#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pou h LEU 6 N 0.00 0.67 0.17 -2.12 4.07 -1.98 0.51 115.31 116.62 1pou h LEU 6 Ca 0.00 0.02 0.01 0.00 0.08 0.00 0.00 57.88 57.99 1pou h LEU 6 Cb 0.00 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 41.59 1pou h LEU 6 CO 0.00 0.44 -0.24 -0.33 -1.08 0.00 0.00 178.44 177.23 1pou h GLU 7 N 0.80 -0.46 -0.60 1.13 3.07 -2.00 0.15 114.58 116.69 1pou h GLU 7 Ca 0.31 0.03 0.02 0.00 -0.50 0.00 0.00 59.36 59.22 1pou h GLU 7 Cb 0.13 0.10 -0.04 0.00 -0.84 0.00 0.00 28.75 28.11 1pou h GLU 7 CO -0.16 -0.30 0.37 0.93 -1.40 0.00 0.00 179.01 178.45 1pou h GLU 8 N -0.47 0.72 -0.28 2.33 5.08 -1.87 0.19 114.58 120.27 1pou h GLU 8 Ca 0.02 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1pou h GLU 8 Cb 0.47 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 1pou h GLU 8 CO -0.10 0.47 0.11 -0.07 -1.00 0.00 0.00 179.01 178.42 1pou h LEU 9 N 0.74 0.13 0.45 1.33 3.38 -0.52 0.14 115.31 120.95 1pou h LEU 9 Ca 0.24 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 1pou h LEU 9 Cb -0.00 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1pou h LEU 9 CO -0.09 0.11 -0.30 -0.08 0.09 0.00 0.00 178.44 178.17 1pou h GLU 10 N 0.24 -0.70 -0.15 1.13 4.57 -0.23 0.13 114.58 119.56 1pou h GLU 10 Ca 0.12 0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.39 1pou h GLU 10 Cb 0.08 0.16 -0.05 0.00 -0.16 0.00 0.00 28.75 28.78 1pou h GLU 10 CO -0.12 -0.47 -0.16 1.96 -1.18 0.00 0.00 179.01 179.05 1pou h GLN 11 N -0.73 -0.18 -0.00 1.92 1.08 -0.82 0.13 115.11 116.51 1pou h GLN 11 Ca -0.05 0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.20 1pou h GLN 11 Cb 0.61 0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 28.03 1pou h GLN 11 CO 0.03 -0.12 -0.24 0.35 -0.95 0.00 0.00 178.83 177.90 1pou h PHE 12 N -0.19 -0.64 -0.40 2.96 3.57 -0.63 0.72 116.94 122.34 1pou h PHE 12 Ca 0.10 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1pou h PHE 12 Cb 0.34 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.34 1pou h PHE 12 CO -0.28 -0.33 0.25 0.00 -2.23 0.00 0.00 178.31 175.72 1pou h ALA 13 N 0.48 0.51 -0.56 2.41 0.00 -0.21 0.29 119.26 122.18 1pou h ALA 13 Ca 0.06 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1pou h ALA 13 Cb 0.45 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1pou h ALA 13 CO -0.22 -0.01 0.27 -0.22 0.00 0.00 0.00 179.25 179.07 1pou h LYS 14 N 0.53 0.50 -0.62 0.00 3.64 -0.61 0.36 116.57 120.37 1pou h LYS 14 Ca 0.14 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 1pou h LYS 14 Cb -0.03 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1pou h LYS 14 CO -0.03 0.33 0.23 1.15 -2.27 0.00 0.00 179.45 178.86 1pou h THR 15 N 0.51 1.24 -0.14 1.00 2.02 0.06 0.88 112.91 118.49 