#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 5.19 0.88 6.55 1.43 -1.26 -5.02 118.68 126.45 1myf s LEU 2 Ca 0.00 -3.15 -0.12 0.00 -1.03 0.00 0.00 54.13 49.83 1myf s LEU 2 Cb 0.00 -1.83 0.12 0.00 0.03 0.00 0.00 46.19 44.51 1myf s LEU 2 CO 0.00 -0.29 1.10 -0.44 0.23 0.00 0.00 176.35 176.95 1myf s SER 3 N 0.23 3.71 0.28 2.29 0.01 -1.26 -4.70 113.70 114.26 1myf s SER 3 Ca 0.20 1.27 0.02 0.00 1.31 0.00 0.00 55.95 58.75 1myf s SER 3 Cb -0.17 -1.95 0.66 0.00 0.21 0.00 0.00 66.02 64.77 1myf s SER 3 CO -0.06 -2.46 1.71 -0.33 0.41 0.00 0.00 173.24 172.51 1myf h GLU 4 N -1.43 0.41 0.04 12.44 4.39 -1.98 -0.53 114.58 127.93 1myf h GLU 4 Ca -0.50 -0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.21 1myf h GLU 4 Cb 1.29 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.80 1myf h GLU 4 CO 0.58 0.27 -0.38 0.78 -1.16 0.00 0.00 179.01 179.11 1myf h GLY 5 N 0.43 -0.69 0.57 -3.84 0.00 -1.99 0.25 103.07 97.79 1myf h GLY 5 Ca 0.52 0.45 0.09 0.00 0.00 0.00 0.00 47.33 48.40 1myf h GLY 5 CO -0.50 -0.25 0.49 0.83 0.00 0.00 0.00 176.54 177.11 1myf h GLU 6 N -0.56 0.81 -0.90 4.80 3.07 -1.60 0.48 114.58 120.68 1myf h GLU 6 Ca 0.05 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 1myf h GLU 6 Cb 0.62 -0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 28.31 1myf h GLU 6 CO -0.27 0.54 0.49 -1.49 -1.40 0.00 0.00 179.01 176.88 1myf h TRP 7 N 0.83 1.24 -0.71 4.33 -0.00 -0.25 -0.24 115.95 121.15 1myf h TRP 7 Ca 0.39 -0.03 -0.06 0.00 -0.00 0.00 0.00 58.89 59.20 1myf h TRP 7 Cb 0.32 -0.40 -0.03 0.00 -0.00 0.00 0.00 29.16 29.06 1myf h TRP 7 CO -0.05 0.86 0.22 1.96 -0.00 0.00 0.00 178.44 181.42 1myf h GLN 8 N 1.27 1.10 0.07 0.49 1.08 0.14 0.96 115.11 120.22 1myf h GLN 8 Ca 0.32 -0.24 0.01 0.00 -1.45 0.00 0.00 58.65 57.29 1myf h GLN 8 Cb 0.03 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 1myf h GLN 8 CO -0.05 0.95 -0.11 -0.07 -0.95 0.00 0.00 178.83 178.60 1myf h LEU 9 N 1.04 -0.29 0.11 1.46 -0.00 -0.56 0.23 115.31 117.30 1myf h LEU 9 Ca 0.23 0.04 0.02 0.00 -0.00 0.00 0.00 57.88 58.16 1myf h LEU 9 Cb 0.31 0.11 -0.05 0.00 -0.00 0.00 0.00 40.66 41.03 1myf h LEU 9 CO -0.01 -0.16 -0.40 0.58 -0.00 0.00 0.00 178.44 178.45 1myf h VAL 10 N -0.22 0.19 -0.31 1.22 2.07 -0.54 0.14 116.25 118.80 1myf h VAL 10 Ca 0.02 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 1myf h VAL 10 Cb 0.23 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 1myf h VAL 10 CO -0.06 0.00 0.07 -0.07 0.02 0.00 0.00 177.57 177.53 1myf h LEU 11 N -0.63 0.41 0.58 2.57 3.38 -0.72 0.45 115.31 121.36 1myf h LEU 11 Ca 0.03 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1myf h LEU 11 Cb 0.66 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.31 1myf h LEU 11 CO -0.24 0.43 -0.28 -0.74 0.09 0.00 0.00 178.44 177.70 1myf h HIS 12 N 0.45 -0.73 -0.69 1.13 2.76 0.50 0.21 115.15 118.79 1myf h HIS 12 Ca 0.11 -0.02 0.13 0.00 -2.20 0.00 0.00 60.37 58.39 1myf h HIS 12 Cb 0.18 0.24 -0.09 0.00 1.55 0.00 0.00 27.41 29.29 1myf h HIS 12 CO 0.01 -0.44 0.22 0.28 -1.30 0.00 0.00 177.93 176.69 1myf h VAL 13 N -0.80 0.65 -0.13 5.26 2.07 -0.54 0.17 116.25 122.92 1myf h VAL 13 Ca -0.08 -0.12 -0.11 0.00 0.82 0.00 0.00 66.70 67.21 1myf h VAL 13 Cb 0.61 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1myf h VAL 13 CO 0.13 0.07 -0.39 -0.25 0.02 0.00 0.00 177.57 177.15 1myf h TRP 14 N 0.36 0.34 -0.17 1.57 2.91 -0.48 0.40 115.95 120.88 1myf h TRP 14 Ca 0.37 -0.09 -0.05 0.00 1.13 0.00 0.00 58.89 60.25 1myf h TRP 14 Cb 0.56 -0.08 -0.00 0.00 -0.51 0.00 0.00 29.16 29.13 1myf h TRP 14 CO -0.21 0.64 -0.09 0.00 -1.03 0.00 0.00 178.44 177.76 1myf h ALA 15 N 1.35 0.24 0.00 2.65 0.00 0.09 -3.25 119.26 120.34 1myf h ALA 15 Ca 0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1myf h ALA 15 Cb 0.80 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1myf h ALA 15 CO 0.06 0.06 -0.02 -0.22 0.00 0.00 0.00 179.25 179.13 1myf h LYS 16 N 0.04 0.00 -0.68 0.00 1.63 0.95 0.24 116.57 118.74 1myf h LYS 16 Ca 0.04 0.00 0.20 0.00 -0.85 0.00 0.00 60.65 60.04 1myf h LYS 16 Cb 0.56 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.17 1myf h LYS 16 CO 0.03 0.02 0.69 0.28 -3.45 0.00 0.00 179.45 177.02 1myf h VAL 17 N 0.00 0.30 0.00 2.00 2.07 -0.31 -3.44 116.25 116.87 1myf h VAL 17 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1myf h VAL 17 Cb 0.34 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1myf h VAL 17 CO 0.00 0.00 0.00 1.21 0.02 0.00 0.00 177.57 178.80 1myf n GLU 18 N -3.69 0.00 -1.80 1.57 4.07 0.60 -4.23 120.64 117.16 1myf n GLU 18 Ca 0.14 0.00 -0.05 0.00 -0.06 0.00 0.00 57.16 57.19 1myf n GLU 18 Cb 0.93 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 32.30 1myf n GLU 18 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1myf n ALA 19 N -0.17 -0.48 -1.89 4.31 0.00 0.13 -4.80 120.51 117.60 1myf n ALA 19 Ca 0.00 0.06 -0.35 0.00 0.00 0.00 0.00 53.44 53.15 1myf n ALA 19 Cb 0.00 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 18.62 1myf n ALA 19 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1myf n ASP 20 N -0.59 7.24 -0.35 0.00 2.03 -1.26 -4.72 116.55 118.90 1myf n ASP 20 Ca -0.06 -3.40 0.09 0.00 0.52 0.00 0.00 54.79 51.94 1myf n ASP 20 Cb 0.36 -1.22 0.27 0.00 -0.72 0.00 0.00 41.12 39.80 1myf n ASP 20 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1myf