3.38 -1.30 0.90 115.31 121.91 1myf h LEU 104 Ca 0.43 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.23 1myf h LEU 104 Cb 1.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 1myf h LEU 104 CO -0.09 0.18 -0.68 -0.33 0.09 0.00 0.00 178.44 177.61 1myf h GLU 105 N 0.00 0.41 -0.37 1.13 5.08 -1.04 0.95 114.58 120.74 1myf h GLU 105 Ca -0.00 -0.31 -0.05 0.00 -1.00 0.00 0.00 59.36 57.99 1myf h GLU 105 Cb 0.47 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1myf h GLU 105 CO 0.02 0.94 0.03 0.74 -1.00 0.00 0.00 179.01 179.74 1myf h PHE 106 N 0.29 0.68 0.00 4.33 0.04 -0.93 -0.95 116.94 120.40 1myf h PHE 106 Ca -0.02 -0.11 -0.07 0.00 2.80 0.00 0.00 57.97 60.57 1myf h PHE 106 Cb 1.24 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 39.19 1myf h PHE 106 CO 0.04 0.71 -0.34 0.97 -0.60 0.00 0.00 178.31 179.09 1myf h ILE 107 N 0.46 1.22 -0.06 -0.55 2.10 -0.72 -0.39 117.51 119.57 1myf h ILE 107 Ca 0.11 -1.19 0.01 0.00 1.08 0.00 0.00 64.86 64.87 1myf h ILE 107 Cb 0.42 1.65 -0.01 0.00 -1.09 0.00 0.00 36.82 37.79 1myf h ILE 107 CO 0.01 0.34 -0.02 0.28 -1.08 0.00 0.00 178.15 177.69 1myf h SER 108 N 0.00 -0.06 -0.43 2.19 0.02 -0.45 0.15 113.55 114.98 1myf h SER 108 Ca -0.00 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.02 1myf h SER 108 Cb 0.62 0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.15 1myf h SER 108 CO 0.04 -0.02 0.15 -0.08 -1.14 0.00 0.00 176.83 175.78 1myf h GLU 109 N 0.00 0.31 -0.08 3.45 4.57 -0.71 -0.06 114.58 122.05 1myf h GLU 109 Ca 0.03 -0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.22 1myf h GLU 109 Cb 0.04 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.53 1myf h GLU 109 CO -0.06 0.20 -0.14 0.00 -1.18 0.00 0.00 179.01 177.83 1myf h ALA 110 N 1.28 -0.10 -0.25 2.92 0.00 -0.67 0.11 119.26 122.55 1myf h ALA 110 Ca 0.20 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.20 1myf h ALA 110 Cb 0.19 0.27 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 1myf h ALA 110 CO -0.20 -0.61 -0.24 0.82 0.00 0.00 0.00 179.25 179.02 1myf h ILE 111 N -0.20 0.40 -0.57 0.00 2.04 -0.27 0.10 117.51 119.02 1myf h ILE 111 Ca 0.08 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.97 1myf h ILE 111 Cb 0.30 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.74 1myf h ILE 111 CO -0.20 0.00 0.33 0.40 0.00 0.00 0.00 178.15 178.69 1myf h ILE 112 N -0.24 1.03 0.32 -0.67 1.08 -0.59 -0.22 117.51 118.23 1myf h ILE 112 Ca 0.14 -0.22 -0.00 0.00 -0.39 0.00 0.00 64.86 64.38 1myf h ILE 112 Cb 0.45 0.32 -0.02 0.00 -3.07 0.00 0.00 36.82 34.51 1myf h ILE 112 CO -0.39 0.12 -0.27 -0.74 -0.69 0.00 0.00 178.15 176.18 1myf h HIS 113 N 0.65 -0.72 -0.26 1.37 2.76 0.60 0.45 115.15 120.00 1myf h HIS 113 Ca 0.24 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.42 1myf h HIS 