#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 0.63 -0.77 -2.67 4.07 -2.03 0.33 115.31 114.87 1pou h LEU 6 Ca 0.00 0.15 0.16 0.00 0.08 0.00 0.00 57.88 58.27 1pou h LEU 6 Cb 0.00 0.06 -0.11 0.00 1.08 0.00 0.00 40.66 41.70 1pou h LEU 6 CO 0.00 0.03 0.25 -0.33 -1.08 0.00 0.00 178.44 177.32 1pou h GLU 7 N 0.51 0.34 0.09 1.13 3.07 -2.05 0.12 114.58 117.78 1pou h GLU 7 Ca 0.67 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 59.51 1pou h GLU 7 Cb 1.36 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 1pou h GLU 7 CO -0.52 0.23 -0.04 1.49 -1.40 0.00 0.00 179.01 178.77 1pou h GLU 8 N 0.35 -0.11 -0.41 2.33 4.81 -0.84 -3.24 114.58 117.47 1pou h GLU 8 Ca 0.44 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.75 1pou h GLU 8 Cb 0.73 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.07 1pou h GLU 8 CO -0.47 0.30 0.00 -0.07 -0.73 0.00 0.00 179.01 178.04 1pou h LEU 9 N -0.57 -0.17 0.79 1.64 3.38 -0.14 0.13 115.31 120.37 1pou h LEU 9 Ca -0.01 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1pou h LEU 9 Cb 0.47 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1pou h LEU 9 CO 0.02 -0.05 -0.41 1.05 0.09 0.00 0.00 178.44 179.14 1pou h GLU 10 N 0.11 -1.06 -0.32 1.13 4.11 -0.93 0.20 114.58 117.81 1pou h GLU 10 Ca 0.20 0.07 0.07 0.00 0.07 0.00 0.00 59.36 59.78 1pou h GLU 10 Cb 0.29 0.24 -0.08 0.00 0.50 0.00 0.00 28.75 29.70 1pou h GLU 10 CO -0.34 -0.71 -0.23 1.96 0.07 0.00 0.00 179.01 179.77 1pou h GLN 11 N -1.10 -0.19 -0.29 1.06 1.08 -1.55 -0.08 115.11 114.03 1pou h GLN 11 Ca -0.11 0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.17 1pou h GLN 11 Cb 0.86 0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 28.27 1pou h GLN 11 CO 0.16 -0.13 -0.10 0.35 -0.95 0.00 0.00 178.83 178.16 1pou h PHE 12 N -0.20 -0.23 0.31 2.96 3.57 -0.66 0.13 116.94 122.83 1pou h PHE 12 Ca 0.16 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 1pou h PHE 12 Cb 0.45 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1pou h PHE 12 CO -0.42 -0.16 -0.15 0.00 -2.23 0.00 0.00 178.31 175.34 1pou h ALA 13 N 1.23 -0.42 -0.47 2.41 0.00 0.29 0.44 119.26 122.74 1pou h ALA 13 Ca 0.15 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.03 1pou h ALA 13 Cb 0.26 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1pou h ALA 13 CO -0.33 -0.73 0.15 0.87 0.00 0.00 0.00 179.25 179.21 1pou h LYS 14 N -0.43 0.30 -0.76 0.00 1.79 -0.88 -0.87 116.57 115.72 1pou h LYS 14 Ca -0.04 -0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 58.37 1pou h LYS 14 Cb 0.33 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 1pou h LYS 14 CO 0.07 0.20 0.33 1.15 -1.08 0.00 0.00 179.45 180.12 1pou h THR 15 N 0.31 1.25 0.14 -0.16 2.02 -0.36 0.54 112.91 116.65 