#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1azy n PHE 2 N 0.00 -3.99 -2.18 -1.77 3.01 -1.26 -4.86 117.46 106.40 1azy n PHE 2 Ca 0.00 -0.69 0.00 0.00 1.01 0.00 0.00 57.45 57.77 1azy n PHE 2 Cb 0.00 -0.61 0.00 0.00 -0.01 0.00 0.00 39.48 38.86 1azy n PHE 2 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1azy n LEU 3 N 0.00 -5.86 -0.07 4.37 4.77 -1.26 -4.57 117.00 114.38 1azy n LEU 3 Ca 0.10 3.02 -0.12 0.00 -0.03 0.00 0.00 56.01 58.98 1azy n LEU 3 Cb 0.34 -3.11 0.02 0.00 -2.33 0.00 0.00 43.42 38.34 1azy n LEU 3 CO 0.25 -2.17 0.52 0.00 -1.33 0.00 0.00 177.39 174.66 1azy h ALA 4 N 4.35 0.63 -0.42 -1.18 0.00 -1.99 -2.33 119.26 118.32 1azy h ALA 4 Ca 0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1azy h ALA 4 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1azy h ALA 4 CO 0.00 0.67 0.24 1.96 0.00 0.00 0.00 179.25 182.13 1azy h GLN 5 N 0.62 0.58 -0.21 0.00 4.20 -1.98 -0.46 115.11 117.88 1azy h GLN 5 Ca 0.04 -0.06 0.05 0.00 0.06 0.00 0.00 58.65 58.74 1azy h GLN 5 Cb 1.02 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 28.63 1azy h GLN 5 CO 0.10 0.45 -0.12 1.49 -0.67 0.00 0.00 178.83 180.08 1azy h GLU 6 N 0.55 -0.11 -0.09 1.46 4.81 -1.80 -1.54 114.58 117.87 1azy h GLU 6 Ca 0.15 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1azy h GLU 6 Cb 0.03 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 1azy h GLU 6 CO -0.03 -0.07 0.04 0.82 -0.73 0.00 0.00 179.01 179.05 1azy h ILE 7 N -0.11 1.10 -0.54 2.32 1.08 -1.09 -2.61 117.51 117.64 1azy h ILE 7 Ca 0.12 -0.28 0.09 0.00 -0.39 0.00 0.00 64.86 64.39 1azy h ILE 7 Cb 0.29 1.13 -0.07 0.00 -3.07 0.00 0.00 36.82 35.09 1azy h ILE 7 CO -0.28 0.09 0.16 0.40 -0.69 0.00 0.00 178.15 177.83 1azy h ILE 8 N 0.03 0.75 0.34 -0.67 2.04 -0.88 -2.74 117.51 116.38 1azy h ILE 8 Ca 0.03 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1azy h ILE 8 Cb 0.10 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1azy h ILE 8 CO -0.00 0.06 -0.23 -0.09 0.00 0.00 0.00 178.15 177.89 1azy h ARG 9 N 0.31 -0.54 -0.62 2.37 2.43 -1.14 -0.77 114.38 116.42 1azy h ARG 9 Ca 0.27 0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.57 1azy h ARG 9 Cb 0.35 0.12 -0.11 0.00 -0.42 0.00 0.00 29.97 29.91 1azy h ARG 9 CO -0.31 -0.36 -0.45 0.87 -1.51 0.00 0.00 179.97 178.21 1azy h LYS 10 N -0.56 -0.20 -0.56 0.20 1.57 -1.17 0.14 116.57 115.99 1azy h LYS 10 Ca -0.03 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1azy h LYS 10 Cb 0.47 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 1azy h LYS 10 CO 0.02 -0.13 0.21 -0.22 -0.57 0.00 0.00 179.45 178.76 1azy h LYS 11 N -0.21 0.82 -0.71 3.15 1.63 -1.44 -1.56 116.57 118.24 1azy h LYS 11 Ca 0.18 -0.13 -0.04 0.00 -0.85 0.00 0.00 60.65 59.81 1azy h LYS 11 Cb 0.56 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 1azy h LYS 11 CO -0.72 0.69 0.28 -0.09 -3.45 0.00 0.00 179.45 176.15 1azy h ARG 12 N 0.81 1.06 -0.99 1.90 2.43 0.70 -2.45 114.38 117.84 1azy h ARG 12 Ca 0.19 -0.19 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 1azy h ARG 12 Cb 0.18 -0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 29.49 1azy h ARG 12 CO -0.02 0.87 0.14 -0.25 -1.51 0.00 0.00 179.97 179.20 1azy n ASP 13 N -4.29 3.04 -1.80 -3.80 8.00 0.18 -4.85 116.55 113.04 1azy n ASP 13 Ca 0.06 -2.37 -0.15 0.00 0.71 0.00 0.00 54.79 53.04 1azy n ASP 13 Cb 0.19 -0.58 -0.00 0.00 -0.02 0.00 0.00 41.12 40.71 1azy n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1azy n GLY 14 N 0.11 -0.25 3.92 0.44 0.00 -0.92 -5.03 105.19 103.45 1azy n GLY 14 Ca 0.13 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 1azy n GLY 14 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1azy s HIS 15 N -2.79 3.14 -0.14 1.61 3.76 -0.63 -5.01 115.29 115.22 1azy s HIS 15 Ca 0.03 -0.17 -0.13 0.00 -0.15 0.00 0.00 55.06 54.63 1azy s HIS 15 Cb -0.01 -1.73 -0.05 0.00 1.11 0.00 0.00 32.58 31.90 1azy s HIS 15 CO 0.03 0.24 0.29 0.00 -0.85 0.00 0.00 174.74 174.46 1azy s ALA 16 N -2.16 3.63 0.22 -1.40 0.00 -1.26 -4.27 121.76 116.52 1azy s ALA 16 Ca 0.39 -0.45 -0.28 0.00 0.00 0.00 0.00 51.96 51.61 1azy s ALA 16 Cb -0.08 -2.35 -0.09 0.00 0.00 0.00 0.00 23.12 20.60 1azy s ALA 16 CO 0.28 0.18 0.89 -0.51 0.00 0.00 0.00 175.76 176.60 1azy s LEU 17 N 0.18 4.62 0.77 0.00 1.43 -1.26 -4.97 118.68 119.45 1azy s LEU 17 Ca 0.17 1.85 -0.12 0.00 -1.03 0.00 0.00 54.13 55.01 1azy s LEU 17 Cb -0.13 -3.53 0.05 0.00 0.03 0.00 0.00 46.19 42.61 1azy s LEU 17 CO 0.05 0.17 1.10 -0.94 0.23 0.00 0.00 176.35 176.96 1azy s SER 18 N -1.19 4.80 0.10 2.29 1.04 -1.26 -4.80 113.70 114.69 1azy s SER 18 Ca 0.40 1.19 -0.20 0.00 0.48 0.00 0.00 55.95 57.81 1azy s SER 18 Cb -0.25 -1.92 -0.09 0.00 0.10 0.00 0.00 66.02 63.86 1azy s SER 18 CO 0.30 -1.76 1.71 -0.78 0.98 0.00 0.00 173.24 173.69 1azy h ASP 19 N -0.94 0.20 -0.62 7.02 3.58 -1.97 0.64 116.42 124.33 1azy h ASP 19 Ca -0.46 -0.07 0.09 0.00 0.42 0.00 0.00 57.03 57.01 1azy h ASP 19 Cb 1.27 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 42.23 1azy h ASP 19 CO 0.62 0.22 0.41 -0.33 -2.88 0.00 0.00 179.24 177.28 1azy h GLU 20 N 0.18 0.46 0.03 0.28 3.07 -1.98 0.36 114.58 116.97 1azy h GLU 20 Ca 0.06 -0.03 -0.23 0.00 -0.50 0.00 0.00 59.36 58.66 1azy h GLU 20 Cb 0.06 -0.10 0.02 0.00 -0.84 0.00 0.00 28.75 27.88 1azy h GLU 20 CO -0.01 0.30 -0.93 0.93 -1.40 0.00 0.00 179.01 177.90 1azy h GLU 21 N 0.47 0.59 -0.44 2.33 5.08 -1.69 -1.71 114.58 119.20 1azy h GLU 21 Ca 0.28 -0.67 -0.13 0.00 -1.00 0.00 0.00 59.36 57.85 1azy h GLU 21 Cb 0.49 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1azy h GLU 21 CO -0.08 1.27 -0.21 0.82 -1.00 0.00 0.00 179.01 179.80 1azy h ILE 22 N 0.19 1.27 -0.47 3.13 2.04 -0.05 -1.94 117.51 121.69 1azy h ILE 22 Ca -0.12 -1.37 -0.02 0.00 1.00 0.00 0.00 64.86 64.35 1azy h ILE 22 Cb 1.62 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.87 1azy h ILE 22 CO 0.18 0.47 0.22 0.03 0.00 0.00 0.00 178.15 179.05 1azy h ARG 23 N 0.76 0.68 -0.77 2.37 3.08 -0.36 -1.64 114.38 118.52 1azy h ARG 23 Ca 0.10 -0.11 0.01 0.00 0.07 0.00 0.00 59.98 60.05 1azy h ARG 23 Cb 0.78 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.67 1azy h ARG 23 CO 0.06 0.58 0.50 0.35 -1.07 0.00 0.00 179.97 180.40 1azy h PHE 24 N 0.62 0.97 -0.17 3.04 3.04 -1.23 -2.34 116.94 120.87 1azy h PHE 24 Ca 0.16 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.11 1azy h PHE 24 Cb 0.13 -0.33 -0.01 0.00 2.56 0.00 0.00 35.95 38.31 1azy h PHE 24 CO -0.01 0.62 0.03 0.35 -2.02 0.00 0.00 178.31 177.29 1azy h PHE 25 N 1.04 0.30 -0.70 0.41 3.04 -1.01 -2.79 116.94 117.23 1azy h PHE 25 Ca 0.28 -0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.19 1azy h PHE 25 Cb -0.10 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 38.29 1azy h PHE 25 CO -0.02 0.44 0.42 0.82 -2.02 0.00 0.00 178.31 177.95 1azy h ILE 26 N 0.07 1.20 -0.56 1.41 1.08 -1.11 -1.40 117.51 118.20 1azy h ILE 26 Ca 0.05 -0.44 -0.07 0.00 -0.39 0.00 0.00 64.86 64.02 1azy h ILE 26 Cb 0.30 0.23 -0.02 0.00 -3.07 0.00 0.00 36.82 34.26 1azy h ILE 26 CO 0.00 0.21 0.08 0.78 -0.69 0.00 0.00 178.15 178.53 1azy h ASN 27 N 0.95 0.85 -0.09 1.72 2.35 -1.48 -1.14 115.58 118.74 1azy h ASN 27 Ca 0.25 -0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 1azy h ASN 27 Cb -0.03 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 1azy h ASN 27 CO -0.05 0.86 0.01 1.23 -1.65 0.00 0.00 177.43 177.83 1azy h GLY 28 N 1.00 0.25 1.08 2.83 0.00 -1.09 0.55 103.07 107.70 1azy h GLY 28 Ca 0.17 -0.12 -0.13 0.00 0.00 0.00 0.00 47.33 47.25 1azy h GLY 28 CO 0.01 0.11 -0.24 -2.22 0.00 0.00 0.00 176.54 174.20 1azy h ILE 29 N 0.24 1.27 -0.16 2.60 2.04 -0.19 -1.80 117.51 121.51 1azy h ILE 29 Ca 0.06 -1.40 -0.08 0.00 1.00 0.00 0.00 64.86 64.43 1azy h ILE 29 Cb 0.16 1.24 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1azy h ILE 29 CO 0.00 0.48 -0.22 -0.09 0.00 0.00 0.00 178.15 178.32 1azy h ARG 30 N 0.75 0.43 -0.94 2.37 2.43 -0.16 -3.17 114.38 116.09 1azy h ARG 30 Ca 0.09 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 1azy h ARG 30 Cb 0.82 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 1azy h ARG 30 CO 0.07 0.83 0.01 -0.25 -1.51 0.00 0.00 179.97 179.12 1azy n ASP 31 N -4.46 1.91 -0.85 -3.80 8.00 0.18 -4.89 116.55 112.64 1azy n ASP 31 Ca -0.06 -2.16 -0.06 0.00 0.71 0.00 0.00 54.79 53.21 1azy n ASP 31 Cb 0.42 -0.53 -0.03 0.00 -0.02 0.00 0.00 41.12 40.96 1azy n ASP 31 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1azy n ASN 32 N 0.12 -2.48 0.11 -2.24 2.85 -1.09 -4.79 115.26 107.73 1azy n ASN 32 Ca 0.05 0.15 0.12 0.00 -0.11 0.00 0.00 54.58 54.80 1azy n ASN 32 Cb 0.43 -2.21 0.21 0.00 1.24 0.00 0.00 39.78 39.45 1azy n ASN 32 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1azy h THR 33 N 0.00 0.00 -3.46 -0.44 1.35 -1.64 -3.42 112.91 105.30 1azy h THR 33 Ca -0.13 -0.65 -0.72 0.00 -0.55 0.00 0.00 66.41 64.37 1azy h THR 33 Cb 0.55 1.40 -0.27 0.00 -1.73 0.00 0.00 68.15 68.10 1azy h THR 33 CO 0.19 0.00 -0.46 -0.63 -0.25 0.00 0.00 175.52 174.36 1azy s ILE 34 N -3.19 4.35 0.98 6.82 1.01 -0.86 -5.02 121.20 125.30 1azy s ILE 34 Ca 0.07 -1.30 -0.14 0.00 0.00 0.00 0.00 60.65 59.27 1azy s ILE 34 Cb 0.11 -3.63 0.03 0.00 0.01 0.00 0.00 42.46 38.99 1azy s ILE 34 CO 0.69 -0.48 0.24 -1.54 0.00 0.00 0.00 174.94 173.85 1azy n SER 35 N 4.95 -2.41 -0.07 3.58 3.41 -1.26 -4.73 113.62 117.10 1azy n SER 35 Ca -0.10 0.24 -0.07 0.00 -0.26 0.00 0.00 58.87 58.67 1azy n SER 35 Cb 0.43 -1.13 -0.01 0.00 -0.26 0.00 0.00 64.21 63.25 1azy n SER 35 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1azy h GLU 36 N -1.61 -0.13 -0.42 4.33 4.81 -1.98 -0.97 114.58 118.61 1azy h GLU 36 Ca -0.45 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 58.83 1azy h GLU 36 Cb 1.30 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.68 1azy h GLU 36 CO 0.34 -0.09 0.28 0.78 -0.73 0.00 0.00 179.01 179.60 1azy h GLY 37 N -0.14 0.46 2.00 1.92 0.00 -1.98 0.12 103.07 105.45 1azy h GLY 37 Ca 0.15 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1azy h GLY 37 CO -0.36 0.13 -0.18 1.46 0.00 0.00 0.00 176.54 177.58 1azy h GLN 38 N 0.39 0.00 0.08 4.80 4.20 -1.54 -1.64 115.11 121.40 1azy h GLN 38 Ca 0.18 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.76 1azy h GLN 38 Cb 0.22 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.00 1azy h GLN 38 CO -0.04 0.18 -0.62 0.82 -0.67 0.00 0.00 178.83 178.49 1azy h ILE 39 N 0.00 1.52 -0.20 2.54 2.04 -0.06 -3.12 117.51 120.22 1azy h ILE 39 Ca -0.00 -2.43 -0.02 0.00 1.00 0.00 0.00 64.86 63.41 1azy h ILE 39 Cb 0.91 3.15 -0.01 0.00 -0.74 0.00 0.00 36.82 40.13 1azy h ILE 39 CO 0.02 0.65 0.02 0.00 0.00 0.00 0.00 178.15 178.84 1azy h ALA 40 N -0.00 1.67 -0.04 1.87 0.00 -0.84 -1.87 119.26 120.04 1azy h ALA 40 Ca -0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1azy h ALA 40 Cb 1.40 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 1azy h ALA 40 CO 0.06 0.25 -0.05 0.00 0.00 0.00 0.00 179.25 179.52 1azy h ALA 41 N 1.75 0.05 -0.72 0.00 0.00 -1.41 -2.73 119.26 116.21 1azy h ALA 41 Ca 0.07 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1azy h ALA 41 Cb 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1azy h ALA 41 CO 0.00 -0.15 0.26 1.25 0.00 0.00 0.00 179.25 180.62 1azy h LEU 42 N -0.39 1.00 -0.68 0.00 5.85 -1.44 -2.26 115.31 117.39 1azy h LEU 42 Ca 0.00 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.59 1azy h LEU 42 Cb 0.58 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1azy h LEU 42 CO 0.01 0.91 0.42 0.00 -0.34 0.00 0.00 178.44 179.45 1azy h ALA 43 N 1.23 0.88 -0.50 1.25 0.00 -1.37 -2.20 119.26 118.54 1azy h ALA 43 Ca 0.24 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1azy h ALA 43 Cb 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1azy h ALA 43 CO -0.02 0.20 0.08 0.52 0.00 0.00 0.00 179.25 180.04 1azy h MET 44 N 0.84 0.83 -0.13 0.00 2.86 -1.13 -1.45 114.93 116.74 1azy h MET 44 Ca 0.27 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1azy h MET 44 Cb -0.00 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1azy h MET 44 CO -0.10 0.82 0.04 1.79 1.06 0.00 0.00 176.91 180.52 1azy h THR 45 N 0.70 1.06 -0.01 2.22 1.35 -1.10 -0.78 112.91 116.36 1azy h THR 45 Ca 0.15 -0.21 -0.19 0.00 -0.55 0.00 0.00 66.41 65.61 1azy h THR 45 Cb 0.39 0.92 -0.01 0.00 -1.73 0.00 0.00 68.15 67.73 1azy h THR 45 CO 0.01 0.08 -0.83 0.40 -0.25 0.00 0.00 175.52 174.92 1azy h ILE 46 N 0.18 1.47 0.00 6.82 2.04 -1.09 0.49 117.51 127.41 1azy h ILE 46 Ca 0.05 -2.49 -0.03 0.00 1.00 0.00 0.00 64.86 63.39 1azy h ILE 46 Cb 0.06 2.37 -0.00 0.00 -0.74 0.00 0.00 36.82 38.51 1azy h ILE 46 CO -0.00 0.73 -0.15 0.15 0.00 0.00 0.00 178.15 178.87 1azy h PHE 47 N 0.13 0.00 0.00 1.37 3.57 -0.08 0.53 116.94 122.47 1azy h PHE 47 Ca -0.04 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1azy h PHE 47 Cb 1.44 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.18 1azy h PHE 47 CO 0.03 0.15 -1.79 1.19 -2.23 0.00 0.00 178.31 175.67 1azy n PHE 48 N -3.46 0.00 0.14 0.41 3.72 -0.76 -4.60 117.46 112.90 1azy n PHE 48 Ca -0.01 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.41 1azy n PHE 48 Cb 0.32 -0.40 -0.02 0.00 -0.94 0.00 0.00 39.48 38.45 1azy n PHE 48 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1azy n HIS 49 N -2.10 0.00 -4.86 1.38 8.25 0.15 -5.10 115.22 112.94 1azy n HIS 49 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1azy n HIS 49 Cb 0.46 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.56 1azy n HIS 49 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1azy n ASP 50 N -1.11 -3.80 -3.75 0.41 -0.08 0.19 -4.87 116.55 103.54 1azy n ASP 50 Ca 0.01 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.16 1azy n ASP 50 Cb 0.05 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.39 1azy n ASP 50 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 1azy s MET 51 N 0.00 0.23 0.74 -0.67 -1.94 -1.26 -4.74 119.30 111.66 1azy s MET 51 Ca 0.00 0.46 -0.14 0.00 -1.71 0.00 0.00 55.69 54.30 1azy s MET 51 Cb 0.00 -0.03 0.04 0.00 2.01 0.00 0.00 34.83 36.86 1azy s MET 51 CO 0.00 -0.12 1.16 0.95 -0.01 0.00 0.00 175.02 177.01 1azy s THR 52 N 0.85 2.60 0.27 2.05 -4.23 -1.26 -4.61 115.64 111.32 1azy s THR 52 Ca -0.06 0.27 -0.04 0.00 -1.18 0.00 0.00 61.69 60.68 1azy s THR 52 Cb -0.07 -2.75 0.35 0.00 1.34 0.00 0.00 72.50 71.36 1azy s THR 52 CO -0.05 -0.18 1.61 -0.03 -0.54 0.00 0.00 174.62 175.42 1azy h MET 53 N -0.47 0.06 -0.36 3.99 4.05 -2.01 0.26 114.93 120.45 1azy h MET 53 Ca -0.47 -0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 58.95 1azy h MET 53 Cb 1.27 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 32.04 1azy h MET 53 CO 0.50 0.04 0.22 -1.35 0.23 0.00 0.00 176.91 176.55 1azy h PRO 54 N 0.06 0.49 -0.91 0.39 0.11 -2.00 -1.14 132.00 129.00 1azy h PRO 54 Ca 0.49 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.54 1azy h PRO 54 Cb 0.91 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 31.87 1azy h PRO 54 CO -0.79 0.36 0.51 0.93 -0.21 0.00 0.00 178.00 178.80 1azy h GLU 55 N 0.47 1.25 -0.54 1.05 5.08 -1.26 -1.11 114.58 119.53 1azy h GLU 55 Ca 0.13 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1azy h GLU 55 Cb -0.01 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 28.97 1azy h GLU 55 CO -0.03 0.90 0.32 0.00 -1.00 0.00 0.00 179.01 179.20 1azy h ARG 56 N 1.26 0.73 -0.37 2.33 3.08 -0.08 -1.14 114.38 120.20 1azy h ARG 56 Ca 0.32 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 60.18 1azy h ARG 56 Cb 0.00 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 1azy h ARG 56 CO -0.05 0.54 -0.23 0.28 -1.07 0.00 0.00 179.97 179.43 1azy h VAL 57 N 0.72 1.28 -0.52 2.04 2.07 -0.90 -2.82 116.25 118.12 1azy h VAL 57 Ca 0.19 -1.38 -0.04 0.00 0.82 0.00 0.00 66.70 66.30 1azy h VAL 57 Cb 0.00 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1azy h VAL 57 CO -0.03 0.46 0.17 0.28 0.02 0.00 0.00 177.57 178.46 1azy h SER 58 N 0.60 0.70 0.24 0.57 0.02 -1.04 -0.49 113.55 114.15 1azy h SER 58 Ca 0.08 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1azy h SER 58 Cb 0.79 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1azy h SER 58 CO 0.06 0.66 -0.12 0.25 -1.14 0.00 0.00 176.83 176.55 1azy h LEU 59 N 0.75 -0.27 -0.23 5.07 5.85 -1.14 -0.87 115.31 124.46 1azy h LEU 59 Ca 0.17 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.79 1azy h LEU 59 Cb 0.21 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1azy h LEU 59 CO -0.01 -0.01 0.01 0.74 -0.34 0.00 0.00 178.44 178.84 1azy h THR 60 N -0.54 0.85 -0.64 1.05 2.02 -1.29 -1.63 112.91 112.73 1azy h THR 60 Ca -0.03 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1azy h THR 60 Cb 0.40 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1azy h THR 60 CO 0.05 0.02 0.41 0.24 0.37 0.00 0.00 175.52 176.61 1azy h MET 61 N 0.09 0.86 0.00 6.66 2.86 -1.08 0.37 114.93 124.69 1azy h MET 61 Ca 0.11 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1azy h MET 61 Cb 0.13 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 1azy h MET 61 CO -0.17 0.59 -0.01 0.00 1.06 0.00 0.00 176.91 178.38 1azy h ALA 62 N 1.22 1.01 0.09 6.32 0.00 -0.83 -0.65 119.26 126.42 1azy h ALA 62 Ca 0.23 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.81 1azy h ALA 62 Cb -0.07 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1azy h ALA 62 CO -0.05 0.01 -1.75 0.52 0.00 0.00 0.00 179.25 177.98 1azy h MET 63 N 0.00 0.19 0.13 0.00 2.86 -0.42 -3.14 114.93 114.55 1azy h MET 63 Ca -0.00 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.30 1azy h MET 63 Cb 0.37 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.16 1azy h MET 63 CO 0.00 0.99 -0.06 -0.09 1.06 0.00 0.00 176.91 178.81 1azy h ARG 64 N 0.05 -0.17 0.00 1.72 2.43 -0.60 -2.50 114.38 115.31 1azy h ARG 64 Ca -0.32 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1azy h ARG 64 Cb 2.02 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.61 1azy h ARG 64 CO 0.11 0.08 0.00 -0.25 -1.51 0.00 0.00 179.97 178.41 1azy n ASP 65 N -5.06 0.00 -0.12 -3.80 9.92 -0.28 -2.65 116.55 114.56 1azy n ASP 65 Ca -0.09 -0.66 -0.05 0.00 -0.53 0.00 0.00 54.79 53.46 1azy n ASP 65 Cb 0.18 0.00 0.14 0.00 -0.64 0.00 0.00 41.12 40.81 1azy n ASP 65 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1azy h SER 66 N 0.00 0.80 0.00 -2.24 0.87 -1.39 -3.45 113.55 108.14 1azy h SER 66 Ca 0.00 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 1azy h SER 66 Cb 0.00 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 1azy h SER 66 CO 0.00 0.86 0.00 0.61 -0.53 0.00 0.00 176.83 177.77 1azy n GLY 67 N -0.61 3.08 3.89 5.77 0.00 -1.08 -4.70 105.19 111.53 1azy n GLY 67 Ca 0.03 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 44.89 1azy n GLY 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1azy s THR 68 N 4.11 5.42 -0.25 2.61 -4.23 0.41 -4.95 115.64 118.77 1azy s THR 68 Ca 0.00 0.07 0.02 0.00 -1.18 0.00 0.00 61.69 60.61 1azy s THR 68 Cb 0.00 -3.50 0.06 0.00 1.34 0.00 0.00 72.50 70.39 1azy s THR 68 CO 0.00 0.45 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.73 1azy s VAL 69 N -1.21 2.05 0.77 2.29 1.01 -1.26 -4.70 120.40 119.35 1azy s VAL 69 Ca 0.23 -1.50 -0.14 0.00 0.00 0.00 0.00 61.98 60.57 1azy s VAL 69 Cb -0.13 -2.15 0.06 0.00 0.00 0.00 0.00 36.38 34.16 1azy s VAL 69 CO 0.13 0.01 1.20 -0.76 0.00 0.00 0.00 175.10 175.68 1azy s LEU 70 N 1.17 3.21 -0.13 3.92 1.43 0.26 -4.95 118.68 123.58 1azy s LEU 70 Ca -0.07 2.32 -0.06 0.00 -1.03 0.00 0.00 54.13 55.29 1azy s LEU 70 Cb -0.19 -4.58 0.05 0.00 0.03 0.00 0.00 46.19 41.50 1azy s LEU 70 CO -0.06 -2.46 0.30 -0.62 0.23 0.00 0.00 176.35 173.74 1azy s ASP 71 N -2.19 -0.30 -0.18 2.29 2.15 -1.26 -3.96 116.67 113.22 1azy s ASP 71 Ca 0.73 0.65 0.17 0.00 0.43 0.00 0.00 52.55 54.52 1azy s ASP 71 Cb -0.28 0.55 0.53 0.00 -0.30 0.00 0.00 42.92 43.42 1azy s ASP 71 CO 0.49 -0.18 1.42 0.79 -0.17 0.00 0.00 175.17 177.51 1azy n TRP 72 N 4.34 0.93 -0.03 -5.34 7.02 -1.26 -4.67 117.44 118.42 1azy n TRP 72 Ca -0.23 -0.88 -0.12 0.00 -1.02 0.00 0.00 57.50 55.25 1azy n TRP 72 Cb 0.53 -0.31 -0.07 0.00 -2.42 0.00 0.00 31.31 29.04 1azy n TRP 72 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 1azy h LYS 73 N 1.77 0.19 -0.60 -0.99 3.64 -1.98 -3.00 116.57 115.60 1azy h LYS 73 Ca 0.00 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1azy h LYS 73 Cb 1.44 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 33.21 1azy h LYS 73 CO 0.22 0.40 0.40 0.66 -2.27 0.00 0.00 179.45 178.86 1azy h SER 74 N -0.05 0.51 0.65 4.20 4.64 -2.04 -1.02 113.55 120.43 1azy h SER 74 Ca 0.03 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.34 1azy h SER 74 Cb 0.31 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1azy h SER 74 CO 0.00 0.33 -0.09 -0.07 -0.87 0.00 0.00 176.83 176.14 1azy h LEU 75 N 0.58 0.00 -2.35 5.97 3.38 -1.85 -3.47 115.31 117.57 1azy h LEU 75 Ca 0.26 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.76 1azy h LEU 75 Cb 0.27 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.04 1azy h LEU 75 CO -0.08 0.09 -0.90 1.41 0.09 0.00 0.00 178.44 179.05 1azy n HIS 76 N -3.32 -1.78 -1.94 1.13 8.25 -0.39 -4.94 115.22 112.23 1azy n HIS 76 Ca -0.01 0.65 -0.34 0.00 -0.26 0.00 0.00 57.72 57.77 1azy n HIS 76 Cb 0.28 -3.74 0.03 0.00 1.12 0.00 0.00 29.99 27.67 1azy n HIS 76 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1azy s LEU 77 N -6.75 3.51 -0.84 2.41 1.43 -1.26 -4.96 118.68 112.23 1azy s LEU 77 Ca 0.17 2.04 -0.02 0.00 -1.03 0.00 0.00 54.13 55.29 1azy s LEU 77 Cb -0.06 -4.56 0.35 0.00 0.03 0.00 0.00 46.19 41.95 1azy s LEU 77 CO 0.87 -1.47 2.02 -0.46 0.23 0.00 0.00 176.35 177.54 1azy n ASN 78 N -2.04 7.50 -3.66 2.29 6.94 -1.26 -4.95 115.26 120.08 1azy n ASN 78 Ca 0.11 -3.84 -0.00 0.00 -0.02 0.00 0.00 54.58 50.83 1azy n ASN 78 Cb 0.52 -1.06 -0.01 0.00 -2.36 0.00 0.00 39.78 36.87 1azy n ASN 78 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1azy s GLY 79 N -1.14 -0.33 0.30 4.83 0.00 -1.26 -4.99 107.32 104.73 1azy s GLY 79 Ca 0.52 0.46 -0.27 0.00 0.00 0.00 0.00 44.72 45.43 1azy s GLY 79 CO -0.41 0.39 0.95 2.56 0.00 0.00 0.00 173.10 176.59 1azy s PRO 80 N -2.65 4.65 -0.42 2.90 0.04 -1.26 -4.83 135.00 133.44 1azy s PRO 80 Ca 0.14 1.39 -0.21 0.00 0.04 0.00 0.00 61.00 62.37 1azy s PRO 80 Cb 0.03 -2.94 0.02 0.00 0.04 0.00 0.00 34.50 31.65 1azy s PRO 80 CO -0.02 0.33 0.64 0.42 0.04 0.00 0.00 177.00 178.42 1azy s ILE 81 N -1.48 4.84 0.24 0.56 -1.09 -1.26 -1.13 121.20 121.89 1azy s ILE 81 Ca 0.48 0.22 0.02 0.00 -2.23 0.00 0.00 60.65 59.14 1azy s ILE 81 Cb -0.21 -4.17 -0.05 0.00 -1.58 0.00 0.00 42.46 36.44 1azy s ILE 81 CO 0.27 -0.53 0.06 0.68 -1.23 0.00 0.00 174.94 174.19 1azy s VAL 82 N 2.79 0.70 -0.17 2.92 -7.23 -0.68 0.44 120.40 119.17 1azy s VAL 82 Ca 0.23 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 58.08 1azy s VAL 82 Cb -0.14 -2.51 0.14 0.00 0.56 0.00 0.00 36.38 34.42 1azy s VAL 82 CO 0.18 -0.13 1.12 -0.62 -0.31 0.00 0.00 175.10 175.33 1azy s ASP 83 N -3.30 -0.23 0.26 4.85 2.15 -1.23 -4.13 116.67 115.04 1azy s ASP 83 Ca 0.34 0.13 0.09 0.00 0.43 0.00 0.00 52.55 53.53 1azy s ASP 83 Cb 0.07 0.21 -0.04 0.00 -0.30 0.00 0.00 42.92 42.86 1azy s ASP 83 CO 0.11 -0.30 0.07 -1.59 -0.17 0.00 0.00 175.17 173.29 1azy s LYS 84 N -1.89 2.51 -0.01 4.34 -2.85 -1.26 -2.97 119.74 117.61 1azy s LYS 84 Ca 0.05 -1.29 -0.00 0.00 -1.00 0.00 0.00 55.97 53.72 1azy s LYS 84 Cb -0.01 -2.30 0.01 0.00 -2.06 0.00 0.00 37.83 33.48 1azy s LYS 84 CO -0.04 0.37 0.02 -1.58 0.10 0.00 0.00 175.35 174.22 1azy s HIS 85 N -2.26 0.00 0.39 1.78 2.46 -0.36 -4.93 115.29 112.37 1azy s HIS 85 Ca 0.32 0.08 0.08 0.00 0.47 0.00 0.00 55.06 56.00 1azy s HIS 85 Cb -0.07 -0.09 -0.07 0.00 -0.13 0.00 0.00 32.58 32.22 1azy s HIS 85 CO 0.22 -0.04 0.01 0.45 -2.47 0.00 0.00 174.74 172.90 1azy s SER 86 N 0.45 3.95 -0.15 9.88 0.15 -1.26 -0.09 113.70 126.62 1azy s SER 86 Ca -0.04 -1.26 0.16 0.00 0.70 0.00 0.00 55.95 55.52 1azy s SER 86 Cb -0.05 -0.41 0.66 0.00 -1.71 0.00 0.00 66.02 64.51 1azy s SER 86 CO -0.01 -0.38 1.58 0.35 1.20 0.00 0.00 173.24 175.97 1azy n THR 87 N -0.96 2.13 0.00 6.45 -2.24 -1.15 -4.90 114.28 113.61 1azy n THR 87 Ca -0.04 -1.41 0.00 0.00 -2.27 0.00 0.00 64.05 60.33 1azy n THR 87 Cb 0.65 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 1azy n THR 87 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1azy n GLY 88 N 0.53 -2.06 0.00 3.38 0.00 -1.26 -4.74 105.19 101.03 1azy n GLY 88 Ca 0.24 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1azy n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1azy n GLY 89 N -2.22 0.88 3.57 -0.02 0.00 -1.26 -4.86 105.19 101.28 1azy n GLY 89 Ca 0.00 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 1azy n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1azy s VAL 90 N -2.00 5.07 0.00 1.61 1.01 -1.26 -3.74 120.40 121.09 1azy s VAL 90 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.40 1azy s VAL 90 Cb 0.00 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1azy s VAL 90 CO 0.00 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.62 1azy n GLY 91 N 4.74 0.71 3.21 4.51 0.00 -1.26 -2.52 105.19 114.58 1azy n GLY 91 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 1azy n GLY 91 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1azy n ASP 92 N 0.00 3.30 -1.76 1.61 2.03 -1.25 -2.17 116.55 118.32 1azy n ASP 92 Ca 0.00 -2.75 0.07 0.00 0.52 0.00 0.00 54.79 52.62 1azy n ASP 92 Cb 0.00 -1.47 0.37 0.00 -0.72 0.00 0.00 41.12 39.29 1azy n ASP 92 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1azy n VAL 93 N 6.31 2.47 0.28 5.18 3.14 -1.26 -4.61 118.33 129.84 1azy n VAL 93 Ca 0.49 -1.26 0.15 0.00 -2.96 0.00 0.00 64.34 60.75 1azy n VAL 93 Cb 0.42 -0.27 0.89 0.00 -1.06 0.00 0.00 33.84 33.82 1azy n VAL 93 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 1azy h THR 94 N 3.67 0.55 -0.18 1.55 1.35 -1.95 -2.84 112.91 115.06 1azy h THR 94 Ca 0.00 0.00 -0.09 0.00 -0.55 0.00 0.00 66.41 65.77 1azy h THR 94 Cb 1.83 0.98 -0.01 0.00 -1.73 0.00 0.00 68.15 69.21 1azy h THR 94 CO 0.44 0.00 -0.27 -1.28 -0.25 0.00 0.00 175.52 174.16 1azy h SER 95 N 0.00 0.34 0.33 5.36 0.87 -1.98 0.19 113.55 118.66 1azy h SER 95 Ca 0.01 -0.11 -0.08 0.00 -1.23 0.00 0.00 61.79 60.38 1azy h SER 95 Cb 0.06 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 1azy h SER 95 CO -0.00 0.61 -0.36 -0.07 -0.53 0.00 0.00 176.83 176.48 1azy h LEU 96 N 0.30 0.05 0.10 2.23 3.38 -1.89 -2.17 115.31 117.31 1azy h LEU 96 Ca 0.05 -0.02 -0.35 0.00 0.09 0.00 0.00 57.88 57.64 1azy h LEU 96 Cb 0.64 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1azy h LEU 96 CO 0.05 0.41 -1.96 0.23 0.09 0.00 0.00 178.44 177.25 1azy n MET 97 N -4.10 0.72 -0.09 1.13 2.81 -1.09 -4.36 117.12 112.14 1azy n MET 97 Ca -0.02 0.29 -0.06 0.00 -1.81 0.00 0.00 57.70 56.10 1azy n MET 97 Cb 0.41 -1.69 0.01 0.00 -0.71 0.00 0.00 33.22 31.23 1azy n MET 97 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1azy h LEU 98 N -0.09 0.02 0.06 4.03 6.46 -0.58 -2.32 115.31 122.90 1azy h LEU 98 Ca -0.44 0.05 0.03 0.00 -0.12 0.00 0.00 57.88 57.40 1azy h LEU 98 Cb 1.93 0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 41.88 1azy h LEU 98 CO 0.03 0.05 -0.40 1.23 -0.62 0.00 0.00 178.44 178.73 1azy h GLY 99 N 0.19 -0.75 0.97 3.75 0.00 -1.60 -2.40 103.07 103.22 1azy h GLY 99 Ca 0.16 0.48 -0.02 0.00 0.00 0.00 0.00 47.33 47.95 1azy h GLY 99 CO -0.20 -0.26 -0.18 -2.55 0.00 0.00 0.00 176.54 173.35 1azy h PRO 100 N -0.59 -0.48 -0.67 4.80 0.11 -1.75 -2.92 132.00 130.50 1azy h PRO 100 Ca 0.04 0.03 0.14 0.00 0.11 0.00 0.00 66.00 66.32 1azy h PRO 100 Cb 0.65 0.11 -0.11 0.00 0.11 0.00 0.00 31.00 31.76 1azy h PRO 100 CO -0.27 -0.32 0.05 0.52 -0.21 0.00 0.00 178.00 177.78 1azy h MET 101 N -0.50 0.16 0.00 1.05 2.86 -1.34 -0.74 114.93 116.43 1azy h MET 101 Ca -0.04 -0.01 -0.13 0.00 -2.06 0.00 0.00 59.70 57.46 1azy h MET 101 Cb 0.39 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1azy h MET 101 CO 0.06 0.10 -0.61 0.28 1.06 0.00 0.00 176.91 177.80 1azy h VAL 102 N 0.16 1.33 0.00 -2.22 2.07 -1.48 -3.04 116.25 113.07 1azy h VAL 102 Ca 0.36 -2.18 -0.14 0.00 0.82 0.00 0.00 66.70 65.55 1azy h VAL 102 Cb 0.60 2.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 1azy h VAL 102 CO -0.54 0.60 -0.68 0.00 0.02 0.00 0.00 177.57 176.97 1azy h ALA 103 N 1.39 0.80 0.00 1.67 0.00 -1.17 -0.80 119.26 121.15 1azy h ALA 103 Ca -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1azy h ALA 103 Cb 1.17 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1azy h ALA 103 CO 0.08 0.85 0.00 0.00 0.00 0.00 0.00 179.25 180.18 1azy n ALA 104 N -2.38 2.35 -0.89 0.00 0.00 -0.35 -2.68 120.51 116.56 1azy n ALA 104 Ca -0.01 -0.14 0.08 0.00 0.00 0.00 0.00 53.44 53.38 1azy n ALA 104 Cb 0.69 -1.40 0.12 0.00 0.00 0.00 0.00 19.45 18.86 1azy n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1azy n GLY 106 N -1.25 0.76 3.86 0.00 0.00 -1.09 -4.96 105.19 102.51 1azy n GLY 106 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1azy n GLY 106 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1azy s GLY 107 N -1.73 2.12 -0.26 -0.02 0.00 -0.35 -4.04 107.32 103.05 1azy s GLY 107 Ca 0.00 -0.76 -0.09 0.00 0.00 0.00 0.00 44.72 43.87 1azy s GLY 107 CO 0.00 -0.60 0.12 -0.19 0.00 0.00 0.00 173.10 172.43 1azy s TYR 108 N -1.21 3.16 -0.52 1.90 1.51 -0.28 -3.61 117.35 118.30 1azy s TYR 108 Ca 0.23 -0.13 -0.02 0.00 -1.01 0.00 0.00 57.07 56.14 1azy s TYR 108 Cb -0.12 -2.29 0.14 0.00 -0.11 0.00 0.00 41.96 39.58 1azy s TYR 108 CO 0.13 -0.22 0.32 0.42 -1.11 0.00 0.00 175.55 175.09 1azy s ILE 109 N 1.56 3.34 -1.39 2.71 -1.09 -0.54 -1.69 121.20 124.10 1azy s ILE 109 Ca 0.06 -2.68 -0.09 0.00 -2.23 0.00 0.00 60.65 55.72 1azy s ILE 109 Cb -0.15 -3.24 0.08 0.00 -1.58 0.00 0.00 42.46 37.57 1azy s ILE 109 CO 0.07 -0.79 2.32 -0.81 -1.23 0.00 0.00 174.94 174.50 1azy n PRO 110 N 3.84 3.88 -1.67 2.79 -0.04 -1.26 -2.96 135.00 139.58 1azy n PRO 110 Ca 0.04 -3.11 -0.17 0.00 -0.04 0.00 0.00 63.50 60.22 1azy n PRO 110 Cb 0.38 -2.85 -0.11 0.00 -0.04 0.00 0.00 33.50 30.89 1azy n PRO 110 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1azy n MET 111 N 3.36 0.36 -2.58 0.54 2.81 -0.91 -4.90 117.12 115.80 1azy n MET 111 Ca 0.57 -1.85 -0.41 0.00 -1.81 0.00 0.00 57.70 54.20 1azy n MET 111 Cb 0.30 -3.92 -0.03 0.00 -0.71 0.00 0.00 33.22 28.86 1azy n MET 111 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1azy s ILE 112 N 16.39 3.80 0.00 2.02 1.01 -1.26 -2.42 121.20 140.73 1azy s ILE 112 Ca 0.80 0.22 0.00 0.00 0.00 0.00 0.00 60.65 61.67 1azy s ILE 112 Cb -0.04 -4.91 0.00 0.00 0.01 0.00 0.00 42.46 37.52 1azy s ILE 112 CO 0.18 -1.83 0.00 -1.20 0.00 0.00 0.00 174.94 172.09 1azy n SER 113 N 9.17 0.00 -1.45 3.58 7.64 0.02 -4.82 113.62 127.77 1azy n SER 113 Ca 0.05 -0.36 -0.01 0.00 1.01 0.00 0.00 58.87 59.56 1azy n SER 113 Cb 0.49 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.71 1azy n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1azy n GLY 114 N 5.00 -0.04 7.00 0.23 0.00 -1.26 -2.84 105.19 113.28 1azy n GLY 114 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1azy n GLY 114 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1azy n ARG 115 N -0.34 0.00 0.00 1.61 1.85 -1.26 -4.74 116.66 113.78 1azy n ARG 115 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.78 1azy n ARG 115 Cb 0.55 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.96 1azy n ARG 115 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1azy n GLY 116 N 0.00 -1.97 3.76 2.89 0.00 -1.20 -4.33 105.19 104.34 1azy n GLY 116 Ca 0.00 0.95 -0.39 0.00 0.00 0.00 0.00 46.02 46.58 1azy n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1azy s LEU 117 N 0.00 4.11 0.00 0.99 1.02 -1.26 -1.72 118.68 121.82 1azy s LEU 117 Ca 0.00 2.75 0.00 0.00 0.02 0.00 0.00 54.13 56.90 1azy s LEU 117 Cb 0.00 -3.99 0.00 0.00 0.02 0.00 0.00 46.19 42.22 1azy s LEU 117 CO 0.00 -1.09 0.00 0.61 0.02 0.00 0.00 176.35 175.89 1azy n GLY 118 N 0.63 2.95 0.47 -3.19 0.00 -1.26 -4.64 105.19 100.14 1azy n GLY 118 Ca 0.05 -0.81 -0.01 0.00 0.00 0.00 0.00 46.02 45.26 1azy n GLY 118 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1azy n HIS 119 N 0.00 0.00 -3.84 1.61 1.44 -1.25 -4.94 115.22 108.24 1azy n HIS 119 Ca 0.00 -0.07 -0.29 0.00 -2.01 0.00 0.00 57.72 55.36 1azy n HIS 119 Cb 0.00 0.26 -0.16 0.00 0.12 0.00 0.00 29.99 30.21 1azy n HIS 119 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 1azy s THR 120 N 0.00 1.01 -0.93 0.61 2.01 -0.70 -4.93 115.64 112.71 1azy s THR 120 Ca 0.00 -0.86 -0.25 0.00 0.31 0.00 0.00 61.69 60.89 1azy s THR 120 Cb 0.00 -1.39 -0.09 0.00 0.01 0.00 0.00 72.50 71.03 1azy s THR 120 CO 0.00 -0.14 2.08 -0.83 -0.69 0.00 0.00 174.62 175.05 1azy s GLY 121 N 1.64 -0.20 0.77 4.40 0.00 -1.26 -3.27 107.32 109.39 1azy s GLY 121 Ca -0.03 -1.42 -0.13 0.00 0.00 0.00 0.00 44.72 43.14 1azy s GLY 121 CO -0.07 3.77 1.15 -0.32 0.00 0.00 0.00 173.10 177.62 1azy s GLY 122 N 8.59 2.01 0.25 0.20 0.00 -1.26 -4.91 107.32 112.20 1azy s GLY 122 Ca 0.77 0.62 0.08 0.00 0.00 0.00 0.00 44.72 46.18 1azy s GLY 122 CO 0.05 1.00 1.58 -0.91 0.00 0.00 0.00 173.10 174.83 1azy h THR 123 N -0.80 1.42 -0.88 0.90 1.35 -1.92 -3.17 112.91 109.82 1azy h THR 123 Ca -0.45 -2.07 0.16 0.00 -0.55 0.00 0.00 66.41 63.50 1azy h THR 123 Cb 1.27 2.09 -0.07 0.00 -1.73 0.00 0.00 68.15 69.71 1azy h THR 123 CO 0.49 0.60 0.57 -0.07 -0.25 0.00 0.00 175.52 176.86 1azy h LEU 124 N 0.08 0.55 -0.26 3.87 3.38 -1.92 0.90 115.31 121.92 1azy h LEU 124 Ca -0.01 0.04 -0.18 0.00 0.09 0.00 0.00 57.88 57.82 1azy h LEU 124 Cb 1.11 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 1azy h LEU 124 CO 0.09 0.26 -0.86 0.44 0.09 0.00 0.00 178.44 178.45 1azy h ASP 125 N 0.57 0.00 -0.03 -0.43 3.32 -1.94 -3.01 116.42 114.90 1azy h ASP 125 Ca 0.45 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.50 1azy h ASP 125 Cb 0.88 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.43 1azy h ASP 125 CO -0.20 0.86 0.00 0.11 -1.72 0.00 0.00 179.24 178.30 1azy h LYS 126 N 0.00 0.05 0.00 3.56 1.57 -0.96 -2.61 116.57 118.19 1azy h LYS 126 Ca -0.01 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1azy h LYS 126 Cb 1.54 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.84 1azy h LYS 126 CO 0.11 0.32 0.00 -0.07 -0.57 0.00 0.00 179.45 179.24 1azy h LEU 127 N -0.22 0.00 -0.37 2.94 3.38 -1.14 -1.47 115.31 118.43 1azy h LEU 127 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1azy h LEU 127 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1azy h LEU 127 CO 0.00 0.00 -0.06 -0.62 0.09 0.00 0.00 178.44 177.85 1azy n GLU 128 N -2.63 1.01 0.00 1.13 1.02 -0.98 -2.97 120.64 117.21 1azy n GLU 128 Ca -0.01 -0.37 0.15 0.00 -0.02 0.00 0.00 57.16 56.90 1azy n GLU 128 Cb 0.09 -1.49 0.70 0.00 -0.02 0.00 0.00 31.44 30.72 1azy n GLU 128 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1azy n SER 129 N -0.67 0.59 -4.51 1.62 3.41 -0.55 -4.63 113.62 108.88 1azy n SER 129 Ca 0.18 -0.98 -0.42 0.00 -0.26 0.00 0.00 58.87 57.39 1azy n SER 129 Cb 0.26 -0.03 -0.09 0.00 -0.26 0.00 0.00 64.21 64.09 1azy n SER 129 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1azy s ILE 130 N -2.18 5.09 -0.73 -1.33 1.01 -1.16 -4.39 121.20 117.52 1azy s ILE 130 Ca 0.38 -0.16 -0.37 0.00 0.00 0.00 0.00 60.65 60.50 1azy s ILE 130 Cb 0.21 -3.98 -0.20 0.00 0.01 0.00 0.00 42.46 38.51 1azy s ILE 130 CO 0.40 -0.32 2.42 -2.65 0.00 0.00 0.00 174.94 174.79 1azy n PRO 131 N 5.58 0.10 -0.01 2.79 -0.02 -1.26 -1.27 135.00 140.90 1azy n PRO 131 Ca -0.07 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1azy n PRO 131 Cb 0.48 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 1azy n PRO 131 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1azy n GLY 132 N 6.92 0.47 3.56 -1.23 0.00 -1.26 -4.34 105.19 109.30 1azy n GLY 132 Ca 0.59 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 46.13 1azy n GLY 132 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1azy n PHE 133 N -2.00 1.91 -3.32 1.61 7.35 -0.40 -4.38 117.46 118.23 1azy n PHE 133 Ca 0.00 0.08 -0.42 0.00 -0.76 0.00 0.00 57.45 56.35 1azy n PHE 133 Cb 0.00 -2.63 -0.09 0.00 0.35 0.00 0.00 39.48 37.12 1azy n PHE 133 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1azy s ASP 134 N 6.70 6.21 0.00 -2.13 2.15 0.14 -4.86 116.67 124.88 1azy s ASP 134 Ca 1.02 -0.52 0.19 0.00 0.43 0.00 0.00 52.55 53.67 1azy s ASP 134 Cb -0.66 -2.23 0.57 0.00 -0.30 0.00 0.00 42.92 40.30 1azy s ASP 134 CO 0.46 -0.53 1.44 2.30 -0.17 0.00 0.00 175.17 178.67 1azy n ILE 135 N 5.42 0.39 -2.67 4.11 -5.35 -1.26 -4.48 119.36 115.51 1azy n ILE 135 Ca -0.07 -0.50 -0.27 0.00 -0.27 0.00 0.00 62.75 61.64 1azy n ILE 135 Cb 0.48 0.44 -0.02 0.00 -1.74 0.00 0.00 39.64 38.81 1azy n ILE 135 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1azy n PHE 136 N 0.68 3.64 -2.43 4.28 3.72 -1.26 -0.77 117.46 125.33 1azy n PHE 136 Ca 0.16 -3.48 -0.37 0.00 -0.05 0.00 0.00 57.45 53.71 1azy n PHE 136 Cb 0.39 -0.25 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 1azy n PHE 136 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1azy s PRO 137 N -3.51 4.11 0.88 -1.08 0.04 -1.26 -5.00 135.00 129.17 1azy s PRO 137 Ca 0.48 1.66 -0.11 0.00 0.04 0.00 0.00 61.00 63.07 1azy s PRO 137 Cb 0.35 -2.61 0.12 0.00 0.04 0.00 0.00 34.50 32.40 1azy s PRO 137 CO -0.17 -0.23 1.09 0.16 0.04 0.00 0.00 177.00 177.90 1azy s ASP 138 N -1.36 3.59 0.21 6.66 -4.77 -1.26 -4.60 116.67 115.13 1azy s ASP 138 Ca 0.57 1.65 -0.17 0.00 -3.30 0.00 0.00 52.55 51.30 1azy s ASP 138 Cb -0.26 -2.31 0.20 0.00 -1.09 0.00 0.00 42.92 39.46 1azy s ASP 138 CO 0.33 -2.59 1.59 0.44 0.70 0.00 0.00 175.17 175.64 1azy h ASP 139 N -1.52 -1.00 -0.87 2.11 3.32 -1.98 0.17 116.42 116.65 1azy h ASP 139 Ca -0.48 0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.79 1azy h ASP 139 Cb 1.27 0.55 -0.04 0.00 0.22 0.00 0.00 39.33 41.32 1azy h ASP 139 CO 0.52 -0.28 0.47 0.78 -1.72 0.00 0.00 179.24 179.02 1azy h ASN 140 N -0.09 1.10 -0.34 6.45 2.35 -1.99 0.18 115.58 123.24 1azy h ASN 140 Ca 0.29 -0.10 -0.14 0.00 -0.55 0.00 0.00 56.30 55.80 1azy h ASN 140 Cb 0.55 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1azy h ASN 140 CO -0.74 0.88 -0.33 -0.09 -1.65 0.00 0.00 177.43 175.51 1azy h ARG 141 N 1.23 0.82 0.02 0.81 9.65 -1.65 -2.39 114.38 122.86 1azy h ARG 141 Ca 0.31 -0.43 -0.00 0.00 -1.10 0.00 0.00 59.98 58.76 1azy h ARG 141 Cb 0.03 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 1azy h ARG 141 CO -0.05 1.06 -0.01 0.35 2.80 0.00 0.00 179.97 184.13 1azy h PHE 142 N 0.60 -0.03 -0.68 2.20 3.57 -0.29 -1.94 116.94 120.38 1azy h PHE 142 Ca 0.05 -0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.69 1azy h PHE 142 Cb 0.91 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.62 1azy h PHE 142 CO 0.07 -0.01 0.46 0.00 -2.23 0.00 0.00 178.31 176.60 1azy h ARG 143 N -0.04 0.33 -0.03 1.11 3.08 -0.60 -2.31 114.38 115.92 1azy h ARG 143 Ca -0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1azy h ARG 143 Cb 0.03 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 1azy h ARG 143 CO 0.00 0.22 -0.03 0.93 -1.07 0.00 0.00 179.97 180.02 1azy h GLU 144 N 0.34 0.07 -0.62 0.04 5.08 -0.85 -3.06 114.58 115.58 1azy h GLU 144 Ca 0.33 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.70 1azy h GLU 144 Cb 0.80 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.00 1azy h GLU 144 CO -0.09 0.56 0.34 0.82 -1.00 0.00 0.00 179.01 179.64 1azy h ILE 145 N -0.42 0.96 0.30 3.13 2.04 -0.85 0.30 117.51 122.98 1azy h ILE 145 Ca 0.00 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 1azy h ILE 145 Cb 0.55 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1azy h ILE 145 CO 0.01 0.12 -0.27 0.40 0.00 0.00 0.00 178.15 178.41 1azy h ILE 146 N 0.63 0.44 -0.69 -0.67 1.08 -1.52 0.58 117.51 117.36 1azy h ILE 146 Ca 0.28 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.71 1azy h ILE 146 Cb 0.17 0.44 -0.03 0.00 -3.07 0.00 0.00 36.82 34.33 1azy h ILE 146 CO -0.18 0.00 0.29 0.50 -0.69 0.00 0.00 178.15 178.08 1azy h LYS 147 N -0.59 1.02 0.15 2.37 3.64 -1.40 0.56 116.57 122.33 1azy h LYS 147 Ca -0.02 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.18 1azy h LYS 147 Cb 0.53 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1azy h LYS 147 CO -0.03 0.83 -0.07 -0.44 -2.27 0.00 0.00 179.45 177.47 1azy h ASP 148 N 0.97 -0.18 0.01 4.20 3.32 -0.78 -3.40 116.42 120.57 1azy h ASP 148 Ca 0.23 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.17 1azy h ASP 148 Cb 0.18 0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.79 1azy h ASP 148 CO -0.02 0.08 -0.48 0.58 -1.72 0.00 0.00 179.24 177.67 1azy h VAL 149 N -0.61 1.49 0.00 -1.35 2.07 0.07 -3.49 116.25 114.44 1azy h VAL 149 Ca -0.02 -2.09 0.00 0.00 0.82 0.00 0.00 66.70 65.41 1azy h VAL 149 Cb 0.16 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1azy h VAL 149 CO 0.03 0.59 0.00 0.61 0.02 0.00 0.00 177.57 178.83 1azy n GLY 150 N 1.14 2.14 3.61 2.17 0.00 0.20 -4.94 105.19 109.51 1azy n GLY 150 Ca -0.10 -0.60 -0.28 0.00 0.00 0.00 0.00 46.02 45.04 1azy n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1azy s VAL 151 N -0.79 1.90 -0.30 1.61 1.01 -1.26 -1.47 120.40 121.10 1azy s VAL 151 Ca 0.00 -2.00 -0.19 0.00 0.00 0.00 0.00 61.98 59.79 1azy s VAL 151 Cb 0.00 -2.96 0.19 0.00 0.00 0.00 0.00 36.38 33.62 1azy s VAL 151 CO 0.00 0.00 1.24 0.00 0.00 0.00 0.00 175.10 176.34 1azy s ALA 152 N -2.76 -3.17 -0.46 5.51 0.00 -1.16 -4.27 121.76 115.45 1azy s ALA 152 Ca 0.34 1.84 -0.08 0.00 0.00 0.00 0.00 51.96 54.06 1azy s ALA 152 Cb 0.10 -2.24 0.12 0.00 0.00 0.00 0.00 23.12 21.09 1azy s ALA 152 CO 0.17 -0.94 0.32 0.42 0.00 0.00 0.00 175.76 175.73 1azy s ILE 153 N 2.06 4.07 0.21 0.00 1.01 -1.26 -2.14 121.20 125.14 1azy s ILE 153 Ca -0.00 -1.81 0.10 0.00 0.00 0.00 0.00 60.65 58.94 1azy s ILE 153 Cb -0.02 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 1azy s ILE 153 CO -0.16 -0.75 -0.20 0.27 0.00 0.00 0.00 174.94 174.10 1azy s ILE 154 N 1.33 2.10 0.32 2.92 -4.36 -1.02 -4.80 121.20 117.70 1azy s ILE 154 Ca 0.06 -2.11 -0.23 0.00 -0.26 0.00 0.00 60.65 58.11 1azy s ILE 154 Cb -0.26 -2.05 -0.10 0.00 1.25 0.00 0.00 42.46 41.30 1azy s ILE 154 CO -0.01 -0.32 0.89 -0.83 0.24 0.00 0.00 174.94 174.91 1azy s GLY 155 N -2.96 2.67 0.05 6.27 0.00 0.05 -0.80 107.32 112.61 1azy s GLY 155 Ca 0.21 0.41 -0.32 0.00 0.00 0.00 0.00 44.72 45.02 1azy s GLY 155 CO 0.09 0.80 1.85 0.61 0.00 0.00 0.00 173.10 176.45 1azy n GLN 156 N 0.35 2.55 -1.44 2.90 10.64 -1.13 -4.85 117.38 126.41 1azy n GLN 156 Ca 0.02 0.93 -0.39 0.00 -1.83 0.00 0.00 57.00 55.73 1azy n GLN 156 Cb 0.51 -2.81 -0.03 0.00 -0.86 0.00 0.00 30.24 27.05 1azy n GLN 156 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 1azy n THR 157 N 4.86 4.47 0.00 -0.39 -1.04 -1.26 -4.89 114.28 116.02 1azy n THR 157 Ca 0.20 -2.89 0.00 0.00 -2.04 0.00 0.00 64.05 59.32 1azy n THR 157 Cb 0.35 -2.53 0.00 0.00 -1.82 0.00 0.00 70.33 66.33 1azy n THR 157 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1azy n SER 158 N 3.31 0.00 -2.24 8.00 7.64 -1.26 -4.51 113.62 124.57 1azy n SER 158 Ca 0.76 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.64 1azy n SER 158 Cb 0.24 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 1azy n SER 158 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1azy n SER 159 N 0.28 0.00 -0.03 6.43 3.41 -1.26 -4.30 113.62 118.15 1azy n SER 159 Ca 0.00 -0.70 -0.02 0.00 -0.26 0.00 0.00 58.87 57.89 1azy n SER 159 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 1azy n SER 159 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1azy h LEU 160 N 3.53 0.00 -6.40 1.04 5.85 -1.84 1.20 115.31 118.69 1azy h LEU 160 Ca 0.00 0.00 -0.59 0.00 0.84 0.00 0.00 57.88 58.13 1azy h LEU 160 Cb 0.00 0.00 -0.38 0.00 0.37 0.00 0.00 40.66 40.65 1azy h LEU 160 CO 0.04 0.32 -0.95 0.00 -0.34 0.00 0.00 178.44 177.51 1azy s ALA 161 N -2.88 1.41 0.14 1.25 0.00 -1.26 -2.96 121.76 117.45 1azy s ALA 161 Ca -0.06 -2.42 -0.13 0.00 0.00 0.00 0.00 51.96 49.34 1azy s ALA 161 Cb 0.01 -1.61 -0.00 0.00 0.00 0.00 0.00 23.12 21.52 1azy s ALA 161 CO 0.09 -1.99 1.58 -1.35 0.00 0.00 0.00 175.76 174.09 1azy h PRO 162 N 5.77 0.81 -1.00 0.00 0.11 -1.84 -3.21 132.00 132.64 1azy h PRO 162 Ca 0.24 -0.27 0.21 0.00 0.11 0.00 0.00 66.00 66.29 1azy h PRO 162 Cb 0.91 -0.07 -0.10 0.00 0.11 0.00 0.00 31.00 31.86 1azy h PRO 162 CO 0.37 0.88 0.62 0.00 -0.21 0.00 0.00 178.00 179.66 1azy h ALA 163 N 0.90 1.86 0.00 -0.75 0.00 -1.87 0.16 119.26 119.56 1azy h ALA 163 Ca 0.12 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1azy h ALA 163 Cb 0.53 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1azy h ALA 163 CO 0.03 -0.24 -0.01 0.22 0.00 0.00 0.00 179.25 179.25 1azy h ASP 164 N 0.63 0.00 0.91 0.00 3.58 -1.89 -2.08 116.42 117.57 1azy h ASP 164 Ca 0.57 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.98 1azy h ASP 164 Cb 1.08 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.14 1azy h ASP 164 CO -0.35 0.01 -0.44 0.50 -2.88 0.00 0.00 179.24 176.09 1azy h LYS 165 N 0.00 -1.17 -0.27 0.28 1.63 -0.82 -1.13 116.57 115.10 1azy h LYS 165 Ca -0.00 0.08 -0.16 0.00 -0.85 0.00 0.00 60.65 59.72 1azy h LYS 165 Cb 0.03 0.27 0.00 0.00 -0.60 0.00 0.00 32.23 31.93 1azy h LYS 165 CO 0.00 -0.78 -0.47 0.00 -3.45 0.00 0.00 179.45 174.76 1azy h ARG 166 N -1.22 0.79 -0.27 1.90 3.08 -1.62 -2.72 114.38 114.31 1azy h ARG 166 Ca -0.12 -0.49 0.04 0.00 0.07 0.00 0.00 59.98 59.47 1azy h ARG 166 Cb 0.93 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.00 1azy h ARG 166 CO 0.20 1.12 0.06 0.35 -1.07 0.00 0.00 179.97 180.63 1azy h PHE 167 N 0.54 0.10 -0.40 3.04 3.04 -1.43 -2.06 116.94 119.77 1azy h PHE 167 Ca 0.02 0.02 -0.12 0.00 3.98 0.00 0.00 57.97 61.86 1azy h PHE 167 Cb 1.07 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.56 1azy h PHE 167 CO 0.08 0.03 -0.23 -0.92 -2.02 0.00 0.00 178.31 175.25 1azy h TYR 168 N 0.16 1.01 -0.68 0.41 3.20 -1.26 -2.38 116.97 117.43 1azy h TYR 168 Ca 0.12 -0.26 0.05 0.00 3.14 0.00 0.00 58.73 61.78 1azy h TYR 168 Cb 0.12 -0.23 -0.05 0.00 1.54 