#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 0.54 -0.79 -2.67 4.07 -2.03 0.26 115.31 114.69 1pou h LEU 6 Ca 0.00 0.18 0.18 0.00 0.08 0.00 0.00 57.88 58.33 1pou h LEU 6 Cb 0.00 0.12 -0.14 0.00 1.08 0.00 0.00 40.66 41.72 1pou h LEU 6 CO 0.00 -0.09 0.00 -0.08 -1.08 0.00 0.00 178.44 177.19 1pou h GLU 7 N 0.37 0.09 -0.33 1.13 4.81 -2.04 0.36 114.58 118.97 1pou h GLU 7 Ca 0.72 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.97 1pou h GLU 7 Cb 1.60 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.94 1pou h GLU 7 CO -0.58 0.06 0.16 0.93 -0.73 0.00 0.00 179.01 178.85 1pou h GLU 8 N 0.09 0.33 0.18 1.92 5.08 -0.91 -0.60 114.58 120.67 1pou h GLU 8 Ca 0.44 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.77 1pou h GLU 8 Cb 0.79 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1pou h GLU 8 CO -0.71 0.22 -0.09 -0.07 -1.00 0.00 0.00 179.01 177.36 1pou h LEU 9 N 0.34 -0.21 0.32 1.33 4.07 -1.04 0.26 115.31 120.39 1pou h LEU 9 Ca 0.14 -0.15 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 1pou h LEU 9 Cb 0.05 0.05 0.00 0.00 1.08 0.00 0.00 40.66 41.85 1pou h LEU 9 CO -0.10 0.03 -0.15 1.05 -1.08 0.00 0.00 178.44 178.19 1pou h GLU 10 N -0.44 -0.42 -0.92 1.13 4.11 -0.97 0.11 114.58 117.19 1pou h GLU 10 Ca -0.02 0.03 0.01 0.00 0.07 0.00 0.00 59.36 59.44 1pou h GLU 10 Cb 0.34 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 1pou h GLU 10 CO 0.04 -0.24 0.61 1.96 0.07 0.00 0.00 179.01 181.46 1pou h GLN 11 N -0.49 1.21 -0.19 1.06 1.08 -1.13 0.82 115.11 117.46 1pou h GLN 11 Ca -0.04 -0.07 0.05 0.00 -1.45 0.00 0.00 58.65 57.13 1pou h GLN 11 Cb 0.37 -0.27 -0.05 0.00 -0.05 0.00 0.00 27.48 27.48 1pou h GLN 11 CO 0.07 0.80 -0.12 0.35 -0.95 0.00 0.00 178.83 178.98 1pou h PHE 12 N 1.24 -0.30 -0.46 2.96 3.57 -0.34 0.13 116.94 123.73 1pou h PHE 12 Ca 0.34 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.93 1pou h PHE 12 Cb -0.13 0.16 -0.05 0.00 2.79 0.00 0.00 35.95 38.72 1pou h PHE 12 CO -0.01 -0.19 0.16 0.00 -2.23 0.00 0.00 178.31 176.05 1pou h ALA 13 N 1.03 0.56 -0.93 2.41 0.00 0.61 0.43 119.26 123.38 1pou h ALA 13 Ca 0.11 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1pou h ALA 13 Cb 0.28 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 1pou h ALA 13 CO -0.27 -0.23 0.60 0.87 0.00 0.00 0.00 179.25 180.22 1pou h LYS 14 N 0.33 1.10 -0.49 0.00 1.57 -0.54 0.35 116.57 118.89 1pou h LYS 14 Ca 0.22 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 1pou h LYS 14 Cb 0.22 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1pou h LYS 14 CO -0.23 0.73 0.19 1.15 -0.57 0.00 0.00 179.45 180.73 1pou h THR 15 N 1.13 1.21 -0.45 -0.16 2.02 0.42 -2.75 112.91 114.34 1pou h THR 15 Ca 0.38 -0.66 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 1pou h THR 15 Cb 0.06 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 1pou h THR 15 CO -0.14 0.25 0.27 0.15 0.37 0.00 0.00 175.52 176.42 1pou h PHE 16 N 0.66 0.60 -0.44 3.16 3.57 0.78 0.11 116.94 125.38 1pou h PHE 16 Ca 0.16 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.75 1pou h PHE 16 Cb 0.20 -0.20 -0.09 0.00 2.79 0.00 0.00 35.95 38.65 1pou h PHE 16 CO 0.01 0.42 -0.22 0.87 -2.23 0.00 0.00 178.31 177.16 1pou h LYS 17 N 0.60 -0.13 0.08 1.11 1.79 -0.93 0.15 116.57 119.24 1pou h LYS 17 Ca 0.16 0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.64 1pou h LYS 17 Cb 0.00 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.68 1pou h LYS 17 CO -0.03 -0.09 -0.04 1.96 -1.08 0.00 0.00 179.45 180.17 1pou h GLN 18 N -0.14 -0.11 -0.30 3.15 4.20 -0.91 0.32 115.11 121.32 1pou h GLN 18 Ca 0.21 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.97 1pou h GLN 18 Cb 0.46 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.22 1pou h GLN 18 CO -0.53 -0.08 0.03 0.00 -0.67 0.00 0.00 178.83 177.59 1pou h ARG 19 N -0.12 0.12 -0.51 1.46 2.47 -0.45 0.97 114.38 118.32 1pou h ARG 19 Ca -0.01 -0.01 0.09 0.00 -1.26 0.00 0.00 59.98 58.80 1pou h ARG 19 Cb 0.10 -0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.31 1pou h ARG 19 CO 0.01 0.08 0.08 -0.09 0.56 0.00 0.00 179.97 180.61 1pou h ARG 20 N 0.13 0.20 -0.34 0.04 2.43 -0.50 0.13 114.38 116.47 1pou h ARG 20 Ca 0.14 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1pou h ARG 20 Cb 0.17 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 1pou h ARG 20 CO -0.21 0.14 0.23 0.82 -1.51 0.00 0.00 179.97 179.43 1pou h ILE 21 N 0.21 1.09 -0.93 1.20 2.04 -0.13 -0.42 117.51 120.58 1pou h ILE 21 Ca 0.26 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.99 1pou h ILE 21 Cb 0.37 0.59 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 1pou h ILE 21 CO -0.36 0.09 0.60 0.11 0.00 0.00 0.00 178.15 178.59 1pou h LYS 22 N 0.46 1.10 0.00 2.37 6.56 0.17 0.16 116.57 127.40 1pou h LYS 22 Ca 0.13 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.65 1pou h LYS 22 Cb -0.05 -0.25 0.00 0.00 -0.57 0.00 0.00 32.23 31.36 1pou h LYS 22 CO -0.03 0.73 0.00 1.28 -2.06 0.00 0.00 179.45 179.37 1pou n LEU 23 N -4.52 0.41 -1.35 2.94 4.77 0.36 -4.87 117.00 114.75 1pou n LEU 23 Ca 0.13 0.63 -0.13 0.00 -0.03 0.00 0.00 56.01 56.61 1pou n LEU 23 Cb 0.12 -0.61 -0.02 0.00 -2.33 0.00 0.00 43.42 40.58 1pou n LEU 23 CO 0.33 -0.58 -0.15 0.61 -1.33 0.00 0.00 177.39 176.27 1pou n GLY 24 N -0.51 0.19 3.57 -0.72 0.00 0.56 -4.97 105.19 103.30 1pou n GLY 24 Ca 0.01 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.60 3.10 