#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 0.14 -3.88 3.17 0.00 -1.26 -5.15 116.66 109.69 1hom n ARG 1 Ca 0.00 -0.19 -0.27 0.00 -0.00 0.00 0.00 57.85 57.39 1hom n ARG 1 Cb 0.00 0.24 -0.17 0.00 -0.00 0.00 0.00 32.46 32.53 1hom n ARG 1 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1hom s LYS 2 N 0.01 1.35 0.20 2.89 1.02 -1.26 -5.12 119.74 118.82 1hom s LYS 2 Ca 0.01 -0.27 0.02 0.00 0.02 0.00 0.00 55.97 55.75 1hom s LYS 2 Cb 0.05 -1.62 -0.05 0.00 -0.52 0.00 0.00 37.83 35.69 1hom s LYS 2 CO -0.01 -0.32 0.01 1.03 -0.92 0.00 0.00 175.35 175.13 1hom s ARG 3 N 1.73 1.20 -0.01 1.68 1.81 -1.26 -5.12 118.95 118.99 1hom s ARG 3 Ca 0.04 -1.60 -0.00 0.00 -1.72 0.00 0.00 55.73 52.45 1hom s ARG 3 Cb -0.13 -0.37 -0.00 0.00 -0.45 0.00 0.00 34.95 33.99 1hom s ARG 3 CO -0.08 -0.13 0.06 0.78 -0.68 0.00 0.00 175.30 175.25 1hom h GLY 4 N 2.60 -0.01 -6.96 -3.53 0.00 -2.02 -3.48 103.07 89.68 1hom h GLY 4 Ca -0.37 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.38 1hom h GLY 4 CO 0.63 -0.00 -0.91 -2.13 0.00 0.00 0.00 176.54 174.13 1hom n ARG 5 N -2.19 -0.94 0.00 4.80 3.00 -1.26 -4.89 116.66 115.19 1hom n ARG 5 Ca -0.00 0.08 0.00 0.00 -0.00 0.00 0.00 57.85 57.93 1hom n ARG 5 Cb 0.00 -3.35 0.00 0.00 0.00 0.00 0.00 32.46 29.11 1hom n ARG 5 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1hom n GLN 6 N -4.38 0.00 -3.43 -0.14 1.13 -1.26 -4.89 117.38 104.40 1hom n GLN 6 Ca -0.31 0.19 -0.25 0.00 -1.94 0.00 0.00 57.00 54.69 1hom n GLN 6 Cb 0.66 -1.06 0.00 0.00 0.11 0.00 0.00 30.24 29.95 1hom n GLN 6 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 1hom n THR 7 N -1.06 -1.24 -2.81 5.09 5.66 -1.26 -4.96 114.28 113.70 1hom n THR 7 Ca 0.00 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.70 1hom n THR 7 Cb 0.00 -2.14 -0.03 0.00 -1.55 0.00 0.00 70.33 66.62 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 -3.02 3.49 0.57 1.09 2.02 -1.26 -5.06 117.35 115.17 1hom s TYR 8 Ca 0.44 1.00 -0.16 0.00 -0.37 0.00 0.00 57.07 57.98 1hom s TYR 8 Cb -0.23 -2.41 -0.05 0.00 -0.40 0.00 0.00 41.96 38.87 1hom s TYR 8 CO 0.54 -0.14 1.04 0.95 -1.57 0.00 0.00 175.55 176.37 1hom s THR 9 N -2.44 4.02 0.20 -0.71 -4.23 -1.26 -4.93 115.64 106.29 1hom s THR 9 Ca 0.50 0.97 -0.11 0.00 -1.18 0.00 0.00 61.69 61.88 1hom s THR 9 Cb -0.10 -3.48 0.14 0.00 1.34 0.00 0.00 72.50 70.39 1hom s THR 9 CO 0.34 -0.55 1.73 -0.09 -0.54 0.00 0.00 174.62 175.51 1hom h ARG 10 N 0.60 0.32 -0.46 3.99 2.43 -1.99 -2.02 114.38 117.26 1hom h ARG 10 Ca -0.47 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 58.69 1hom h ARG 10 Cb 1.21 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 1hom h ARG 10 CO 0.59 0.21 0.30 -0.92 -1.51 0.00 0.00 179.97 178.64 1hom h TYR 11 N 0.33 0.56 0.01 2.20 3.20 -1.98 0.41 116.97 121.71 1hom h TYR 11 Ca 0.29 