113 Cb 0.07 0.27 -0.02 0.00 1.55 0.00 0.00 27.41 29.28 1myf h HIS 113 CO -0.07 -0.40 0.16 0.28 -1.30 0.00 0.00 177.93 176.60 1myf h VAL 114 N -0.61 1.04 0.12 5.26 2.07 -0.38 0.65 116.25 124.40 1myf h VAL 114 Ca -0.02 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.40 1myf h VAL 114 Cb 0.54 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 1myf h VAL 114 CO -0.02 0.06 -0.26 -0.07 0.02 0.00 0.00 177.57 177.29 1myf h LEU 115 N 0.33 -0.75 -1.03 2.57 3.38 -0.91 0.98 115.31 119.88 1myf h LEU 115 Ca 0.10 0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1myf h LEU 115 Cb -0.01 0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 1myf h LEU 115 CO -0.04 -0.35 0.63 -0.74 0.09 0.00 0.00 178.44 178.02 1myf h HIS 116 N -0.48 1.22 -0.16 1.13 2.76 -0.59 0.24 115.15 119.28 1myf h HIS 116 Ca 0.03 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.20 1myf h HIS 116 Cb 0.50 -0.41 -0.01 0.00 1.55 0.00 0.00 27.41 29.04 1myf h HIS 116 CO -0.24 0.78 0.01 0.77 -1.30 0.00 0.00 177.93 177.94 1myf h SER 117 N 1.31 0.27 0.81 3.26 0.02 -0.32 -3.02 113.55 115.87 1myf h SER 117 Ca 0.35 -0.30 -0.24 0.00 -0.84 0.00 0.00 61.79 60.76 1myf h SER 117 Cb -0.14 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 1myf h SER 117 CO -0.07 0.50 -1.19 0.03 -1.14 0.00 0.00 176.83 174.96 1myf h ARG 118 N 0.03 0.08 -1.78 3.45 3.08 -0.68 -3.40 114.38 115.17 1myf h ARG 118 Ca 0.05 -0.14 -0.54 0.00 0.07 0.00 0.00 59.98 59.42 1myf h ARG 118 Cb 0.36 0.05 -0.41 0.00 0.08 0.00 0.00 29.97 30.05 1myf h ARG 118 CO 0.01 1.00 -0.84 0.72 -1.07 0.00 0.00 179.97 179.78 1myf n HIS 119 N -3.36 2.79 -1.04 3.04 8.25 0.85 -5.08 115.22 120.67 1myf n HIS 119 Ca -0.05 -3.48 -0.29 0.00 -0.26 0.00 0.00 57.72 53.64 1myf n HIS 119 Cb 0.98 -0.32 0.20 0.00 1.12 0.00 0.00 29.99 31.97 1myf n HIS 119 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1myf s PRO 120 N -3.28 -0.07 0.00 -0.41 0.04 -1.14 -0.85 135.00 129.28 1myf s PRO 120 Ca 0.44 0.49 0.00 0.00 0.04 0.00 0.00 61.00 61.97 1myf s PRO 120 Cb 0.36 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 33.22 1myf s PRO 120 CO -0.12 -3.07 0.00 0.41 0.04 0.00 0.00 177.00 174.26 1myf n GLY 121 N -0.70 1.42 0.11 0.56 0.00 -1.26 -4.19 105.19 101.13 1myf n GLY 121 Ca 0.05 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 45.90 1myf n GLY 121 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1myf h ASP 122 N 0.00 0.23 -0.04 1.61 2.03 -2.00 -3.38 116.42 114.87 1myf h ASP 122 Ca 0.00 -0.49 -0.70 0.00 -0.73 0.00 0.00 57.03 55.11 1myf h ASP 122 Cb 0.00 -0.08 -0.03 0.00 -0.83 0.00 0.00 39.33 38.40 1myf h ASP 122 CO 0.00 1.44 3.26 0.33 -1.03 0.00 0.00 179.24 183.24 1myf n PHE 123 N -3.29 3.28 -2.64 4.15 7.35 -0.03 -4.72 117.46 121.56 1myf n PHE 123 Ca -0.23 -3.00 -0.12 0.00 -0.76 