#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hom n ARG 1 N 0.00 -2.49 -3.22 0.03 3.00 -1.26 -5.00 116.66 107.72 1hom n ARG 1 Ca 0.00 1.78 -0.25 0.00 -0.01 0.00 0.00 57.85 59.38 1hom n ARG 1 Cb 0.00 -3.00 0.03 0.00 0.00 0.00 0.00 32.46 29.49 1hom n ARG 1 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1hom n LYS 2 N -3.86 -2.10 -1.54 5.56 0.00 -1.26 -4.94 118.16 110.03 1hom n LYS 2 Ca -0.02 1.72 -0.34 0.00 0.00 0.00 0.00 58.31 59.67 1hom n LYS 2 Cb 0.55 -3.53 0.08 0.00 0.00 0.00 0.00 35.03 32.13 1hom n LYS 2 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1hom s ARG 3 N -2.44 2.31 0.00 1.64 0.52 -1.26 -4.81 118.95 114.90 1hom s ARG 3 Ca 0.31 1.74 0.00 0.00 -0.52 0.00 0.00 55.73 57.26 1hom s ARG 3 Cb -0.05 -1.86 0.00 0.00 0.52 0.00 0.00 34.95 33.56 1hom s ARG 3 CO 0.80 -1.70 0.00 0.41 0.02 0.00 0.00 175.30 174.83 1hom n GLY 4 N 0.32 0.00 3.37 -3.53 0.00 -1.26 -5.09 105.19 99.01 1hom n GLY 4 Ca 0.13 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 1hom n GLY 4 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1hom n ARG 5 N 0.00 3.44 0.00 1.61 3.00 -1.26 -4.90 116.66 118.54 1hom n ARG 5 Ca 0.00 -3.89 0.00 0.00 -0.00 0.00 0.00 57.85 53.96 1hom n ARG 5 Cb 0.00 -2.97 0.00 0.00 0.00 0.00 0.00 32.46 29.49 1hom n ARG 5 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 1hom n GLN 6 N 5.05 0.00 0.00 -0.14 0.00 -1.26 -4.93 117.38 116.09 1hom n GLN 6 Ca 0.36 0.47 0.00 0.00 -0.00 0.00 0.00 57.00 57.83 1hom n GLN 6 Cb 0.41 -1.13 0.00 0.00 0.00 0.00 0.00 30.24 29.53 1hom n GLN 6 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 1hom n THR 7 N -1.31 0.00 -4.24 1.69 5.66 -1.26 -4.96 114.28 109.86 1hom n THR 7 Ca 0.00 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.86 1hom n THR 7 Cb 0.00 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 68.68 1hom n THR 7 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1hom s TYR 8 N 0.00 1.22 0.40 1.09 2.02 -1.26 -5.16 117.35 115.66 1hom s TYR 8 Ca 0.00 -1.03 -0.15 0.00 -0.37 0.00 0.00 57.07 55.52 1hom s TYR 8 Cb 0.00 -0.69 -0.08 0.00 -0.40 0.00 0.00 41.96 40.78 1hom s TYR 8 CO 0.00 -0.22 0.83 0.95 -1.57 0.00 0.00 175.55 175.54 1hom s THR 9 N -3.66 4.63 0.24 -0.71 -4.23 -1.26 -4.95 115.64 105.69 1hom s THR 9 Ca 0.24 1.00 -0.10 0.00 -1.18 0.00 0.00 61.69 61.65 1hom s THR 9 Cb 0.06 -3.66 0.30 0.00 1.34 0.00 0.00 72.50 70.54 1hom s THR 9 CO 0.04 -0.39 1.61 -0.09 -0.54 0.00 0.00 174.62 175.26 1hom h ARG 10 N 1.68 0.02 -0.57 3.99 1.12 -2.01 -1.24 114.38 117.37 1hom h ARG 10 Ca -0.48 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.40 1hom h ARG 