0.00 0.00 36.73 38.11 1azy h TYR 168 CO -0.16 1.04 0.40 0.00 -1.64 0.00 0.00 178.16 177.80 1azy h ALA 169 N 0.81 0.90 0.22 1.82 0.00 -1.31 -1.53 119.26 120.16 1azy h ALA 169 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1azy h ALA 169 Cb 0.80 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1azy h ALA 169 CO 0.07 0.11 -0.10 1.15 0.00 0.00 0.00 179.25 180.47 1azy h THR 170 N 0.75 0.86 -0.97 0.00 2.02 -1.36 -3.15 112.91 111.07 1azy h THR 170 Ca 0.29 -0.53 0.19 0.00 0.77 0.00 0.00 66.41 67.13 1azy h THR 170 Cb 0.12 1.17 -0.09 0.00 -1.74 0.00 0.00 68.15 67.62 1azy h THR 170 CO -0.15 0.12 0.61 0.03 0.37 0.00 0.00 175.52 176.50 1azy h ARG 171 N -0.56 0.62 -0.02 6.66 3.08 -1.21 -1.61 114.38 121.34 1azy h ARG 171 Ca -0.03 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 1azy h ARG 171 Cb 0.42 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 1azy h ARG 171 CO 0.05 0.41 -0.10 0.22 -1.07 0.00 0.00 179.97 179.48 1azy h ASP 172 N 0.64 0.02 -0.01 7.04 3.58 -1.24 -2.83 116.42 123.62 1azy h ASP 172 Ca 0.53 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.98 1azy h ASP 172 Cb 0.98 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 42.02 1azy h ASP 172 CO -0.29 0.12 -0.55 2.30 -2.88 0.00 0.00 179.24 177.95 1azy n ILE 173 N -4.41 0.00 -0.37 2.25 -5.35 -0.67 -4.42 119.36 106.39 1azy n ILE 173 Ca -0.02 -0.23 0.07 0.00 -0.27 0.00 0.00 62.75 62.30 1azy n ILE 173 Cb 0.18 1.13 0.20 0.00 -1.74 0.00 0.00 39.64 39.41 1azy n ILE 173 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1azy n THR 174 N -0.60 1.29 -2.15 7.28 -2.24 -0.81 -4.99 114.28 112.06 1azy n THR 174 Ca 0.06 -1.17 -0.20 0.00 -2.27 0.00 0.00 64.05 60.47 1azy n THR 174 Cb 0.34 0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 68.88 1azy n THR 174 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1azy n ALA 175 N 0.46 -0.50 -1.12 6.98 0.00 -1.13 -4.90 120.51 120.29 1azy n ALA 175 Ca 0.15 0.20 0.07 0.00 0.00 0.00 0.00 53.44 53.87 1azy n ALA 175 Cb 0.56 -2.07 0.20 0.00 0.00 0.00 0.00 19.45 18.14 1azy n ALA 175 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1azy n THR 176 N -3.58 2.17 0.08 0.00 -2.24 -1.09 -4.68 114.28 104.94 1azy n THR 176 Ca -0.22 -2.23 -0.17 0.00 -2.27 0.00 0.00 64.05 59.16 1azy n THR 176 Cb 0.67 -0.26 -0.09 0.00 -2.10 0.00 0.00 70.33 68.55 1azy n THR 176 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1azy h VAL 177 N 0.96 1.39 -0.37 2.28 3.04 -1.90 -3.36 116.25 118.28 1azy h VAL 177 Ca 0.03 -2.59 -0.70 0.00 -1.01 0.00 0.00 66.70 62.43 1azy h VAL 177 Cb 1.28 2.62 -0.02 0.00 -2.01 0.00 0.00 31.29 33.15 1azy h VAL 177 CO 0.15 0.77 3.36 -0.90 -1.01 0.00 0.00 177.57 179.94 1azy n ASP 178 N -3.71 8.23 -3.88 3.17 5.75 -1.26 -4.69 116.55 120.15 1azy n ASP 178 Ca -0.09 -2.76 -0.30 0.00 -0.01 0.00 0.00 54.79 51.63 1azy n ASP 178 Cb 0.92 -1.51 -0.16 0.00 -1.03 0.00 0.00 41.12 39.35 1azy n ASP 178 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1azy s SER 179 N 1.67 3.62 0.28 -1.12 0.15 -1.26 -5.05 113.70 111.99 1azy s SER 179 Ca 0.63 -1.10 0.02 0.00 0.70 0.00 0.00 55.95 56.21 1azy s SER 179 Cb 0.18 -1.03 0.67 0.00 -1.71 0.00 0.00 66.02 64.13 1azy s SER 179 CO -0.07 -0.26 1.71 0.40 1.20 0.00 0.00 173.24 176.22 1azy h ILE 180 N 6.63 0.53 -0.83 6.45 2.04 -1.96 -1.22 117.51 129.16 1azy h ILE 180 Ca -0.17 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 1azy h ILE 180 Cb 1.08 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 1azy h ILE 180 CO 0.39 0.08 0.40 -0.65 0.00 0.00 0.00 178.15 178.37 1azy h PRO 181 N 0.44 1.19 -0.29 2.37 0.11 -1.96 -0.83 132.00 133.03 1azy h PRO 181 Ca 0.53 -0.17 -0.16 0.00 0.11 0.00 0.00 66.00 66.30 1azy h PRO 181 Cb 0.95 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 31.84 1azy h PRO 181 CO -0.49 0.91 -0.47 -0.07 -0.21 0.00 0.00 178.00 177.67 1azy h LEU 182 N 1.18 0.84 -0.03 2.35 3.38 -1.66 -2.86 115.31 118.51 1azy h LEU 182 Ca 0.28 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1azy h LEU 182 Cb 0.11 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1azy h LEU 182 CO -0.04 1.18 -0.01 0.40 0.09 0.00 0.00 178.44 180.06 1azy h ILE 183 N 0.61 1.29 -0.43 1.22 2.04 -1.04 -2.05 117.51 119.15 1azy h ILE 183 Ca 0.03 -0.89 0.09 0.00 1.00 0.00 0.00 64.86 65.10 1azy h ILE 183 Cb 1.04 1.84 -0.09 0.00 -0.74 0.00 0.00 36.82 38.87 1azy h ILE 183 CO 0.10 0.24 -0.21 0.74 0.00 0.00 0.00 178.15 179.02 1azy h THR 184 N -0.31 0.38 -0.11 -0.27 2.02 -1.17 -1.37 112.91 112.09 1azy h THR 184 Ca 0.01 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.09 1azy h THR 184 Cb 0.38 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1azy h THR 184 CO 0.00 0.00 -0.37 0.00 0.37 0.00 0.00 175.52 175.52 1azy h ALA 185 N 1.16 1.18 -0.01 6.16 0.00 -1.52 -2.91 119.26 123.32 1azy h ALA 185 Ca 0.21 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1azy h ALA 185 Cb 0.45 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1azy h ALA 185 CO -0.51 0.55 -0.00 1.03 0.00 0.00 0.00 179.25 180.32 1azy h SER 186 N 0.19 0.01 -0.02 0.00 0.87 -0.55 -2.39 113.55 111.66 1azy h SER 186 Ca 0.02 -0.32 -0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1azy h SER 186 Cb 0.74 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1azy h SER 186 CO 0.06 0.33 0.01 0.40 -0.53 0.00 0.00 176.83 177.10 1azy h ILE 187 N -0.30 1.06 0.00 2.23 2.04 -1.30 -3.21 117.51 118.03 1azy h ILE 187 Ca 0.00 -0.18 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 1azy h ILE 187 Cb 0.32 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1azy h ILE 187 CO 0.00 0.05 -0.27 -0.07 0.00 0.00 0.00 178.15 177.86 1azy h LEU 188 N -0.04 0.00 -0.33 1.44 3.38 -1.61 -3.30 115.31 114.85 1azy h LEU 188 Ca 0.01 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.04 1azy h LEU 188 Cb 0.07 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 1azy h LEU 188 CO -0.00 0.27 -0.04 0.00 0.09 0.00 0.00 178.44 178.76 1azy h ALA 189 N 1.73 0.26 0.07 1.53 0.00 -1.42 0.34 119.26 121.77 1azy h ALA 189 Ca -0.00 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1azy h ALA 189 Cb 0.75 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1azy h ALA 189 CO 0.03 -0.43 -0.03 0.87 0.00 0.00 0.00 179.25 179.69 1azy h LYS 190 N 0.05 -0.09 -0.23 0.00 1.79 -1.71 -3.06 116.57 113.32 1azy h LYS 190 Ca 0.16 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.62 1azy h LYS 190 Cb 0.23 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.90 1azy h LYS 190 CO -0.31 0.06 0.06 0.87 -1.08 0.00 0.00 179.45 179.06 1azy h LYS 191 N -0.23 0.36 0.00 3.15 1.79 -1.59 -2.73 116.57 117.32 1azy h LYS 191 Ca -0.01 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1azy h LYS 191 Cb 0.19 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1azy h LYS 191 CO 0.02 0.47 0.00 1.28 -1.08 0.00 0.00 179.45 180.14 1azy n LEU 192 N -4.74 0.00 0.13 2.94 4.77 0.12 -1.00 117.00 119.21 1azy n LEU 192 Ca -0.04 0.45 0.01 0.00 -0.03 0.00 0.00 56.01 56.40 1azy n LEU 192 Cb 0.17 -0.45 0.04 0.00 -2.33 0.00 0.00 43.42 40.85 1azy n LEU 192 CO 0.36 -0.38 0.42 0.00 -1.33 0.00 0.00 177.39 176.46 1azy h ALA 193 N 2.17 0.65 0.00 -1.18 0.00 -1.37 -3.22 119.26 116.30 1azy h ALA 193 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1azy h ALA 193 Cb 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1azy h ALA 193 CO 0.00 0.76 0.00 0.39 0.00 0.00 0.00 179.25 180.40 1azy n GLU 194 N -3.31 0.32 -3.23 0.00 1.02 -0.17 -0.58 120.64 114.69 1azy n GLU 194 Ca 0.01 0.08 -0.15 0.00 -0.02 0.00 0.00 57.16 57.07 1azy n GLU 194 Cb 0.75 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.74 1azy n GLU 194 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1azy n GLY 195 N -0.13 -0.23 3.76 0.62 0.00 -1.22 -4.69 105.19 103.31 1azy n GLY 195 Ca 0.09 0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1azy n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1azy s LEU 196 N -5.72 2.16 -0.06 0.99 1.43 -1.26 -4.82 118.68 111.40 1azy s LEU 196 Ca 0.13 1.18 0.03 0.00 -1.03 0.00 0.00 54.13 54.44 1azy s LEU 196 Cb -0.06 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.52 1azy s LEU 196 CO 0.59 -2.48 -0.02 0.47 0.23 0.00 0.00 176.35 175.14 1azy n ASP 197 N -3.75 3.58 -3.89 2.29 8.00 0.17 -4.85 116.55 118.10 1azy n ASP 197 Ca 0.06 -0.02 -0.09 0.00 0.71 0.00 0.00 54.79 55.46 1azy n ASP 197 Cb 0.57 0.27 -0.08 0.00 -0.02 0.00 0.00 41.12 41.86 1azy n ASP 197 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1azy s ALA 198 N -2.13 -0.13 0.14 2.24 0.00 -1.12 -2.19 121.76 118.56 1azy s ALA 198 Ca -0.06 -0.67 -0.11 0.00 0.00 0.00 0.00 51.96 51.13 1azy s ALA 198 Cb 0.02 0.43 0.00 0.00 0.00 0.00 0.00 23.12 23.58 1azy s ALA 198 CO 0.19 -0.47 0.30 -1.17 0.00 0.00 0.00 175.76 174.61 1azy s LEU 199 N -2.79 0.91 -0.12 0.00 2.96 -0.51 -3.48 118.68 115.65 1azy s LEU 199 Ca 0.04 -0.69 -0.04 0.00 -0.22 0.00 0.00 54.13 53.22 1azy s LEU 199 Cb 0.05 1.35 0.06 0.00 0.50 0.00 0.00 46.19 48.15 1azy s LEU 199 CO -0.10 -0.86 0.22 0.54 -1.32 0.00 0.00 176.35 174.82 1azy s VAL 200 N -3.90 -0.35 -0.06 1.68 0.11 -1.16 -3.11 120.40 113.62 1azy s VAL 200 Ca 0.11 0.26 -0.18 0.00 -2.93 0.00 0.00 61.98 59.24 1azy s VAL 200 Cb 0.03 -0.42 -0.05 0.00 -1.53 0.00 0.00 36.38 34.41 1azy s VAL 200 CO -0.05 0.09 0.49 -0.04 -3.33 0.00 0.00 175.10 172.25 1azy s MET 201 N 2.36 4.24 -0.70 1.54 -1.94 -0.64 -1.22 119.30 122.93 1azy s MET 201 Ca 0.03 0.50 -0.08 0.00 -1.71 0.00 0.00 55.69 54.43 1azy s MET 201 Cb -0.12 -3.36 0.18 0.00 2.01 0.00 0.00 34.83 33.54 1azy s MET 201 CO -0.08 0.34 0.58 0.34 -0.01 0.00 0.00 175.02 176.19 1azy s ASP 202 N 0.01 5.96 -0.40 3.03 2.15 0.87 -0.75 116.67 127.53 1azy s ASP 202 Ca 0.26 -2.71 -0.22 0.00 0.43 0.00 0.00 52.55 50.31 1azy s ASP 202 Cb -0.16 -2.03 0.01 0.00 -0.30 0.00 0.00 42.92 40.45 1azy s ASP 202 CO 0.13 -0.49 0.71 -0.69 -0.17 0.00 0.00 175.17 174.66 1azy s VAL 203 N 0.14 4.77 0.51 1.11 1.01 0.18 -2.91 120.40 125.21 1azy s VAL 203 Ca 0.16 0.51 -0.20 0.00 0.00 0.00 0.00 61.98 62.46 1azy s VAL 203 Cb -0.16 -4.20 -0.08 0.00 0.00 0.00 0.00 36.38 31.94 1azy s VAL 203 CO -0.06 -0.51 1.07 -0.54 0.00 0.00 0.00 175.10 175.06 1azy s LYS 204 N 2.99 3.64 0.02 2.72 -0.14 -1.26 -1.91 119.74 125.80 1azy s LYS 204 Ca 0.27 1.45 0.04 0.00 -1.36 0.00 0.00 55.97 56.37 1azy s LYS 204 Cb -0.13 -2.06 -0.02 0.00 -1.68 0.00 0.00 37.83 33.94 1azy s LYS 204 CO 0.18 -0.58 -0.12 0.14 -0.76 0.00 0.00 175.35 174.21 1azy s VAL 205 N -1.90 0.93 0.00 3.17 -7.23 -0.09 -4.36 120.40 110.91 1azy s VAL 205 Ca 0.69 -0.78 0.00 0.00 -1.81 0.00 0.00 61.98 60.08 1azy s VAL 205 Cb -0.19 -0.83 0.00 0.00 0.56 0.00 0.00 36.38 35.91 1azy s VAL 205 CO 0.22 0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.68 1azy n GLY 206 N 2.22 -0.10 0.19 2.32 0.00 -1.26 -1.47 105.19 107.09 1azy n GLY 206 Ca -0.17 -2.27 -0.03 0.00 0.00 0.00 0.00 46.02 43.55 1azy n GLY 206 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1azy h SER 207 N 0.00 -0.21 -0.14 1.61 4.64 -1.90 -0.34 113.55 117.21 1azy h SER 207 Ca 0.00 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1azy h SER 207 Cb 0.00 0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1azy h SER 207 CO 0.00 -0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.50 1azy n GLY 208 N -1.30 0.97 3.86 -0.77 0.00 -0.45 -4.90 105.19 102.59 1azy n GLY 208 Ca 0.04 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.56 1azy n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1azy s ALA 209 N -1.55 3.16 -0.01 4.61 0.00 -0.14 -4.82 121.76 123.01 1azy s ALA 209 Ca 0.11 0.01 -0.21 0.00 0.00 0.00 0.00 51.96 51.87 1azy s ALA 209 Cb 0.08 -2.98 -0.12 0.00 0.00 0.00 0.00 23.12 20.10 1azy s ALA 209 CO 0.05 -0.25 0.88 0.35 0.00 0.00 0.00 175.76 176.80 1azy h PHE 210 N 0.80 -0.71 -3.96 0.00 3.57 -1.85 -3.44 116.94 111.35 1azy h PHE 210 Ca -0.46 -0.02 -0.50 0.00 3.53 0.00 0.00 57.97 60.52 1azy h PHE 210 Cb 1.19 0.23 0.04 0.00 2.79 0.00 0.00 35.95 40.20 1azy h PHE 210 CO 0.63 -0.44 0.46 -1.64 -2.23 0.00 0.00 178.31 175.10 1azy s MET 211 N -4.04 4.04 0.27 1.11 -1.94 -1.26 -4.97 119.30 112.50 1azy s MET 211 Ca -0.11 1.69 -0.02 0.00 -1.71 0.00 0.00 55.69 55.53 1azy s MET 211 Cb 0.01 -2.57 0.35 0.00 2.01 0.00 0.00 34.83 34.63 1azy s MET 211 CO 0.34 -0.29 1.81 -1.00 -0.01 0.00 0.00 175.02 175.87 1azy h PRO 212 N 2.47 0.89 -5.87 2.03 0.13 -1.93 -3.45 132.00 126.28 1azy h PRO 212 Ca -0.49 -0.18 -0.50 0.00 -0.87 0.00 0.00 66.00 63.95 1azy h PRO 212 Cb 1.23 -0.13 -0.19 0.00 0.13 0.00 0.00 31.00 32.03 1azy h PRO 212 CO 0.62 0.79 -0.79 0.95 -0.23 0.00 0.00 178.00 179.34 1azy s THR 213 N -5.25 1.65 0.27 1.56 -4.23 -1.26 -4.96 115.64 103.41 1azy s THR 213 Ca -0.10 -1.73 -0.00 0.00 -1.18 0.00 0.00 61.69 58.68 1azy s THR 213 Cb 0.15 -1.65 0.25 0.00 1.34 0.00 0.00 72.50 72.60 1azy s THR 213 CO 0.81 -0.25 1.79 0.22 -0.54 0.00 0.00 174.62 176.64 1azy h TYR 214 N 3.61 0.91 0.00 3.99 3.20 -1.97 0.42 116.97 127.13 1azy h TYR 214 Ca -0.43 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.45 1azy h TYR 214 Cb 1.20 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 39.19 1azy h TYR 214 CO 0.65 0.28 -0.11 0.93 -1.64 0.00 0.00 178.16 178.27 1azy h GLU 215 N 0.75 0.00 0.00 1.82 3.07 -1.99 -0.72 114.58 117.52 1azy h GLU 215 Ca 0.47 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 59.13 1azy h GLU 215 Cb 0.60 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.47 1azy h GLU 215 CO -0.32 0.11 -1.49 -0.07 -1.40 0.00 0.00 179.01 175.83 1azy h LEU 216 N 0.00 0.00 -0.29 1.33 3.38 -0.67 -2.59 115.31 116.47 1azy h LEU 216 Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1azy h LEU 216 Cb 0.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1azy h LEU 216 CO 0.01 0.72 -0.42 0.28 0.09 0.00 0.00 178.44 179.12 1azy h SER 217 N 0.00 0.88 -0.54 -0.43 0.02 -0.44 -2.17 113.55 110.87 1azy h SER 217 Ca -0.20 -0.51 -0.09 0.00 -0.84 0.00 0.00 61.79 60.15 1azy h SER 217 Cb 1.72 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.99 1azy h SER 217 CO 0.06 1.22 -0.01 -0.08 -1.14 0.00 0.00 176.83 176.87 1azy h GLU 218 N 0.57 0.96 -0.01 3.45 4.81 -1.26 -1.79 114.58 121.32 1azy h GLU 218 Ca 0.03 -0.31 0.03 0.00 -0.13 0.00 0.00 59.36 58.97 1azy h GLU 218 Cb 1.02 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.29 1azy h GLU 218 CO 0.10 0.98 -0.16 0.00 -0.73 0.00 0.00 179.01 179.20 1azy h ALA 219 N 0.95 -0.18 -0.96 2.92 0.00 -1.36 -1.37 119.26 119.26 1azy h ALA 219 Ca 0.15 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1azy h ALA 219 Cb 0.55 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1azy h ALA 219 CO 0.03 -0.65 0.59 1.25 0.00 0.00 0.00 179.25 180.48 1azy h LEU 220 N -0.25 1.14 -0.72 0.00 5.85 -1.27 -2.34 115.31 117.72 1azy h LEU 220 Ca 0.06 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1azy h LEU 220 Cb 0.33 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1azy h LEU 220 CO -0.16 0.86 0.47 0.00 -0.34 0.00 0.00 178.44 179.27 1azy h ALA 221 N 1.33 0.91 -0.16 1.25 0.00 -0.82 -1.19 119.26 120.58 1azy h ALA 221 Ca 0.35 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.10 1azy h ALA 221 Cb -0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1azy h ALA 221 CO -0.07 0.34 -0.33 0.93 0.00 0.00 0.00 179.25 180.13 1azy h GLU 222 N 0.97 0.32 -0.17 0.00 3.07 -0.87 -2.58 114.58 115.32 1azy h GLU 222 Ca 0.26 -0.13 -0.07 0.00 -0.50 0.00 0.00 59.36 58.92 1azy h GLU 222 Cb -0.09 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 27.80 1azy h GLU 222 CO -0.05 0.61 -0.16 0.00 -1.40 0.00 0.00 179.01 178.01 1azy h ALA 223 N 1.38 0.25 -0.52 3.43 0.00 -1.01 -2.83 119.26 119.96 1azy h ALA 223 Ca 0.04 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.63 1azy h ALA 223 Cb 0.72 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1azy h ALA 223 CO 0.05 0.15 0.32 0.82 0.00 0.00 0.00 179.25 180.59 1azy h ILE 224 N 0.07 1.07 -0.84 0.00 2.04 -1.13 -2.11 117.51 116.61 1azy h ILE 224 Ca 0.03 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1azy h ILE 224 Cb 0.69 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 1azy h ILE 224 CO 0.04 0.12 0.53 0.58 0.00 0.00 0.00 178.15 179.42 1azy h VAL 225 N 0.64 1.23 0.52 1.67 2.07 -1.50 -2.58 116.25 118.30 1azy h VAL 225 Ca 0.21 -0.46 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 1azy h VAL 225 Cb 0.00 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 29.78 1azy h VAL 225 CO -0.08 0.23 -0.25 1.23 0.02 0.00 0.00 177.57 178.71 1azy h GLY 226 N 1.16 -0.73 1.88 2.17 0.00 -1.13 -2.55 103.07 103.87 1azy h GLY 226 Ca 0.31 0.27 -0.13 0.00 0.00 0.00 0.00 47.33 47.77 1azy h GLY 226 CO -0.06 -0.27 -0.59 -0.39 0.00 0.00 0.00 176.54 175.23 1azy h VAL 227 N -0.96 1.40 0.32 4.60 -1.51 -1.50 -0.47 116.25 118.14 1azy h VAL 227 Ca -0.07 -1.98 -0.02 0.00 -1.23 0.00 0.00 66.70 63.41 1azy h VAL 227 Cb 0.62 2.