1pou h THR 15 Ca 0.23 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 66.66 1pou h THR 15 Cb 0.25 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1pou h THR 15 CO -0.25 0.31 -0.07 0.15 0.37 0.00 0.00 175.52 176.03 1pou h PHE 16 N 1.09 -0.18 0.15 3.16 3.04 0.63 0.19 116.94 125.02 1pou h PHE 16 Ca 0.26 -0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.22 1pou h PHE 16 Cb 0.17 0.06 -0.02 0.00 2.56 0.00 0.00 35.95 38.71 1pou h PHE 16 CO 0.02 -0.11 -0.21 -0.22 -2.02 0.00 0.00 178.31 175.76 1pou h LYS 17 N -0.19 -0.41 -0.21 1.11 3.64 -0.81 0.72 116.57 120.41 1pou h LYS 17 Ca -0.02 0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1pou h LYS 17 Cb 0.15 0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 32.00 1pou h LYS 17 CO 0.03 -0.27 -0.21 1.96 -2.27 0.00 0.00 179.45 178.69 1pou h GLN 18 N -0.42 -0.22 -0.16 1.90 4.20 -0.71 -0.55 115.11 119.15 1pou h GLN 18 Ca 0.02 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 1pou h GLN 18 Cb 0.42 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1pou h GLN 18 CO -0.09 -0.14 0.08 -0.09 -0.67 0.00 0.00 178.83 177.91 1pou h ARG 19 N -0.23 0.24 -0.64 1.46 2.43 -0.45 0.52 114.38 117.72 1pou h ARG 19 Ca 0.13 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.30 1pou h ARG 19 Cb 0.42 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.88 1pou h ARG 19 CO -0.34 0.29 0.37 0.07 -1.51 0.00 0.00 179.97 178.85 1pou h ARG 20 N 0.13 0.69 -0.26 0.20 0.11 -0.61 0.10 114.38 114.75 1pou h ARG 20 Ca 0.06 -0.04 0.01 0.00 0.10 0.00 0.00 59.98 60.11 1pou h ARG 20 Cb 0.13 -0.15 -0.02 0.00 1.11 0.00 0.00 29.97 31.04 1pou h ARG 20 CO -0.01 0.45 0.14 0.82 0.10 0.00 0.00 179.97 181.48 1pou h ILE 21 N 0.71 1.02 -0.99 0.08 2.04 -0.71 0.14 117.51 119.80 1pou h ILE 21 Ca 0.27 -0.10 0.08 0.00 1.00 0.00 0.00 64.86 66.12 1pou h ILE 21 Cb 0.11 0.70 -0.07 0.00 -0.74 0.00 0.00 36.82 36.81 1pou h ILE 21 CO -0.14 0.05 0.63 0.11 0.00 0.00 0.00 178.15 178.80 1pou h LYS 22 N 0.29 1.06 0.00 2.37 1.79 -0.09 0.12 116.57 122.11 1pou h LYS 22 Ca 0.10 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1pou h LYS 22 Cb 0.01 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 30.42 1pou h LYS 22 CO -0.06 0.70 0.00 1.28 -1.08 0.00 0.00 179.45 180.30 1pou n LEU 23 N -4.56 0.00 -0.77 2.94 4.77 0.28 -4.87 117.00 114.79 1pou n LEU 23 Ca 0.16 0.07 -0.08 0.00 -0.03 0.00 0.00 56.01 56.13 1pou n LEU 23 Cb 0.24 -0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1pou n LEU 23 CO 0.30 -0.03 -0.09 0.61 -1.33 0.00 0.00 177.39 176.86 1pou n GLY 24 N 0.29 0.47 3.43 -0.72 0.00 0.42 -4.98 105.19 104.10 1pou n GLY 24 Ca 0.14 -0.61 -0.44 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.35 2.87 0.00 1.61 0.08 