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.20 1hom h TYR 11 Cb 0.38 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.41 1hom h TYR 11 CO -0.20 0.35 -0.43 0.37 -1.64 0.00 0.00 178.16 176.60 1hom h GLN 12 N 0.60 -0.57 0.00 1.82 4.15 -1.83 -1.88 115.11 117.40 1hom h GLN 12 Ca 0.17 0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.56 1hom h GLN 12 Cb -0.05 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 1hom h GLN 12 CO -0.05 -0.38 -0.31 1.15 -1.93 0.00 0.00 178.83 177.31 1hom h THR 13 N -0.60 1.13 0.30 2.39 2.02 -0.96 -2.96 112.91 114.24 1hom h THR 13 Ca 0.04 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.12 1hom h THR 13 Cb 0.67 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 1hom h THR 13 CO -0.32 0.31 -0.33 0.25 0.37 0.00 0.00 175.52 175.80 1hom h LEU 14 N 0.00 -0.91 -0.49 2.58 7.12 0.60 0.16 115.31 124.36 1hom h LEU 14 Ca -0.00 0.08 0.01 0.00 0.13 0.00 0.00 57.88 58.10 1hom h LEU 14 Cb 0.59 0.32 -0.03 0.00 -0.53 0.00 0.00 40.66 41.01 1hom h LEU 14 CO 0.04 -0.46 0.32 -0.33 -0.13 0.00 0.00 178.44 177.88 1hom h GLU 15 N -0.67 0.64 -0.23 1.25 4.39 -1.29 0.23 114.58 118.89 1hom h GLU 15 Ca -0.01 -0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.69 1hom h GLU 15 Cb 0.62 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.10 1hom h GLU 15 CO -0.08 0.42 0.01 -0.07 -1.16 0.00 0.00 179.01 178.13 1hom h LEU 16 N 0.66 -0.06 -0.52 1.33 4.07 -1.33 0.33 115.31 119.79 1hom h LEU 16 Ca 0.18 0.05 -0.16 0.00 0.08 0.00 0.00 57.88 58.03 1hom h LEU 16 Cb -0.07 0.08 -0.02 0.00 1.08 0.00 0.00 40.66 41.74 1hom h LEU 16 CO -0.04 0.00 -0.73 -0.33 -1.08 0.00 0.00 178.44 176.26 1hom h GLU 17 N 0.09 0.11 -0.35 1.13 5.08 -0.33 0.20 114.58 120.51 1hom h GLU 17 Ca 0.11 -0.10 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1hom h GLU 17 Cb 0.13 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1hom h GLU 17 CO -0.17 0.79 -0.01 1.57 -1.00 0.00 0.00 179.01 180.19 1hom h LYS 18 N 0.07 0.54 -0.51 2.33 5.09 -0.28 -0.09 116.57 123.73 1hom h LYS 18 Ca -0.02 -0.12 -0.12 0.00 0.09 0.00 0.00 60.65 60.49 1hom h LYS 18 Cb 1.29 -0.08 -0.02 0.00 0.10 0.00 0.00 32.23 33.53 1hom h LYS 18 CO 0.10 0.58 -0.14 0.93 -2.09 0.00 0.00 179.45 178.83 1hom h GLU 19 N 0.52 0.99 -0.61 0.07 4.39 -0.61 -3.04 114.58 116.30 1hom h GLU 19 Ca 0.11 -0.39 0.12 0.00 0.34 0.00 0.00 59.36 59.54 1hom h GLU 19 Cb 0.35 -0.05 -0.10 0.00 -0.10 0.00 0.00 28.75 28.85 1hom h GLU 19 CO 0.01 1.07 0.03 0.35 -1.16 0.00 0.00 179.01 179.31 1hom h PHE 20 N 0.86 0.02 0.00 4.33 3.57 0.92 0.38 116.94 127.01 1hom h PHE 20 Ca 0.13 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1hom h PHE 20 Cb 0.71 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.54 1hom h PHE 20 CO 0.05 -0.13 -0.05 0.45 -2.23 0.00 0.00 178.31 176.40 1hom h HIS 21 N 0.15 0.00 0.16 0.41 3.86 -1.07 -1.93 115.15 