0.00 1.61 0.40 -0.25 -4.93 117.98 115.31 1pou s PHE 25 Ca 0.00 0.39 0.00 0.00 -0.60 0.00 0.00 56.93 56.72 1pou s PHE 25 Cb 0.00 -3.35 0.00 0.00 0.51 0.00 0.00 43.02 40.18 1pou s PHE 25 CO 0.00 -0.74 1.36 0.25 0.70 0.00 0.00 175.22 176.79 1pou n THR 26 N 5.78 1.36 0.00 0.64 -2.24 -1.26 -4.60 114.28 113.95 1pou n THR 26 Ca 0.01 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1pou n THR 26 Cb 0.48 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.50 1pou n THR 26 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pou n GLN 27 N 1.12 0.00 -0.32 -0.78 6.02 -1.26 -4.30 117.38 117.85 1pou n GLN 27 Ca 0.00 0.00 0.19 0.00 -0.01 0.00 0.00 57.00 57.18 1pou n GLN 27 Cb 0.44 0.00 0.39 0.00 1.02 0.00 0.00 30.24 32.09 1pou n GLN 27 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1pou h GLY 28 N 0.00 1.80 0.47 1.08 0.00 -1.88 0.14 103.07 104.69 1pou h GLY 28 Ca 0.00 -0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.18 1pou h GLY 28 CO 0.00 -0.39 -0.13 -1.80 0.00 0.00 0.00 176.54 174.22 1pou h ASP 29 N 0.35 -0.42 -0.53 0.19 1.82 -1.89 0.16 116.42 116.10 1pou h ASP 29 Ca 0.65 0.08 0.04 0.00 -0.39 0.00 0.00 57.03 57.42 1pou h ASP 29 Cb 1.38 0.21 -0.04 0.00 0.68 0.00 0.00 39.33 41.56 1pou h ASP 29 CO -0.59 -0.17 0.29 0.58 -1.61 0.00 0.00 179.24 177.74 1pou h VAL 30 N -0.15 0.99 -0.50 2.25 2.07 -1.16 0.05 116.25 119.80 1pou h VAL 30 Ca 0.10 -0.19 0.10 0.00 0.82 0.00 0.00 66.70 67.53 1pou h VAL 30 Cb 0.29 0.38 -0.10 0.00 -1.52 0.00 0.00 31.29 30.34 1pou h VAL 30 CO -0.24 0.10 -0.19 1.23 0.02 0.00 0.00 177.57 178.49 1pou h GLY 31 N 0.57 0.22 0.77 2.17 0.00 0.07 0.22 103.07 107.09 1pou h GLY 31 Ca 0.23 0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 1pou h GLY 31 CO -0.14 -0.21 -0.04 -2.00 0.00 0.00 0.00 176.54 174.16 1pou h LEU 32 N -0.07 -0.09 -0.37 3.11 5.85 -0.07 0.20 115.31 123.87 1pou h LEU 32 Ca 0.24 -0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1pou h LEU 32 Cb 0.44 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 1pou h LEU 32 CO -0.55 0.15 0.12 0.00 -0.34 0.00 0.00 178.44 177.82 1pou h ALA 33 N 0.58 0.43 -0.44 1.25 0.00 -0.72 0.18 119.26 120.54 1pou h ALA 33 Ca -0.01 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.01 1pou h ALA 33 Cb 0.28 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 1pou h ALA 33 CO 0.02 -0.27 0.12 0.52 0.00 0.00 0.00 179.25 179.63 1pou h MET 34 N 0.27 0.26 -0.96 0.00 2.86 -0.51 0.39 114.93 117.24 1pou h MET 34 Ca 0.17 -0.02 0.16 0.00 -2.06 0.00 0.00 59.70 57.95 1pou h MET 34 Cb 0.16 -0.06 -0.16 0.00 0.06 0.00 0.00 31.60 31.60 1pou h MET 34 CO -0.18 0.17 -0.36 0.78 1.06 0.00 0.00 176.91 178.38 1pou h GLY 35 N 0.27 0.19 0.70 8.32 0.00 