h VAL 21 N 2.18 0.88 0.79 5.18 -1.51 -1.92 0.19 116.25 122.04 1myf h VAL 21 Ca 0.53 -0.32 -0.04 0.00 -1.23 0.00 0.00 66.70 65.65 1myf h VAL 21 Cb 0.40 -0.13 0.01 0.00 -2.13 0.00 0.00 31.29 29.44 1myf h VAL 21 CO 1.20 0.17 -0.38 0.00 -1.23 0.00 0.00 177.57 177.33 1myf h ALA 22 N 1.56 -1.21 0.03 5.19 0.00 -1.84 0.20 119.26 123.18 1myf h ALA 22 Ca 0.50 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1myf h ALA 22 Cb 0.58 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1myf h ALA 22 CO -0.28 -1.14 -0.01 0.78 0.00 0.00 0.00 179.25 178.60 1myf h GLY 23 N -1.12 -0.04 0.80 0.00 0.00 -1.81 0.75 103.07 101.65 1myf h GLY 23 Ca -0.11 0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.27 1myf h GLY 23 CO 0.18 -0.01 0.28 0.45 0.00 0.00 0.00 176.54 177.43 1myf h HIS 24 N -0.14 0.51 -0.24 5.60 3.86 -0.72 0.10 115.15 124.13 1myf h HIS 24 Ca -0.00 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.26 1myf h HIS 24 Cb 0.13 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.41 1myf h HIS 24 CO -0.04 0.27 0.04 0.78 0.86 0.00 0.00 177.93 179.84 1myf h GLY 25 N 0.55 0.26 1.00 2.45 0.00 -0.12 0.31 103.07 107.52 1myf h GLY 25 Ca 0.21 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.51 1myf h GLY 25 CO -0.12 -0.02 -0.25 -1.61 0.00 0.00 0.00 176.54 174.54 1myf h GLN 26 N 0.12 -0.67 -0.77 4.80 4.15 -0.05 -2.70 115.11 119.99 1myf h GLN 26 Ca 0.11 0.05 0.17 0.00 0.77 0.00 0.00 58.65 59.75 1myf h GLN 26 Cb 0.12 0.15 -0.12 0.00 0.21 0.00 0.00 27.48 27.84 1myf h GLN 26 CO -0.16 -0.44 0.18 0.22 -1.93 0.00 0.00 178.83 176.70 1myf h ASP 27 N -0.70 -0.00 -0.09 -0.69 3.58 -0.39 0.20 116.42 118.33 1myf h ASP 27 Ca -0.07 0.16 0.03 0.00 0.42 0.00 0.00 57.03 57.57 1myf h ASP 27 Cb 0.54 0.21 -0.04 0.00 1.72 0.00 0.00 39.33 41.76 1myf h ASP 27 CO 0.12 -0.06 -0.12 0.40 -2.88 0.00 0.00 179.24 176.69 1myf h ILE 28 N 0.26 0.66 -0.26 2.25 1.08 -0.09 0.17 117.51 121.57 1myf h ILE 28 Ca 0.44 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.86 1myf h ILE 28 Cb 0.78 0.66 -0.01 0.00 -3.07 0.00 0.00 36.82 35.19 1myf h ILE 28 CO -0.54 0.00 -0.03 -0.07 -0.69 0.00 0.00 178.15 176.81 1myf h LEU 29 N -0.17 0.48 -0.56 1.44 3.38 -0.93 0.17 115.31 119.13 1myf h LEU 29 Ca 0.07 -0.34 0.09 0.00 0.09 0.00 0.00 57.88 57.79 1myf h LEU 29 Cb 0.27 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.82 1myf h LEU 29 CO -0.19 0.71 0.18 0.40 0.09 0.00 0.00 178.44 179.63 1myf h ILE 30 N 0.25 0.76 0.44 1.22 2.04 -0.15 0.16 117.51 122.23 1myf h ILE 30 Ca 0.07 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.79 1myf h ILE 30 Cb 0.48 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1myf h ILE 30 CO 0.02 0.06 -0.21 -0.09 0.00 0.00 0.00 178.15 177.93 1myf h ARG 31 N 0.35 -0.57 0.01 2.37 2.43 -0.53 -2.34 114.38 116.10 1myf h ARG 31 Ca 0.28 0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.51 1myf h ARG 31 Cb 0.35 0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 29.97 1myf h ARG 31 CO -0.30 -0.28 -0.50 1.25 -1.51 0.00 0.00 179.97 178.62 1myf h LEU 32 N -0.81 -1.53 -0.44 3.80 7.12 -0.29 0.04 115.31 123.19 1myf h LEU 32 Ca -0.06 0.17 0.08 0.00 0.13 0.00 0.00 57.88 58.20 1myf h LEU 32 Cb 0.55 0.58 -0.07 0.00 -0.53 0.00 0.00 40.66 41.20 1myf h LEU 32 CO 0.10 -0.51 0.03 -0.26 -0.13 0.00 0.00 178.44 177.68 1myf h PHE 33 N -0.65 0.04 -0.47 1.25 0.04 -0.77 0.39 116.94 116.77 1myf h PHE 33 Ca 0.02 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.75 1myf h PHE 33 Cb 0.71 0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.89 1myf h PHE 33 CO -0.48 -0.06 -0.01 0.87 -0.60 0.00 0.00 178.31 178.03 1myf h LYS 34 N 0.15 0.79 -0.12 1.51 1.57 -1.06 -3.10 116.57 116.30 1myf h LYS 34 Ca 0.22 -0.21 -0.20 0.00 -1.87 0.00 0.00 60.65 58.59 1myf h LYS 34 Cb 0.31 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1myf h LYS 34 CO -0.34 0.80 -0.73 0.77 -0.57 0.00 0.00 179.45 179.38 1myf h SER 35 N 0.73 0.70 -3.16 0.86 0.02 0.05 -3.43 113.55 109.32 1myf h SER 35 Ca 0.14 -0.45 -0.49 0.00 -0.84 0.00 0.00 61.79 60.15 1myf h SER 35 Cb 0.46 -0.21 -0.40 0.00 0.14 0.00 0.00 62.40 62.39 1myf h SER 35 CO 0.02 1.22 -0.76 -1.00 -1.14 0.00 0.00 176.83 175.17 1myf s HIS 36 N -3.72 0.65 0.02 3.45 3.76 0.13 -5.04 115.29 114.54 1myf s HIS 36 Ca -0.08 -0.63 0.13 0.00 -0.15 0.00 0.00 55.06 54.33 1myf s HIS 36 Cb 0.10 -0.88 0.11 0.00 1.11 0.00 0.00 32.58 33.01 1myf s HIS 36 CO 0.87 -0.57 1.45 -1.00 -0.85 0.00 0.00 174.74 174.64 1myf h PRO 37 N 8.32 0.00 -0.61 8.40 0.13 -1.82 -3.28 132.00 143.14 1myf h PRO 37 Ca -0.16 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.92 1myf h PRO 37 Cb 1.13 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 1myf h PRO 37 CO 0.32 0.65 0.17 0.93 -0.23 0.00 0.00 178.00 179.84 1myf h GLU 38 N 0.00 0.97 -0.89 0.86 3.07 -1.96 -0.03 114.58 116.59 1myf h GLU 38 Ca -0.01 -0.22 0.04 0.00 -0.50 0.00 0.00 59.36 58.67 1myf h GLU 38 Cb 1.40 -0.13 -0.05 0.00 -0.84 0.00 0.00 28.75 29.13 1myf h GLU 38 CO 0.08 0.87 0.59 1.79 -1.40 0.00 0.00 179.01 180.94 1myf h THR 39 N 0.88 1.15 -0.01 1.13 1.35 -1.95 -1.73 112.91 113.74 1myf h THR 39 Ca 0.19 -0.38 -0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1myf h THR 39 Cb 0.32 -0.06 -0.00 0.00 -1.73 0.00 0.00 68.15 66.68 1myf h THR 39 CO -0.00 0.20 -0.01 0.25 -0.25 0.00 0.00 175.52 