116.73 1hom h HIS 21 Ca 0.32 0.00 -0.32 0.00 -1.16 0.00 0.00 60.37 59.21 1hom h HIS 21 Cb 0.51 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.98 1hom h HIS 21 CO -0.33 0.05 -1.54 0.74 0.86 0.00 0.00 177.93 177.70 1hom h PHE 22 N 0.00 0.62 -2.12 2.45 -1.00 -0.61 -3.49 116.94 112.80 1hom h PHE 22 Ca -0.00 -0.46 -0.04 0.00 2.81 0.00 0.00 57.97 60.29 1hom h PHE 22 Cb 0.12 -0.02 -0.22 0.00 3.61 0.00 0.00 35.95 39.44 1hom h PHE 22 CO 0.00 1.48 0.04 0.54 -1.61 0.00 0.00 178.31 178.75 1hom s ASN 23 N -7.19 -0.75 0.00 2.17 2.20 0.10 -5.03 114.94 106.44 1hom s ASN 23 Ca -0.10 1.37 0.20 0.00 -0.94 0.00 0.00 52.86 53.39 1hom s ASN 23 Cb 0.06 1.34 0.57 0.00 -2.00 0.00 0.00 41.25 41.22 1hom s ASN 23 CO 0.87 -0.23 1.47 -1.14 -2.94 0.00 0.00 177.10 175.13 1hom n ARG 24 N 3.20 2.48 -3.71 3.55 0.63 -1.26 -3.99 116.66 117.57 1hom n ARG 24 Ca -0.16 -2.30 -0.12 0.00 -0.92 0.00 0.00 57.85 54.35 1hom n ARG 24 Cb 0.56 -1.50 -0.10 0.00 0.45 0.00 0.00 32.46 31.87 1hom n ARG 24 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1hom s TYR 25 N -1.16 -0.56 0.07 -0.14 2.02 -1.26 -5.08 117.35 111.24 1hom s TYR 25 Ca 0.43 1.27 0.06 0.00 -0.37 0.00 0.00 57.07 58.47 1hom s TYR 25 Cb 0.22 0.23 -0.04 0.00 -0.40 0.00 0.00 41.96 41.98 1hom s TYR 25 CO 0.29 -0.29 -0.12 -0.51 -1.57 0.00 0.00 175.55 173.35 1hom s LEU 26 N 0.81 2.95 0.49 -1.29 1.43 -1.26 -5.13 118.68 116.67 1hom s LEU 26 Ca -0.05 -0.36 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 1hom s LEU 26 Cb -0.05 -1.74 0.02 0.00 0.03 0.00 0.00 46.19 44.44 1hom s LEU 26 CO -0.06 0.22 0.70 0.42 0.23 0.00 0.00 176.35 177.85 1hom s THR 27 N -1.10 3.19 0.13 5.49 -4.23 -1.26 -4.92 115.64 112.93 1hom s THR 27 Ca 0.19 -0.68 -0.19 0.00 -1.18 0.00 0.00 61.69 59.83 1hom s THR 27 Cb -0.11 -3.17 -0.04 0.00 1.34 0.00 0.00 72.50 70.53 1hom s THR 27 CO 0.10 -0.11 1.75 -0.09 -0.54 0.00 0.00 174.62 175.73 1hom h ARG 28 N 0.29 0.17 -0.52 3.99 2.43 -2.01 0.65 114.38 119.39 1hom h ARG 28 Ca -0.43 -0.01 0.10 0.00 -0.81 0.00 0.00 59.98 58.83 1hom h ARG 28 Cb 1.28 -0.04 -0.10 0.00 -0.42 0.00 0.00 29.97 30.69 1hom h ARG 28 CO 0.53 0.11 -0.16 0.00 -1.51 0.00 0.00 179.97 178.94 1hom h ARG 29 N 0.17 -0.03 -0.68 0.20 3.08 -1.99 0.23 114.38 115.36 1hom h ARG 29 Ca 0.10 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 1hom h ARG 29 Cb 0.08 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1hom h ARG 29 CO -0.11 -0.02 0.29 -0.09 -1.07 0.00 0.00 179.97 178.97 1hom h ARG 30 N -0.03 1.01 -0.67 0.04 1.12 -1.83 -0.93 114.38 113.10 1hom h ARG 30 Ca 0.25 -0.17 0.03 0.00 -1.11 0.00 0.00 59.98 58.97 1hom h ARG 30 Cb 0.41 -0.17 -0.04 0.00 -0.01 0.00 0.00 29.97 30.16 1hom h ARG 30 CO -0.55 0.83 0.41 0.00 -3.11 0.00 0.00 179.97 177.55 1hom h ARG 31 N 0.96 0.78 0.55 0.20 3.08 0.37 -0.25 114.38 120.08 1hom h ARG 31 Ca 0.23 