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.81 1azy h VAL 227 CO 0.12 0.57 -0.15 0.00 -1.23 0.00 0.00 177.57 176.88 1azy h ALA 228 N 1.31 -0.43 0.00 5.19 0.00 -1.55 0.41 119.26 124.19 1azy h ALA 228 Ca -0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1azy h ALA 228 Cb 1.06 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1azy h ALA 228 CO 0.08 -0.59 -0.01 -0.91 0.00 0.00 0.00 179.25 177.82 1azy h ASN 229 N -0.73 0.00 0.45 0.00 2.35 -1.45 0.30 115.58 116.50 1azy h ASN 229 Ca -0.04 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.54 1azy h ASN 229 Cb 0.50 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1azy h ASN 229 CO 0.07 0.01 -0.73 1.23 -1.65 0.00 0.00 177.43 176.37 1azy h GLY 230 N 0.05 0.26 -0.14 2.83 0.00 -0.64 -3.09 103.07 102.34 1azy h GLY 230 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1azy h GLY 230 CO 0.00 0.33 0.00 0.00 0.00 0.00 0.00 176.54 176.87 1azy n ALA 231 N -2.47 2.56 0.00 3.60 0.00 0.14 -4.92 120.51 119.42 1azy n ALA 231 Ca -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1azy n ALA 231 Cb 0.70 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1azy n ALA 231 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1azy n GLY 232 N 0.95 0.46 3.52 0.00 0.00 -0.67 -5.04 105.19 104.41 1azy n GLY 232 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1azy n GLY 232 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1azy s VAL 233 N -2.08 5.21 -0.66 1.61 1.01 -0.93 -4.94 120.40 119.63 1azy s VAL 233 Ca 0.00 -0.17 -0.27 0.00 0.00 0.00 0.00 61.98 61.54 1azy s VAL 233 Cb 0.00 -3.82 -0.12 0.00 0.00 0.00 0.00 36.38 32.43 1azy s VAL 233 CO 0.00 -0.13 2.48 -1.14 0.00 0.00 0.00 175.10 176.31 1azy n ARG 234 N 5.29 0.71 -4.64 2.72 3.00 -0.93 -3.32 116.66 119.49 1azy n ARG 234 Ca -0.10 -0.07 -0.31 0.00 -0.00 0.00 0.00 57.85 57.37 1azy n ARG 234 Cb 0.49 -2.91 -0.13 0.00 0.00 0.00 0.00 32.46 29.91 1azy n ARG 234 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1azy s THR 235 N 11.31 2.73 0.14 5.15 2.01 -1.26 -1.42 115.64 134.30 1azy s THR 235 Ca 1.08 -1.24 -0.01 0.00 0.31 0.00 0.00 61.69 61.83 1azy s THR 235 Cb -0.46 -2.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.86 1azy s THR 235 CO 0.31 0.31 0.08 0.42 -0.69 0.00 0.00 174.62 175.05 1azy s THR 236 N -0.94 0.08 0.04 -0.82 -4.23 -1.18 -4.47 115.64 104.13 1azy s THR 236 Ca 0.15 -1.91 -0.04 0.00 -1.18 0.00 0.00 61.69 58.71 1azy s THR 236 Cb -0.10 -2.11 -0.02 0.00 1.34 0.00 0.00 72.50 71.61 1azy s THR 236 CO 0.05 -0.38 0.06 0.00 -0.54 0.00 0.00 174.62 173.81 1azy s ALA 237 N -4.06 0.08 0.10 3.99 0.00 -1.04 -1.61 121.76 119.22 1azy s ALA 237 Ca 0.26 -0.73 0.06 0.00 0.00 0.00 0.00 51.96 51.56 1azy s ALA 237 Cb 0.07 0.27 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 1azy s ALA 237 CO 0.03 -0.33 -0.16 -0.51 0.00 0.00 0.00 175.76 174.79 1azy s LEU 238 N -2.32 2.34 -0.56 0.00 1.43 0.07 -1.71 118.68 117.93 1azy s LEU 238 Ca -0.02 -0.72 -0.09 0.00 -1.03 0.00 0.00 54.13 52.27 1azy s LEU 238 Cb 0.01 -0.63 0.14 0.00 0.03 0.00 0.00 46.19 45.74 1azy s LEU 238 CO -0.06 -0.07 0.43 -0.76 0.23 0.00 0.00 176.35 176.12 1azy s LEU 239 N -2.10 5.78 0.30 1.79 1.43 -0.99 -0.65 118.68 124.25 1azy s LEU 239 Ca 0.05 -2.22 -0.14 0.00 -1.03 0.00 0.00 54.13 50.78 1azy s LEU 239 Cb -0.08 -2.01 -0.09 0.00 0.03 0.00 0.00 46.19 44.04 1azy s LEU 239 CO 0.03 -0.61 0.70 -0.89 0.23 0.00 0.00 176.35 175.81 1azy s THR 240 N 0.90 4.72 0.31 5.49 2.01 -0.80 -0.93 115.64 127.33 1azy s THR 240 Ca 0.10 0.89 -0.27 0.00 0.31 0.00 0.00 61.69 62.71 1azy s THR 240 Cb -0.23 -3.63 -0.09 0.00 0.01 0.00 0.00 72.50 68.56 1azy s THR 240 CO -0.03 -0.13 1.01 -0.62 -0.69 0.00 0.00 174.62 174.17 1azy s ASP 241 N -2.23 7.25 -0.34 3.53 -1.08 0.42 -0.92 116.67 123.30 1azy s ASP 241 Ca 0.52 2.04 0.15 0.00 -0.52 0.00 0.00 52.55 54.74 1azy s ASP 241 Cb -0.11 -2.60 0.44 0.00 -1.46 0.00 0.00 42.92 39.19 1azy s ASP 241 CO 0.18 -0.14 1.19 0.80 0.52 0.00 0.00 175.17 177.73 1azy n MET 242 N 0.81 1.28 -0.21 4.34 1.56 -0.54 -4.81 117.12 119.55 1azy n MET 242 Ca 0.01 -2.54 0.11 0.00 -0.27 0.00 0.00 57.70 55.01 1azy n MET 242 Cb 0.48 -0.67 0.26 0.00 2.15 0.00 0.00 33.22 35.44 1azy n MET 242 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 1azy n ASN 243 N -0.52 3.15 -3.53 6.12 3.02 -1.26 -1.34 115.26 120.89 1azy n ASN 243 Ca 0.01 -1.95 -0.03 0.00 -0.03 0.00 0.00 54.58 52.58 1azy n ASN 243 Cb 0.84 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 1azy n ASN 243 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1azy s GLN 244 N -1.45 1.19 0.18 3.52 -2.07 -1.26 -4.54 119.66 115.23 1azy s GLN 244 Ca 0.39 -0.72 -0.31 0.00 -1.82 0.00 0.00 55.36 52.90 1azy s GLN 244 Cb 0.22 0.36 -0.09 0.00 -1.09 0.00 0.00 33.01 32.40 1azy s GLN 244 CO 0.30 -0.55 1.45 0.08 -1.32 0.00 0.00 175.29 175.25 1azy s VAL 245 N -2.60 2.88 -0.01 3.63 1.01 -1.26 -4.88 120.40 119.16 1azy s VAL 245 Ca 0.18 0.67 -0.22 0.00 0.00 0.00 0.00 61.98 62.60 1azy s VAL 245 Cb -0.01 -3.43 -0.13 0.00 0.00 0.00 0.00 36.38 32.81 1azy s VAL 245 CO 0.03 0.07 0.94 0.25 0.00 0.00 0.00 175.10 176.40 1azy h LEU 246 N 6.10 -0.65-10.68 3.92 5.85 -1.68 -3.45 115.31 114.71 1azy h LEU 246 Ca -0.44 0.01 -0.45 0.00 0.84 0.00 0.00 57.88 57.83 1azy h LEU 246 Cb 1.21 0.17 0.14 0.00 0.37 0.00 0.00 40.66 42.55 1azy h LEU 246 CO 0.84 -0.25 0.38 0.00 -0.34 0.00 0.00 178.44 179.07 1azy s ALA 247 N -4.57 2.21 -0.77 1.25 0.00 -0.92 -4.02 121.76 114.94 1azy s ALA 247 Ca -0.12 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.00 1azy s ALA 247 Cb 0.01 -2.88 0.31 0.00 0.00 0.00 0.00 23.12 20.55 1azy s ALA 247 CO 0.37 -2.22 0.98 0.43 0.00 0.00 0.00 175.76 175.31 1azy n SER 248 N -3.67 2.73 -3.52 0.00 7.64 -1.26 -4.85 113.62 110.69 1azy n SER 248 Ca 0.11 -2.34 -0.13 0.00 1.01 0.00 0.00 58.87 57.53 1azy n SER 248 Cb 0.60 -0.56 -0.04 0.00 -1.01 0.00 0.00 64.21 63.20 1azy n SER 248 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1azy s SER 249 N -0.32 -0.48 -0.04 6.43 1.04 -1.26 -1.59 113.70 117.48 1azy s SER 249 Ca 0.20 0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.99 1azy s SER 249 Cb 0.15 0.43 0.03 0.00 0.10 0.00 0.00 66.02 66.73 1azy s SER 249 CO 0.06 -0.57 -0.00 0.00 0.98 0.00 0.00 173.24 173.71 1azy s ALA 250 N -1.92 0.41 0.00 5.32 0.00 -0.70 -4.50 121.76 120.37 1azy s ALA 250 Ca -0.03 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1azy s ALA 250 Cb -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1azy s ALA 250 CO -0.00 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.05 1azy n GLY 251 N 4.26 -0.53 1.49 0.00 0.00 -1.26 -0.95 105.19 108.20 1azy n GLY 251 Ca -0.23 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1azy n GLY 251 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1azy n ASN 252 N 0.00 0.00 -0.13 1.61 3.02 -1.26 -4.74 115.26 113.76 1azy n ASN 252 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.45 1azy n ASN 252 Cb 0.00 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 1azy n ASN 252 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1azy h ALA 253 N 0.00 0.52 -0.14 5.41 0.00 -1.75 -2.42 119.26 120.88 1azy h ALA 253 Ca 0.00 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1azy h ALA 253 Cb 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1azy h ALA 253 CO 0.00 0.30 0.10 -0.39 0.00 0.00 0.00 179.25 179.26 1azy h VAL 254 N 0.51 0.96 0.23 0.00 -1.51 -1.88 -1.24 116.25 113.32 1azy h VAL 254 Ca 0.11 -0.02 -0.30 0.00 -1.23 0.00 0.00 66.70 65.25 1azy h VAL 254 Cb 0.48 0.90 0.03 0.00 -2.13 0.00 0.00 31.29 30.57 1azy h VAL 254 CO 0.02 0.01 -1.35 -0.33 -1.23 0.00 0.00 177.57 174.69 1azy h GLU 255 N 0.06 0.48 -0.06 5.19 5.08 -1.79 -2.68 114.58 120.86 1azy h GLU 255 Ca 0.06 -0.82 -0.05 0.00 -1.00 0.00 0.00 59.36 57.55 1azy h GLU 255 Cb 0.18 0.31 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1azy h GLU 255 CO -0.01 1.39 -0.20 0.28 -1.00 0.00 0.00 179.01 179.47 1azy h VAL 256 N 0.02 1.18 -0.17 3.13 2.07 -1.11 -0.35 116.25 121.03 1azy h VAL 256 Ca -0.24 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.41 1azy h VAL 256 Cb 2.05 1.36 -0.00 0.00 -1.52 0.00 0.00 31.29 33.17 1azy h VAL 256 CO 0.24 0.25 -0.05 -0.09 0.02 0.00 0.00 177.57 177.93 1azy h ARG 257 N 0.09 0.34 -0.90 1.57 2.43 -1.30 -2.62 114.38 113.98 1azy h ARG 257 Ca 0.02 -0.13 0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1azy h ARG 257 Cb 0.42 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.90 1azy h ARG 257 CO 0.03 0.62 0.59 1.49 -1.51 0.00 0.00 179.97 181.19 1azy h GLU 258 N 0.03 1.10 0.00 0.20 4.81 -0.95 -0.80 114.58 118.97 1azy h GLU 258 Ca 0.04 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.15 1azy h GLU 258 Cb 0.50 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1azy h GLU 258 CO 0.02 0.73 -0.27 0.00 -0.73 0.00 0.00 179.01 178.75 1azy h ALA 259 N 1.47 1.24 0.11 2.92 0.00 -1.00 -2.34 119.26 121.66 1azy h ALA 259 Ca 0.36 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.86 1azy h ALA 259 Cb 0.01 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 17.78 1azy h ALA 259 CO -0.11 0.34 -0.70 0.28 0.00 0.00 0.00 179.25 179.07 1azy h VAL 260 N 0.00 1.53 0.00 0.00 2.07 -0.80 -2.78 116.25 116.27 1azy h VAL 260 Ca -0.00 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.06 1azy h VAL 260 Cb 0.61 3.15 0.00 0.00 -1.52 0.00 0.00 31.29 33.53 1azy h VAL 260 CO 0.04 0.69 0.00 1.56 0.02 0.00 0.00 177.57 179.88 1azy h GLN 261 N -0.41 0.00 0.00 1.57 4.20 -1.21 -1.34 115.11 117.93 1azy h GLN 261 Ca -0.12 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 1azy h GLN 261 Cb 1.53 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.31 1azy h GLN 261 CO 0.13 0.00 -0.00 0.35 -0.67 0.00 0.00 178.83 178.64 1azy h PHE 262 N 0.00 -0.00 -0.23 2.96 3.04 -1.36 0.21 116.94 121.56 1azy h PHE 262 Ca 0.00 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.02 1azy h PHE 262 Cb 0.22 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.72 1azy h PHE 262 CO 0.00 0.56 0.23 -0.07 -2.02 0.00 0.00 178.31 177.01 1azy h LEU 263 N -1.00 0.00 -2.83 0.59 3.38 -1.13 -0.01 115.31 114.31 1azy h LEU 263 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1azy h LEU 263 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1azy h LEU 263 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.88 1azy n THR 264 N -3.91 1.02 -1.03 0.22 -2.24 -0.56 -4.31 114.28 103.47 1azy n THR 264 Ca 0.03 -1.01 -0.01 0.00 -2.27 0.00 0.00 64.05 60.79 1azy n THR 264 Cb 0.37 0.49 -0.00 0.00 -2.10 0.00 0.00 70.33 69.09 1azy n THR 264 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1azy n GLY 265 N 1.01 0.15 0.22 3.38 0.00 -0.02 -4.81 105.19 105.13 1azy n GLY 265 Ca 0.17 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1azy n GLY 265 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1azy h GLU 266 N 0.12 0.00 -1.53 1.61 4.81 -0.89 -3.44 114.58 115.27 1azy h GLU 266 Ca -0.02 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.30 1azy h GLU 266 Cb 0.89 0.00 -0.27 0.00 0.63 0.00 0.00 28.75 30.00 1azy h GLU 266 CO 0.03 0.23 0.47 -0.47 -0.73 0.00 0.00 179.01 178.54 1azy s TYR 267 N -4.43 -0.46 -0.14 0.92 5.04 -0.40 -5.03 117.35 112.85 1azy s TYR 267 Ca -0.03 1.06 -0.04 0.00 -2.44 0.00 0.00 57.07 55.61 1azy s TYR 267 Cb 0.15 0.37 0.05 0.00 0.35 0.00 0.00 41.96 42.88 1azy s TYR 267 CO 0.69 -0.23 0.07 1.03 -1.34 0.00 0.00 175.55 175.77 1azy s ARG 268 N 0.56 0.13 0.02 4.97 0.52 -1.26 -3.12 118.95 120.77 1azy s ARG 268 Ca -0.00 0.00 -0.30 0.00 -0.52 0.00 0.00 55.73 54.91 1azy s ARG 268 Cb -0.05 -1.50 -0.07 0.00 0.52 0.00 0.00 34.95 33.86 1azy s ARG 268 CO -0.10 -0.56 1.57 1.21 0.02 0.00 0.00 175.30 177.44 1azy s ASN 269 N 2.11 6.69 0.37 0.23 3.84 -1.26 -4.91 114.94 122.00 1azy s ASN 269 Ca 0.03 2.32 0.05 0.00 0.21 0.00 0.00 52.86 55.47 1azy s ASN 269 Cb -0.15 -2.56 0.74 0.00 -0.55 0.00 0.00 41.25 38.73 1azy s ASN 269 CO -0.07 -0.84 1.98 1.55 -2.79 0.00 0.00 177.10 176.93 1azy h PRO 270 N 8.39 0.73 -0.02 0.43 0.13 -1.98 0.67 132.00 140.34 1azy h PRO 270 Ca -0.40 -0.04 -0.20 0.00 -0.87 0.00 0.00 66.00 64.48 1azy h PRO 270 Cb 1.19 -0.16 0.02 0.00 0.13 0.00 0.00 31.00 32.17 1azy h PRO 270 CO 0.93 0.48 -0.79 0.00 -0.23 0.00 0.00 178.00 178.39 1azy h ARG 271 N 0.75 0.57 -0.41 0.86 3.08 -1.91 -2.15 114.38 115.17 1azy h ARG 271 Ca 0.28 -0.59 -0.05 0.00 0.07 0.00 0.00 59.98 59.69 1azy h ARG 271 Cb 0.16 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1azy h ARG 271 CO -0.08 1.20 0.04 1.25 -1.07 0.00 0.00 179.97 181.31 1azy h LEU 272 N 0.17 0.60 -0.22 3.04 5.85 -1.65 -2.58 115.31 120.53 1azy h LEU 272 Ca -0.09 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1azy h LEU 272 Cb 1.46 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 1azy h LEU 272 CO 0.16 0.65 0.05 0.15 -0.34 0.00 0.00 178.44 179.10 1azy h PHE 273 N 0.62 0.38 -0.39 1.25 3.57 -0.80 -1.24 116.94 120.33 1azy h PHE 273 Ca 0.13 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1azy h PHE 273 Cb 0.33 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 1azy h PHE 273 CO 0.01 0.47 0.25 -0.44 -2.23 0.00 0.00 178.31 176.38 1azy h ASP 274 N 0.18 0.46 -0.51 0.41 3.32 -1.16 0.35 116.42 119.47 1azy h ASP 274 Ca 0.07 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 1azy h ASP 274 Cb 0.29 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1azy h ASP 274 CO 0.00 0.36 -0.15 0.58 -1.72 0.00 0.00 179.24 178.31 1azy h VAL 275 N 0.52 1.27 -0.38 -1.35 2.07 -1.46 -0.64 116.25 116.28 1azy h VAL 275 Ca 0.14 -1.