0.96 0.32 103.07 113.83 1pou h GLY 35 Ca 0.21 0.48 -0.02 0.00 0.00 0.00 0.00 47.33 48.00 1pou h GLY 35 CO -0.25 -0.24 -0.17 0.50 0.00 0.00 0.00 176.54 176.38 1pou h LYS 36 N -0.01 -0.46 -0.02 4.80 6.56 -0.16 -3.26 116.57 124.01 1pou h LYS 36 Ca 0.36 0.03 -0.20 0.00 -1.06 0.00 0.00 60.65 59.78 1pou h LYS 36 Cb 0.62 0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 32.38 1pou h LYS 36 CO -0.97 -0.16 -0.86 -0.07 -2.06 0.00 0.00 179.45 175.33 1pou h LEU 37 N -0.79 0.43 0.00 2.94 3.38 -0.30 -3.43 115.31 117.53 1pou h LEU 37 Ca -0.05 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1pou h LEU 37 Cb 0.52 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1pou h LEU 37 CO 0.08 1.11 -0.11 -1.22 0.09 0.00 0.00 178.44 178.38 1pou n TYR 38 N -3.74 -1.17 0.00 1.13 4.02 0.70 -5.07 117.16 113.03 1pou n TYR 38 Ca -0.05 0.21 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 1pou n TYR 38 Cb 0.79 0.38 0.00 0.00 -0.02 0.00 0.00 39.34 40.49 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 2.11 2.99 2.55 2.72 0.00 0.77 -4.96 105.19 111.38 1pou n GLY 39 Ca 0.00 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 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 5.95 -4.68 1.61 5.15 -1.26 -2.84 115.26 119.20 1pou n ASN 40 Ca 0.00 -2.73 -0.24 0.00 -0.60 0.00 0.00 54.58 51.02 1pou n ASN 40 Cb 0.00 -1.62 0.11 0.00 -0.53 0.00 0.00 39.78 37.74 1pou n ASN 40 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1pou s ASP 41 N 2.75 4.34 -1.00 1.20 -1.08 -1.26 -4.68 116.67 116.95 1pou s ASP 41 Ca 0.57 -0.38 0.00 0.00 -0.52 0.00 0.00 52.55 52.21 1pou s ASP 41 Cb 0.16 0.01 0.00 0.00 -1.46 0.00 0.00 42.92 41.63 1pou s ASP 41 CO -0.08 -1.87 0.00 0.49 0.52 0.00 0.00 175.17 174.24 1pou n PHE 42 N -2.83 -0.06 -1.70 -5.34 3.01 -1.26 -4.31 117.46 104.96 1pou n PHE 42 Ca 0.15 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.21 1pou n PHE 42 Cb 0.61 -1.95 -0.03 0.00 -0.01 0.00 0.00 39.48 38.10 1pou n PHE 42 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1pou n SER 43 N 0.40 3.42 0.00 4.37 7.64 -1.26 -3.72 113.62 124.48 1pou n SER 43 Ca -0.10 -2.77 0.00 0.00 1.01 0.00 0.00 58.87 57.01 1pou n SER 43 Cb 0.35 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.07 1pou n SER 43 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pou n GLN 44 N 7.11 0.00 -0.11 1.43 6.02 -1.26 -4.61 117.38 125.97 1pou n GLN 44 Ca 0.50 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 57.35 1pou n GLN 44 Cb 0.42 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.58 1pou n GLN 44 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1pou h THR 45 N 0.00 0.00 -0.15 5.09 2.02 -2.00 0.63 112.91 118.50 1pou h THR 45 