0.43 -4.93 117.98 115.68 1pou s PHE 25 Ca 0.00 -0.65 0.00 0.00 0.12 0.00 0.00 56.93 56.40 1pou s PHE 25 Cb 0.00 -4.04 0.00 0.00 -0.57 0.00 0.00 43.02 38.41 1pou s PHE 25 CO 0.00 -1.39 1.62 0.25 -0.10 0.00 0.00 175.22 175.60 1pou n THR 26 N 5.76 1.62 0.00 0.64 -2.24 -1.26 -4.24 114.28 114.55 1pou n THR 26 Ca -0.06 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1pou n THR 26 Cb 0.44 -1.39 0.00 0.00 -2.10 0.00 0.00 70.33 67.29 1pou n THR 26 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1pou n GLN 27 N 1.52 0.00 -0.34 -0.78 0.00 -1.26 -4.27 117.38 112.26 1pou n GLN 27 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.00 57.08 1pou n GLN 27 Cb 0.42 0.00 0.25 0.00 0.00 0.00 0.00 30.24 30.90 1pou n GLN 27 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 1pou h GLY 28 N 0.00 1.57 -0.08 1.69 0.00 -1.87 -0.21 103.07 104.17 1pou h GLY 28 Ca 0.00 -0.35 0.06 0.00 0.00 0.00 0.00 47.33 47.04 1pou h GLY 28 CO 0.00 0.06 -0.37 -1.80 0.00 0.00 0.00 176.54 174.43 1pou h ASP 29 N 0.83 -1.20 0.46 0.19 1.82 -1.88 0.16 116.42 116.80 1pou h ASP 29 Ca 0.50 0.18 -0.01 0.00 -0.39 0.00 0.00 57.03 57.31 1pou h ASP 29 Cb 0.61 0.52 -0.01 0.00 0.68 0.00 0.00 39.33 41.13 1pou h ASP 29 CO -0.31 -0.37 -0.31 0.58 -1.61 0.00 0.00 179.24 177.22 1pou h VAL 30 N -0.36 0.36 -0.74 2.25 2.07 -1.63 -1.16 116.25 117.03 1pou h VAL 30 Ca 0.12 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.80 1pou h VAL 30 Cb 0.57 0.36 -0.14 0.00 -1.52 0.00 0.00 31.29 30.56 1pou h VAL 30 CO -0.47 0.00 -0.11 1.23 0.02 0.00 0.00 177.57 178.24 1pou h GLY 31 N -0.75 0.66 0.89 2.17 0.00 -0.50 0.21 103.07 105.75 1pou h GLY 31 Ca -0.05 0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.47 1pou h GLY 31 CO 0.03 -0.29 -0.14 -2.00 0.00 0.00 0.00 176.54 174.15 1pou h LEU 32 N 0.04 -0.35 -0.36 3.11 5.85 -0.52 0.58 115.31 123.66 1pou h LEU 32 Ca 0.38 0.03 0.04 0.00 0.84 0.00 0.00 57.88 59.17 1pou h LEU 32 Cb 0.62 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.72 1pou h LEU 32 CO -0.72 -0.22 0.11 0.00 -0.34 0.00 0.00 178.44 177.27 1pou h ALA 33 N 0.46 0.41 -0.49 1.25 0.00 0.26 0.15 119.26 121.30 1pou h ALA 33 Ca -0.01 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1pou h ALA 33 Cb 0.29 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1pou h ALA 33 CO -0.00 -0.28 0.21 0.52 0.00 0.00 0.00 179.25 179.70 1pou h MET 34 N 0.26 0.40 -0.87 0.00 2.86 -0.55 0.62 114.93 117.64 1pou h MET 34 Ca 0.17 -0.02 0.11 0.00 -2.06 0.00 0.00 59.70 57.90 1pou h MET 34 Cb 0.15 -0.09 -0.13 0.00 0.06 0.00 0.00 31.60 31.59 1pou h MET 34 CO -0.18 0.26 -0.46 0.78 1.06 0.00 0.00 176.91 178.37 1pou h GLY 35 N 0.41 -0.36 0.73 8.32 0.00 0.24 0.26 103.07 112.67 1pou h GLY 35 Ca 0.23 