10 Cb 1.18 -0.01 -0.03 0.00 -0.01 0.00 0.00 29.97 31.11 1hom h ARG 10 CO 0.63 0.02 0.37 -0.92 -3.11 0.00 0.00 179.97 176.96 1hom h TYR 11 N 0.03 0.73 -0.17 2.20 3.20 -1.98 0.17 116.97 121.15 1hom h TYR 11 Ca 0.37 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.29 1hom h TYR 11 Cb 0.60 -0.24 -0.06 0.00 1.54 0.00 0.00 36.73 38.57 1hom h TYR 11 CO -0.54 0.47 -0.47 0.37 -1.64 0.00 0.00 178.16 176.35 1hom h GLN 12 N 0.77 -0.44 -0.47 1.82 4.15 -1.63 -0.04 115.11 119.28 1hom h GLN 12 Ca 0.21 0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.62 1hom h GLN 12 Cb -0.07 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 1hom h GLN 12 CO -0.04 -0.30 0.12 1.15 -1.93 0.00 0.00 178.83 177.83 1hom h THR 13 N -0.46 1.20 -0.22 2.39 2.02 -1.17 -2.29 112.91 114.38 1hom h THR 13 Ca 0.03 -0.72 0.05 0.00 0.77 0.00 0.00 66.41 66.54 1hom h THR 13 Cb 0.56 0.72 -0.05 0.00 -1.74 0.00 0.00 68.15 67.64 1hom h THR 13 CO -0.40 0.27 -0.09 0.25 0.37 0.00 0.00 175.52 175.91 1hom h LEU 14 N 0.68 -0.31 -0.49 2.58 7.12 0.66 0.26 115.31 125.82 1hom h LEU 14 Ca 0.16 0.08 -0.15 0.00 0.13 0.00 0.00 57.88 58.10 1hom h LEU 14 Cb 0.25 0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 40.55 1hom h LEU 14 CO -0.00 -0.12 -0.33 -0.08 -0.13 0.00 0.00 178.44 177.78 1hom h GLU 15 N -0.05 0.89 -0.37 1.25 4.57 -0.82 0.70 114.58 120.75 1hom h GLU 15 Ca 0.12 -0.43 0.05 0.00 -1.18 0.00 0.00 59.36 57.92 1hom h GLU 15 Cb 0.23 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.77 1hom h GLU 15 CO -0.26 1.08 0.09 -0.07 -1.18 0.00 0.00 179.01 178.67 1hom h LEU 16 N 0.74 0.04 -0.71 1.64 4.07 -1.00 0.69 115.31 120.79 1hom h LEU 16 Ca 0.07 0.06 -0.14 0.00 0.08 0.00 0.00 57.88 57.95 1hom h LEU 16 Cb 0.90 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.69 1hom h LEU 16 CO 0.08 0.06 -0.62 -0.33 -1.08 0.00 0.00 178.44 176.55 1hom h GLU 17 N 0.22 0.09 -0.50 1.13 5.08 -0.35 0.47 114.58 120.72 1hom h GLU 17 Ca 0.17 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.50 1hom h GLU 17 Cb 0.19 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 1hom h GLU 17 CO -0.22 0.68 0.29 0.87 -1.00 0.00 0.00 179.01 179.63 1hom h LYS 18 N 0.07 0.55 -0.60 2.33 1.57 -0.40 -2.44 116.57 117.65 1hom h LYS 18 Ca -0.01 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.65 1hom h LYS 18 Cb 1.11 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.27 1hom h LYS 18 CO 0.09 0.37 0.04 1.05 -0.57 0.00 0.00 179.45 180.42 1hom h GLU 19 N 0.57 1.03 -0.76 3.15 4.11 -0.66 -3.24 114.58 118.78 1hom h GLU 19 Ca 0.21 -0.31 0.14 0.00 0.07 0.00 0.00 59.36 59.47 1hom h GLU 19 Cb 0.05 -0.10 -0.14 0.00 0.50 0.00 0.00 28.75 29.06 1hom h GLU 19 CO -0.11 1.00 -0.29 0.35 0.07 0.00 0.00 179.01 180.03 1hom h PHE 20 N 0.93 -0.75 0.00 2.06 3.57 -0.42 0.43 116.94 122.75 1hom h PHE 20 Ca 0.17 0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.75 1hom h PHE 20 Cb 0.51 0.45 -0.00 0.00 2.79 0.00 0.00 35.95 39.69 1hom h PHE 20 CO 0.04 -0.37 -0.02 1.12 -2.23 0.00 0.00 178.31 176.84 1hom h HIS 21 N -0.06 0.00 0.00 0.41 2.07 -1.53 -3.08 115.15 112.95 1hom h HIS 21 Ca 0.32 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.84 1hom h HIS 21 Cb 0.58 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.56 1hom h HIS 21 CO -0.69 0.02 0.00 1.19 -3.07 0.00 0.00 177.93 175.39 1hom n PHE 22 N -3.66 0.00 -2.85 6.12 3.72 -0.26 -4.79 117.46 115.74 1hom n PHE 22 Ca -0.03 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.94 1hom n PHE 22 Cb 0.11 -0.05 -0.01 0.00 -0.94 0.00 0.00 39.48 38.59 1hom n PHE 22 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1hom s ASN 23 N -1.47 6.89 0.43 4.37 0.02 0.14 -4.78 114.94 120.53 1hom s ASN 23 Ca 0.00 -2.56 0.14 0.00 -1.02 0.00 0.00 52.86 49.42 1hom s ASN 23 Cb 0.00 -2.44 0.93 0.00 0.02 0.00 0.00 41.25 39.76 1hom s ASN 23 CO 0.00 -0.95 1.95 -0.09 0.02 0.00 0.00 177.10 178.03 1hom h ARG 24 N 7.82 0.01 -6.60 -0.60 2.43 -1.76 -3.38 114.38 112.30 1hom h ARG 24 Ca 0.29 -0.00 -0.70 0.00 -0.81 0.00 0.00 59.98 58.76 1hom h ARG 24 Cb 0.92 -0.00 -0.27 0.00 -0.42 0.00 0.00 29.97 30.19 1hom h ARG 24 CO 1.26 0.23 -0.86 0.71 -1.51 0.00 0.00 179.97 179.80 1hom s TYR 25 N -4.55 2.40 0.20 2.20 1.51 -1.26 -5.01 117.35 112.85 1hom s TYR 25 Ca -0.04 -0.38 0.09 0.00 -1.01 0.00 0.00 57.07 55.74 1hom s TYR 25 Cb 0.15 -1.48 -0.04 0.00 -0.11 0.00 0.00 41.96 40.48 1hom s TYR 25 CO 0.70 0.06 -0.09 -0.51 -1.11 0.00 0.00 175.55 174.61 1hom s LEU 26 N -0.87 2.97 0.14 -1.29 1.43 -1.26 -5.14 118.68 114.66 1hom s LEU 26 Ca 0.11 -0.62 0.07 0.00 -1.03 0.00 0.00 54.13 52.66 1hom s LEU 26 Cb -0.10 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1hom s LEU 26 CO 0.01 0.08 -0.06 0.42 0.23 0.00 0.00 176.35 177.03 1hom s THR 27 N -1.85 3.46 0.23 5.49 -4.23 -1.26 -5.00 115.64 112.48 1hom s THR 27 Ca 0.26 -1.40 -0.07 0.00 -1.18 0.00 0.00 61.69 59.29 1hom s THR 27 Cb -0.08 -2.68 0.22 0.00 1.34 0.00 0.00 72.50 71.29 1hom s THR 27 CO 0.16 -0.01 1.68 -0.09 -0.54 0.00 0.00 174.62 175.81 1hom h ARG 28 N 3.14 0.21 0.27 3.99 2.43 -2.01 0.82 114.38 123.23 1hom h ARG 28 Ca -0.48 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1hom h ARG 28 Cb 1.19 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.65 1hom h