175.71 1myf h LEU 40 N 1.11 0.02 -1.21 3.87 7.12 -1.51 -3.11 115.31 121.60 1myf h LEU 40 Ca 0.36 -0.52 0.31 0.00 0.13 0.00 0.00 57.88 58.15 1myf h LEU 40 Cb 0.03 -0.00 -0.12 0.00 -0.53 0.00 0.00 40.66 40.03 1myf h LEU 40 CO -0.11 0.53 0.66 -0.08 -0.13 0.00 0.00 178.44 179.32 1myf h GLU 41 N -0.50 0.35 -0.00 1.25 4.81 -0.69 0.62 114.58 120.41 1myf h GLU 41 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1myf h GLU 41 Cb 0.53 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 1myf h GLU 41 CO 0.00 0.23 0.00 -0.22 -0.73 0.00 0.00 179.01 178.29 1myf h LYS 42 N 0.36 0.00 -6.30 1.92 1.63 -1.24 -3.42 116.57 109.51 1myf h LYS 42 Ca 0.68 0.00 -0.57 0.00 -0.85 0.00 0.00 60.65 59.91 1myf h LYS 42 Cb 1.68 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 33.26 1myf h LYS 42 CO -0.43 0.00 0.90 -0.06 -3.45 0.00 0.00 179.45 176.41 1myf s PHE 43 N -4.73 2.94 0.21 1.91 0.40 0.21 -4.92 117.98 114.00 1myf s PHE 43 Ca -0.05 1.06 -0.09 0.00 -0.60 0.00 0.00 56.93 57.25 1myf s PHE 43 Cb 0.16 -3.74 0.23 0.00 0.51 0.00 0.00 43.02 40.17 1myf s PHE 43 CO 0.58 -1.24 1.84 0.22 0.70 0.00 0.00 175.22 177.32 1myf h ASP 44 N 8.54 0.71 0.20 1.36 3.58 -1.87 0.26 116.42 129.21 1myf h ASP 44 Ca -0.23 0.01 -0.30 0.00 0.42 0.00 0.00 57.03 56.92 1myf h ASP 44 Cb 1.08 -0.14 0.03 0.00 1.72 0.00 0.00 39.33 42.02 1myf h ASP 44 CO 1.02 0.48 -1.29 0.03 -2.88 0.00 0.00 179.24 176.61 1myf h ARG 45 N 0.85 0.58 0.00 0.28 3.08 -1.96 -3.35 114.38 113.86 1myf h ARG 45 Ca 0.30 -0.82 0.00 0.00 0.07 0.00 0.00 59.98 59.53 1myf h ARG 45 Cb 0.08 0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.41 1myf h ARG 45 CO -0.13 1.38 -0.43 1.19 -1.07 0.00 0.00 179.97 180.90 1myf n PHE 46 N -3.75 0.14 -0.24 3.04 3.72 -0.99 -4.17 117.46 115.20 1myf n PHE 46 Ca -0.14 0.04 0.32 0.00 -0.05 0.00 0.00 57.45 57.62 1myf n PHE 46 Cb 1.01 -0.40 0.72 0.00 -0.94 0.00 0.00 39.48 39.88 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 0.00 0.00 -0.00 -1.08 3.64 -0.63 0.11 116.57 118.61 1myf h LYS 47 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1myf h LYS 47 Cb 0.56 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 1myf h LYS 47 CO 0.00 0.00 -0.04 -2.39 -2.27 0.00 0.00 179.45 174.75 1myf n HIS 48 N -4.00 0.00 -2.35 1.91 1.44 -1.26 -4.77 115.22 106.19 1myf n HIS 48 Ca 0.22 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.50 1myf n HIS 48 Cb 1.17 -0.39 -0.02 0.00 0.12 0.00 0.00 29.99 30.87 1myf n HIS 48 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1myf s LEU 49 N -2.82 3.88 -0.11 2.39 1.02 0.38 -4.91 118.68 118.51 1myf s LEU 49 Ca 0.20 1.31 -0.23 0.00 0.02 0.00 0.00 54.13 55.43 1myf s LEU 49 Cb 0.19 -3.54 -0.27 0.00 0.02 0.00 0.00 46.19 42.60 1myf s LEU 49 CO 0.51 -1.13 0.68 0.11 0.02 0.00 0.00 176.35 176.55 1myf h LYS 50 N 9.65 0.15 0.00 1.70 1.57 -1.88 -3.50 116.57 124.26 1myf h LYS 50 Ca -0.28 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1myf h LYS 50 Cb 1.11 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1myf h LYS 50 CO 1.03 1.12 0.00 -2.37 -0.57 0.00 0.00 179.45 178.66 1myf n THR 51 N -4.28 0.00 -0.99 -0.16 5.66 -1.26 -5.10 114.28 108.15 1myf n THR 51 Ca -0.18 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.52 1myf n THR 51 Cb 0.71 0.00 0.15 0.00 -1.55 0.00 0.00 70.33 69.64 1myf n THR 51 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1myf s GLU 52 N 0.77 1.13 0.00 1.09 2.56 -1.26 -2.46 118.70 120.53 1myf s GLU 52 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 54.97 56.07 1myf s GLU 52 Cb 0.00 -1.77 0.00 0.00 2.00 0.00 0.00 34.13 34.36 1myf s GLU 52 CO 0.00 -2.41 0.00 0.00 -0.56 0.00 0.00 175.26 172.29 1myf n ALA 53 N -4.04 0.00 0.08 6.30 0.00 -1.26 -4.40 120.51 117.20 1myf n ALA 53 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.40 1myf n ALA 53 Cb 0.54 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.90 1myf n ALA 53 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1myf h GLU 54 N 0.00 -0.22 -0.40 0.00 4.81 -1.97 0.66 114.58 117.46 1myf h GLU 54 Ca 0.00 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.33 1myf h GLU 54 Cb 0.00 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 29.35 1myf h GLU 54 CO 0.00 0.15 -0.18 0.52 -0.73 0.00 0.00 179.01 178.78 1myf h MET 55 N -0.66 -0.10 -0.77 1.92 2.86 -1.69 0.79 114.93 117.28 1myf h MET 55 Ca -0.02 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1myf h MET 55 Cb 0.48 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.13 1myf h MET 55 CO 0.04 -0.07 0.49 -0.22 1.06 0.00 0.00 176.91 178.22 1myf h LYS 56 N -0.10 1.03 -0.00 1.72 3.64 -1.83 -1.58 116.57 119.45 1myf h LYS 56 Ca 0.20 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1myf h LYS 56 Cb 0.40 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1myf h LYS 56 CO -0.46 0.70 -0.02 0.00 -2.27 0.00 0.00 179.45 177.40 1myf n ALA 57 N -2.32 2.54 -2.18 5.00 0.00 0.21 -4.73 120.51 119.02 1myf n ALA 57 Ca 0.07 -0.16 -0.35 0.00 0.00 0.00 0.00 53.44 53.00 1myf n ALA 57 Cb 0.03 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 17.97 1myf n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1myf s SER 58 N -2.53 5.51 0.38 0.00 0.15 0.16 -4.79 113.70 112.59 1myf s SER 58 Ca 0.30 -0.32 0.05 0.00 0.70 0.00 0.00 55.95 56.68 1myf s SER 58 Cb 0.20 -2.55 0.77 0.00 -1.71 0.00 0.00 66.02 