1pou h THR 15 Ca 0.26 -0.78 0.04 0.00 0.77 0.00 0.00 66.41 66.70 1pou h THR 15 Cb 0.20 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 1pou h THR 15 CO -0.20 0.30 -0.11 0.15 0.37 0.00 0.00 175.52 176.04 1pou h PHE 16 N 0.88 -0.26 -0.02 3.16 3.04 0.19 0.13 116.94 124.05 1pou h PHE 16 Ca 0.21 0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.20 1pou h PHE 16 Cb 0.24 0.14 -0.03 0.00 2.56 0.00 0.00 35.95 38.86 1pou h PHE 16 CO 0.02 -0.16 -0.13 -0.22 -2.02 0.00 0.00 178.31 175.79 1pou h LYS 17 N -0.12 -0.21 -0.44 1.11 3.64 -0.62 0.15 116.57 120.09 1pou h LYS 17 Ca 0.09 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1pou h LYS 17 Cb 0.25 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 1pou h LYS 17 CO -0.21 -0.14 0.26 -0.56 -2.27 0.00 0.00 179.45 176.53 1pou h GLN 18 N -0.21 0.50 -0.26 1.90 -0.00 -0.43 -0.19 115.11 116.42 1pou h GLN 18 Ca 0.05 -0.03 -0.04 0.00 -0.00 0.00 0.00 58.65 58.64 1pou h GLN 18 Cb 0.29 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.48 27.64 1pou h GLN 18 CO -0.15 0.33 0.01 -0.09 -0.00 0.00 0.00 178.83 178.93 1pou h ARG 19 N 0.52 0.46 -0.37 0.06 9.65 -0.55 0.87 114.38 125.02 1pou h ARG 19 Ca 0.18 -0.14 0.08 0.00 -1.10 0.00 0.00 59.98 59.00 1pou h ARG 19 Cb 0.02 -0.04 -0.08 0.00 -1.39 0.00 0.00 29.97 28.47 1pou h ARG 19 CO -0.08 0.61 -0.19 -0.09 2.80 0.00 0.00 179.97 183.01 1pou h ARG 20 N 0.24 -0.13 -0.17 0.20 2.43 -0.41 0.17 114.38 116.71 1pou h ARG 20 Ca 0.08 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1pou h ARG 20 Cb 0.40 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1pou h ARG 20 CO 0.01 -0.08 0.09 0.82 -1.51 0.00 0.00 179.97 179.30 1pou h ILE 21 N -0.13 1.01 -0.80 1.20 2.04 -0.75 -0.23 117.51 119.84 1pou h ILE 21 Ca 0.19 -0.07 0.07 0.00 1.00 0.00 0.00 64.86 66.05 1pou h ILE 21 Cb 0.42 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 1pou h ILE 21 CO -0.46 0.04 0.48 0.50 0.00 0.00 0.00 178.15 178.71 1pou h LYS 22 N 0.19 0.83 0.00 2.37 1.63 -0.05 0.17 116.57 121.71 1pou h LYS 22 Ca 0.07 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 1pou h LYS 22 Cb 0.01 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.45 1pou h LYS 22 CO -0.04 0.55 0.00 -0.07 -3.45 0.00 0.00 179.45 176.44 1pou h LEU 23 N 0.85 0.00 1.79 5.20 3.38 -0.37 -3.46 115.31 122.70 1pou h LEU 23 Ca 0.36 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.05 1pou h LEU 23 Cb 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1pou h LEU 23 CO -0.20 0.00 -0.34 0.61 0.09 0.00 0.00 178.44 178.60 1pou n GLY 24 N -0.17 0.05 3.50 0.83 0.00 0.58 -4.95 105.19 105.03 1pou n GLY 24 Ca 0.01 -0.31 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 1pou n GLY 24 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1pou