ARG 28 CO 0.55 0.14 -0.47 0.00 -1.51 0.00 0.00 179.97 178.68 1hom h ARG 29 N 0.21 -0.78 -0.81 0.20 -0.00 -2.00 0.34 114.38 111.55 1hom h ARG 29 Ca 0.38 0.05 0.16 0.00 -0.50 0.00 0.00 59.98 60.07 1hom h ARG 29 Cb 0.63 0.18 -0.06 0.00 0.00 0.00 0.00 29.97 30.72 1hom h ARG 29 CO -0.51 -0.52 0.53 0.00 0.00 0.00 0.00 179.97 179.48 1hom h ARG 30 N -0.80 0.45 -0.62 0.04 2.47 -1.72 -0.26 114.38 113.92 1hom h ARG 30 Ca -0.02 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.63 1hom h ARG 30 Cb 0.76 -0.10 -0.03 0.00 -1.65 0.00 0.00 29.97 28.96 1hom h ARG 30 CO -0.18 0.30 0.22 0.00 0.56 0.00 0.00 179.97 180.87 1hom h ARG 31 N 0.46 0.96 -0.30 0.04 3.08 0.11 0.14 114.38 118.86 1hom h ARG 31 Ca 0.40 -0.19 0.02 0.00 0.07 0.00 0.00 59.98 60.28 1hom h ARG 31 Cb 0.89 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.77 1hom h ARG 31 CO -0.14 0.83 0.14 0.82 -1.07 0.00 0.00 179.97 180.55 1hom h ILE 32 N 0.89 0.97 0.46 2.04 5.03 0.67 0.15 117.51 127.71 1hom h ILE 32 Ca 0.20 -0.10 -0.01 0.00 -0.12 0.00 0.00 64.86 64.83 1hom h ILE 32 Cb 0.26 0.65 -0.02 0.00 -3.03 0.00 0.00 36.82 34.68 1hom h ILE 32 CO -0.01 0.05 -0.42 -0.33 -0.68 0.00 0.00 178.15 176.77 1hom h GLU 33 N 0.29 -0.85 -0.12 2.37 5.08 -0.68 -2.01 114.58 118.66 1hom h GLU 33 Ca 0.13 0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.41 1hom h GLU 33 Cb 0.06 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1hom h GLU 33 CO -0.10 -0.57 -0.52 0.97 -1.00 0.00 0.00 179.01 177.80 1hom h ILE 34 N -0.88 1.34 -0.46 3.13 -0.00 -0.69 0.31 117.51 120.25 1hom h ILE 34 Ca -0.05 -1.77 0.09 0.00 -0.00 0.00 0.00 64.86 63.14 1hom h ILE 34 Cb 0.77 1.81 -0.08 0.00 -0.00 0.00 0.00 36.82 39.32 1hom h ILE 34 CO -0.04 0.53 -0.07 0.00 -0.00 0.00 0.00 178.15 178.58 1hom h ALA 35 N 1.18 0.36 -0.52 0.18 0.00 -0.64 0.46 119.26 120.28 1hom h ALA 35 Ca 0.01 0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 1hom h ALA 35 Cb 1.00 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1hom h ALA 35 CO 0.09 -0.43 -0.07 0.45 0.00 0.00 0.00 179.25 179.29 1hom h HIS 36 N 0.04 1.07 0.45 0.00 3.86 -0.48 0.45 115.15 120.55 1hom h HIS 36 Ca 0.23 -0.21 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1hom h HIS 36 Cb 0.35 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 1hom h HIS 36 CO -0.36 1.00 -0.39 0.00 0.86 0.00 0.00 177.93 179.04 1hom h ALA 37 N 0.92 -1.10 0.00 2.45 0.00 -0.15 -2.91 119.26 118.47 1hom h ALA 37 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1hom h ALA 37 Cb 0.62 0.59 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1hom h ALA 37 CO 0.04 -1.11 0.00 -0.07 