0.00 0.00 57.45 53.34 1myf n PHE 123 Cb 1.05 -2.53 0.06 0.00 0.35 0.00 0.00 39.48 38.41 1myf n PHE 123 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1myf n GLY 124 N 3.94 1.13 0.32 7.13 0.00 -1.26 -4.68 105.19 111.78 1myf n GLY 124 Ca 0.57 -2.06 -0.01 0.00 0.00 0.00 0.00 46.02 44.52 1myf n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1myf n ALA 125 N -2.84 -0.12 -0.13 4.61 0.00 -1.26 -0.56 120.51 120.21 1myf n ALA 125 Ca -0.09 0.83 -0.08 0.00 0.00 0.00 0.00 53.44 54.10 1myf n ALA 125 Cb 0.33 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.41 1myf n ALA 125 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1myf h ASP 126 N 0.00 0.48 0.50 0.00 2.03 -1.94 0.96 116.42 118.45 1myf h ASP 126 Ca 0.29 -0.05 -0.02 0.00 -0.73 0.00 0.00 57.03 56.52 1myf h ASP 126 Cb 0.50 -0.12 0.00 0.00 -0.83 0.00 0.00 39.33 38.88 1myf h ASP 126 CO -0.83 0.39 -0.24 0.00 -1.03 0.00 0.00 179.24 177.53 1myf h ALA 127 N 1.12 -0.67 -0.87 4.15 0.00 -1.11 -0.88 119.26 121.00 1myf h ALA 127 Ca 0.15 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.95 1myf h ALA 127 Cb -0.01 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 17.97 1myf h ALA 127 CO -0.03 -0.74 0.53 -0.56 0.00 0.00 0.00 179.25 178.44 1myf h GLN 128 N -0.93 0.89 -0.76 0.00 3.07 -0.99 0.15 115.11 116.54 1myf h GLN 128 Ca -0.07 -0.05 -0.02 0.00 0.09 0.00 0.00 58.65 58.60 1myf h GLN 128 Cb 0.60 -0.20 -0.04 0.00 0.08 0.00 0.00 27.48 27.92 1myf h GLN 128 CO 0.11 0.59 0.39 0.78 0.09 0.00 0.00 178.83 180.79 1myf h GLY 129 N 0.92 1.14 0.50 0.06 0.00 -0.77 0.13 103.07 105.05 1myf h GLY 129 Ca 0.40 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 1myf h GLY 129 CO -0.21 0.50 -0.01 0.00 0.00 0.00 0.00 176.54 176.82 1myf h ALA 130 N 1.37 -0.02 -0.12 3.60 0.00 0.56 -0.08 119.26 124.56 1myf h ALA 130 Ca 0.27 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1myf h ALA 130 Cb 0.06 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1myf h ALA 130 CO -0.04 -0.26 -0.05 1.98 0.00 0.00 0.00 179.25 180.88 1myf h MET 131 N -0.52 -0.02 -0.30 0.00 -1.53 -0.72 0.55 114.93 112.38 1myf h MET 131 Ca -0.00 0.00 0.06 0.00 -3.44 0.00 0.00 59.70 56.32 1myf h MET 131 Cb 0.50 0.01 -0.05 0.00 -0.55 0.00 0.00 31.60 31.50 1myf h MET 131 CO 0.00 -0.02 -0.06 -0.97 0.14 0.00 0.00 176.91 176.01 1myf h ASN 132 N -0.02 -0.24 -0.44 1.39 -1.24 -0.71 0.14 115.58 114.45 1myf h ASN 132 Ca 0.07 0.09 0.05 0.00 0.71 0.00 0.00 56.30 57.21 1myf h ASN 132 Cb 0.12 0.17 -0.05 0.00 0.73 0.00 0.00 38.32 39.30 1myf h ASN 132 CO -0.14 -0.08 0.17 0.11 -1.29 0.00 0.00 177.43 176.19 1myf h LYS 133 N 0.02 0.34 -0.52 6.67 1.57 -0.68 0.11 116.57 124.07 1myf h LYS 133 Ca 0.14 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.93 1myf h LYS 133 Cb 0.21 