62.74 1myf s SER 58 CO 0.46 -2.31 2.03 -0.33 1.20 0.00 0.00 173.24 174.29 1myf h GLU 59 N 12.42 0.66 -0.59 5.44 5.08 -1.87 0.67 114.58 136.39 1myf h GLU 59 Ca -0.09 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.15 1myf h GLU 59 Cb 1.08 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 1myf h GLU 59 CO 1.25 0.44 0.07 0.22 -1.00 0.00 0.00 179.01 179.99 1myf h ASP 60 N 0.68 0.97 -0.40 1.42 3.58 -1.97 0.14 116.42 120.84 1myf h ASP 60 Ca 0.20 -0.27 -0.00 0.00 0.42 0.00 0.00 57.03 57.37 1myf h ASP 60 Cb -0.03 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.74 1myf h ASP 60 CO -0.05 1.00 0.23 0.25 -2.88 0.00 0.00 179.24 177.79 1myf h LEU 61 N 0.90 0.48 -0.20 2.28 5.85 -1.48 0.24 115.31 123.38 1myf h LEU 61 Ca 0.18 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1myf h LEU 61 Cb 0.46 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1myf h LEU 61 CO 0.02 0.41 0.09 0.50 -0.34 0.00 0.00 178.44 179.12 1myf h LYS 62 N 0.52 0.20 -0.87 1.25 3.64 -0.46 0.19 116.57 121.04 1myf h LYS 62 Ca 0.14 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.56 1myf h LYS 62 Cb 0.02 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.74 1myf h LYS 62 CO -0.03 0.13 0.57 -0.22 -2.27 0.00 0.00 179.45 177.64 1myf h LYS 63 N 0.21 1.00 -0.19 1.90 3.64 -0.48 -0.53 116.57 122.10 1myf h LYS 63 Ca 0.08 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1myf h LYS 63 Cb 0.03 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 1myf h LYS 63 CO -0.06 0.66 0.05 1.25 -2.27 0.00 0.00 179.45 179.08 1myf h HIS 64 N 1.03 0.31 -0.79 1.91 2.76 0.12 -0.61 115.15 119.88 1myf h HIS 64 Ca 0.36 -0.03 0.17 0.00 -2.20 0.00 0.00 60.37 58.67 1myf h HIS 64 Cb 0.12 -0.09 -0.11 0.00 1.55 0.00 0.00 27.41 28.89 1myf h HIS 64 CO -0.00 0.40 0.28 0.78 -1.30 0.00 0.00 177.93 178.10 1myf h GLY 65 N 0.13 1.21 0.98 5.26 0.00 0.56 0.31 103.07 111.51 1myf h GLY 65 Ca 0.06 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 1myf h GLY 65 CO -0.00 -0.18 -0.32 -2.08 0.00 0.00 0.00 176.54 173.96 1myf h VAL 66 N 0.37 0.34 -0.57 4.60 2.07 -0.94 0.13 116.25 122.25 1myf h VAL 66 Ca 0.46 -0.05 0.11 0.00 0.82 0.00 0.00 66.70 68.04 1myf h VAL 66 Cb 0.78 0.36 -0.11 0.00 -1.52 0.00 0.00 31.29 30.80 1myf h VAL 66 CO -0.48 0.01 -0.16 0.74 0.02 0.00 0.00 177.57 177.70 1myf h THR 67 N -0.92 0.40 0.53 2.57 2.02 0.57 0.29 112.91 118.36 1myf h THR 67 Ca -0.09 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 1myf h THR 67 Cb 0.69 0.40 0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1myf h THR 67 CO 0.15 0.00 -0.25 0.58 0.37 0.00 0.00 175.52 176.36 1myf h VAL 68 N -0.02 0.24 -0.10 3.16 2.07 -0.35 -0.63 116.25 120.62 1myf h VAL 68 Ca 0.27 -0.45 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 1myf h VAL 68 Cb 0.43 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1myf h VAL 68 CO -0.60 0.04 -0.28 -0.07 0.02 0.00 0.00 177.57 176.68 1myf h LEU 69 N -1.07 0.19 -0.60 2.57 3.38 -0.62 -0.30 115.31 118.86 1myf h LEU 69 Ca -0.07 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.71 1myf h LEU 69 Cb 0.61 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1myf h LEU 69 CO 0.12 0.48 -0.27 0.74 0.09 0.00 0.00 178.44 179.59 1myf h THR 70 N 0.17 1.27 0.72 0.22 2.02 -0.44 0.38 112.91 117.25 1myf h THR 70 Ca 0.03 -1.41 -0.04 0.00 0.77 0.00 0.00 66.41 65.76 1myf h THR 70 Cb 0.60 1.26 0.01 0.00 -1.74 0.00 0.00 68.15 68.27 1myf h THR 70 CO 0.04 0.47 -0.35 0.00 0.37 0.00 0.00 175.52 176.06 1myf h ALA 71 N 0.99 -1.05 -0.65 6.16 0.00 -0.48 0.15 119.26 124.38 1myf h ALA 71 Ca 0.09 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.90 1myf h ALA 71 Cb 0.81 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 18.89 1myf h ALA 71 CO 0.07 -0.98 0.19 1.25 0.00 0.00 0.00 179.25 179.78 1myf h LEU 72 N -1.15 0.12 -0.75 0.00 5.85 -1.08 -0.70 115.31 117.59 1myf h LEU 72 Ca -0.10 0.11 0.09 0.00 0.84 0.00 0.00 57.88 58.82 1myf h LEU 72 Cb 0.74 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.82 1myf h LEU 72 CO 0.16 0.06 0.39 1.23 -0.34 0.00 0.00 178.44 179.94 1myf h GLY 73 N 0.34 1.13 1.24 3.75 0.00 -0.21 0.00 103.07 109.32 1myf h GLY 73 Ca 0.34 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.36 1myf h GLY 73 CO -0.39 0.09 0.18 0.00 0.00 0.00 0.00 176.54 176.42 1myf h ALA 74 N 1.43 1.14 0.36 3.60 0.00 0.73 0.21 119.26 126.74 1myf h ALA 74 Ca 0.36 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1myf h ALA 74 Cb 0.35 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1myf h ALA 74 CO -0.26 0.59 -0.17 0.82 0.00 0.00 0.00 179.25 180.23 1myf h ILE 75 N 0.92 0.65 -0.14 0.00 1.08 0.07 -1.12 117.51 118.97 1myf h ILE 75 Ca 0.20 -0.03 0.05 0.00 -0.39 0.00 0.00 64.86 64.69 1myf h ILE 75 Cb 0.29 0.66 -0.05 0.00 -3.07 0.00 0.00 36.82 34.65 1myf h ILE 75 CO -0.01 0.01 -0.21 -0.07 -0.69 0.00 0.00 178.15 177.18 1myf h LEU 76 N -0.50 -0.66 -1.23 1.44 3.38 -0.84 -2.65 115.31 114.25 1myf h LEU 76 Ca -0.05 0.11 0.12 0.00 0.09 0.00 0.00 57.88 58.15 1myf h LEU 76 Cb 0.38 0.30 -0.07 0.00 0.09 0.00 0.00 40.66 41.36 1myf h LEU 76 CO 0.08 -0.26 0.57 0.11 0.09 0.00 0.00 178.44 179.03 1myf h LYS 77 N -0.27 0.78 0.00 1.13 1.79 -0.23 -0.89 116.57 118.89 1myf h LYS 77 Ca 0.10 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1myf h LYS 77 Cb 0.42 