s PHE 25 N -2.67 2.68 1.20 1.61 0.40 -0.20 -5.00 117.98 116.00 1pou s PHE 25 Ca 0.00 -0.22 -0.16 0.00 -0.60 0.00 0.00 56.93 55.95 1pou s PHE 25 Cb 0.00 -4.23 0.29 0.00 0.51 0.00 0.00 43.02 39.59 1pou s PHE 25 CO 0.00 -1.56 1.03 0.95 0.70 0.00 0.00 175.22 176.34 1pou s THR 26 N 4.22 1.75 0.21 0.64 -4.23 -1.26 -4.58 115.64 112.39 1pou s THR 26 Ca 0.28 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 60.67 1pou s THR 26 Cb -0.14 -2.23 0.20 0.00 1.34 0.00 0.00 72.50 71.67 1pou s THR 26 CO 0.15 0.00 1.65 1.56 -0.54 0.00 0.00 174.62 177.44 1pou h GLN 27 N -2.67 0.07 0.18 3.99 7.50 -1.94 0.19 115.11 122.43 1pou h GLN 27 Ca -0.54 -0.00 0.01 0.00 0.50 0.00 0.00 58.65 58.62 1pou h GLN 27 Cb 1.33 -0.01 -0.03 0.00 0.05 0.00 0.00 27.48 28.81 1pou h GLN 27 CO 0.45 0.04 -0.32 0.78 -1.50 0.00 0.00 178.83 178.28 1pou h GLY 28 N 0.07 -0.65 0.36 3.46 0.00 -1.93 0.81 103.07 105.18 1pou h GLY 28 Ca 0.30 0.38 0.01 0.00 0.00 0.00 0.00 47.33 48.02 1pou h GLY 28 CO -0.56 -0.26 -0.45 -1.80 0.00 0.00 0.00 176.54 173.48 1pou h ASP 29 N -0.58 -1.28 -0.15 0.19 1.82 -1.60 0.12 116.42 114.93 1pou h ASP 29 Ca 0.02 0.13 -0.00 0.00 -0.39 0.00 0.00 57.03 56.78 1pou h ASP 29 Cb 0.59 0.46 -0.01 0.00 0.68 0.00 0.00 39.33 41.05 1pou h ASP 29 CO -0.15 -0.54 0.09 0.58 -1.61 0.00 0.00 179.24 177.61 1pou h VAL 30 N -0.76 1.08 -0.37 2.25 2.07 -0.98 0.39 116.25 119.94 1pou h VAL 30 Ca -0.01 -0.20 0.08 0.00 0.82 0.00 0.00 66.70 67.39 1pou h VAL 30 Cb 0.74 0.94 -0.08 0.00 -1.52 0.00 0.00 31.29 31.36 1pou h VAL 30 CO -0.18 0.07 -0.24 1.23 0.02 0.00 0.00 177.57 178.47 1pou h GLY 31 N 0.17 -0.05 0.96 2.17 0.00 -0.62 0.17 103.07 105.86 1pou h GLY 31 Ca 0.05 0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.66 1pou h GLY 31 CO -0.01 -0.20 -0.29 -2.00 0.00 0.00 0.00 176.54 174.03 1pou h LEU 32 N -0.19 -0.70 -0.43 3.11 5.85 -0.42 0.10 115.31 122.63 1pou h LEU 32 Ca 0.18 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.91 1pou h LEU 32 Cb 0.47 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1pou h LEU 32 CO -0.48 -0.46 0.28 0.00 -0.34 0.00 0.00 178.44 177.44 1pou h ALA 33 N -0.52 0.55 -0.54 1.25 0.00 -0.74 0.13 119.26 119.40 1pou h ALA 33 Ca -0.08 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.87 1pou h ALA 33 Cb 0.65 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1pou h ALA 33 CO 0.14 -0.01 0.22 0.52 0.00 0.00 0.00 179.25 180.12 1pou h MET 34 N 0.57 0.41 -0.70 0.00 2.86 -0.65 -0.30 114.93 117.13 1pou h MET 34 Ca 0.16 -0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.87 1pou h MET 34 Cb -0.05 -0.09 -0.12 0.00 0.06 0.00 0.00 31.60 31.40 1pou h MET 34 CO -0.05 0.27 -0.47 0.78 1.06 0.00 0.00 176.91 178.51 1pou h GLY 35 N 0.43 -0.49 