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1pou h THR 45 Cb 0.00 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.40 1pou h THR 45 CO 0.00 0.00 0.07 0.74 0.37 0.00 0.00 175.52 176.70 1pou h THR 46 N -0.42 1.06 -0.12 3.16 2.02 -1.88 0.77 112.91 117.50 1pou h THR 46 Ca 0.06 -0.15 -0.21 0.00 0.77 0.00 0.00 66.41 66.87 1pou h THR 46 Cb 0.59 0.86 0.01 0.00 -1.74 0.00 0.00 68.15 67.87 1pou h THR 46 CO -0.54 0.06 -0.76 0.40 0.37 0.00 0.00 175.52 175.04 1pou h ILE 47 N 0.21 1.30 0.29 3.11 1.08 -1.26 0.24 117.51 122.48 1pou h ILE 47 Ca 0.05 -1.99 -0.01 0.00 -0.39 0.00 0.00 64.86 62.53 1pou h ILE 47 Cb 0.02 2.10 -0.01 0.00 -3.07 0.00 0.00 36.82 35.86 1pou h ILE 47 CO -0.01 0.62 -0.19 -1.28 -0.69 0.00 0.00 178.15 176.61 1pou h SER 48 N 0.43 -0.47 -0.77 1.72 0.87 -0.37 -1.35 113.55 113.62 1pou h SER 48 Ca -0.06 0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.57 1pou h SER 48 Cb 1.40 0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 63.46 1pou h SER 48 CO 0.16 -0.30 0.48 0.03 -0.53 0.00 0.00 176.83 176.67 1pou h ARG 49 N -0.47 0.90 0.17 2.24 3.08 -0.83 0.48 114.38 119.95 1pou h ARG 49 Ca -0.03 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1pou h ARG 49 Cb 0.39 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 1pou h ARG 49 CO 0.03 0.59 -0.40 0.35 -1.07 0.00 0.00 179.97 179.46 1pou h PHE 50 N 0.92 -1.16 -0.49 3.04 3.57 -0.39 0.14 116.94 122.57 1pou h PHE 50 Ca 0.31 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.81 1pou h PHE 50 Cb 0.05 0.48 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 1pou h PHE 50 CO -0.04 -0.48 0.17 1.49 -2.23 0.00 0.00 178.31 177.22 1pou h GLU 51 N -0.63 0.72 0.00 1.11 4.22 -0.87 0.13 114.58 119.25 1pou h GLU 51 Ca -0.02 -0.12 0.00 0.00 0.08 0.00 0.00 59.36 59.31 1pou h GLU 51 Cb 0.61 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1pou h GLU 51 CO -0.18 0.62 0.00 0.00 -2.18 0.00 0.00 179.01 177.27 1pou n ALA 52 N -2.46 1.63 -3.72 2.92 0.00 0.13 -4.85 120.51 114.16 1pou n ALA 52 Ca 0.04 -0.05 -0.26 0.00 0.00 0.00 0.00 53.44 53.16 1pou n ALA 52 Cb 0.18 -1.21 0.06 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.43 -3.08 0.09 0.00 0.00 0.44 -4.91 117.00 108.10 1pou n LEU 53 Ca 0.04 -0.63 -0.12 0.00 0.00 0.00 0.00 56.01 55.30 1pou n LEU 53 Cb 0.13 -2.86 -0.13 0.00 0.00 0.00 0.00 43.42 40.57 1pou n LEU 53 CO 0.11 0.59 0.04 -1.13 0.00 0.00 0.00 177.39 177.00 1pou h ASN 54 N -2.48 0.24 -0.09 1.96 -0.73 -0.97 -3.36 115.58 110.16 1pou h ASN 54 Ca -0.57 -0.25 -0.14 0.00 1.87 0.00 0.00 56.30 57.20 1pou h ASN 54 Cb 1.37 -0.08 -0.05 0.00 0.27 0.00 0.00 38.32 39.83 1pou h ASN 54 CO 0.60 1.19 -0.13 0.18 -0.37 0.00 0.00 177.43 178.91 1pou n LEU 55 N -3.46 5.44 0.00 0.34 4.77 -1.24 -4.90 117.00 117.95 1pou n LEU 55 Ca -0.05 -2.92 0.00 0.00 -0.03 0.00 0.00 56.01 53.01 1pou n LEU 55 Cb 0.98 -1.