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 1myf h LYS 77 CO -0.29 0.52 0.00 1.63 -1.08 0.00 0.00 179.45 180.22 1myf n LYS 78 N -4.55 0.32 -4.24 3.15 4.76 -0.45 -4.88 118.16 112.27 1myf n LYS 78 Ca 0.16 0.03 -0.35 0.00 -2.87 0.00 0.00 58.31 55.28 1myf n LYS 78 Cb 0.37 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 32.02 1myf n LYS 78 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1myf n LYS 79 N -1.05 -2.65 -0.50 1.97 5.02 -0.34 -0.65 118.16 119.96 1myf n LYS 79 Ca 0.08 0.32 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 1myf n LYS 79 Cb 0.05 -4.83 0.00 0.00 -0.02 0.00 0.00 35.03 30.23 1myf n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1myf n GLY 80 N -1.54 0.84 2.75 0.72 0.00 -1.26 -4.95 105.19 101.74 1myf n GLY 80 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 3.22 -4.31 1.61 8.25 0.18 -4.96 115.22 117.21 1myf n HIS 81 Ca 0.00 -2.93 -0.16 0.00 -0.26 0.00 0.00 57.72 54.36 1myf n HIS 81 Cb 0.00 -0.87 -0.10 0.00 1.12 0.00 0.00 29.99 30.14 1myf n HIS 81 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 1myf s HIS 82 N -3.96 1.50 0.00 4.41 -3.43 -1.26 -4.92 115.29 107.63 1myf s HIS 82 Ca 0.46 -0.90 0.00 0.00 -0.80 0.00 0.00 55.06 53.82 1myf s HIS 82 Cb 0.30 -0.85 0.00 0.00 -1.43 0.00 0.00 32.58 30.60 1myf s HIS 82 CO -0.21 -0.03 0.00 -0.85 -2.00 0.00 0.00 174.74 171.65 1myf n GLU 83 N -0.37 0.00 -0.31 -0.38 -0.00 -1.26 -5.00 120.64 113.32 1myf n GLU 83 Ca -0.06 0.00 0.02 0.00 -0.00 0.00 0.00 57.16 57.12 1myf n GLU 83 Cb 0.63 0.00 0.16 0.00 -0.00 0.00 0.00 31.44 32.24 1myf n GLU 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1myf h ALA 84 N 0.00 1.23 -0.41 -1.84 0.00 -2.01 -0.84 119.26 115.38 1myf h ALA 84 Ca 0.00 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1myf h ALA 84 Cb 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1myf h ALA 84 CO 0.00 0.22 -0.03 0.93 0.00 0.00 0.00 179.25 180.37 1myf h GLU 85 N 0.92 0.75 -0.13 0.00 3.07 -1.99 -3.28 114.58 113.92 1myf h GLU 85 Ca 0.40 -0.26 -0.03 0.00 -0.50 0.00 0.00 59.36 58.97 1myf h GLU 85 Cb 0.27 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.12 1myf h GLU 85 CO -0.21 0.85 -0.05 -0.07 -1.40 0.00 0.00 179.01 178.13 1myf h LEU 86 N 0.58 0.28 -0.68 1.33 3.38 -1.72 -3.28 115.31 115.20 1myf h LEU 86 Ca 0.11 -0.40 0.06 0.00 0.09 0.00 0.00 57.88 57.75 1myf h LEU 86 Cb 0.53 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 41.12 1myf h LEU 86 CO 0.03 0.61 -0.40 0.29 0.09 0.00 0.00 178.44 179.06 1myf n LYS 87 N -4.69 -0.30 0.13 1.13 5.02 -0.41 -0.08 118.16 118.96 1myf n LYS 87 Ca -0.06 1.22 -0.00 0.00 -2.02 0.00 0.00 58.31 57.44 1myf n LYS 87 Cb 0.27 -1.79 0.27 0.00 -0.02 0.00 0.00 35.03 33.76 1myf n LYS 87 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1myf h PRO 88 N 0.00 0.14 -0.34 1.97 0.13 -1.74 -0.47 132.00 131.68 1myf h PRO 88 Ca 0.11 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 65.12 1myf h PRO 88 Cb 0.28 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.39 1myf h PRO 88 CO -0.64 0.52 -0.03 1.25 -0.23 0.00 0.00 178.00 178.87 1myf h LEU 89 N 0.12 0.61 0.34 1.56 6.46 -1.13 0.15 115.31 123.41 1myf h LEU 89 Ca 0.01 -0.33 -0.01 0.00 -0.12 0.00 0.00 57.88 57.43 1myf h LEU 89 Cb 0.76 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.52 1myf h LEU 89 CO 0.06 0.79 -0.21 0.00 -0.62 0.00 0.00 178.44 178.46 1myf h ALA 90 N 0.84 -0.52 -0.60 1.25 0.00 -0.35 -1.01 119.26 118.87 1myf h ALA 90 Ca 0.09 -0.10 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1myf h ALA 90 Cb 0.49 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 18.45 1myf h ALA 90 CO 0.02 -0.81 0.05 0.37 0.00 0.00 0.00 179.25 178.88 1myf h GLN 91 N -0.53 0.16 0.72 0.00 4.15 -0.93 0.36 115.11 119.04 1myf h GLN 91 Ca -0.03 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.34 1myf h GLN 91 Cb 0.44 -0.04 0.01 0.00 0.21 0.00 0.00 27.48 28.10 1myf h GLN 91 CO 0.03 0.10 -0.35 0.66 -1.93 0.00 0.00 178.83 177.35 1myf h SER 92 N 0.16 -0.82 -0.78 -0.69 4.64 -0.71 0.69 113.55 116.04 1myf h SER 92 Ca 0.32 0.01 0.22 0.00 -0.47 0.00 0.00 61.79 61.87 1myf h SER 92 Cb 0.50 0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.77 1myf h SER 92 CO -0.48 -0.46 0.56 0.45 -0.87 0.00 0.00 176.83 176.03 1myf h HIS 93 N -1.21 0.07 0.00 4.77 3.86 -0.99 0.18 115.15 121.82 1myf h HIS 93 Ca -0.10 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1myf h HIS 93 Cb 0.76 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.21 1myf h HIS 93 CO 0.00 0.02 0.00 0.00 0.86 0.00 0.00 177.93 178.81 1myf n ALA 94 N -2.67 -0.01 0.06 2.45 0.00 0.13 -1.29 120.51 119.18 1myf n ALA 94 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.49 1myf n ALA 94 Cb 0.82 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.26 1myf n ALA 94 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1myf h THR 95 N 0.00 1.41 0.00 0.00 1.35 -0.78 -2.94 112.91 111.95 1myf h THR 95 Ca 0.00 -2.35 -0.29 0.00 -0.55 0.00 0.00 66.41 63.22 1myf h THR 95 Cb 0.00 2.30 -0.04 0.00 -1.73 0.00 0.00 68.15 68.68 1myf h THR 95 CO 0.00 0.70 -1.80 1.17 -0.25 0.00 0.00 175.52 175.34 1myf n LYS 96 N -3.77 0.56 0.06 4.72 4.81 0.47 -4.75 118.16 120.27 1myf n LYS 96 Ca -0.05 0.34 -0.14 0.00 -0.87 0.00 0.00 58.31 57.59 1myf n LYS 96 Cb 0.78 -1.55 -0.14 0.00 0.02 0.00 0.00 35.03 34.14 1myf n LYS 96 