0.93 8.32 0.00 0.79 0.41 103.07 113.45 1pou h GLY 35 Ca 0.26 0.61 0.00 0.00 0.00 0.00 0.00 47.33 48.20 1pou h GLY 35 CO -0.23 -0.13 -0.03 0.50 0.00 0.00 0.00 176.54 176.65 1pou h LYS 36 N -0.17 -0.06 0.00 4.80 1.79 0.06 -3.09 116.57 119.90 1pou h LYS 36 Ca 0.19 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.49 1pou h LYS 36 Cb 0.54 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 1pou h LYS 36 CO -0.77 -0.04 -0.86 -0.07 -1.08 0.00 0.00 179.45 176.62 1pou h LEU 37 N -0.07 0.00 0.00 2.94 3.38 -0.67 -3.45 115.31 117.45 1pou h LEU 37 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1pou h LEU 37 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1pou h LEU 37 CO -0.03 0.86 0.00 -1.22 0.09 0.00 0.00 178.44 178.14 1pou n TYR 38 N -3.44 -2.99 0.00 1.13 4.02 0.11 -5.08 117.16 110.90 1pou n TYR 38 Ca -0.00 0.74 0.00 0.00 -0.01 0.00 0.00 57.90 58.63 1pou n TYR 38 Cb 0.84 1.57 0.00 0.00 -0.02 0.00 0.00 39.34 41.73 1pou n TYR 38 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1pou n GLY 39 N 0.56 3.21 1.47 2.72 0.00 0.89 -4.91 105.19 109.13 1pou n GLY 39 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1pou n GLY 39 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1pou n ASN 40 N 0.00 4.76 -1.65 1.61 6.94 -1.26 -3.55 115.26 122.12 1pou n ASN 40 Ca 0.00 -2.27 -0.04 0.00 -0.02 0.00 0.00 54.58 52.25 1pou n ASN 40 Cb 0.00 -0.99 -0.02 0.00 -2.36 0.00 0.00 39.78 36.41 1pou n ASN 40 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 1pou n ASP 41 N 1.42 5.49 -1.87 0.53 2.03 -1.26 -3.73 116.55 119.16 1pou n ASP 41 Ca 0.00 -2.52 -0.00 0.00 0.52 0.00 0.00 54.79 52.79 1pou n ASP 41 Cb 0.47 -1.17 0.02 0.00 -0.72 0.00 0.00 41.12 39.72 1pou n ASP 41 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1pou n PHE 42 N 1.50 0.01 -1.06 -0.67 3.72 -1.26 -4.62 117.46 115.08 1pou n PHE 42 Ca 0.11 -1.06 -0.34 0.00 -0.05 0.00 0.00 57.45 56.11 1pou n PHE 42 Cb 0.57 0.22 -0.03 0.00 -0.94 0.00 0.00 39.48 39.31 1pou n PHE 42 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1pou n SER 43 N -0.17 4.43 0.00 4.37 7.64 -1.24 -4.15 113.62 124.49 1pou n SER 43 Ca -0.05 -2.53 0.00 0.00 1.01 0.00 0.00 58.87 57.30 1pou n SER 43 Cb 0.92 -1.22 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 1pou n SER 43 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1pou n GLN 44 N 5.30 0.00 -0.06 1.43 7.27 -1.26 -4.65 117.38 125.40 1pou n GLN 44 Ca 0.51 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 57.53 1pou n GLN 44 Cb 0.26 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 32.88 1pou n GLN 44 CO 0.00 0.00 0.00 1.15 0.07 0.00 0.00 177.06 178.28 1pou h THR 45 N 0.00 0.00 -0.93 1.69 2.02 -1.96 0.15 112.91 113.88 1pou h THR 45 Ca 0.00 