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 1hom h ARG 31 Cb 0.18 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1hom h ARG 31 CO -0.02 0.52 -0.36 0.82 -1.07 0.00 0.00 179.97 179.86 1hom h ILE 32 N 0.81 0.27 -0.69 2.04 2.04 0.20 0.21 117.51 122.38 1hom h ILE 32 Ca 0.27 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.13 1hom h ILE 32 Cb 0.02 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.34 1hom h ILE 32 CO -0.11 0.00 0.44 1.05 0.00 0.00 0.00 178.15 179.53 1hom h GLU 33 N -0.87 0.92 -0.22 2.37 4.11 -1.07 -1.17 114.58 118.65 1hom h GLU 33 Ca -0.06 -0.07 -0.17 0.00 0.07 0.00 0.00 59.36 59.13 1hom h GLU 33 Cb 0.72 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1hom h GLU 33 CO 0.05 0.63 -0.55 0.97 0.07 0.00 0.00 179.01 180.19 1hom h ILE 34 N 0.94 1.30 -0.48 -1.06 2.10 -0.93 0.11 117.51 119.50 1hom h ILE 34 Ca 0.25 -1.77 0.07 0.00 1.08 0.00 0.00 64.86 64.49 1hom h ILE 34 Cb -0.08 1.71 -0.06 0.00 -1.09 0.00 0.00 36.82 37.31 1hom h ILE 34 CO -0.05 0.56 0.14 0.00 -1.08 0.00 0.00 178.15 177.72 1hom h ALA 35 N 0.87 0.57 0.24 0.18 0.00 -0.28 -2.26 119.26 118.58 1hom h ALA 35 Ca 0.01 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1hom h ALA 35 Cb 1.11 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1hom h ALA 35 CO 0.11 -0.26 -0.12 0.45 0.00 0.00 0.00 179.25 179.44 1hom h HIS 36 N 0.30 -0.30 -0.98 0.00 3.86 -0.90 0.22 115.15 117.34 1hom h HIS 36 Ca 0.23 -0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.55 1hom h HIS 36 Cb 0.27 0.10 -0.13 0.00 1.06 0.00 0.00 27.41 28.71 1hom h HIS 36 CO -0.18 -0.02 -0.53 0.00 0.86 0.00 0.00 177.93 178.06 1hom h ALA 37 N 0.12 -0.33 -0.46 2.45 0.00 -0.24 -0.50 119.26 120.30 1hom h ALA 37 Ca -0.03 0.17 -0.27 0.00 0.00 0.00 0.00 54.91 54.78 1hom h ALA 37 Cb 0.41 1.26 -0.16 0.00 0.00 0.00 0.00 17.79 19.30 1hom h ALA 37 CO 0.05 -0.86 -0.09 1.47 0.00 0.00 0.00 179.25 179.82 1hom n LEU 38 N -5.32 4.52 -3.98 0.00 -0.00 -0.90 -5.00 117.00 106.32 1hom n LEU 38 Ca 0.04 -3.94 -0.30 0.00 -0.00 0.00 0.00 56.01 51.81 1hom n LEU 38 Cb 0.31 -0.63 -0.02 0.00 -0.00 0.00 0.00 43.42 43.08 1hom n LEU 38 CO -0.15 1.38 -0.24 0.00 -0.00 0.00 0.00 177.39 178.39 1hom n LEU 40 N -4.48 0.00 -4.34 0.00 4.32 0.64 -5.01 117.00 108.12 1hom n LEU 40 Ca -0.25 -2.04 -0.28 0.00 -0.02 0.00 0.00 56.01 53.42 1hom n LEU 40 Cb 0.65 -0.07 -0.14 0.00 -1.62 0.00 0.00 43.42 42.24 1hom n LEU 40 CO 0.75 -0.52 -0.56 0.42 -1.22 0.00 0.00 177.39 176.26 1hom s THR 41 N -1.92 2.08 0.22 -5.08 -4.23 -1.26 -4.59 115.64 100.87 1hom s THR 41 Ca 0.26 -1.53 -0.07 0.00 -1.18 0.00 0.00 61.69 59.16 1hom s THR 41 Cb -0.02 -1.82 0.18 0.00 1.34 0.00 0.00 72.50 72.18 1hom s THR 41 CO 0.16 0.19 1.73 -0.33 -0.54 0.00 0.00 174.62 175.84 1hom h GLU 42 N 4.36 0.39 -0.76 3.99 5.08 -1.96 0.25 114.58 125.93 1hom h GLU 42 Ca -0.48 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1hom h GLU 42 Cb 1.16 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 1hom h GLU 42 CO 0.41 0.26 0.49 0.07 -1.00 0.00 0.00 179.01 179.24 1hom h ARG 43 N 0.40 1.00 -0.24 2.33 -0.00 -1.98 0.32 114.38 116.21 1hom h ARG 43 Ca 0.35 -0.07 -0.20 0.00 -0.00 0.00 0.00 59.98 60.06 1hom h ARG 43 Cb 0.49 -0.22 0.00 0.00 -0.00 0.00 0.00 29.97 30.24 1hom h ARG 43 CO -0.36 0.67 -0.63 -0.56 -0.00 0.00 0.00 179.97 179.09 1hom h GLN 44 N 1.03 0.84 -0.81 0.08 -0.00 -1.48 -0.85 115.11 113.92 1hom h GLN 44 Ca 0.28 -0.59 0.03 0.00 -0.00 0.00 0.00 58.65 58.36 1hom h GLN 44 Cb -0.10 0.09 -0.05 0.00 -0.00 0.00 0.00 27.48 27.42 1hom h GLN 44 CO -0.06 1.22 0.52 0.82 -0.00 0.00 0.00 178.83 181.33 1hom h ILE 45 N 0.61 1.14 -0.25 1.86 2.04 -0.71 0.90 117.51 123.10 1hom h ILE 45 Ca -0.01 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 1hom h ILE 45 Cb 1.25 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 1hom h ILE 45 CO 0.14 0.19 0.13 0.50 0.00 0.00 0.00 178.15 179.11 1hom h LYS 46 N 1.03 0.35 -0.22 2.37 3.64 -0.05 0.20 116.57 123.88 1hom h LYS 46 Ca 0.32 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.70 1hom h LYS 46 Cb -0.02 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.69 1hom h LYS 46 CO -0.10 0.32 -0.08 0.82 -2.27 0.00 0.00 179.45 178.14 1hom h ILE 47 N 0.29 0.73 0.02 2.00 1.08 -0.49 0.31 117.51 121.45 1hom h ILE 47 Ca 0.09 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.56 1hom h ILE 47 Cb 0.07 0.73 0.00 0.00 -3.07 0.00 0.00 36.82 34.55 1hom h ILE 47 CO -0.01 0.00 -0.01 -0.25 -0.69 0.00 0.00 178.15 177.19 1hom h TRP 48 N -0.03 -0.02 -0.45 1.37 7.01 -0.55 0.72 115.95 124.00 1hom h TRP 48 Ca 0.11 -0.00 0.13 0.00 2.11 0.00 0.00 58.89 61.24 1hom h TRP 48 Cb 0.20 0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.25 1hom h TRP 48 CO -0.25 0.15 0.34 0.74 -2.79 0.00 0.00 178.44 176.63 1hom h PHE 49 N -0.19 0.00 0.34 2.65 -1.00 -0.52 0.11 116.94 118.33 1hom h PHE 49 Ca -0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1hom h PHE 49 Cb 0.18 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.74 1hom h PHE 49 CO -0.02 0.00 -0.16 0.37 -1.61 0.00 0.00 178.31 176.89 1hom h GLN 50 N 0.00 -0.43 -0.63 1.51 5.75 0.53 -3.21 115.11 118.63 1hom h GLN 50 Ca 0.22 0.03 0.04 0.00 -0.15 0.00 0.00 58.65 58.78 1hom h GLN 50 Cb 0.90 0.10 -0.04 0.00 1.07 0.00 0.00 27.48 29.50 1hom h GLN 50 CO -0.00 -0.26 0.38 -2.95 -2.65 0.00 0.00 178.83 173.35 1hom h ASN 51 N -1.11 0.60 -0.32 -0.69 7.08 -0.43 0.72 115.58 121.45 1hom h ASN 51 Ca -0.05 0.01 0.09 0.00 -3.08 0.00 0.00 56.30 53.28 1hom h ASN 51 Cb 0.38 -0.12 -0.01 0.00 -2.08 0.00 0.00 38.32 36.49 1hom h ASN 51 CO 0.08 0.41 0.51 -0.09 -2.08 0.00 0.00 177.43 176.25 1hom h ARG 52 N 0.73 0.00 0.00 4.14 1.12 -0.96 -1.25 114.38 