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1myf h HIS 97 N -1.00 0.34 0.00 5.64 3.86 -1.30 -3.49 115.15 119.20 1myf h HIS 97 Ca -0.43 -0.25 0.00 0.00 -1.16 0.00 0.00 60.37 58.53 1myf h HIS 97 Cb 1.33 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.79 1myf h HIS 97 CO -0.13 1.25 0.00 0.36 0.86 0.00 0.00 177.93 180.27 1myf n LYS 98 N -3.41 0.00 0.00 2.45 -0.00 -0.99 -4.95 118.16 111.26 1myf n LYS 98 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.19 1myf n LYS 98 Cb 1.02 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 36.05 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 -2.66 0.00 -1.62 0.58 5.41 -0.41 -4.98 119.36 115.68 1myf n ILE 99 Ca 0.00 0.00 -0.52 0.00 1.00 0.00 0.00 62.75 63.23 1myf n ILE 99 Cb 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 38.87 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 1.23 0.28 0.38 -0.04 -1.26 -4.65 135.00 130.95 1myf n PRO 100 Ca 0.00 0.45 0.16 0.00 -0.04 0.00 0.00 63.50 64.07 1myf n PRO 100 Cb 0.00 -2.11 0.77 0.00 -0.04 0.00 0.00 33.50 32.12 1myf n PRO 100 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1myf h ILE 101 N 3.67 0.22 -0.56 0.52 2.04 -1.43 -2.42 117.51 119.55 1myf h ILE 101 Ca -0.47 -0.50 0.10 0.00 1.00 0.00 0.00 64.86 64.98 1myf h ILE 101 Cb 1.33 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 38.78 1myf h ILE 101 CO 0.82 0.06 0.38 0.50 0.00 0.00 0.00 178.15 179.91 1myf h LYS 102 N 0.00 0.35 -0.73 2.37 3.64 -1.90 0.42 116.57 120.72 1myf h LYS 102 Ca -0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1myf h LYS 102 Cb 0.40 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1myf h LYS 102 CO 0.01 0.23 0.34 1.88 -2.27 0.00 0.00 179.45 179.64 1myf h TYR 103 N 0.36 1.04 -0.17 1.91 -1.99 -1.81 0.12 116.97 116.44 1myf h TYR 103 Ca 0.26 -0.05 -0.08 0.00 2.00 0.00 0.00 58.73 60.86 1myf h TYR 103 Cb 0.54 -0.32 -0.01 0.00 2.00 0.00 0.00 36.73 38.93 1myf h TYR 103 CO -0.00 0.76 -0.27 -0.07 -0.00 0.00 0.00 178.16 178.58 1myf h LEU 104 N 1.04 0.31 -0.70 3.88 3.38 -0.41 -1.56 115.31 121.25 1myf h LEU 104 Ca 0.25 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 1myf h LEU 104 Cb 0.12 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1myf h LEU 104 CO -0.03 0.59 0.25 -0.08 0.09 0.00 0.00 178.44 179.25 1myf h GLU 105 N 0.28 1.07 -0.62 1.13 4.81 0.29 0.36 114.58 121.90 1myf h GLU 105 Ca 0.04 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 1myf h GLU 105 Cb 0.63 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 1myf h GLU 105 CO 0.05 0.90 0.34 0.74 -0.73 0.00 0.00 179.01 180.31 1myf h PHE 106 N 1.01 0.85 -0.17 0.92 0.04 -0.10 -0.05 116.94 119.44 1myf h PHE 106 Ca 0.23 -0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.90 1myf h PHE 106 Cb 0.26 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 1myf h PHE 106 CO 0.02 0.61 -0.24 0.82 -0.60 0.00 0.00 178.31 178.92 1myf h ILE 107 N 0.84 1.24 -0.21 -0.55 2.04 -0.79 -1.79 117.51 118.29 1myf h ILE 107 Ca 0.22 -1.13 0.03 0.00 1.00 0.00 0.00 64.86 64.98 1myf h ILE 107 Cb 0.04 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 1myf h ILE 107 CO -0.04 0.35 0.02 0.28 0.00 0.00 0.00 178.15 178.77 1myf h SER 108 N 0.28 -0.03 -0.45 1.72 0.02 0.42 0.57 113.55 116.08 1myf h SER 108 Ca 0.05 0.04 0.08 0.00 -0.84 0.00 0.00 61.79 61.11 1myf h SER 108 Cb 0.58 0.06 -0.07 0.00 0.14 0.00 0.00 62.40 63.11 1myf h SER 108 CO 0.04 0.01 0.06 -0.08 -1.14 0.00 0.00 176.83 175.72 1myf h GLU 109 N 0.10 0.17 0.70 3.45 4.22 -0.68 -0.15 114.58 122.39 1myf h GLU 109 Ca 0.10 -0.01 -0.03 0.00 0.08 0.00 0.00 59.36 59.50 1myf h GLU 109 Cb 0.10 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1myf h GLU 109 CO -0.14 0.11 -0.41 0.00 -2.18 0.00 0.00 179.01 176.39 1myf h ALA 110 N 1.36 -1.07 -0.77 2.92 0.00 -0.82 0.23 119.26 121.12 1myf h ALA 110 Ca 0.22 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1myf h ALA 110 Cb 0.30 0.50 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1myf h ALA 110 CO -0.32 -1.11 0.48 0.97 0.00 0.00 0.00 179.25 179.27 1myf h ILE 111 N -1.04 1.09 -0.59 0.00 6.09 -0.71 -0.36 117.51 122.00 1myf h ILE 111 Ca -0.09 -0.32 0.02 0.00 -1.37 0.00 0.00 64.86 63.10 1myf h ILE 111 Cb 0.84 0.08 -0.04 0.00 0.47 0.00 0.00 36.82 38.17 1myf h ILE 111 CO 0.10 0.17 0.37 0.40 -3.07 0.00 0.00 178.15 176.11 1myf h ILE 112 N 0.92 1.09 -0.49 2.19 1.08 -0.92 0.08 117.51 121.47 1myf h ILE 112 Ca 0.31 -0.25 0.04 0.00 -0.39 0.00 0.00 64.86 64.58 1myf h ILE 112 Cb 0.05 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 34.05 1myf h ILE 112 CO -0.13 0.13 0.24 -0.74 -0.69 0.00 0.00 178.15 176.96 1myf h HIS 113 N 0.73 0.43 -0.26 1.37 2.76 0.64 0.97 115.15 121.80 1myf h HIS 113 Ca 0.23 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.41 1myf h HIS 113 Cb -0.01 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 1myf h HIS 113 CO -0.05 0.21 0.10 0.28 -1.30 0.00 0.00 177.93 177.17 1myf h VAL 114 N 0.46 1.17 -0.14 5.26 2.07 -0.29 -0.57 116.25 124.22 1myf h VAL 114 Ca 0.22 -0.52 0.04 0.00 0.82 0.00 0.00 66.70 67.26 1myf h VAL 114 Cb 0.14 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 1myf h VAL 114 CO -0.16 0.17 -0.09 -0.07 0.02 0.00 0.00 177.57 177.45 1myf h LEU 115 N 0.27 -0.28 -0.26 2.57 3.38 -0.61 0.23 115.31 120.60 1myf h LEU 115 Ca 0.09 