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 1myf h LYS 133 CO -0.29 0.22 0.31 0.00 -0.57 0.00 0.00 179.45 179.12 1myf h ALA 134 N 1.27 0.67 -0.72 3.86 0.00 0.08 0.17 119.26 124.58 1myf h ALA 134 Ca 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1myf h ALA 134 Cb 0.18 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1myf h ALA 134 CO -0.19 0.01 0.44 -0.07 0.00 0.00 0.00 179.25 179.44 1myf h LEU 135 N 0.61 0.86 -0.39 0.00 -0.00 -0.22 -0.14 115.31 116.02 1myf h LEU 135 Ca 0.21 -0.06 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 1myf h LEU 135 Cb 0.03 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.45 1myf h LEU 135 CO -0.10 0.66 0.25 -0.33 -0.00 0.00 0.00 178.44 178.93 1myf h GLU 136 N 0.98 0.53 -0.45 1.13 5.08 0.17 0.96 114.58 122.97 1myf h GLU 136 Ca 0.26 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.64 1myf h GLU 136 Cb -0.05 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.04 1myf h GLU 136 CO -0.05 0.37 0.17 -0.07 -1.00 0.00 0.00 179.01 178.43 1myf h LEU 137 N 0.53 0.20 0.24 1.33 3.38 -0.25 0.20 115.31 120.94 1myf h LEU 137 Ca 0.14 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1myf h LEU 137 Cb -0.03 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1myf h LEU 137 CO -0.03 0.15 -0.24 0.15 0.09 0.00 0.00 178.44 178.56 1myf h PHE 138 N 0.36 -0.63 -0.58 1.13 3.57 0.08 0.35 116.94 121.21 1myf h PHE 138 Ca 0.21 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.80 1myf h PHE 138 Cb 0.19 0.25 -0.07 0.00 2.79 0.00 0.00 35.95 39.11 1myf h PHE 138 CO -0.14 -0.35 0.21 0.00 -2.23 0.00 0.00 178.31 175.79 1myf h ARG 139 N -0.51 0.38 -0.47 1.11 3.08 -0.58 -0.34 114.38 117.05 1myf h ARG 139 Ca -0.00 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1myf h ARG 139 Cb 0.48 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1myf h ARG 139 CO -0.05 0.25 0.12 -0.22 -1.07 0.00 0.00 179.97 179.00 1myf h LYS 140 N 0.39 0.70 -0.18 0.04 3.11 -0.16 0.50 116.57 120.97 1myf h LYS 140 Ca 0.29 -0.13 -0.04 0.00 -2.81 0.00 0.00 60.65 57.96 1myf h LYS 140 Cb 0.34 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.45 1myf h LYS 140 CO -0.29 0.64 -0.06 0.22 -2.81 0.00 0.00 179.45 177.15 1myf h ASP 141 N 0.69 0.36 -0.71 4.20 3.58 0.12 -0.09 116.42 124.56 1myf h ASP 141 Ca 0.16 -0.38 0.03 0.00 0.42 0.00 0.00 57.03 57.25 1myf h ASP 141 Cb 0.25 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.15 1myf h ASP 141 CO -0.00 0.66 0.45 0.40 -2.88 0.00 0.00 179.24 177.86 1myf h ILE 142 N 0.06 1.09 -0.39 2.25 2.04 -0.80 0.18 117.51 121.94 1myf h ILE 142 Ca 0.04 -0.30 0.05 0.00 1.00 0.00 0.00 64.86 65.65 1myf h ILE 142 Cb 0.51 0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 36.70 1myf h ILE 142 CO 0.02 0.16 0.14 0.00 0.00 0.00 0.00 178.15 178.47 1myf h ALA 143 N 1.31 0.47 -0.58 1.87 0.00 -0.56 0.31 119.26 122.07 1myf h ALA 143 Ca 0.29 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1myf h ALA 143 Cb 0.02 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1myf h ALA 143 CO -0.11 -0.25 0.32 0.00 0.00 0.00 0.00 179.25 179.21 1myf h ALA 144 N 1.25 0.75 -0.59 0.00 0.00 -0.20 -2.49 119.26 117.98 1myf h ALA 144 Ca 0.18 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1myf h ALA 144 Cb 0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1myf h ALA 144 CO -0.18 0.27 0.25 0.87 0.00 0.00 0.00 179.25 180.47 1myf h LYS 145 N 0.79 0.85 0.00 0.00 6.56 0.30 -0.08 116.57 124.99 1myf h LYS 145 Ca 0.21 -0.12 -0.02 0.00 -1.06 0.00 0.00 60.65 59.66 1myf h LYS 145 Cb 0.06 -0.15 -0.00 0.00 -0.57 0.00 0.00 32.23 31.56 1myf h LYS 145 CO -0.03 0.68 -0.08 1.88 -2.06 0.00 0.00 179.45 179.84 1myf h TYR 146 N 0.84 0.00 0.03 -1.35 -1.99 -0.00 0.13 116.97 114.63 1myf h TYR 146 Ca 0.20 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.93 1myf h TYR 146 Cb 0.14 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.87 1myf h TYR 146 CO 0.01 0.08 -0.01 0.87 -0.00 0.00 0.00 178.16 179.11 1myf h LYS 147 N 0.00 -0.04 -0.52 4.88 1.57 -0.65 0.32 116.57 122.13 1myf h LYS 147 Ca -0.00 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.89 1myf h LYS 147 Cb 0.16 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.39 1myf h LYS 147 CO 0.01 0.61 -0.06 0.93 -0.57 0.00 0.00 179.45 180.37 1myf h GLU 148 N -0.76 0.05 0.00 3.15 5.08 -0.27 0.77 114.58 122.61 1myf h GLU 148 Ca -0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1myf h GLU 148 Cb 0.67 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1myf h GLU 148 CO 0.01 0.04 0.00 1.28 -1.00 0.00 0.00 179.01 179.33 1myf n LEU 149 N -5.31 0.00 -1.23 1.33 4.77 0.38 -4.90 117.00 112.05 1myf n LEU 149 Ca 0.06 0.33 -0.01 0.00 -0.03 0.00 0.00 56.01 56.35 1myf n LEU 149 Cb 0.28 -0.33 0.01 0.00 -2.33 0.00 0.00 43.42 41.06 1myf n LEU 149 CO 0.12 -0.14 0.01 0.61 -1.33 0.00 0.00 177.39 176.66 1myf n GLY 150 N 0.18 0.39 1.30 -0.72 0.00 0.27 -5.01 105.19 101.59 1myf n GLY 150 Ca 0.07 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1myf n GLY 150 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1myf n TYR 151 N -1.28 -0.41 0.27 1.61 4.02 0.94 -4.83 117.16 117.48 1myf n TYR 151 Ca -0.02 0.07 0.16 0.00 -0.01 0.00 0.00 57.90 58.10 1myf n TYR 151 Cb 0.51 0.15 0.68 0.00 -0.02 0.00 0.00 39.34 40.67 1myf n TYR 151 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1myf h GLN 152 N 0.00 0.00 0.00 -0.72 1.08 -1.34 -3.47 115.11 110.66 1myf h GLN 152 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1myf h GLN 152 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1myf h GLN 152 CO 0.00 0.04 0.00 0.41 -0.95 0.00 0.00 178.83 178.33