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.30 1pou h THR 45 Cb 0.00 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.33 1pou h THR 45 CO 0.00 0.00 0.56 0.74 0.37 0.00 0.00 175.52 177.19 1pou h THR 46 N -0.13 0.89 -0.44 3.16 2.02 -1.82 0.11 112.91 116.69 1pou h THR 46 Ca 0.03 -0.30 -0.05 0.00 0.77 0.00 0.00 66.41 66.86 1pou h THR 46 Cb 0.21 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 1pou h THR 46 CO -0.24 0.16 0.10 0.40 0.37 0.00 0.00 175.52 176.31 1pou h ILE 47 N 0.89 1.24 -0.44 3.11 1.08 -1.60 0.14 117.51 121.92 1pou h ILE 47 Ca 0.46 -0.83 -0.06 0.00 -0.39 0.00 0.00 64.86 64.05 1pou h ILE 47 Cb 0.47 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 35.14 1pou h ILE 47 CO -0.27 0.29 0.06 0.77 -0.69 0.00 0.00 178.15 178.31 1pou h SER 48 N 0.58 0.72 -0.44 1.72 4.64 0.52 0.08 113.55 121.36 1pou h SER 48 Ca 0.14 -0.27 0.02 0.00 -0.47 0.00 0.00 61.79 61.21 1pou h SER 48 Cb 0.33 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.20 1pou h SER 48 CO 0.00 0.81 0.26 0.03 -0.87 0.00 0.00 176.83 177.06 1pou h ARG 49 N 0.60 0.51 0.42 4.77 2.47 -0.61 0.15 114.38 122.69 1pou h ARG 49 Ca 0.13 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.81 1pou h ARG 49 Cb 0.41 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.59 1pou h ARG 49 CO 0.01 0.34 -0.42 0.35 0.56 0.00 0.00 179.97 180.81 1pou h PHE 50 N 0.53 -1.14 -0.43 3.04 3.57 -0.55 0.20 116.94 122.14 1pou h PHE 50 Ca 0.18 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.66 1pou h PHE 50 Cb 0.01 0.44 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1pou h PHE 50 CO -0.07 -0.58 0.16 1.49 -2.23 0.00 0.00 178.31 177.08 1pou h GLU 51 N -0.86 0.62 0.00 1.11 4.22 -0.72 0.20 114.58 119.15 1pou h GLU 51 Ca -0.04 -0.09 0.00 0.00 0.08 0.00 0.00 59.36 59.31 1pou h GLU 51 Cb 0.76 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1pou h GLU 51 CO -0.06 0.53 0.00 0.00 -2.18 0.00 0.00 179.01 177.29 1pou n ALA 52 N -2.47 2.14 -2.30 2.92 0.00 0.49 -4.77 120.51 116.52 1pou n ALA 52 Ca 0.03 -0.11 -0.20 0.00 0.00 0.00 0.00 53.44 53.16 1pou n ALA 52 Cb 0.16 -1.34 -0.02 0.00 0.00 0.00 0.00 19.45 18.25 1pou n ALA 52 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1pou n LEU 53 N -1.19 -1.82 0.08 0.00 0.00 0.70 -4.88 117.00 109.88 1pou n LEU 53 Ca 0.12 0.06 -0.12 0.00 0.00 0.00 0.00 56.01 56.07 1pou n LEU 53 Cb 0.13 -2.86 -0.04 0.00 0.00 0.00 0.00 43.42 40.65 1pou n LEU 53 CO 0.14 -0.31 0.18 -1.13 0.00 0.00 0.00 177.39 176.28 1pou h ASN 54 N 0.00 0.43 0.08 1.96 -0.73 -0.85 -1.36 115.58 115.10 1pou h ASN 54 Ca -0.47 -0.36 0.00 0.00 1.87 0.00 0.00 56.30 57.35 1pou h ASN 54 Cb 1.35 -0.13 0.00 0.00 0.27 0.00 0.00 38.32 39.81 1pou h ASN 54 CO 0.57 1.17 0.00 0.18 -0.37 