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.33 1azy h VAL 275 Cb -0.03 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1azy h VAL 275 CO -0.03 0.46 0.14 0.74 0.02 0.00 0.00 177.57 178.90 1azy h THR 276 N 0.89 1.20 -0.45 2.57 2.02 -0.96 -2.35 112.91 115.83 1azy h THR 276 Ca 0.13 -0.62 -0.13 0.00 0.77 0.00 0.00 66.41 66.56 1azy h THR 276 Cb 0.72 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1azy h THR 276 CO 0.06 0.22 -0.23 -0.03 0.37 0.00 0.00 175.52 175.91 1azy h MET 277 N 0.47 0.95 -0.70 6.66 -1.53 -0.86 -2.86 114.93 117.07 1azy h MET 277 Ca 0.13 -0.42 -0.01 0.00 -3.44 0.00 0.00 59.70 55.95 1azy h MET 277 Cb 0.21 -0.02 -0.03 0.00 -0.55 0.00 0.00 31.60 31.20 1azy h MET 277 CO -0.01 1.09 0.39 0.00 0.14 0.00 0.00 176.91 178.52 1azy h ALA 278 N 0.84 1.37 -0.09 0.39 0.00 -0.99 -1.69 119.26 119.09 1azy h ALA 278 Ca 0.10 -0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.67 1azy h ALA 278 Cb 0.81 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1azy h ALA 278 CO 0.07 0.52 -0.87 -0.07 0.00 0.00 0.00 179.25 178.90 1azy h LEU 279 N 0.98 0.86 -0.50 0.00 3.38 -1.42 -3.19 115.31 115.41 1azy h LEU 279 Ca 0.25 -0.61 -0.14 0.00 0.09 0.00 0.00 57.88 57.47 1azy h LEU 279 Cb 0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1azy h LEU 279 CO -0.04 1.41 -0.25 0.00 0.09 0.00 0.00 178.44 179.65 1azy h VAL 281 N 0.82 1.02 -0.03 0.00 2.07 -1.38 -0.49 116.25 118.25 1azy h VAL 281 Ca 0.10 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1azy h VAL 281 Cb 0.82 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1azy h VAL 281 CO 0.07 0.17 0.02 -0.33 0.02 0.00 0.00 177.57 177.52 1azy h GLU 282 N 0.92 0.04 -0.92 1.57 4.39 -1.50 -0.84 114.58 118.24 1azy h GLU 282 Ca 0.37 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.08 1azy h GLU 282 Cb 0.20 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.79 1azy h GLU 282 CO -0.18 0.09 0.61 0.52 -1.16 0.00 0.00 179.01 178.88 1azy h MET 283 N -0.02 1.20 -0.13 2.33 2.86 -0.99 0.31 114.93 120.50 1azy h MET 283 Ca 0.01 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1azy h MET 283 Cb 0.06 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 1azy h MET 283 CO -0.00 0.80 0.03 -0.07 1.06 0.00 0.00 176.91 178.73 1azy h LEU 284 N 1.24 0.20 0.01 1.22 3.38 -0.89 0.15 115.31 120.62 1azy h LEU 284 Ca 0.34 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1azy h LEU 284 Cb -0.13 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1azy h LEU 284 CO -0.08 0.37 -0.00 0.40 0.09 0.00 0.00 178.44 179.22 1azy h ILE 285 N 0.01 1.11 -0.58 1.22 2.04 -0.75 0.39 117.51 120.95 1azy h ILE 285 Ca 0.04 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 1azy h ILE 285 Cb 0.25 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 1azy h ILE 285 CO 0.00 0.09 0.22 0.28 0.00 0.00 0.00 178.15 178.75 1azy h SER 286 N -0.17 0.78 0.93 1.72 0.02 -0.39 -1.89 113.55 114.54 1azy h SER 286 Ca -0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1azy h SER 286 Cb 0.16 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1azy h SER 286 CO 0.00 0.71 0.00 0.61 -1.14 0.00 0.00 176.83 177.01 1azy n GLY 287 N -1.02 -1.38 1.75 -3.77 0.00 0.52 -4.85 105.19 96.45 1azy n GLY 287 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1azy n GLY 287 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1azy n LYS 288 N -1.80 0.00 0.00 1.61 4.76 -0.17 -4.66 118.16 117.90 1azy n LYS 288 Ca 0.05 0.07 0.15 0.00 -2.87 0.00 0.00 58.31 55.71 1azy n LYS 288 Cb 0.30 -2.76 0.88 0.00 -1.84 0.00 0.00 35.03 31.60 1azy n LYS 288 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1azy n LEU 289 N 0.00 0.00 -3.55 -0.35 4.77 0.12 -4.78 117.00 113.22 1azy n LEU 289 Ca 0.00 0.02 -0.17 0.00 -0.03 0.00 0.00 56.01 55.83 1azy n LEU 289 Cb 0.00 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.00 1azy n LEU 289 CO 0.00 -0.00 0.43 0.00 -1.33 0.00 0.00 177.39 176.49 1azy s ALA 290 N -2.05 -1.76 -0.12 -1.18 0.00 -1.19 -4.92 121.76 110.54 1azy s ALA 290 Ca 0.44 1.48 0.16 0.00 0.00 0.00 0.00 51.96 54.03 1azy s ALA 290 Cb 0.21 -0.28 -0.10 0.00 0.00 0.00 0.00 23.12 22.94 1azy s ALA 290 CO 0.35 -0.36 0.97 0.87 0.00 0.00 0.00 175.76 177.60 1azy h LYS 291 N 3.49 0.00 -3.51 0.00 6.56 -1.92 -3.40 116.57 117.79 1azy h LYS 291 Ca -0.27 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.28 1azy h LYS 291 Cb 1.15 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 32.71 1azy h LYS 291 CO 0.31 0.37 -0.06 0.16 -2.06 0.00 0.00 179.45 178.18 1azy s ASP 292 N -5.98 -0.14 0.17 0.86 -4.77 -1.26 -5.06 116.67 100.49 1azy s ASP 292 Ca -0.01 -0.78 -0.17 0.00 -3.30 0.00 0.00 52.55 48.28 1azy s ASP 292 Cb 0.08 0.59 0.11 0.00 -1.09 0.00 0.00 42.92 42.61 1azy s ASP 292 CO 0.80 -1.13 1.66 -0.78 0.70 0.00 0.00 175.17 176.42 1azy h ASP 293 N 2.23 -0.45 -0.44 2.11 1.82 -1.94 -1.11 116.42 118.64 1azy h ASP 293 Ca -0.26 0.13 0.05 0.00 -0.39 0.00 0.00 57.03 56.56 1azy h ASP 293 Cb 1.25 0.28 -0.04 0.00 0.68 0.00 0.00 39.33 41.50 1azy h ASP 293 CO 0.35 -0.16 0.19 0.00 -1.61 0.00 0.00 179.24 178.01 1azy h ALA 294 N 1.36 0.54 -0.09 -0.78 0.00 -1.98 0.25 119.26 118.56 1azy h ALA 294 Ca 0.20 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1azy h ALA 294 Cb 0.33 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1azy h ALA 294 CO -0.44 -0.19 0.06 1.49 0.00 0.00 0.00 179.25 180.17 1azy h GLU 295 N 0.38 0.12 0.32 0.00 4.81 -1.85 -1.92 114.58 116.43 1azy h GLU 295 Ca 0.20 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1azy h GLU 295 Cb 0.16 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.52 1azy h GLU 295 CO -0.18 0.08 -0.16 0.00 -0.73 0.00 0.00 179.01 178.03 1azy h ALA 296 N 1.03 -0.43 -0.41 2.92 0.00 -0.75 -1.75 119.26 119.87 1azy h ALA 296 Ca 0.03 -0.13 0.11 0.00 0.00 0.00 0.00 54.91 54.92 1azy h ALA 296 Cb -0.01 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1azy h ALA 296 CO -0.01 -0.70 0.29 0.00 0.00 0.00 0.00 179.25 178.84 1azy h ARG 297 N -0.53 0.07 0.48 0.00 3.08 -0.49 -1.37 114.38 115.63 1azy h ARG 297 Ca -0.04 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1azy h ARG 297 Cb 0.39 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1azy h ARG 297 CO 0.07 0.05 -0.23 0.00 -1.07 0.00 0.00 179.97 178.79 1azy h ALA 298 N 1.79 -0.65 -0.78 0.04 0.00 -0.91 -1.75 119.26 117.01 1azy h ALA 298 Ca 0.19 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.03 1azy h ALA 298 Cb 0.67 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 18.63 1azy h ALA 298 CO -0.02 -0.67 0.40 0.87 0.00 0.00 0.00 179.25 179.83 1azy h LYS 299 N -1.02 0.62 -0.44 0.00 1.57 -0.86 -2.11 116.57 114.33 1azy h LYS 299 Ca -0.07 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 1azy h LYS 299 Cb 0.59 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1azy h LYS 299 CO 0.11 0.41 0.04 -0.07 -0.57 0.00 0.00 179.45 179.37 1azy h LEU 300 N 0.64 0.73 -1.65 2.94 3.38 -1.29 -2.39 115.31 117.67 1azy h LEU 300 Ca 0.40 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1azy h LEU 300 Cb 0.46 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1azy h LEU 300 CO -0.30 0.83 -0.20 -0.61 0.09 0.00 0.00 178.44 178.25 1azy h GLN 301 N 0.60 0.00 0.55 1.13 5.75 -0.93 -2.03 115.11 120.18 1azy h GLN 301 Ca 0.13 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.60 1azy h GLN 301 Cb 0.43 0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.98 1azy h GLN 301 CO 0.01 0.20 -0.26 0.00 -2.65 0.00 0.00 178.83 176.13 1azy h ALA 302 N 1.80 -0.79 -0.67 3.38 0.00 -1.01 -1.91 119.26 120.06 1azy h ALA 302 Ca -0.00 -0.16 0.18 0.00 0.00 0.00 0.00 54.91 54.92 1azy h ALA 302 Cb 0.42 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1azy h ALA 302 CO 0.03 -0.74 0.47 0.28 0.00 0.00 0.00 179.25 179.29 1azy h VAL 303 N -1.10 0.71 0.00 0.00 2.07 -1.42 0.43 116.25 116.94 1azy h VAL 303 Ca -0.08 -0.04 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 1azy h VAL 303 Cb 0.56 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1azy h VAL 303 CO 0.12 0.02 -0.58 0.25 0.02 0.00 0.00 177.57 177.41 1azy h LEU 304 N 0.12 0.00 0.00 2.57 5.85 -1.33 -1.85 115.31 120.67 1azy h LEU 304 Ca 0.32 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.86 1azy h LEU 304 Cb 1.12 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1azy h LEU 304 CO -0.04 0.58 -2.16 0.47 -0.34 0.00 0.00 178.44 176.95 1azy n ASP 305 N -3.42 0.04 -0.79 1.25 8.00 0.12 -4.36 116.55 117.39 1azy n ASP 305 Ca 0.00 0.02 0.06 0.00 0.71 0.00 0.00 54.79 55.58 1azy n ASP 305 Cb 0.69 1.43 0.18 0.00 -0.02 0.00 0.00 41.12 43.40 1azy n ASP 305 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1azy n ASN 306 N -2.53 2.27 0.00 -2.24 6.94 0.87 -4.92 115.26 115.66 1azy n ASN 306 Ca -0.18 -2.06 0.00 0.00 -0.02 0.00 0.00 54.58 52.32 1azy n ASN 306 Cb 0.87 -0.30 0.00 0.00 -2.36 0.00 0.00 39.78 37.98 1azy n ASN 306 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1azy n GLY 307 N 1.03 1.69 0.25 4.83 0.00 -1.25 -4.86 105.19 106.88 1azy n GLY 307 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.23 1azy n GLY 307 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1azy h LYS 308 N 1.65 0.00 0.24 1.61 1.63 -1.88 -2.31 116.57 117.51 1azy h LYS 308 Ca 0.00 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 1azy h LYS 308 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1azy h LYS 308 CO 0.00 0.05 -0.11 0.00 -3.45 0.00 0.00 179.45 175.93 1azy h ALA 309 N 1.95 -0.32 -0.08 5.00 0.00 -1.67 -2.92 119.26 121.23 1azy h ALA 309 Ca -0.00 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1azy h ALA 309 Cb 0.08 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1azy h ALA 309 CO 0.01 -0.43 0.08 0.00 0.00 0.00 0.00 179.25 178.90 1azy h ALA 310 N -0.28 1.82 -0.43 0.00 0.00 -1.72 -1.01 119.26 117.63 1azy h ALA 310 Ca -0.03 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1azy h ALA 310 Cb 0.51 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1azy h ALA 310 CO 0.05 -0.12 0.05 1.49 0.00 0.00 0.00 179.25 180.72 1azy h GLU 311 N 0.00 0.73 -0.49 0.00 4.81 -1.36 -1.43 114.58 116.84 1azy h GLU 311 Ca 0.04 -0.21 -0.09 0.00 -0.13 0.00 0.00 59.36 58.97 1azy h GLU 311 Cb 0.19 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1azy h GLU 311 CO -0.00 0.77 -0.06 0.28 -0.73 0.00 0.00 179.01 179.27 1azy h VAL 312 N 0.58 1.26 -0.38 0.32 2.07 -1.00 -0.50 116.25 118.59 1azy h VAL 312 Ca 0.13 -1.14 -0.00 0.00 0.82 0.00 0.00 66.70 66.50 1azy h VAL 312 Cb 0.41 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1azy h VAL 312 CO 0.01 0.40 0.23 0.15 0.02 0.00 0.00 177.57 178.38 1azy h PHE 313 N 0.79 0.51 -0.27 1.57 3.57 -1.30 0.49 116.94 122.30 1azy h PHE 313 Ca 0.14 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 1azy h PHE 313 Cb 0.56 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1azy h PHE 313 CO 0.03 0.37 0.05 0.78 -2.23 0.00 0.00 178.31 177.31 1azy h GLY 314 N 0.50 0.42 2.00 2.40 0.00 -0.76 -0.77 103.07 106.86 1azy h GLY 314 Ca 0.14 -0.21 -0.18 0.00 0.00 0.00 0.00 47.33 47.07 1azy h GLY 314 CO -0.03 0.20 -0.87 3.21 0.00 0.00 0.00 176.54 179.05 1azy h ARG 315 N 0.39 0.00 -0.09 4.80 3.08 -0.49 -2.88 114.38 119.19 1azy h ARG 315 Ca 0.09 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 1azy h ARG 315 Cb 0.18 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 1azy h ARG 315 CO -0.00 0.87 -0.13 1.98 -1.07 0.00 0.00 179.97 181.62 1azy h MET 316 N 0.00 0.24 -0.72 0.04 4.05 -0.40 -2.60 114.93 115.54 1azy h MET 316 Ca -0.01 -0.14 0.03 0.00 -0.28 0.00 0.00 59.70 59.30 1azy h MET 316 Cb 1.61 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 32.38 1azy h MET 316 CO 0.11 0.71 0.45 0.28 0.23 0.00 0.00 176.91 178.70 1azy h VAL 317 N -0.20 1.10 -0.29 -5.77 2.07 -1.22 -2.51 116.25 109.43 1azy h VAL 317 Ca 0.01 -0.30 -0.15 0.00 0.82 0.00 0.00 66.70 67.07 1azy h VAL 317 Cb 0.69 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1azy h VAL 317 CO 0.03 0.16 -0.43 0.00 0.02 0.00 0.00 177.57 177.35 1azy h ALA 318 N 1.30 0.69 0.00 1.67 0.00 -1.56 0.56 119.26 121.92 1azy h ALA 318 Ca 0.29 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1azy h ALA 318 Cb 0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1azy h ALA 318 CO -0.11 0.67 -0.03 0.00 0.00 0.00 0.00 179.25 179.78 1azy h ALA 319 N 0.92 1.01 -0.66 0.00 0.00 -1.25 -2.62 119.26 116.67 1azy h ALA 319 Ca 0.04 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.64 1azy h ALA 319 Cb 0.99 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.60 1azy h ALA 319 CO 0.09 0.03 0.26 1.04 0.00 0.00 0.00 179.25 180.68 1azy n GLN 320 N -3.13 2.57 -1.08 0.00 6.02 -0.96 -4.94 117.38 115.85 1azy n GLN 320 Ca 0.00 -3.07 -0.03 0.00 -0.01 0.00 0.00 57.00 53.89 1azy n GLN 320 Cb 0.31 -2.04 -0.01 0.00 1.02 0.00 0.00 30.24 29.52 1azy n GLN 320 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1azy n LYS 321 N -0.82 -0.53 -2.38 -1.09 4.01 -0.99 0.26 118.16 116.63 1azy n LYS 321 Ca 0.43 0.41 -0.26 0.00 -0.51 0.00 0.00 58.31 58.38 1azy n LYS 321 Cb 1.33 -4.00 0.15 0.00 -0.51 0.00 0.00 35.03 32.00 1azy n LYS 321 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 1azy s GLY 322 N -2.42 1.77 0.55 0.72 0.00 0.19 -4.13 107.32 104.01 1azy s GLY 322 Ca 0.00 -1.66 -0.22 0.00 0.00 0.00 0.00 44.72 42.85 1azy s GLY 322 CO 0.00 -0.97 1.34 -4.14 0.00 0.00 0.00 173.10 169.33 1azy s PRO 323 N -5.44 3.14 0.00 2.90 0.02 -1.26 -4.25 135.00 130.11 1azy s PRO 323 Ca 0.71 2.20 0.30 0.00 0.02 0.00 0.00 61.00 64.22 1azy s PRO 323 Cb -0.04 -2.24 1.57 0.00 0.02 0.00 0.00 34.50 33.81 1azy s PRO 323 CO 0.48 -1.17 2.07 0.25 -0.33 0.00 0.00 177.00 178.29 1azy n THR 324 N -1.05 0.01 -2.43 0.99 -2.24 -1.26 -3.46 114.28 104.85 1azy n THR 324 Ca 0.10 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.74 1azy n THR 324 Cb 0.45 -0.51 0.03 0.00 -2.10 0.00 0.00 70.33 68.20 1azy n THR 324 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1azy n ASP 325 N -1.24 3.36 -0.12 3.42 5.75 -1.26 -4.89 116.55 121.57 1azy n ASP 325 Ca 0.16 -3.03 -0.12 0.00 -0.01 0.00 0.00 54.79 51.78 1azy n ASP 325 Cb 0.22 -0.42 -0.03 0.00 -1.03 0.00 0.00 41.12 39.86 1azy n ASP 325 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 1azy h PHE 326 N 2.47 0.90 -0.53 2.11 3.57 -1.89 -2.34 116.94 121.23 1azy h PHE 326 Ca 0.13 -0.24 -0.09 0.00 3.53 0.00 0.00 57.97 61.30 1azy h PHE 326 Cb 1.33 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.85 1azy h PHE 326 CO 0.69 0.99 -0.04 0.28 -2.23 0.00 0.00 178.31 178.00 1azy h VAL 327 N 0.55 1.27 -0.11 1.41 2.07 -1.90 0.04 116.25 119.59 1azy h VAL 327 Ca 0.07 -1.16 -0.10 0.00 0.82 0.00 0.00 66.70 66.33 1azy h VAL 327 Cb 0.78 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1azy h VAL 327 CO 0.06 0.41 -0.33 -0.08 0.02 0.00 0.00 177.57 177.65 1azy h GLU 328 N 0.83 0.41 -1.35 1.57 4.81 -1.96 -3.37 114.58 115.53 1azy h GLU 328 Ca 0.15 -0.30 -0.58 0.00 -0.13 0.00 0.00 59.36 58.50 1azy h GLU 328 Cb 0.58 0.05 -0.42 0.00 0.63 0.00 0.00 28.75 29.59 1azy h GLU 328 CO 0.03 0.92 -0.76 0.09 -0.73 0.00 0.00 179.01 178.57 1azy n ASN 329 N -4.39 4.71 0.20 1.04 5.03 -0.88 -4.85 115.26 116.12 1azy n ASN 329 Ca -0.08 -3.71 0.05 0.00 0.87 0.00 0.00 54.58 51.72 1azy n ASN 329 Cb 0.50 -0.44 0.51 0.00 -1.02 0.00 0.00 39.78 39.33 1azy n ASN 329 CO 0.00 0.00 0.00 0.10 -1.83 0.00 0.00 177.26 175.53 1azy h TYR 330 N 2.50 0.07 0.00 3.10 -0.00 -1.15 -2.98 116.97 118.51 1azy h TYR 330 Ca 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.03 1azy h TYR 330 Cb 1.06 -0.02 0.00 0.00 0.00 0.00 0.00 36.73 37.77 1azy h TYR 330 CO 0.82 0.18 0.00 0.00 -0.00 0.00 0.00 178.16 179.17 1azy h ALA 331 N 1.82 1.00 0.00 0.10 0.00 -1.89 -1.44 