0.62 -0.00 0.00 0.00 0.00 0.00 47.33 48.18 1pou h GLY 35 CO -0.20 -0.11 -0.01 0.50 0.00 0.00 0.00 176.54 176.71 1pou h LYS 36 N -0.07 -0.04 -0.09 4.80 1.57 0.27 -2.85 116.57 120.15 1pou h LYS 36 Ca 0.24 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 1pou h LYS 36 Cb 0.53 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1pou h LYS 36 CO -0.89 0.23 -0.03 -0.07 -0.57 0.00 0.00 179.45 178.12 1pou h LEU 37 N -0.31 0.19 0.00 2.94 3.38 -0.59 -3.43 115.31 117.48 1pou h LEU 37 Ca -0.00 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1pou h LEU 37 Cb 0.29 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1pou h LEU 37 CO 0.01 0.54 -0.27 -1.22 0.09 0.00 0.00 178.44 177.59 1pou n TYR 38 N -4.76 -0.52 0.00 1.13 4.01 0.59 -5.09 117.16 112.52 1pou n TYR 38 Ca -0.07 0.09 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1pou n TYR 38 Cb 0.25 0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.46 1pou n TYR 38 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pou n GLY 39 N 2.73 3.69 2.17 2.72 0.00 0.53 -4.95 105.19 112.07 1pou n GLY 39 Ca 0.00 -0.76 -0.25 0.00 0.00 0.00 0.00 46.02 45.02 1pou n GLY 39 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1pou n ASN 40 N 0.00 6.82 0.13 1.61 4.05 -1.26 -3.23 115.26 123.38 1pou n ASN 40 Ca 0.00 -2.58 0.13 0.00 0.45 0.00 0.00 54.58 52.57 1pou n ASN 40 Cb 0.00 -1.46 0.47 0.00 1.23 0.00 0.00 39.78 40.01 1pou n ASN 40 CO 0.00 0.00 0.00 -0.78 -3.05 0.00 0.00 177.26 173.43 1pou h ASP 41 N 3.85 0.00 -1.15 1.20 3.58 -1.89 -3.28 116.42 118.74 1pou h ASP 41 Ca 0.49 0.00 -0.61 0.00 0.42 0.00 0.00 57.03 57.33 1pou h ASP 41 Cb 0.94 0.00 -0.38 0.00 1.72 0.00 0.00 39.33 41.61 1pou h ASP 41 CO 0.93 0.00 -0.25 0.49 -2.88 0.00 0.00 179.24 177.53 1pou n PHE 42 N -2.31 3.05 0.35 0.28 3.01 -1.26 -4.70 117.46 115.88 1pou n PHE 42 Ca 0.03 -2.63 -0.14 0.00 1.01 0.00 0.00 57.45 55.73 1pou n PHE 42 Cb 0.31 -0.59 -0.07 0.00 -0.01 0.00 0.00 39.48 39.13 1pou n PHE 42 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1pou h SER 43 N 2.35 -0.77 0.00 4.37 4.64 -1.89 -3.36 113.55 118.90 1pou h SER 43 Ca 0.42 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1pou h SER 43 Cb 1.06 0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1pou h SER 43 CO 1.03 -0.52 0.00 0.00 -0.87 0.00 0.00 176.83 176.47 1pou n GLN 44 N -4.60 0.00 0.13 4.77 -0.00 -1.26 -4.69 117.38 111.73 1pou n GLN 44 Ca -0.11 0.00 -0.13 0.00 -0.00 0.00 0.00 57.00 56.76 1pou n GLN 44 Cb 0.36 0.00 -0.06 0.00 -0.00 0.00 0.00 30.24 30.53 1pou n GLN 44 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 1pou h THR 45 N 0.00 0.64 -0.13 -0.39 1.35 -1.95 -0.55 112.91 111.87 1pou h THR 45 Ca 0.00 0.00 0.04 0.00 -0.55 0.00 0.00 66.41 65.90 