0.00 0.00 0.00 179.25 178.11 1hom h LEU 38 N -0.82 0.00 -1.74 0.00 -0.00 -1.02 -3.48 115.31 108.25 1hom h LEU 38 Ca -0.06 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.75 1hom h LEU 38 Cb 0.70 0.00 0.03 0.00 -0.00 0.00 0.00 40.66 41.39 1hom h LEU 38 CO -0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 178.44 178.28 1hom s LEU 40 N -2.75 2.52 0.26 0.00 1.02 0.56 -5.00 118.68 115.29 1hom s LEU 40 Ca 0.02 -1.43 0.08 0.00 0.02 0.00 0.00 54.13 52.82 1hom s LEU 40 Cb -0.01 -0.98 -0.04 0.00 0.02 0.00 0.00 46.19 45.18 1hom s LEU 40 CO 0.15 -0.97 0.08 0.42 0.02 0.00 0.00 176.35 176.05 1hom s THR 41 N -2.82 3.90 0.13 5.49 -4.23 -1.26 -4.51 115.64 112.34 1hom s THR 41 Ca 0.21 -1.68 -0.27 0.00 -1.18 0.00 0.00 61.69 58.77 1hom s THR 41 Cb -0.00 -3.09 -0.03 0.00 1.34 0.00 0.00 72.50 70.71 1hom s THR 41 CO 0.13 -0.36 1.60 -0.08 -0.54 0.00 0.00 174.62 175.36 1hom h GLU 42 N 1.73 -0.43 -0.42 3.99 4.57 -1.97 -0.24 114.58 121.80 1hom h GLU 42 Ca -0.46 0.03 0.09 0.00 -1.18 0.00 0.00 59.36 57.84 1hom h GLU 42 Cb 1.24 0.10 -0.09 0.00 -0.16 0.00 0.00 28.75 29.84 1hom h GLU 42 CO 0.60 -0.28 -0.19 0.07 -1.18 0.00 0.00 179.01 178.03 1hom h ARG 43 N -0.44 -0.10 -0.08 1.92 0.11 -1.98 0.11 114.38 113.92 1hom h ARG 43 Ca 0.09 0.01 -0.15 0.00 0.10 0.00 0.00 59.98 60.03 1hom h ARG 43 Cb 0.59 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.68 1hom h ARG 43 CO -0.38 -0.07 -0.59 -0.56 0.10 0.00 0.00 179.97 178.48 1hom h GLN 44 N -0.10 0.27 -0.07 0.08 3.07 -1.72 0.96 115.11 117.60 1hom h GLN 44 Ca 0.21 -0.18 -0.00 0.00 0.09 0.00 0.00 58.65 58.76 1hom h GLN 44 Cb 0.42 0.03 -0.00 0.00 0.08 0.00 0.00 27.48 28.00 1hom h GLN 44 CO -0.49 0.78 0.03 0.82 0.09 0.00 0.00 178.83 180.06 1hom h ILE 45 N 0.20 1.16 -0.98 1.86 1.08 -0.54 -0.74 117.51 119.55 1hom h ILE 45 Ca -0.00 -0.47 0.08 0.00 -0.39 0.00 0.00 64.86 64.08 1hom h ILE 45 Cb 1.09 1.34 -0.07 0.00 -3.07 0.00 0.00 36.82 36.11 1hom h ILE 45 CO 0.09 0.13 0.63 0.50 -0.69 0.00 0.00 178.15 178.82 1hom h LYS 46 N -0.06 1.07 0.71 2.37 3.11 -0.26 0.99 116.57 124.50 1hom h LYS 46 Ca 0.02 -0.06 -0.03 0.00 -2.81 0.00 0.00 60.65 57.76 1hom h LYS 46 Cb 0.19 -0.24 0.01 0.00 -1.00 0.00 0.00 32.23 31.18 1hom h LYS 46 CO -0.00 0.71 -0.34 0.82 -2.81 0.00 0.00 179.45 177.83 1hom h ILE 47 N 1.11 0.19 -0.37 2.00 5.03 -0.64 -1.93 117.51 122.89 1hom h ILE 47 Ca 0.44 -0.20 0.02 0.00 -0.12 0.00 0.00 64.86 64.99 1hom h ILE 47 Cb 0.24 0.23 -0.03 0.00 -3.03 0.00 0.00 36.82 34.23 1hom h ILE 47 CO -0.18 0.02 0.21 -0.25 -0.68 0.00 0.00 178.15 177.26 1hom h TRP 48 N -1.12 0.39 0.00 1.37 7.01 -0.45 0.20 115.95 