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 1pou n LEU 55 CO 0.51 1.38 0.00 -1.20 -1.33 0.00 0.00 177.39 176.75 1pou n SER 56 N 1.85 0.00 0.00 -1.43 7.64 -1.26 -3.67 113.62 116.75 1pou n SER 56 Ca 0.25 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.13 1pou n SER 56 Cb 0.70 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.90 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 -0.37 1.43 7.35 -1.26 -4.65 117.46 119.96 1pou n PHE 57 Ca 0.00 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.66 1pou n PHE 57 Cb 0.00 0.00 0.01 0.00 0.35 0.00 0.00 39.48 39.84 1pou n PHE 57 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 1pou n LYS 58 N 0.00 -0.27 0.01 -4.13 2.85 -1.24 -0.51 118.16 114.87 1pou n LYS 58 Ca 0.00 1.46 -0.12 0.00 -1.05 0.00 0.00 58.31 58.60 1pou n LYS 58 Cb 0.00 -2.16 -0.09 0.00 -0.65 0.00 0.00 35.03 32.13 1pou n LYS 58 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 177.40 176.38 1pou h ASN 59 N 0.00 -0.10 -1.03 -5.58 -0.73 -1.83 -3.37 115.58 102.95 1pou h ASN 59 Ca 0.29 -0.50 0.26 0.00 1.87 0.00 0.00 56.30 58.21 1pou h ASN 59 Cb 0.52 0.02 -0.11 0.00 0.27 0.00 0.00 38.32 39.02 1pou h ASN 59 CO -0.93 0.53 0.63 0.24 -0.37 0.00 0.00 177.43 177.53 1pou h MET 60 N -0.81 0.48 -0.03 6.67 2.86 -1.19 0.24 114.93 123.16 1pou h MET 60 Ca -0.01 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 1pou h MET 60 Cb 0.59 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 1pou h MET 60 CO 0.02 0.32 -0.17 0.00 1.06 0.00 0.00 176.91 178.13 1pou h LYS 62 N 0.04 0.36 -0.66 0.00 1.57 -0.84 -3.39 116.57 113.66 1pou h LYS 62 Ca 0.01 -0.61 -0.04 0.00 -1.87 0.00 0.00 60.65 58.14 1pou h LYS 62 Cb 0.33 0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 1pou h LYS 62 CO 0.02 1.29 0.26 1.37 -0.57 0.00 0.00 179.45 181.82 1pou h LEU 63 N -0.13 0.89 0.13 2.94 8.10 -0.25 -1.47 115.31 125.51 1pou h LEU 63 Ca -0.27 -0.12 -0.00 0.00 0.11 0.00 0.00 57.88 57.60 1pou h LEU 63 Cb 1.90 -0.23 -0.01 0.00 -0.44 0.00 0.00 40.66 41.88 1pou h LEU 63 CO 0.16 0.80 -0.14 0.50 -4.11 0.00 0.00 178.44 175.64 1pou h LYS 64 N 0.95 -0.27 -0.88 0.17 3.64 -0.81 0.16 116.57 119.53 1pou h LYS 64 Ca 0.22 0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.70 1pou h LYS 64 Cb 0.19 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.00 1pou h LYS 64 CO -0.02 -0.18 0.54 -1.00 -2.27 0.00 0.00 179.45 176.52 1pou h PRO 65 N -0.28 0.92 -0.49 1.90 0.13 -1.73 0.15 132.00 132.60 1pou h PRO 65 Ca -0.02 -0.06 0.10 0.00 -0.87 0.00 0.00 66.00 65.16 1pou h