119.26 118.86 1azy h ALA 331 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1azy h ALA 331 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1azy h ALA 331 CO 0.02 0.00 -1.32 1.63 0.00 0.00 0.00 179.25 179.57 1azy n LYS 332 N -2.68 0.35 -0.07 0.00 4.76 -1.12 -4.51 118.16 114.89 1azy n LYS 332 Ca -0.02 -0.06 -0.18 0.00 -2.87 0.00 0.00 58.31 55.18 1azy n LYS 332 Cb 0.07 -1.56 -0.13 0.00 -1.84 0.00 0.00 35.03 31.57 1azy n LYS 332 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1azy n TYR 333 N -1.98 0.52 -2.55 2.13 4.01 -0.60 -4.97 117.16 113.73 1azy n TYR 333 Ca 0.00 0.12 -0.40 0.00 -0.16 0.00 0.00 57.90 57.46 1azy n TYR 333 Cb 0.46 -1.07 -0.05 0.00 -0.31 0.00 0.00 39.34 38.37 1azy n TYR 333 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1azy s LEU 334 N -6.63 4.55 0.20 7.72 1.43 -0.88 -4.54 118.68 120.52 1azy s LEU 334 Ca -0.27 2.13 -0.32 0.00 -1.03 0.00 0.00 54.13 54.64 1azy s LEU 334 Cb 0.08 -3.61 -0.11 0.00 0.03 0.00 0.00 46.19 42.57 1azy s LEU 334 CO 0.69 -0.10 1.67 -2.84 0.23 0.00 0.00 176.35 175.99 1azy s PRO 335 N -1.00 4.16 -0.14 1.29 0.02 -1.26 -4.97 135.00 133.10 1azy s PRO 335 Ca 0.45 2.52 -0.01 0.00 0.02 0.00 0.00 61.00 63.99 1azy s PRO 335 Cb -0.30 -3.10 -0.02 0.00 0.02 0.00 0.00 34.50 31.11 1azy s PRO 335 CO 0.37 -0.70 -0.11 0.95 -0.33 0.00 0.00 177.00 177.18 1azy s THR 336 N 1.13 3.19 0.88 0.99 -4.23 -1.26 -4.60 115.64 111.74 1azy s THR 336 Ca 0.73 -0.61 -0.11 0.00 -1.18 0.00 0.00 61.69 60.52 1azy s THR 336 Cb -0.48 -2.36 0.12 0.00 1.34 0.00 0.00 72.50 71.12 1azy s THR 336 CO 0.32 0.52 1.09 0.00 -0.54 0.00 0.00 174.62 176.01 1azy s ALA 337 N 0.40 1.65 0.05 3.99 0.00 -1.26 -4.98 121.76 121.61 1azy s ALA 337 Ca -0.09 0.04 -0.17 0.00 0.00 0.00 0.00 51.96 51.74 1azy s ALA 337 Cb -0.16 -3.22 -0.21 0.00 0.00 0.00 0.00 23.12 19.53 1azy s ALA 337 CO 0.05 -2.27 1.19 0.52 0.00 0.00 0.00 175.76 175.24 1azy h MET 338 N -1.49 0.58 -5.24 0.00 2.86 -1.73 -3.44 114.93 106.46 1azy h MET 338 Ca -0.48 -0.55 -0.67 0.00 -2.06 0.00 0.00 59.70 55.94 1azy h MET 338 Cb 1.27 0.14 -0.30 0.00 0.06 0.00 0.00 31.60 32.77 1azy h MET 338 CO 0.53 1.17 -0.81 -1.17 1.06 0.00 0.00 176.91 177.69 1azy s LEU 339 N -8.36 2.43 -0.28 1.22 2.96 -0.01 -5.02 118.68 111.62 1azy s LEU 339 Ca -0.12 -0.47 -0.02 0.00 -0.22 0.00 0.00 54.13 53.30 1azy s LEU 339 Cb 0.06 -1.54 0.09 0.00 0.50 0.00 0.00 46.19 45.30 1azy s LEU 339 CO 0.86 0.11 0.09 -0.89 -1.32 0.00 0.00 176.35 175.21 1azy s THR 340 N 0.65 0.56 0.09 3.68 2.01 -1.25 0.11 115.64 121.49 1azy s THR 340 Ca -0.09 -1.06 0.06 0.00 0.31 0.00 0.00 61.69 60.91 1azy s THR 340 Cb -0.16 -1.36 -0.03 0.00 0.01 0.00 0.00 72.50 70.96 1azy s THR 340 CO 0.02 -0.59 -0.15 -0.54 -0.69 0.00 0.00 174.62 172.68 1azy s LYS 341 N 1.79 0.91 0.18 4.92 1.02 -0.43 -4.94 119.74 123.19 1azy s LYS 341 Ca 0.07 -1.06 -0.14 0.00 0.02 0.00 0.00 55.97 54.86 1azy s LYS 341 Cb -0.17 -0.89 -0.07 0.00 -0.52 0.00 0.00 37.83 36.18 1azy s LYS 341 CO -0.24 0.19 0.58 0.00 -0.92 0.00 0.00 175.35 174.95 1azy s ALA 342 N -1.55 3.54 -0.08 5.17 0.00 -1.26 0.58 121.76 128.15 1azy s ALA 342 Ca 0.02 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.88 1azy s ALA 342 Cb -0.08 -2.55 -0.03 0.00 0.00 0.00 0.00 23.12 20.46 1azy s ALA 342 CO 0.03 0.44 -0.09 0.14 0.00 0.00 0.00 175.76 176.28 1azy s VAL 343 N -1.56 3.52 0.05 0.00 -7.23 -0.45 -4.90 120.40 109.83 1azy s VAL 343 Ca 0.41 -0.53 0.07 0.00 -1.81 0.00 0.00 61.98 60.11 1azy s VAL 343 Cb -0.14 -2.45 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 1azy s VAL 343 CO 0.20 0.58 -0.16 -0.31 -0.31 0.00 0.00 175.10 175.09 1azy s TYR 344 N -0.51 2.61 0.64 2.82 1.51 -1.26 0.55 117.35 123.71 1azy s TYR 344 Ca 0.07 -0.22 -0.14 0.00 -1.01 0.00 0.00 57.07 55.77 1azy s TYR 344 Cb -0.12 -1.46 -0.01 0.00 -0.11 0.00 0.00 41.96 40.26 1azy s TYR 344 CO 0.02 0.30 1.07 0.00 -1.11 0.00 0.00 175.55 175.83 1azy s ALA 345 N -0.99 2.65 0.56 3.71 0.00 -1.26 -4.90 121.76 121.52 1azy s ALA 345 Ca 0.16 0.33 0.24 0.00 0.00 0.00 0.00 51.96 52.69 1azy s ALA 345 Cb -0.11 -3.23 1.53 0.00 0.00 0.00 0.00 23.12 21.31 1azy s ALA 345 CO 0.07 -1.05 2.13 -0.44 0.00 0.00 0.00 175.76 176.46 1azy h ASP 346 N -0.03 0.00 -5.40 0.00 3.32 -1.99 -3.45 116.42 108.86 1azy h ASP 346 Ca -0.46 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.42 1azy h ASP 346 Cb 1.22 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.62 1azy h ASP 346 CO 0.56 0.00 -0.62 0.42 -1.72 0.00 0.00 179.24 177.89 1azy s THR 347 N -4.83 0.10 0.46 0.35 -4.23 -1.26 -5.15 115.64 101.08 1azy s THR 347 Ca -0.05 -1.86 -0.21 0.00 -1.18 0.00 0.00 61.69 58.40 1azy s THR 347 Cb 0.17 -2.01 -0.09 0.00 1.34 0.00 0.00 72.50 71.91 1azy s THR 347 CO 0.62 -0.47 1.02 -1.61 -0.54 0.00 0.00 174.62 173.64 1azy s GLU 348 N -4.04 3.93 0.00 3.99 2.02 -1.26 -4.75 118.70 118.59 1azy s GLU 348 Ca 0.23 1.34 0.00 0.00 0.02 0.00 0.00 54.97 56.56 1azy s GLU 348 Cb 0.07 -2.17 0.00 0.00 0.10 0.00 0.00 34.13 32.13 1azy s GLU 348 CO 0.01 -0.32 0.00 0.41 0.02 0.00 0.00 175.26 175.38 1azy n GLY 349 N -0.24 -0.86 3.34 -1.39 0.00 -0.94 -4.95 105.19 100.15 1azy n GLY 349 Ca 0.08 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.64 1azy n GLY 349 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1azy s PHE 350 N -3.00 2.69 -0.11 1.61 0.40 -0.35 0.41 117.98 119.63 1azy s PHE 350 Ca 0.00 -0.68 -0.29 0.00 -0.60 0.00 0.00 56.93 55.35 1azy s PHE 350 Cb 0.00 -1.75 -0.05 0.00 0.51 0.00 0.00 43.02 41.73 1azy s PHE 350 CO 0.00 -0.21 1.80 0.08 0.70 0.00 0.00 175.22 177.59 1azy s VAL 351 N 0.14 3.40 -0.03 -0.44 1.01 -0.86 -1.09 120.40 122.53 1azy s VAL 351 Ca -0.09 0.46 0.07 0.00 0.00 0.00 0.00 61.98 62.42 1azy s VAL 351 Cb -0.15 -3.36 -0.11 0.00 0.00 0.00 0.00 36.38 32.75 1azy s VAL 351 CO 0.06 -0.11 0.13 -1.54 0.00 0.00 0.00 175.10 173.63 1azy n SER 352 N 8.33 3.26 -4.05 3.32 3.41 0.17 -0.84 113.62 127.22 1azy n SER 352 Ca 0.20 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.73 1azy n SER 352 Cb 0.43 1.16 -0.09 0.00 -0.26 0.00 0.00 64.21 65.45 1azy n SER 352 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1azy s GLU 353 N -2.43 0.71 -0.29 4.33 2.12 -0.48 -4.91 118.70 117.76 1azy s GLU 353 Ca -0.03 -1.20 -0.14 0.00 0.36 0.00 0.00 54.97 53.96 1azy s GLU 353 Cb 0.04 0.24 0.13 0.00 0.26 0.00 0.00 34.13 34.80 1azy s GLU 353 CO 0.31 -0.17 0.83 1.41 -0.54 0.00 0.00 175.26 177.10 1azy s MET 354 N -3.93 0.49 -0.68 4.30 -2.45 -1.26 -0.64 119.30 115.13 1azy s MET 354 Ca 0.09 1.00 -0.19 0.00 -1.25 0.00 0.00 55.69 55.34 1azy s MET 354 Cb 0.07 0.34 0.12 0.00 1.25 0.00 0.00 34.83 36.61 1azy s MET 354 CO -0.08 -0.13 0.82 0.34 1.05 0.00 0.00 175.02 177.02 1azy s ASP 355 N 1.99 6.32 0.13 1.11 2.15 -0.19 -4.70 116.67 123.49 1azy s ASP 355 Ca -0.07 -1.61 -0.22 0.00 0.43 0.00 0.00 52.55 51.08 1azy s ASP 355 Cb -0.06 -2.32 -0.01 0.00 -0.30 0.00 0.00 42.92 40.22 1azy s ASP 355 CO -0.18 -1.09 1.67 0.71 -0.17 0.00 0.00 175.17 176.11 1azy h THR 356 N 5.80 0.61 -0.95 1.71 1.35 -1.89 -1.54 112.91 118.00 1azy h THR 356 Ca -0.17 0.00 0.17 0.00 -0.55 0.00 0.00 66.41 65.86 1azy h THR 356 Cb 1.07 0.61 -0.08 0.00 -1.73 0.00 0.00 68.15 68.02 1azy h THR 356 CO 1.08 0.00 0.60 0.03 -0.25 0.00 0.00 175.52 176.98 1azy h ARG 357 N -0.16 0.67 -0.02 4.72 3.08 -1.91 0.37 114.38 121.13 1azy h ARG 357 Ca 0.10 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 1azy h ARG 357 Cb 0.31 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 1azy h ARG 357 CO -0.25 0.44 0.01 0.00 -1.07 0.00 0.00 179.97 179.10 1azy h ALA 358 N 1.61 0.03 -0.56 0.04 0.00 -1.72 0.06 119.26 118.72 1azy h ALA 358 Ca 0.51 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.27 1azy h ALA 358 Cb 0.86 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1azy h ALA 358 CO -0.27 -0.36 0.24 -0.07 0.00 0.00 0.00 179.25 178.80 1azy h LEU 359 N -0.18 0.73 -0.39 0.00 3.38 -0.61 0.11 115.31 118.35 1azy h LEU 359 Ca 0.01 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1azy h LEU 359 Cb 0.23 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1azy h LEU 359 CO 0.00 0.65 0.22 1.23 0.09 0.00 0.00 178.44 180.62 1azy h GLY 360 N 0.92 0.58 2.00 0.83 0.00 0.02 -2.00 103.07 105.41 1azy h GLY 360 Ca 0.19 -0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 1azy h GLY 360 CO -0.02 0.25 -0.21 -0.33 0.00 0.00 0.00 176.54 176.23 1azy h MET 361 N 0.50 0.00 -0.44 4.80 2.86 -0.41 -2.87 114.93 119.37 1azy h MET 361 Ca 0.14 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.67 1azy h MET 361 Cb 0.05 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1azy h MET 361 CO -0.02 0.21 -0.17 0.00 1.06 0.00 0.00 176.91 177.98 1azy h ALA 362 N 1.79 0.87 0.10 6.32 0.00 -0.21 -1.61 119.26 126.51 1azy h ALA 362 Ca -0.00 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1azy h ALA 362 Cb 0.86 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1azy h ALA 362 CO 0.03 0.64 -0.05 0.28 0.00 0.00 0.00 179.25 180.15 1azy h VAL 363 N 0.74 1.09 -0.10 0.00 2.07 -1.17 -2.75 116.25 116.14 1azy h VAL 363 Ca 0.11 -0.75 0.04 0.00 0.82 0.00 0.00 66.70 66.92 1azy h VAL 363 Cb 0.70 1.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 1azy h VAL 363 CO 0.05 0.18 -0.15 0.58 0.02 0.00 0.00 177.57 178.25 1azy h VAL 364 N -0.48 0.61 -0.04 2.57 2.07 -1.48 0.30 116.25 119.80 1azy h VAL 364 Ca -0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 1azy h VAL 364 Cb 0.40 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1azy h VAL 364 CO 0.02 0.00 0.12 0.00 0.02 0.00 0.00 177.57 177.73 1azy h ALA 365 N 0.83 1.29 -0.70 1.67 0.00 -1.31 0.10 119.26 121.15 1azy h ALA 365 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1azy h ALA 365 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1azy h ALA 365 CO -0.22 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 178.89 1azy n MET 366 N -3.25 3.36 0.00 0.00 0.00 -0.70 -4.90 117.12 111.63 1azy n MET 366 Ca -0.02 -2.81 0.00 0.00 0.00 0.00 0.00 57.70 54.87 1azy n MET 366 Cb 0.20 -1.78 0.00 0.00 0.00 0.00 0.00 33.22 31.64 1azy n MET 366 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1azy n GLY 367 N 1.38 0.59 0.00 3.17 0.00 0.34 -4.86 105.19 105.80 1azy n GLY 367 Ca 0.26 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.35 1azy n GLY 367 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1azy n GLY 368 N -1.40 -0.74 0.19 -0.02 0.00 0.97 -1.30 105.19 102.90 1azy n GLY 368 Ca 0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 46.02 45.95 1azy n GLY 368 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1azy n GLY 369 N -0.09 1.47 3.13 -0.02 0.00 -1.24 -4.67 105.19 103.76 1azy n GLY 369 Ca 0.07 -0.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.86 1azy n GLY 369 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1azy s ARG 370 N -2.00 2.04 -0.00 1.61 1.70 -1.26 -4.67 118.95 116.36 1azy s ARG 370 Ca 0.01 -0.63 0.10 0.00 -0.47 0.00 0.00 55.73 54.74 1azy s ARG 370 Cb -0.00 -1.69 -0.23 0.00 -0.57 0.00 0.00 34.95 32.46 1azy s ARG 370 CO 0.00 0.19 0.81 0.00 -1.08 0.00 0.00 175.30 175.22 1azy h ARG 371 N 6.50 0.02 0.00 3.89 3.08 -1.92 -3.38 114.38 122.57 1azy h ARG 371 Ca -0.30 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.71 1azy h ARG 371 Cb 1.19 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1azy h ARG 371 CO 0.47 0.67 0.00 1.04 -1.07 0.00 0.00 179.97 181.08 1azy n GLN 372 N -3.15 0.00 0.00 0.04 1.13 -1.26 -4.81 117.38 109.33 1azy n GLN 372 Ca -0.13 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.93 1azy n GLN 372 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.37 1azy n GLN 372 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1azy n ALA 373 N -2.73 0.00 0.25 -1.58 0.00 -1.26 -4.92 120.51 110.27 1azy n ALA 373 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 1azy n ALA 373 Cb 0.00 0.00 0.32 0.00 0.00 0.00 0.00 19.45 19.77 1azy n ALA 373 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1azy n SER 374 N 0.00 0.27 -4.77 0.00 3.41 -1.26 -4.70 113.62 106.57 1azy n SER 374 Ca 0.00 0.60 -0.35 0.00 -0.26 0.00 0.00 58.87 58.85 1azy n SER 374 Cb 0.00 -0.64 0.02 0.00 -0.26 0.00 0.00 64.21 63.32 1azy n SER 374 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1azy s ASP 375 N -3.51 5.50 -0.28 4.04 1.11 -1.26 -5.01 116.67 117.26 1azy s ASP 375 Ca 0.02 2.26 0.02 0.00 0.18 0.00 0.00 52.55 55.03 1azy s ASP 375 Cb 0.06 -2.59 0.07 0.00 1.07 0.00 0.00 42.92 41.54 1azy s ASP 375 CO 0.20 -1.38 -0.04 0.42 1.18 0.00 0.00 175.17 175.55 1azy s THR 376 N -1.71 1.95 0.16 -1.27 -4.23 -1.26 -4.92 115.64 104.36 1azy s THR 376 Ca 0.74 -1.71 -0.34 0.00 -1.18 0.00 0.00 61.69 59.21 1azy s THR 376 Cb -0.26 -2.22 -0.15 0.00 1.34 0.00 0.00 72.50 71.20 1azy s THR 376 CO 0.30 -0.24 1.36 -0.38 -0.54 0.00 0.00 174.62 175.11 1azy n ILE 377 N 4.47 0.48 -2.97 2.99 5.41 -1.26 -4.92 119.36 123.55 1azy n ILE 377 Ca -0.08 -0.12 -0.44 0.00 1.00 0.00 0.00 62.75 63.11 1azy n ILE 377 Cb 0.43 -1.15 -0.03 0.00 -0.71 0.00 0.00 39.64 38.17 1azy n ILE 377 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1azy s ASP 378 N 0.39 6.36 0.00 4.38 -1.08 -0.42 -4.90 116.67 121.40 1azy s ASP 378 Ca 0.76 -1.56 0.00 0.00 -0.52 0.00 0.00 52.55 51.23 1azy s ASP 378 Cb -0.79 -2.37 0.00 0.00 -1.46 0.00 0.00 42.92 38.30 1azy s ASP 378 CO 0.47 -1.18 0.10 -1.22 0.52 0.00 0.00 175.17 173.85 1azy n TYR 379 N 6.75 0.00 0.00 -5.34 4.01 -1.26 -2.65 117.16 118.67 1azy n TYR 379 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1azy n TYR 379 Cb 0.46 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.48 1azy n TYR 379 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1azy n SER 380 N 0.13 2.48 -4.83 7.72 3.41 -1.26 -2.54 113.62 118.73 1azy n SER 380 Ca 0.00 -0.23 -0.33 0.00 -0.26 0.00 0.00 58.87 58.05 1azy n SER 380 Cb 0.02 0.96 -0.06 0.00 -0.26 0.00 0.00 64.21 64.87 1azy n SER 380 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1azy s VAL 381 N -1.46 4.52 -5.00 -3.33 1.01 -1.08 -4.29 120.40 110.77 1azy s VAL 381 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.22 1azy s VAL 381 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1azy s VAL 381 CO 0.00 -0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.42 1azy n GLY 382 N -0.59 -0.38 3.51 4.51 0.00 -0.92 -4.21 105.19 107.10 1azy n GLY 382 Ca 0.05 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.31 1azy n GLY 382 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1azy s PHE 383 N -2.69 2.57 0.13 1.61 0.08 -0.13 -1.53 117.98 118.02 1azy s PHE 383 Ca 0.00 -0.25 -0.10 0.00 0.12 0.00 0.00 56.93 56.70 1azy s PHE 383 Cb 0.00 -1.34 0.00 0.00 -0.57 0.00 0.00 43.02 41.11 1azy s PHE 383 CO 0.00 0.41 0.27 0.95 -0.10 0.00 0.00 175.22 176.75 1azy s THR 384 N -1.25 0.10 -1.39 0.64 -4.23 -0.69 -1.72 115.64 107.10 1azy s THR 384 Ca 0.19 -1.18 -0.09 0.00 -1.18 0.00 0.00 61.69 59.44 1azy s THR 384 Cb -0.10 -1.53 0.01 0.00 1.34 0.00 0.00 72.50 72.22 1azy s THR 384 CO 0.11 -0.45 1.12 0.47 -0.54 0.00 0.00 174.62 175.33 1azy n ASP 385 N -0.15 -6.30 -4.76 3.99 9.92 -0.62 0.39 116.55 119.01 1azy n ASP 385 Ca -0.12 -0.53 -0.41 0.00 -0.53 0.00 0.00 54.79 53.21 1azy n ASP 385 Cb 0.63 -4.97 -0.01 0.00 -0.64 0.00 0.00 41.12 36.12 1azy n ASP 385 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 1azy s MET 386 N -6.27 4.19 0.29 -1.24 -1.94 -0.94 -4.15 119.30 109.24 1azy s MET 386 Ca 0.56 2.45 -0.29 0.00 -1.71 0.00 0.00 55.69 56.71 1azy s MET 386 Cb -0.25 -3.03 -0.09 0.00 2.01 0.00 0.00 34.83 33.47 1azy s MET 386 CO 0.70 -0.47 1.05 0.00 -0.01 0.00 0.00 175.02 176.29 1azy s ALA 387 N -0.64 3.33 0.10 3.03 0.00 0.29 -4.94 121.76 122.93 1azy s ALA 387 Ca 0.56 0.79 0.02 0.00 0.00 0.00 0.00 51.96 53.33 1azy s ALA 387 Cb -0.45 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 1azy s ALA 387 CO 0.54 -0.07 0.19 1.03 0.00 0.00 0.00 175.76 177.44 1azy s ARG 388 N -1.58 3.23 0.17 0.00 0.52 -1.26 -4.93 118.95 115.09 1azy s ARG 388 Ca 0.46 -0.60 -0.34 0.00 -0.52 0.00 0.00 55.73 54.73 1azy s ARG 388 Cb -0.28 -2.89 -0.14 0.00 0.52 0.00 0.00 34.95 32.16 1azy s ARG 388 CO 0.36 0.56 1.59 1.28 0.02 0.00 0.00 175.30 179.11 1azy n LEU 389 N 0.02 3.20 0.00 2.53 4.77 -1.26 -1.38 117.00 124.88 1azy n LEU 389 Ca -0.07 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 57.00 1azy n LEU 389 Cb 0.52 -1.