123.34 1hom h TRP 48 Ca -0.10 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.92 1hom h TRP 48 Cb 0.76 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.70 1hom h TRP 48 CO -0.00 0.22 0.00 0.74 -2.79 0.00 0.00 178.44 176.61 1hom h PHE 49 N 0.42 0.00 0.51 2.65 -1.00 -0.93 0.86 116.94 119.46 1hom h PHE 49 Ca 0.15 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.90 1hom h PHE 49 Cb 0.02 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.58 1hom h PHE 49 CO -0.08 0.00 -0.25 0.37 -1.61 0.00 0.00 178.31 176.74 1hom h GLN 50 N 0.00 -0.67 0.36 1.51 5.75 0.22 -3.40 115.11 118.89 1hom h GLN 50 Ca 0.00 0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.53 1hom h GLN 50 Cb 0.08 0.15 0.00 0.00 1.07 0.00 0.00 27.48 28.79 1hom h GLN 50 CO 0.00 -0.44 -0.17 -0.91 -2.65 0.00 0.00 178.83 174.65 1hom h ASN 51 N -1.11 -0.41 -0.57 -0.69 -0.26 -1.13 -3.27 115.58 108.14 1hom h ASN 51 Ca -0.07 -0.14 -0.10 0.00 -0.56 0.00 0.00 56.30 55.43 1hom h ASN 51 Cb 0.53 0.11 -0.00 0.00 -1.06 0.00 0.00 38.32 37.89 1hom h ASN 51 CO 0.12 0.02 0.38 -1.14 -1.06 0.00 0.00 177.43 175.74 1hom n ARG 52 N -5.13 0.63 0.00 0.81 0.00 0.24 -0.80 116.66 112.42 1hom n ARG 52 Ca -0.09 -0.67 0.00 0.00 -0.00 0.00 0.00 57.85 57.09 1hom n ARG 52 Cb 0.27 -3.57 0.00 0.00 0.00 0.00 0.00 32.46 29.16 1hom n ARG 52 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1hom n ARG 53 N 8.76 0.00 -1.82 -0.14 0.63 -1.26 -4.58 116.66 118.25 1hom n ARG 53 Ca 0.46 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 57.00 1hom n ARG 53 Cb 0.44 0.00 0.03 0.00 0.45 0.00 0.00 32.46 33.38 1hom n ARG 53 CO 0.00 0.00 0.00 1.41 -2.51 0.00 0.00 177.63 176.53 1hom s MET 54 N 0.00 3.33 0.00 -0.14 -2.45 0.02 -0.73 119.30 119.33 1hom s MET 54 Ca 0.00 2.26 0.00 0.00 -1.25 0.00 0.00 55.69 56.70 1hom s MET 54 Cb 0.00 -2.38 0.00 0.00 1.25 0.00 0.00 34.83 33.70 1hom s MET 54 CO 0.00 -1.04 0.00 1.17 1.05 0.00 0.00 175.02 176.20 1hom n LYS 55 N -0.76 0.00 -0.03 4.11 4.81 -1.26 -4.67 118.16 120.36 1hom n LYS 55 Ca 0.09 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.52 1hom n LYS 55 Cb 0.44 -1.44 -0.00 0.00 0.02 0.00 0.00 35.03 34.05 1hom n LYS 55 CO 0.00 0.00 0.00 2.35 1.17 0.00 0.00 177.40 180.92 1hom h TRP 56 N 0.00 0.00 0.00 5.64 7.01 -1.63 -3.32 115.95 123.65 1hom h TRP 56 Ca 0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1hom h TRP 56 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.06 1hom h TRP 56 CO 0.00 0.00 0.00 0.36 -2.79 0.00 0.00 178.44 176.01 1hom n LYS 57 N -3.53 0.80 -0.76 2.65 2.85 0.09 -1.50 118.16 118.77 1hom n LYS 57 Ca -0.01 