PRO 65 Cb 0.24 -0.21 -0.09 0.00 0.13 0.00 0.00 31.00 31.07 1pou h PRO 65 CO -0.02 0.61 -0.11 1.25 -0.23 0.00 0.00 178.00 179.49 1pou h LEU 66 N 0.95 -0.44 -0.39 1.56 6.46 -1.21 0.11 115.31 122.36 1pou h LEU 66 Ca 0.40 0.15 -0.09 0.00 -0.12 0.00 0.00 57.88 58.21 1pou h LEU 66 Cb 0.25 0.30 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 1pou h LEU 66 CO -0.20 -0.16 -0.11 -0.07 -0.62 0.00 0.00 178.44 177.28 1pou h LEU 67 N 0.01 0.77 -0.34 2.25 3.38 0.99 0.14 115.31 122.51 1pou h LEU 67 Ca 0.24 -0.37 0.05 0.00 0.09 0.00 0.00 57.88 57.89 1pou h LEU 67 Cb 0.36 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 1pou h LEU 67 CO -0.50 0.97 0.04 -0.33 0.09 0.00 0.00 178.44 178.71 1pou h GLU 68 N 0.56 0.15 -0.43 1.13 5.08 -0.35 0.21 114.58 120.93 1pou h GLU 68 Ca 0.09 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1pou h GLU 68 Cb 0.64 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1pou h GLU 68 CO 0.04 0.10 0.19 0.87 -1.00 0.00 0.00 179.01 179.21 1pou h LYS 69 N 0.15 0.63 -0.41 2.33 1.79 -0.68 -0.39 116.57 120.00 1pou h LYS 69 Ca 0.16 -0.11 0.08 0.00 -2.18 0.00 0.00 60.65 58.60 1pou h LYS 69 Cb 0.19 -0.11 -0.07 0.00 -1.58 0.00 0.00 32.23 30.67 1pou h LYS 69 CO -0.23 0.57 -0.05 2.35 -1.08 0.00 0.00 179.45 181.01 1pou h TRP 70 N 0.55 -0.12 -0.16 -1.35 7.01 -0.15 0.99 115.95 122.72 1pou h TRP 70 Ca 0.15 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.16 1pou h TRP 70 Cb 0.16 0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.33 1pou h TRP 70 CO -0.00 -0.13 0.04 1.25 -2.79 0.00 0.00 178.44 176.81 1pou h LEU 71 N 0.05 0.24 -0.08 0.65 6.46 -0.28 0.16 115.31 122.51 1pou h LEU 71 Ca 0.20 -0.22 0.04 0.00 -0.12 0.00 0.00 57.88 57.78 1pou h LEU 71 Cb 0.30 -0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 40.11 1pou h LEU 71 CO -0.38 0.40 -0.40 -1.13 -0.62 0.00 0.00 178.44 176.31 1pou h ASN 72 N 0.07 -1.23 -0.69 1.25 -1.24 -0.80 -1.09 115.58 111.85 1pou h ASN 72 Ca 0.05 0.16 0.00 0.00 0.71 0.00 0.00 56.30 57.22 1pou h ASN 72 Cb 0.25 0.50 -0.03 0.00 0.73 0.00 0.00 38.32 39.76 1pou h ASN 72 CO -0.00 -0.42 0.44 0.44 -1.29 0.00 0.00 177.43 176.60 1pou h ASP 73 N -0.50 0.81 -0.44 1.15 3.32 -0.47 0.14 116.42 120.42 1pou h ASP 73 Ca 0.07 -0.04 -0.24 0.00 0.02 0.00 0.00 57.03 56.84 1pou h ASP 73 Cb 0.62 -0.20 -0.14 0.00 0.22 0.00 0.00 39.33 39.83 1pou h ASP 73 CO -0.36 0.61 0.31 0.00 -1.72 0.00 0.00 179.24 178.08 1pou n ALA 74 N -2.30 4.09 -0.24 3.45 0.00 0.51 -5.09 120.51 120.94 1pou n ALA 74 Ca 0.06 -1.33 0.00 0.00 0.00 0.00 0.00 53.44 52.17 1pou n ALA 74 Cb 0.03 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1pou n ALA 74 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89