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1azy n LEU 389 CO 0.48 -0.24 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 1azy n GLY 390 N 3.42 3.24 3.74 -0.72 0.00 -0.02 -4.98 105.19 109.87 1azy n GLY 390 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1azy n GLY 390 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1azy s ASP 391 N -1.15 6.66 0.06 1.61 1.11 -0.48 -4.67 116.67 119.81 1azy s ASP 391 Ca 0.00 2.62 -0.25 0.00 0.18 0.00 0.00 52.55 55.10 1azy s ASP 391 Cb 0.00 -2.61 -0.06 0.00 1.07 0.00 0.00 42.92 41.32 1azy s ASP 391 CO 0.00 -0.72 0.77 -1.58 1.18 0.00 0.00 175.17 174.82 1azy s GLN 392 N 0.08 4.50 0.15 8.23 0.74 -1.26 -2.03 119.66 130.08 1azy s GLN 392 Ca 0.62 1.08 0.10 0.00 0.05 0.00 0.00 55.36 57.21 1azy s GLN 392 Cb -0.42 -3.35 -0.04 0.00 1.10 0.00 0.00 33.01 30.30 1azy s GLN 392 CO 0.39 0.32 -0.22 0.14 -0.55 0.00 0.00 175.29 175.37 1azy s VAL 393 N -0.19 2.52 -0.45 1.34 -7.23 0.16 -4.79 120.40 111.76 1azy s VAL 393 Ca 0.38 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 58.79 1azy s VAL 393 Cb -0.21 -2.16 0.00 0.00 0.56 0.00 0.00 36.38 34.57 1azy s VAL 393 CO 0.23 0.02 0.00 -0.90 -0.31 0.00 0.00 175.10 174.14 1azy n ASP 394 N 0.63 0.00 0.18 4.85 5.75 -1.06 -2.22 116.55 124.68 1azy n ASP 394 Ca -0.15 0.00 0.10 0.00 -0.01 0.00 0.00 54.79 54.73 1azy n ASP 394 Cb 0.54 0.00 0.53 0.00 -1.03 0.00 0.00 41.12 41.16 1azy n ASP 394 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1azy h GLY 395 N 0.00 0.00 0.92 6.12 0.00 -1.97 0.61 103.07 108.74 1azy h GLY 395 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 1azy h GLY 395 CO 0.00 0.00 -1.70 -1.06 0.00 0.00 0.00 176.54 173.78 1azy n GLN 396 N -2.24 0.63 -3.76 4.80 6.02 -1.26 -4.82 117.38 116.76 1azy n GLN 396 Ca -0.01 0.26 -0.29 0.00 -0.01 0.00 0.00 57.00 56.96 1azy n GLN 396 Cb 0.18 -1.78 -0.16 0.00 1.02 0.00 0.00 30.24 29.51 1azy n GLN 396 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1azy s ARG 397 N -2.65 0.78 0.88 -1.09 3.52 0.21 -5.14 118.95 115.46 1azy s ARG 397 Ca -0.05 -0.68 -0.12 0.00 -0.13 0.00 0.00 55.73 54.76 1azy s ARG 397 Cb 0.08 -2.11 0.12 0.00 -1.56 0.00 0.00 34.95 31.48 1azy s ARG 397 CO 0.82 -0.74 1.14 -1.25 -0.81 0.00 0.00 175.30 174.46 1azy s PRO 398 N 1.74 1.39 0.13 5.12 0.04 -1.26 -2.57 135.00 139.60 1azy s PRO 398 Ca 0.02 0.30 -0.06 0.00 0.04 0.00 0.00 61.00 61.30 1azy s PRO 398 Cb -0.17 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.40 1azy s PRO 398 CO -0.13 -2.03 1.31 -0.07 0.04 0.00 0.00 177.00 176.12 1azy h LEU 399 N -1.37 0.61 -7.77 -3.56 3.38 -0.23 -3.43 115.31 102.93 1azy h LEU 399 Ca -0.49 -0.47 0.16 0.00 0.09 0.00 0.00 57.88 57.17 1azy h LEU 399 Cb 1.32 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.83 1azy h LEU 399 CO 0.62 1.26 0.50 0.00 0.09 0.00 0.00 178.44 180.91 1azy s ALA 400 N -3.36 -1.58 -0.24 1.53 0.00 -1.23 -0.55 121.76 116.33 1azy s ALA 400 Ca -0.07 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1azy s ALA 400 Cb 0.09 0.68 0.04 0.00 0.00 0.00 0.00 23.12 23.92 1azy s ALA 400 CO 0.87 -1.05 -0.11 0.08 0.00 0.00 0.00 175.76 175.56 1azy s VAL 401 N -2.90 2.46 -0.22 0.00 1.01 0.16 -1.34 120.40 119.58 1azy s VAL 401 Ca 0.15 -1.23 -0.17 0.00 0.00 0.00 0.00 61.98 60.73 1azy s VAL 401 Cb -0.02 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1azy s VAL 401 CO 0.04 0.18 0.48 -0.63 0.00 0.00 0.00 175.10 175.18 1azy s ILE 402 N 1.24 5.12 -0.55 2.22 1.01 0.20 -1.71 121.20 128.73 1azy s ILE 402 Ca -0.02 0.86 -0.17 0.00 0.00 0.00 0.00 60.65 61.32 1azy s ILE 402 Cb -0.17 -3.81 0.12 0.00 0.01 0.00 0.00 42.46 38.62 1azy s ILE 402 CO -0.06 0.16 0.53 -1.00 0.00 0.00 0.00 174.94 174.57 1azy s HIS 403 N 1.81 3.20 0.43 3.97 3.76 -0.58 -1.31 115.29 126.57 1azy s HIS 403 Ca 0.22 -1.21 0.07 0.00 -0.15 0.00 0.00 55.06 53.98 1azy s HIS 403 Cb -0.15 -3.81 -0.05 0.00 1.11 0.00 0.00 32.58 29.67 1azy s HIS 403 CO 0.09 -1.06 0.12 0.00 -0.85 0.00 0.00 174.74 173.04 1azy s ALA 404 N 1.81 3.53 -0.09 -1.40 0.00 0.30 -2.17 121.76 123.74 1azy s ALA 404 Ca 0.05 -1.99 -0.21 0.00 0.00 0.00 0.00 51.96 49.80 1azy s ALA 404 Cb -0.29 -0.18 -0.17 0.00 0.00 0.00 0.00 23.12 22.49 1azy s ALA 404 CO 0.04 -0.15 0.74 0.87 0.00 0.00 0.00 175.76 177.26 1azy h LYS 405 N 1.50 -0.09 -4.91 0.00 1.57 -1.89 0.03 116.57 112.79 1azy h LYS 405 Ca -0.43 0.01 -0.42 0.00 -1.87 0.00 0.00 60.65 57.93 1azy h LYS 405 Cb 1.26 0.02 -0.14 0.00 0.08 0.00 0.00 32.23 33.45 1azy h LYS 405 CO 0.73 0.47 -0.56 0.16 -0.57 0.00 0.00 179.45 179.69 1azy s ASP 406 N -5.76 1.64 0.61 0.86 1.47 -1.26 -3.88 116.67 110.35 1azy s ASP 406 Ca -0.13 -1.54 0.40 0.00 1.18 0.00 0.00 52.55 52.46 1azy s ASP 406 Cb -0.01 0.36 2.06 0.00 -0.34 0.00 0.00 42.92 44.99 1azy s ASP 406 CO 0.49 -0.87 2.22 -0.08 0.68 0.00 0.00 175.17 177.62 1azy h GLU 407 N 2.19 0.00 0.11 2.11 4.57 -1.98 -2.20 114.58 119.38 1azy h GLU 407 Ca -0.34 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.83 1azy h GLU 407 Cb 1.25 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 1azy h GLU 407 CO 0.54 0.00 -0.05 -0.97 -1.18 0.00 0.00 179.01 177.35 1azy h ASN 408 N 0.00 -0.12 0.41 1.04 -1.24 -1.99 -2.34 115.58 111.34 1azy h ASN 408 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1azy h ASN 408 Cb 0.14 0.03 0.00 0.00 0.73 0.00 0.00 38.32 39.23 1azy h ASN 408 CO 0.00 0.03 0.00 -0.55 -1.29 0.00 0.00 177.43 175.62 1azy h ASN 409 N -0.38 0.00 0.14 1.15 -1.07 -1.98 0.13 115.58 113.57 1azy h ASN 409 Ca -0.01 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.35 1azy h ASN 409 Cb 0.11 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.36 1azy h ASN 409 CO 0.02 0.00 -0.07 -0.25 0.07 0.00 0.00 177.43 177.21 1azy h TRP 410 N 0.00 -0.17 -0.85 4.14 7.01 -1.49 -1.41 115.95 123.18 1azy h TRP 410 Ca 0.00 -0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.08 1azy h TRP 410 Cb 0.20 0.06 -0.07 0.00 -2.10 0.00 0.00 29.16 27.25 1azy h TRP 410 CO 0.00 0.22 0.51 0.37 -2.79 0.00 0.00 178.44 176.75 1azy h GLN 411 N -0.62 0.86 0.57 2.65 5.75 -0.42 0.18 115.11 124.07 1azy h GLN 411 Ca -0.02 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.41 1azy h GLN 411 Cb 0.47 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1azy h GLN 411 CO 0.03 0.57 -0.40 0.93 -2.65 0.00 0.00 178.83 177.31 1azy h GLU 412 N 0.88 -0.88 -0.99 1.69 5.08 -0.71 -2.55 114.58 117.10 1azy h GLU 412 Ca 0.40 0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.95 1azy h GLU 412 Cb 0.29 0.20 -0.09 0.00 0.50 0.00 0.00 28.75 29.66 1azy h GLU 412 CO -0.22 -0.59 0.62 0.00 -1.00 0.00 0.00 179.01 177.83 1azy h ALA 413 N -1.26 1.57 -0.79 3.43 0.00 -0.85 -0.71 119.26 120.66 1azy h ALA 413 Ca -0.08 0.03 0.10 0.00 0.00 0.00 0.00 54.91 54.96 1azy h ALA 413 Cb 0.75 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1azy h ALA 413 CO 0.05 0.16 0.52 0.00 0.00 0.00 0.00 179.25 179.98 1azy h ALA 414 N 1.56 1.80 0.03 0.00 0.00 -0.41 0.32 119.26 122.56 1azy h ALA 414 Ca 0.50 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 55.18 1azy h ALA 414 Cb 0.56 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1azy h ALA 414 CO -0.27 0.03 -0.98 0.87 0.00 0.00 0.00 179.25 178.90 1azy h LYS 415 N 0.69 0.29 -0.09 0.00 1.79 -0.74 -2.48 116.57 116.04 1azy h LYS 415 Ca 0.37 -0.35 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 1azy h LYS 415 Cb 0.49 0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 31.25 1azy h LYS 415 CO -0.14 1.07 0.02 0.00 -1.08 0.00 0.00 179.45 179.31 1azy h ALA 416 N 0.80 0.12 0.86 3.86 0.00 -0.30 -1.83 119.26 122.78 1azy h ALA 416 Ca -0.07 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1azy h ALA 416 Cb 1.63 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.39 1azy h ALA 416 CO 0.16 -0.24 -0.44 0.28 0.00 0.00 0.00 179.25 179.01 1azy h VAL 417 N -0.08 0.10 -0.79 0.00 2.07 -0.53 -1.79 116.25 115.23 1azy h VAL 417 Ca 0.03 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.78 1azy h VAL 417 Cb 0.27 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 1azy h VAL 417 CO 0.00 0.00 0.58 0.11 0.02 0.00 0.00 177.57 178.28 1azy h LYS 418 N -1.20 0.00 0.00 1.57 1.57 -1.47 0.13 116.57 117.18 1azy h LYS 418 Ca -0.12 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.44 1azy h LYS 418 Cb 0.93 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.21 1azy h LYS 418 CO 0.17 0.00 -1.09 0.00 -0.57 0.00 0.00 179.45 177.97 1azy h ALA 419 N 1.58 0.40 0.00 3.86 0.00 -1.04 -3.34 119.26 120.73 1azy h ALA 419 Ca 0.38 -0.98 -0.04 0.00 0.00 0.00 0.00 54.91 54.27 1azy h ALA 419 Cb 1.53 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1azy h ALA 419 CO -0.00 1.29 -0.41 0.00 0.00 0.00 0.00 179.25 180.13 1azy h ALA 420 N 1.00 0.80 -2.88 0.00 0.00 0.13 -3.44 119.26 114.87 1azy h ALA 420 Ca -0.04 -0.17 -0.68 0.00 0.00 0.00 0.00 54.91 54.02 1azy h ALA 420 Cb 1.80 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 19.36 1azy h ALA 420 CO 0.12 0.22 -0.56 0.42 0.00 0.00 0.00 179.25 179.45 1azy s ILE 421 N -3.16 4.56 -0.08 0.00 1.01 -0.82 -1.02 121.20 121.69 1azy s ILE 421 Ca 0.04 -0.45 -0.19 0.00 0.00 0.00 0.00 60.65 60.06 1azy s ILE 421 Cb 0.07 -3.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.16 1azy s ILE 421 CO 0.72 0.06 0.50 -0.54 0.00 0.00 0.00 174.94 175.68 1azy s LYS 422 N 1.60 4.30 0.51 2.79 1.02 0.19 -4.91 119.74 125.25 1azy s LYS 422 Ca 0.04 0.52 0.04 0.00 0.02 0.00 0.00 55.97 56.59 1azy s LYS 422 Cb -0.17 -3.40 0.03 0.00 -0.52 0.00 0.00 37.83 33.77 1azy s LYS 422 CO 0.06 0.24 0.71 -0.51 -0.92 0.00 0.00 175.35 174.93 1azy s LEU 423 N 0.33 3.39 0.19 3.17 1.43 -1.26 -0.66 118.68 125.27 1azy s LEU 423 Ca 0.27 -0.24 -0.23 0.00 -1.03 0.00 0.00 54.13 52.90 1azy s LEU 423 Cb -0.16 -2.66 0.06 0.00 0.03 0.00 0.00 46.19 43.46 1azy s LEU 423 CO 0.12 -1.05 0.64 0.00 0.23 0.00 0.00 176.35 176.29 1azy s ALA 424 N -2.62 -1.50 0.09 4.21 0.00 -0.25 -4.67 121.76 117.02 1azy s ALA 424 Ca 0.57 0.29 0.26 0.00 0.00 0.00 0.00 51.96 53.08 1azy s ALA 424 Cb -0.10 0.87 1.01 0.00 0.00 0.00 0.00 23.12 24.90 1azy s ALA 424 CO 0.37 -0.84 1.86 -0.44 0.00 0.00 0.00 175.76 176.70 1azy h ASP 425 N 2.00 0.00 -4.98 0.00 3.32 -1.93 -0.90 116.42 113.93 1azy h ASP 425 Ca -0.30 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.60 1azy h ASP 425 Cb 1.29 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.63 1azy h ASP 425 CO 0.34 0.16 -0.56 -0.75 -1.72 0.00 0.00 179.24 176.70 1azy s LYS 426 N -3.63 0.42 0.23 3.56 2.47 -1.26 -4.72 119.74 116.81 1azy s LYS 426 Ca 0.01 -0.47 -0.32 0.00 -1.56 0.00 0.00 55.97 53.63 1azy s LYS 426 Cb 0.10 0.17 -0.13 0.00 -1.46 0.00 0.00 37.83 36.51 1azy s LYS 426 CO 0.61 -0.09 1.58 0.00 0.16 0.00 0.00 175.35 177.61 1azy n ALA 427 N 1.50 2.02 -1.39 3.13 0.00 -1.26 -4.84 120.51 119.67 1azy n ALA 427 Ca -0.23 0.41 -0.29 0.00 0.00 0.00 0.00 53.44 53.32 1azy n ALA 427 Cb 0.55 -2.41 0.13 0.00 0.00 0.00 0.00 19.45 17.73 1azy n ALA 427 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1azy s PRO 428 N 0.26 1.24 0.28 0.00 0.04 -1.26 -4.99 135.00 130.57 1azy s PRO 428 Ca 0.71 0.53 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 1azy s PRO 428 Cb -0.58 -1.83 -0.10 0.00 0.04 0.00 0.00 34.50 32.04 1azy s PRO 428 CO 0.42 -2.18 1.29 -1.21 0.04 0.00 0.00 177.00 175.36 1azy s GLU 429 N -5.11 4.40 0.54 4.56 0.41 -1.26 -4.93 118.70 117.31 1azy s GLU 429 Ca 0.63 2.12 -0.17 0.00 -0.41 0.00 0.00 54.97 57.14 1azy s GLU 429 Cb -0.16 -3.13 -0.06 0.00 -1.78 0.00 0.00 34.13 29.00 1azy s GLU 429 CO 0.55 -0.17 1.04 -1.12 -0.49 0.00 0.00 175.26 175.07 1azy s SER 430 N -0.23 6.12 0.24 -0.19 0.01 -1.26 -5.07 113.70 113.31 1azy s SER 430 Ca 0.51 1.81 0.11 0.00 1.31 0.00 0.00 55.95 59.69 1azy s SER 430 Cb -0.38 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.27 1azy s SER 430 CO 0.46 -0.94 -0.20 0.42 0.41 0.00 0.00 173.24 173.39 1azy s THR 431 N -2.33 2.51 0.81 1.44 -4.23 -1.26 -5.14 115.64 107.44 1azy s THR 431 Ca 0.64 -2.18 -0.11 0.00 -1.18 0.00 0.00 61.69 58.86 1azy s THR 431 Cb -0.15 -2.27 0.08 0.00 1.34 0.00 0.00 72.50 71.50 1azy s THR 431 CO 0.30 -0.26 1.09 -2.84 -0.54 0.00 0.00 174.62 172.37 1azy s PRO 432 N -3.12 1.97 -0.18 3.99 0.02 -1.26 -4.98 135.00 131.44 1azy s PRO 432 Ca 0.26 0.95 -0.09 0.00 0.02 0.00 0.00 61.00 62.14 1azy s PRO 432 Cb -0.07 -1.88 -0.22 0.00 0.02 0.00 0.00 34.50 32.36 1azy s PRO 432 CO 0.13 -1.78 0.17 0.25 -0.33 0.00 0.00 177.00 175.44 1azy n THR 433 N -3.59 1.66 -3.93 0.99 -2.24 -1.26 -4.55 114.28 101.37 1azy n THR 433 Ca 0.08 -0.48 -0.34 0.00 -2.27 0.00 0.00 64.05 61.03 1azy n THR 433 Cb 0.54 -1.76 -0.14 0.00 -2.10 0.00 0.00 70.33 66.87 1azy n THR 433 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1azy s VAL 434 N -2.50 2.86 -0.04 2.28 1.01 -1.26 -0.44 120.40 122.31 1azy s VAL 434 Ca -0.27 -1.49 -0.23 0.00 0.00 0.00 0.00 61.98 59.99 1azy s VAL 434 Cb 0.08 -2.68 -0.17 0.00 0.00 0.00 0.00 36.38 33.60 1azy s VAL 434 CO 0.68 -0.14 1.01 1.88 0.00 0.00 0.00 175.10 178.53 1azy h TYR 435 N 7.95 -0.17 -2.27 5.22 -1.99 -1.33 -3.49 116.97 120.89 1azy h TYR 435 Ca -0.20 -0.00 0.16 0.00 2.00 0.00 0.00 58.73 60.69 1azy h TYR 435 Cb 1.06 0.06 -0.11 0.00 2.00 0.00 0.00 36.73 39.73 1azy h TYR 435 CO 0.61 0.29 0.51 -0.98 -0.00 0.00 0.00 178.16 178.58 1azy s ARG 436 N -3.74 1.02 -0.26 4.88 1.70 -1.26 -4.99 118.95 116.29 1azy s ARG 436 Ca -0.14 -0.51 -0.01 0.00 -0.47 0.00 0.00 55.73 54.61 1azy s ARG 436 Cb 0.01 0.38 0.04 0.00 -0.57 0.00 0.00 34.95 34.81 1azy s ARG 436 CO 0.54 -0.46 -0.06 0.50 -1.08 0.00 0.00 175.30 174.74 1azy s ARG 437 N -3.18 2.61 0.13 3.89 3.52 -1.26 -2.34 118.95 122.32 1azy s ARG 437 Ca 0.10 -1.13 -0.23 0.00 -0.13 0.00 0.00 55.73 54.34 1azy s ARG 437 Cb -0.01 -3.01 -0.07 0.00 -1.56 0.00 0.00 34.95 30.30 1azy s ARG 437 CO -0.02 -0.49 0.71 0.42 -0.81 0.00 0.00 175.30 175.11 1azy s ILE 438 N 1.26 4.51 0.20 4.11 1.09 -0.69 -4.97 121.20 126.71 1azy s ILE 438 Ca -0.03 1.54 -0.16 0.00 -1.10 0.00 0.00 60.65 60.90 1azy s ILE 438 Cb -0.18 -4.06 0.02 0.00 -1.06 0.00 0.00 42.46 37.18 1azy s ILE 438 CO -0.04 0.53 0.50 -0.94 -0.10 0.00 0.00 174.94 174.89 1azy s SER 439 N -1.08 -0.20 0.00 3.58 1.04 -1.26 -2.50 113.70 113.28 1azy s SER 439 Ca 0.34 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 56.16 1azy s SER 439 Cb -0.22 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1azy s SER 439 CO 0.24 -1.07 0.00 1.21 0.98 0.00 0.00 173.24 174.60