0.00 0.00 177.43 178.97 1pou n LEU 55 N -3.70 0.00 0.00 0.34 4.77 -1.24 -4.86 117.00 112.31 1pou n LEU 55 Ca -0.06 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1pou n LEU 55 Cb 0.84 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 1pou n LEU 55 CO 0.50 -0.21 0.00 -1.20 -1.33 0.00 0.00 177.39 175.15 1pou n SER 56 N -1.25 0.00 0.06 -1.43 7.64 -0.52 -3.80 113.62 114.32 1pou n SER 56 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1pou n SER 56 Cb 0.03 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1pou n SER 56 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1pou n PHE 57 N 0.00 -2.52 -0.21 1.43 7.35 -1.26 -4.93 117.46 117.32 1pou n PHE 57 Ca 0.00 0.39 -0.02 0.00 -0.76 0.00 0.00 57.45 57.06 1pou n PHE 57 Cb 0.00 1.25 0.05 0.00 0.35 0.00 0.00 39.48 41.12 1pou n PHE 57 CO 0.00 0.00 0.00 1.57 -0.76 0.00 0.00 176.76 177.57 1pou h LYS 58 N 0.00 -0.06 0.02 -4.13 2.10 -2.01 0.57 116.57 113.07 1pou h LYS 58 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1pou h LYS 58 Cb 0.00 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 1pou h LYS 58 CO 0.00 -0.04 -0.01 -0.97 -2.00 0.00 0.00 179.45 176.42 1pou h ASN 59 N -0.07 -0.03 -0.90 7.07 -0.73 -1.96 -3.38 115.58 115.58 1pou h ASN 59 Ca 0.29 -0.69 0.17 0.00 1.87 0.00 0.00 56.30 57.93 1pou h ASN 59 Cb 0.52 0.01 -0.16 0.00 0.27 0.00 0.00 38.32 38.95 1pou h ASN 59 CO -0.68 0.77 -0.26 0.23 -0.37 0.00 0.00 177.43 177.12 1pou n MET 60 N -4.71 -0.12 0.21 6.67 2.81 -0.66 -0.39 117.12 120.92 1pou n MET 60 Ca -0.08 1.40 0.05 0.00 -1.81 0.00 0.00 57.70 57.26 1pou n MET 60 Cb 0.35 -2.09 0.46 0.00 -0.71 0.00 0.00 33.22 31.23 1pou n MET 60 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1pou h LYS 62 N 0.00 0.41 -0.26 0.00 1.79 -0.90 -3.38 116.57 114.22 1pou h LYS 62 Ca -0.00 -0.69 -0.10 0.00 -2.18 0.00 0.00 60.65 57.67 1pou h LYS 62 Cb 0.50 0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 31.39 1pou h LYS 62 CO 0.04 1.33 -0.28 1.37 -1.08 0.00 0.00 179.45 180.83 1pou h LEU 63 N 0.07 0.52 0.01 2.94 8.10 -0.44 -3.10 115.31 123.42 1pou h LEU 63 Ca -0.33 -0.19 0.00 0.00 0.11 0.00 0.00 57.88 57.48 1pou h LEU 63 Cb 2.08 -0.14 -0.01 0.00 -0.44 0.00 0.00 40.66 42.14 1pou h LEU 63 CO 0.18 0.79 -0.14 0.50 -4.11 0.00 0.00 178.44 175.66 1pou h LYS 64 N 0.45 -0.18 -0.78 0.17 3.64 -0.77 0.87 116.57 119.98 1pou h LYS 64 Ca 0.06 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.51 1pou h LYS 64 Cb 0.71 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.53 1pou h LYS 64 CO 0.05 -0.12 0.51 -1.00 -2.27 0.00 0.00 179.45 176.63 1pou h PRO 65 N -0.18 0.83 0.05 1.90 0.13 -1.77 0.30 132.00 133.27 1pou h PRO 65 Ca 0.00 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.11 1pou