1pou h THR 45 Cb 0.00 0.64 -0.04 0.00 -1.73 0.00 0.00 68.15 67.01 1pou h THR 45 CO 0.00 0.00 -0.13 0.71 -0.25 0.00 0.00 175.52 175.85 1pou h THR 46 N -0.36 0.64 -0.33 6.82 1.35 -1.92 0.20 112.91 119.31 1pou h THR 46 Ca 0.00 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.87 1pou h THR 46 Cb 0.34 0.64 -0.02 0.00 -1.73 0.00 0.00 68.15 67.38 1pou h THR 46 CO -0.04 0.00 0.20 0.40 -0.25 0.00 0.00 175.52 175.82 1pou h ILE 47 N -0.16 1.05 -0.14 6.82 1.08 -1.80 0.27 117.51 124.63 1pou h ILE 47 Ca 0.09 -0.14 0.03 0.00 -0.39 0.00 0.00 64.86 64.46 1pou h ILE 47 Cb 0.29 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 34.62 1pou h ILE 47 CO -0.23 0.07 -0.07 0.28 -0.69 0.00 0.00 178.15 177.52 1pou h SER 48 N 0.40 -0.23 0.09 1.72 0.02 -0.67 -2.18 113.55 112.71 1pou h SER 48 Ca 0.13 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 1pou h SER 48 Cb -0.01 0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1pou h SER 48 CO -0.05 -0.09 -0.10 0.03 -1.14 0.00 0.00 176.83 175.48 1pou h ARG 49 N -0.06 0.01 0.71 3.45 3.08 -0.18 -0.44 114.38 120.95 1pou h ARG 49 Ca 0.08 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 1pou h ARG 49 Cb 0.17 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.23 1pou h ARG 49 CO -0.17 0.11 -0.34 0.35 -1.07 0.00 0.00 179.97 178.85 1pou h PHE 50 N 0.01 -0.88 -0.14 3.04 3.57 0.13 0.19 116.94 122.86 1pou h PHE 50 Ca 0.00 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.51 1pou h PHE 50 Cb 0.18 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 1pou h PHE 50 CO 0.00 -0.53 0.10 0.93 -2.23 0.00 0.00 178.31 176.58 1pou h GLU 51 N -1.01 0.07 -0.00 1.11 3.07 -0.99 0.15 114.58 116.96 1pou h GLU 51 Ca -0.10 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1pou h GLU 51 Cb 0.75 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.64 1pou h GLU 51 CO 0.16 0.04 -0.01 0.00 -1.40 0.00 0.00 179.01 177.80 1pou n ALA 52 N -2.55 2.45 -3.58 3.43 0.00 -0.22 -4.86 120.51 115.19 1pou n ALA 52 Ca -0.00 -0.13 -0.26 0.00 0.00 0.00 0.00 53.44 53.04 1pou n ALA 52 Cb 0.17 -1.47 -0.00 0.00 0.00 0.00 0.00 19.45 18.15 1pou n ALA 52 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1pou n LEU 53 N -1.36 -1.78 0.07 0.00 4.32 0.51 -4.89 117.00 113.87 1pou n LEU 53 Ca 0.11 -0.55 -0.10 0.00 -0.02 0.00 0.00 56.01 55.46 1pou n LEU 53 Cb 0.28 -2.22 -0.13 0.00 -1.62 0.00 0.00 43.42 39.74 1pou n LEU 53 CO 0.25 0.23 0.07 -1.13 -1.22 0.00 0.00 177.39 175.59 1pou h ASN 54 N -1.25 0.13 0.00 -1.43 -0.73 -1.05 -3.37 115.58 107.88 1pou h ASN 54 Ca -0.48 -0.14 -0.34 0.00 1.87 0.00 0.00 56.30 57.20 1pou h ASN 54 Cb 1.32 -0.04 -0.03 0.00 0.27 0.00 0.00 38.32 39.83 1pou h ASN 54 CO 0.60 1.11 1.09 0.18 -0.37 0.00 0.00 177.43 