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.18 1myf h LEU 115 Cb 0.18 0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.00 1myf h LEU 115 CO -0.01 -0.12 -0.34 -0.74 0.09 0.00 0.00 178.44 177.33 1myf h HIS 116 N -0.09 -0.94 0.01 1.13 2.76 -0.58 0.18 115.15 117.63 1myf h HIS 116 Ca 0.08 0.05 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 1myf h HIS 116 Cb 0.21 0.45 0.01 0.00 1.55 0.00 0.00 27.41 29.62 1myf h HIS 116 CO -0.22 -0.40 -0.26 0.77 -1.30 0.00 0.00 177.93 176.52 1myf h SER 117 N -0.34 0.22 0.60 3.26 0.02 -0.66 -3.34 113.55 113.31 1myf h SER 117 Ca 0.13 -0.80 -0.15 0.00 -0.84 0.00 0.00 61.79 60.12 1myf h SER 117 Cb 0.55 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 1myf h SER 117 CO -0.45 0.99 -1.52 0.54 -1.14 0.00 0.00 176.83 175.26 1myf n ARG 118 N -4.50 0.63 -2.40 3.45 5.12 0.76 -4.55 116.66 115.17 1myf n ARG 118 Ca -0.10 0.15 -0.19 0.00 -1.93 0.00 0.00 57.85 55.78 1myf n ARG 118 Cb 0.52 -1.76 0.02 0.00 -1.16 0.00 0.00 32.46 30.08 1myf n ARG 118 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1myf n HIS 119 N -2.79 2.54 -0.96 -1.55 8.25 0.63 -5.03 115.22 116.31 1myf n HIS 119 Ca -0.10 -2.63 -0.29 0.00 -0.26 0.00 0.00 57.72 54.45 1myf n HIS 119 Cb 0.81 -0.24 0.20 0.00 1.12 0.00 0.00 29.99 31.88 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 -3.53 0.08 0.00 -0.41 0.04 -1.23 -0.22 135.00 129.72 1myf s PRO 120 Ca 0.43 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.14 1myf s PRO 120 Cb 0.40 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 33.26 1myf s PRO 120 CO -0.06 -3.01 0.00 0.41 0.04 0.00 0.00 177.00 174.38 1myf n GLY 121 N -0.46 1.69 0.22 0.56 0.00 -1.26 -4.05 105.19 101.90 1myf n GLY 121 Ca 0.05 -0.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 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 0.85 -0.81 1.61 3.04 -1.99 -3.21 116.42 115.92 1myf h ASP 122 Ca 0.00 -0.54 -0.72 0.00 -3.24 0.00 0.00 57.03 52.52 1myf h ASP 122 Cb 0.00 -0.25 -0.08 0.00 -1.04 0.00 0.00 39.33 37.96 1myf h ASP 122 CO 0.00 1.24 2.76 0.33 -2.04 0.00 0.00 179.24 181.53 1myf n PHE 123 N -4.11 2.71 -2.06 4.15 7.35 0.69 -4.68 117.46 121.50 1myf n PHE 123 Ca -0.05 -2.90 -0.27 0.00 -0.76 0.00 0.00 57.45 53.47 1myf n PHE 123 Cb 0.59 -2.09 0.09 0.00 0.35 0.00 0.00 39.48 38.42 1myf n PHE 123 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1myf s GLY 124 N 1.18 1.66 0.24 7.13 0.00 -1.22 -4.71 107.32 111.61 1myf s GLY 124 Ca 0.54 -0.87 -0.05 0.00 0.00 0.00 0.00 44.72 44.34 1myf s GLY 124 CO -0.06 -0.39 1.73 0.00 0.00 0.00 0.00 173.10 174.38 1myf h ALA 125 N -0.90 1.03 -0.52 3.20 0.00 -1.93 0.21 119.26 120.36 1myf h ALA 125 Ca -0.45 0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.60 1myf h ALA 125 Cb 1.31 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.15 1myf h ALA 125 CO 0.59 -0.21 0.30 0.38 0.00 0.00 0.00 179.25 180.32 1myf h ASP 126 N 0.44 0.48 -0.25 0.00 2.03 -1.96 -0.27 116.42 116.90 1myf h ASP 126 Ca 0.40 0.01 -0.02 0.00 -0.73 0.00 0.00 57.03 56.69 1myf h ASP 126 Cb 0.60 -0.09 -0.01 0.00 -0.83 0.00 0.00 39.33 39.00 1myf h ASP 126 CO -0.40 0.34 0.06 0.00 -1.03 0.00 0.00 179.24 178.22 1myf h ALA 127 N 1.24 0.33 -0.60 4.15 0.00 -1.37 -2.04 119.26 120.97 1myf h ALA 127 Ca 0.21 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 55.08 1myf h ALA 127 Cb 0.04 -0.10 -0.11 0.00 0.00 0.00 0.00 17.79 17.62 1myf h ALA 127 CO -0.10 -0.02 -0.04 0.37 0.00 0.00 0.00 179.25 179.46 1myf h GLN 128 N 0.23 0.08 0.06 0.00 4.15 -0.02 0.29 115.11 119.89 1myf h GLN 128 Ca 0.08 -0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.51 1myf h GLN 128 Cb 0.28 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.93 1myf h GLN 128 CO 0.00 0.05 -0.13 0.78 -1.93 0.00 0.00 178.83 177.60 1myf h GLY 129 N 0.08 -0.21 0.91 2.39 0.00 -0.81 0.12 103.07 105.54 1myf h GLY 129 Ca 0.31 0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.82 1myf h GLY 129 CO -0.55 -0.13 0.44 0.00 0.00 0.00 0.00 176.54 176.29 1myf h ALA 130 N 0.65 0.89 0.22 3.60 0.00 -0.36 0.12 119.26 124.37 1myf h ALA 130 Ca 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1myf h ALA 130 Cb 0.28 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1myf h ALA 130 CO -0.09 0.23 -0.10 1.98 0.00 0.00 0.00 179.25 181.26 1myf h MET 131 N 0.87 -0.28 -0.99 0.00 -1.53 -0.31 -1.39 114.93 111.31 1myf h MET 131 Ca 0.27 0.02 0.03 0.00 -3.44 0.00 0.00 59.70 56.58 1myf h MET 131 Cb -0.02 0.06 -0.06 0.00 -0.55 0.00 0.00 31.60 31.04 1myf h MET 131 CO -0.09 -0.08 0.65 -0.97 0.14 0.00 0.00 176.91 176.56 1myf h ASN 132 N -0.44 1.08 0.18 1.39 -1.24 -0.55 0.15 115.58 116.15 1myf h ASN 132 Ca -0.03 -0.01 0.01 0.00 0.71 0.00 0.00 56.30 56.98 1myf h ASN 132 Cb 0.33 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.11 1myf h ASN 132 CO 0.05 0.74 -0.27 0.11 -1.29 0.00 0.00 177.43 176.77 1myf h LYS 133 N 1.25 -0.50 -0.83 6.67 1.57 -0.63 0.37 116.57 124.48 1myf h LYS 133 Ca 0.39 0.03 0.04 0.00 -1.87 0.00 0.00 60.65 59.24 1myf h LYS 133 Cb -0.01 0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.36 1myf h LYS 133 CO -0.12 -0.34 0.53 0.00 -0.57 0.00 0.00 179.45 178.95 1myf h ALA 134 N 0.16 1.09 -0.47 3.86 0.00 -0.45 0.22 119.26 123.66 1myf h ALA 134 Ca 0.01 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1myf h ALA 134 Cb 0.52 