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.28 1hom n LYS 57 Cb 0.05 -1.18 0.04 0.00 -0.65 0.00 0.00 35.03 33.29 1hom n LYS 57 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1hom n LYS 58 N -0.68 0.29 0.00 -1.58 4.81 -1.26 -4.86 118.16 114.88 1hom n LYS 58 Ca 0.07 -1.68 0.00 0.00 -0.87 0.00 0.00 58.31 55.82 1hom n LYS 58 Cb 0.03 -0.56 0.00 0.00 0.02 0.00 0.00 35.03 34.52 1hom n LYS 58 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1hom n GLU 59 N -0.12 0.00 0.06 1.64 1.02 -0.81 -4.82 120.64 117.62 1hom n GLU 59 Ca 0.05 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.07 1hom n GLU 59 Cb 0.83 -0.14 -0.13 0.00 -0.02 0.00 0.00 31.44 31.98 1hom n GLU 59 CO 0.00 0.00 0.00 -2.95 1.18 0.00 0.00 177.13 175.36 1hom h ASN 60 N 0.00 0.23 0.00 1.62 7.08 -1.47 -3.48 115.58 119.56 1hom h ASN 60 Ca 0.00 -0.29 0.00 0.00 -3.08 0.00 0.00 56.30 52.93 1hom h ASN 60 Cb 0.36 -0.07 0.00 0.00 -2.08 0.00 0.00 38.32 36.53 1hom h ASN 60 CO 0.00 1.24 0.00 1.17 -2.08 0.00 0.00 177.43 177.76 1hom n LYS 61 N -3.39 2.59 -2.90 4.14 4.81 -1.26 -5.03 118.16 117.11 1hom n LYS 61 Ca -0.10 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.28 1hom n LYS 61 Cb 1.01 0.00 0.01 0.00 0.02 0.00 0.00 35.03 36.07 1hom n LYS 61 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1hom n THR 62 N 0.00 -9.51 -1.06 3.15 -2.24 -1.26 -4.95 114.28 98.42 1hom n THR 62 Ca 0.00 1.21 -0.35 0.00 -2.27 0.00 0.00 64.05 62.65 1hom n THR 62 Cb 0.00 -6.13 0.09 0.00 -2.10 0.00 0.00 70.33 62.20 1hom n THR 62 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1hom n LYS 63 N 0.43 0.05 -0.71 -0.78 2.85 -1.26 -4.99 118.16 113.75 1hom n LYS 63 Ca 0.03 0.06 -0.03 0.00 -1.05 0.00 0.00 58.31 57.32 1hom n LYS 63 Cb 0.27 -1.83 -0.03 0.00 -0.65 0.00 0.00 35.03 32.79 1hom n LYS 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1hom n GLY 64 N 1.61 0.79 0.25 2.58 0.00 -1.26 -5.00 105.19 104.17 1hom n GLY 64 Ca 0.08 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 1hom n GLY 64 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1hom h GLU 65 N 0.01 -0.55 -5.60 1.61 3.07 -2.04 -3.31 114.58 107.76 1hom h GLU 65 Ca -0.23 0.04 -0.50 0.00 -0.50 0.00 0.00 59.36 58.16 1hom h GLU 65 Cb 1.18 0.12 -0.06 0.00 -0.84 0.00 0.00 28.75 29.16 1hom h GLU 65 CO -0.12 -0.30 1.65 -0.35 -1.40 0.00 0.00 179.01 178.49 1hom n PRO 66 N -5.29 2.36 0.00 2.33 -0.04 -1.26 -5.38 135.00 127.72 1hom n PRO 66 Ca -0.11 -2.84 0.00 0.00 -0.04 0.00 0.00 63.50 60.51 1hom n PRO 66 Cb 0.27 -3.61 0.00 0.00 -0.04 0.00 0.00 33.50 30.12 1hom n PRO 66 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87