180.04 1pou n LEU 55 N -3.40 6.20 0.00 0.34 4.77 -1.26 -4.86 117.00 118.79 1pou n LEU 55 Ca -0.03 -3.47 0.00 0.00 -0.03 0.00 0.00 56.01 52.48 1pou n LEU 55 Cb 0.97 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 1pou n LEU 55 CO 0.49 1.72 0.00 -1.20 -1.33 0.00 0.00 177.39 177.07 1pou n SER 56 N 2.92 0.00 0.00 -1.43 7.64 -1.26 -3.50 113.62 117.98 1pou n SER 56 Ca 0.53 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.41 1pou n SER 56 Cb 0.65 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 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 0.00 -0.29 1.43 7.35 -1.26 -4.66 117.46 120.02 1pou n PHE 57 Ca 0.00 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.64 1pou n PHE 57 Cb 0.00 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 39.82 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 -0.10 -0.03 -4.13 2.10 -2.00 0.17 116.57 112.57 1pou h LYS 58 Ca 0.00 0.01 -0.07 0.00 -2.00 0.00 0.00 60.65 58.58 1pou h LYS 58 Cb 0.00 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.36 1pou h LYS 58 CO 0.00 -0.07 -0.27 -0.97 -2.00 0.00 0.00 179.45 176.15 1pou h ASN 59 N -0.11 0.29 -0.89 7.07 -0.00 -1.83 -3.34 115.58 116.77 1pou h ASN 59 Ca 0.25 -0.69 0.18 0.00 -0.00 0.00 0.00 56.30 56.03 1pou h ASN 59 Cb 0.56 -0.09 -0.10 0.00 -0.00 0.00 0.00 38.32 38.68 1pou h ASN 59 CO -0.82 0.94 0.46 0.24 -0.00 0.00 0.00 177.43 178.24 1pou h MET 60 N -0.34 0.57 0.00 6.67 2.86 -1.30 0.12 114.93 123.51 1pou h MET 60 Ca -0.02 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1pou h MET 60 Cb 0.95 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.48 1pou h MET 60 CO 0.05 0.38 -0.18 0.00 1.06 0.00 0.00 176.91 178.22 1pou h LYS 62 N 0.00 0.23 -0.32 0.00 1.57 -1.02 -3.39 116.57 113.66 1pou h LYS 62 Ca -0.00 -0.40 0.01 0.00 -1.87 0.00 0.00 60.65 58.38 1pou h LYS 62 Cb 0.36 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1pou h LYS 62 CO 0.02 1.19 0.20 1.37 -0.57 0.00 0.00 179.45 181.67 1pou h LEU 63 N -0.44 0.35 0.40 2.94 8.10 -0.60 -3.18 115.31 122.87 1pou h LEU 63 Ca -0.20 -0.01 -0.00 0.00 0.11 0.00 0.00 57.88 57.78 1pou h LEU 63 Cb 1.61 -0.08 -0.03 0.00 -0.44 0.00 0.00 40.66 41.72 1pou h LEU 63 CO 0.08 0.25 -0.44 0.50 -4.11 0.00 0.00 178.44 174.73 1pou h LYS 64 N 0.42 -0.83 -0.50 0.17 3.11 -0.83 -0.65 116.57 117.47 1pou h LYS 64 Ca 0.12 0.06 0.01 0.00 -2.81 0.00 0.00 60.65 58.03 1pou h LYS 64 Cb -0.04 0.19 -0.03 0.00 -1.00 0.00 0.00 32.23 31.35 1pou h LYS 64 CO -0.03 -0.55 0.33 -1.00 -2.81 0.00 0.00 179.45 175.39 1pou h PRO 65 N -0.86 0.63 -0.36 1.90 0.13 -1.74 0.22 132.00 131.92 1pou h PRO 65 Ca -0.04 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.03 1pou h PRO 65 Cb 0.77 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.74 