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1myf h ALA 134 CO -0.12 0.34 -0.16 1.25 0.00 0.00 0.00 179.25 180.56 1myf h LEU 135 N 1.02 0.93 -0.58 0.00 5.85 -0.45 -0.84 115.31 121.24 1myf h LEU 135 Ca 0.33 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1myf h LEU 135 Cb 0.03 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1myf h LEU 135 CO -0.12 1.07 0.18 -0.08 -0.34 0.00 0.00 178.44 179.16 1myf h GLU 136 N 0.81 0.89 -0.29 1.25 4.57 0.60 0.45 114.58 122.87 1myf h GLU 136 Ca 0.12 -0.19 0.03 0.00 -1.18 0.00 0.00 59.36 58.14 1myf h GLU 136 Cb 0.70 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 29.13 1myf h GLU 136 CO 0.05 0.80 0.10 1.25 -1.18 0.00 0.00 179.01 180.04 1myf h LEU 137 N 0.81 0.12 0.27 1.64 5.85 -0.32 0.19 115.31 123.86 1myf h LEU 137 Ca 0.19 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.94 1myf h LEU 137 Cb 0.28 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1myf h LEU 137 CO -0.01 0.10 -0.35 0.15 -0.34 0.00 0.00 178.44 178.00 1myf h PHE 138 N 0.23 -0.95 -0.56 1.25 3.57 -0.16 0.24 116.94 120.58 1myf h PHE 138 Ca 0.13 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.73 1myf h PHE 138 Cb 0.09 0.38 -0.07 0.00 2.79 0.00 0.00 35.95 39.14 1myf h PHE 138 CO -0.13 -0.48 0.16 0.00 -2.23 0.00 0.00 178.31 175.64 1myf h ARG 139 N -0.67 0.31 -0.29 1.11 3.08 -0.66 -1.15 114.38 116.10 1myf h ARG 139 Ca -0.00 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1myf h ARG 139 Cb 0.64 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 1myf h ARG 139 CO -0.11 0.21 -0.16 0.87 -1.07 0.00 0.00 179.97 179.70 1myf h LYS 140 N 0.32 0.51 0.08 0.04 1.57 -0.04 0.12 116.57 119.17 1myf h LYS 140 Ca 0.28 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1myf h LYS 140 Cb 0.36 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1myf h LYS 140 CO -0.32 0.65 -0.04 0.22 -0.57 0.00 0.00 179.45 179.40 1myf h ASP 141 N 0.47 -0.09 -0.85 0.86 1.82 0.57 0.69 116.42 119.88 1myf h ASP 141 Ca 0.08 -0.31 0.07 0.00 -0.39 0.00 0.00 57.03 56.48 1myf h ASP 141 Cb 0.55 0.02 -0.06 0.00 0.68 0.00 0.00 39.33 40.51 1myf h ASP 141 CO 0.03 0.27 0.52 0.40 -1.61 0.00 0.00 179.24 178.86 1myf h ILE 142 N -0.46 1.01 -0.50 2.25 2.04 -1.10 0.81 117.51 121.55 1myf h ILE 142 Ca -0.01 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.54 1myf h ILE 142 Cb 0.40 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.44 1myf h ILE 142 CO 0.02 0.17 0.31 0.00 0.00 0.00 0.00 178.15 178.65 1myf h ALA 143 N 1.42 0.64 -0.79 1.87 0.00 -0.49 0.20 119.26 122.12 1myf h ALA 143 Ca 0.38 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1myf h ALA 143 Cb 0.21 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1myf h ALA 143 CO -0.19 0.03 0.41 0.00 0.00 0.00 0.00 179.25 179.50 1myf h ALA 144 N 1.21 1.02 -0.46 0.00 0.00 0.33 0.11 119.26 121.46 1myf h ALA 144 Ca 0.20 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1myf h ALA 144 Cb -0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1myf h ALA 144 CO -0.07 0.55 0.22 0.87 0.00 0.00 0.00 179.25 180.82 1myf h LYS 145 N 1.11 0.67 -0.16 0.00 6.56 -0.22 -0.26 116.57 124.26 1myf h LYS 145 Ca 0.28 -0.10 0.03 0.00 -1.06 0.00 0.00 60.65 59.79 1myf h LYS 145 Cb 0.07 -0.12 -0.03 0.00 -0.57 0.00 0.00 32.23 31.59 1myf h LYS 145 CO -0.04 0.57 -0.00 1.88 -2.06 0.00 0.00 179.45 179.80 1myf h TYR 146 N 0.60 -0.01 -0.39 -1.35 -1.99 -0.16 0.13 116.97 113.79 1myf h TYR 146 Ca 0.16 0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.95 1myf h TYR 146 Cb 0.13 0.03 -0.05 0.00 2.00 0.00 0.00 36.73 38.84 1myf h TYR 146 CO -0.01 -0.03 0.12 -0.22 -0.00 0.00 0.00 178.16 178.03 1myf h LYS 147 N 0.05 0.26 -0.17 4.88 3.64 -0.52 0.55 116.57 125.26 1myf h LYS 147 Ca 0.08 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1myf h LYS 147 Cb 0.09 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1myf h LYS 147 CO -0.13 0.17 0.06 1.49 -2.27 0.00 0.00 179.45 178.77 1myf h GLU 148 N 0.27 0.13 0.00 1.90 4.81 -0.29 -2.59 114.58 118.81 1myf h GLU 148 Ca 0.18 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.34 1myf h GLU 148 Cb 0.18 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1myf h GLU 148 CO -0.20 0.09 -0.33 -0.07 -0.73 0.00 0.00 179.01 177.76 1myf h LEU 149 N 0.14 0.00 -0.23 1.64 3.38 -0.28 -3.47 115.31 116.48 1myf h LEU 149 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1myf h LEU 149 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1myf h LEU 149 CO -0.08 0.33 0.00 0.61 0.09 0.00 0.00 178.44 179.40 1myf n GLY 150 N -0.43 0.71 3.00 0.83 0.00 0.16 -5.07 105.19 104.39 1myf n GLY 150 Ca -0.02 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.38 1myf n GLY 150 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1myf s TYR 151 N -1.65 1.02 0.00 1.61 1.51 0.72 -4.99 117.35 115.58 1myf s TYR 151 Ca 0.00 -0.27 -0.23 0.00 -1.01 0.00 0.00 57.07 55.56 1myf s TYR 151 Cb 0.00 -0.74 -0.18 0.00 -0.11 0.00 0.00 41.96 40.93 1myf s TYR 151 CO 0.00 -0.13 1.27 1.96 -1.11 0.00 0.00 175.55 177.54 1myf h GLN 152 N 6.50 0.18 0.00 -0.62 1.08 -1.98 -3.30 115.11 116.97 1myf h GLN 152 Ca -0.33 -0.11 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 1myf h GLN 152 Cb 1.17 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.61 1myf h GLN 152 CO 0.48 0.66 0.00 0.41 -0.95 0.00 0.00 178.83 179.43