h PRO 65 Cb 0.19 -0.19 -0.05 0.00 0.13 0.00 0.00 31.00 31.09 1pou h PRO 65 CO -0.09 0.55 -0.32 1.25 -0.23 0.00 0.00 178.00 179.16 1pou h LEU 66 N 0.86 -0.94 -1.19 1.56 6.46 -1.43 0.57 115.31 121.20 1pou h LEU 66 Ca 0.33 0.12 -0.08 0.00 -0.12 0.00 0.00 57.88 58.13 1pou h LEU 66 Cb 0.20 0.37 -0.01 0.00 -0.73 0.00 0.00 40.66 40.49 1pou h LEU 66 CO -0.11 -0.39 -0.28 -0.07 -0.62 0.00 0.00 178.44 176.96 1pou h LEU 67 N -0.50 0.20 -0.17 2.25 3.38 0.07 -1.35 115.31 119.20 1pou h LEU 67 Ca 0.05 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1pou h LEU 67 Cb 0.56 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1pou h LEU 67 CO -0.23 0.49 0.05 -0.08 0.09 0.00 0.00 178.44 178.76 1pou h GLU 68 N 0.18 0.27 -0.74 1.13 4.81 0.06 0.20 114.58 120.49 1pou h GLU 68 Ca 0.03 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 1pou h GLU 68 Cb 0.60 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 1pou h GLU 68 CO 0.04 0.39 0.22 0.87 -0.73 0.00 0.00 179.01 179.79 1pou h LYS 69 N 0.10 1.16 -0.44 1.92 1.57 -0.77 0.48 116.57 120.60 1pou h LYS 69 Ca 0.06 -0.26 0.08 0.00 -1.87 0.00 0.00 60.65 58.66 1pou h LYS 69 Cb 0.23 -0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.30 1pou h LYS 69 CO -0.00 1.00 -0.03 2.35 -0.57 0.00 0.00 179.45 182.20 1pou h TRP 70 N 1.11 -0.08 -0.23 -1.35 7.01 -0.96 -0.08 115.95 121.38 1pou h TRP 70 Ca 0.24 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.27 1pou h TRP 70 Cb 0.33 0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.48 1pou h TRP 70 CO 0.03 -0.12 0.12 -0.07 -2.79 0.00 0.00 178.44 175.61 1pou h LEU 71 N 0.08 0.29 -0.15 0.65 3.38 0.31 0.19 115.31 120.06 1pou h LEU 71 Ca 0.22 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1pou h LEU 71 Cb 0.32 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 1pou h LEU 71 CO -0.39 0.30 -0.23 -1.13 0.09 0.00 0.00 178.44 177.08 1pou h ASN 72 N 0.25 -0.72 -0.00 -0.43 -1.24 -0.66 0.25 115.58 113.02 1pou h ASN 72 Ca 0.08 0.12 0.00 0.00 0.71 0.00 0.00 56.30 57.21 1pou h ASN 72 Cb 0.07 0.33 -0.00 0.00 0.73 0.00 0.00 38.32 39.45 1pou h ASN 72 CO -0.01 -0.28 -0.01 -0.78 -1.29 0.00 0.00 177.43 175.06 1pou h ASP 73 N -0.29 -0.02 -0.10 1.15 3.58 -0.59 -3.06 116.42 117.09 1pou h ASP 73 Ca 0.11 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.47 1pou h ASP 73 Cb 0.44 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.49 1pou h ASP 73 CO -0.31 -0.01 -0.19 0.00 -2.88 0.00 0.00 179.24 175.84 1pou h ALA 74 N 0.99 1.15 0.00 -0.78 0.00 -0.41 -3.51 119.26 116.70 1pou h ALA 74 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1pou h ALA 74 Cb 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1pou h ALA 74 CO -0.01 0.54 0.00 -1.91 0.00 0.00 0.00 179.25 177.87