1pou h PRO 65 CO -0.09 0.42 0.13 -0.07 -0.23 0.00 0.00 178.00 178.16 1pou h LEU 66 N 0.65 0.51 -0.86 1.56 4.07 -1.42 0.67 115.31 120.50 1pou h LEU 66 Ca 0.19 -0.19 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 1pou h LEU 66 Cb -0.03 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 41.54 1pou h LEU 66 CO -0.04 0.56 0.34 -0.07 -1.08 0.00 0.00 178.44 178.15 1pou h LEU 67 N 0.43 1.08 -0.03 1.67 3.38 -0.28 0.06 115.31 121.62 1pou h LEU 67 Ca 0.12 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1pou h LEU 67 Cb 0.22 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1pou h LEU 67 CO -0.01 0.94 -0.03 -0.08 0.09 0.00 0.00 178.44 179.35 1pou h GLU 68 N 1.15 -0.05 -0.31 1.13 4.57 0.08 0.28 114.58 121.43 1pou h GLU 68 Ca 0.27 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.48 1pou h GLU 68 Cb 0.18 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.75 1pou h GLU 68 CO -0.03 -0.03 0.12 -0.22 -1.18 0.00 0.00 179.01 177.67 1pou h LYS 69 N -0.05 0.26 -0.78 1.92 3.64 -0.77 0.79 116.57 121.58 1pou h LYS 69 Ca 0.03 -0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.52 1pou h LYS 69 Cb 0.08 -0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 31.76 1pou h LYS 69 CO -0.06 0.17 0.38 2.35 -2.27 0.00 0.00 179.45 180.02 1pou h TRP 70 N 0.27 0.67 -0.23 1.91 7.01 -0.53 0.37 115.95 125.41 1pou h TRP 70 Ca 0.14 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.15 1pou h TRP 70 Cb 0.09 -0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 26.97 1pou h TRP 70 CO -0.13 0.18 0.05 -0.07 -2.79 0.00 0.00 178.44 175.68 1pou h LEU 71 N 0.58 0.35 -1.04 0.65 3.38 0.66 0.19 115.31 120.08 1pou h LEU 71 Ca 0.41 -0.25 0.08 0.00 0.09 0.00 0.00 57.88 58.22 1pou h LEU 71 Cb 0.53 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.12 1pou h LEU 71 CO -0.33 0.50 0.63 -1.13 0.09 0.00 0.00 178.44 178.20 1pou h ASN 72 N 0.18 0.98 0.39 -0.43 -0.00 -0.29 0.21 115.58 116.62 1pou h ASN 72 Ca 0.07 0.02 -0.02 0.00 -0.00 0.00 0.00 56.30 56.37 1pou h ASN 72 Cb 0.30 -0.19 0.00 0.00 -0.00 0.00 0.00 38.32 38.44 1pou h ASN 72 CO 0.00 0.60 -0.19 -0.78 -0.00 0.00 0.00 177.43 177.06 1pou h ASP 73 N 1.09 -0.45 0.11 1.15 3.58 -0.47 -3.38 116.42 118.06 1pou h ASP 73 Ca 0.44 -0.08 -0.23 0.00 0.42 0.00 0.00 57.03 57.58 1pou h ASP 73 Cb 0.27 0.12 0.01 0.00 1.72 0.00 0.00 39.33 41.45 1pou h ASP 73 CO -0.19 -0.01 -0.88 0.00 -2.88 0.00 0.00 179.24 175.28 1pou h ALA 74 N -0.86 0.34 0.00 -0.78 0.00 -0.53 -3.51 119.26 113.91 1pou h ALA 74 Ca -0.05 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1pou h ALA 74 Cb 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1pou h ALA 74 CO 0.09 0.74 0.00 0.39 0.00 0.00 0.00 179.25 180.47