118.16 1hom h ARG 52 Ca 0.26 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.13 1hom h ARG 52 Cb 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.03 1hom h ARG 52 CO -0.12 0.00 -1.69 0.54 -3.11 0.00 0.00 179.97 175.58 1hom n ARG 53 N -3.35 0.60 -1.77 0.20 1.74 0.19 -4.74 116.66 109.52 1hom n ARG 53 Ca 0.05 -0.14 -0.39 0.00 -0.77 0.00 0.00 57.85 56.60 1hom n ARG 53 Cb 0.64 -1.47 0.03 0.00 -1.02 0.00 0.00 32.46 30.65 1hom n ARG 53 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1hom s MET 54 N -3.27 3.34 0.00 5.56 -2.45 -0.47 -0.56 119.30 121.44 1hom s MET 54 Ca -0.04 2.32 0.00 0.00 -1.25 0.00 0.00 55.69 56.72 1hom s MET 54 Cb 0.13 -2.41 0.00 0.00 1.25 0.00 0.00 34.83 33.80 1hom s MET 54 CO 0.83 -1.06 0.00 1.17 1.05 0.00 0.00 175.02 177.01 1hom n LYS 55 N -0.71 -0.22 0.08 4.11 4.81 -1.26 -4.78 118.16 120.18 1hom n LYS 55 Ca 0.08 0.06 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1hom n LYS 55 Cb 0.44 -3.17 0.00 0.00 0.02 0.00 0.00 35.03 32.31 1hom n LYS 55 CO 0.00 0.00 0.00 1.87 1.17 0.00 0.00 177.40 180.44 1hom n TRP 56 N -2.50 -0.79 0.30 5.64 -0.00 0.05 -4.47 117.44 115.68 1hom n TRP 56 Ca 0.00 0.14 0.18 0.00 -0.00 0.00 0.00 57.50 57.82 1hom n TRP 56 Cb 0.06 0.18 0.81 0.00 -0.00 0.00 0.00 31.31 32.36 1hom n TRP 56 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 177.69 178.56 1hom h LYS 57 N 0.00 0.00 -2.05 5.87 1.79 -1.13 0.20 116.57 121.25 1hom h LYS 57 Ca 0.00 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.92 1hom h LYS 57 Cb 0.00 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 30.25 1hom h LYS 57 CO 0.00 0.00 -1.02 1.17 -1.08 0.00 0.00 179.45 178.52 1hom n LYS 58 N -3.00 1.22 0.00 3.15 3.00 -1.26 -4.73 118.16 116.54 1hom n LYS 58 Ca -0.00 -3.59 0.00 0.00 -0.00 0.00 0.00 58.31 54.72 1hom n LYS 58 Cb 0.23 -1.56 0.00 0.00 0.00 0.00 0.00 35.03 33.70 1hom n LYS 58 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1hom n GLU 59 N 0.93 0.00 0.03 1.64 1.02 -0.85 -4.09 120.64 119.33 1hom n GLU 59 Ca 0.24 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.50 1hom n GLU 59 Cb 0.53 -0.05 0.24 0.00 -0.02 0.00 0.00 31.44 32.14 1hom n GLU 59 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1hom n ASN 60 N -2.08 0.57 -3.51 1.62 4.05 0.66 -4.82 115.26 111.75 1hom n ASN 60 Ca 0.00 0.01 -0.16 0.00 0.45 0.00 0.00 54.58 54.88 1hom n ASN 60 Cb 0.00 0.14 -0.05 0.00 1.23 0.00 0.00 39.78 41.10 1hom n ASN 60 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 177.26 172.62 1hom s LYS 61 N -3.09 1.10 0.01 1.20 0.00 -1.25 -5.08 119.74 112.64 1hom s LYS 61 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 55.97 56.02 1hom s LYS 61 Cb 0.15 0.51 0.00 0.00 0.00 0.00 0.00 37.83 38.49 1hom s LYS 61 CO 0.70 -0.39 0.00 2.41 0.00 0.00 0.00 175.35 178.07 1hom n THR 62 N 0.49 -7.13 -1.45 3.79 -1.04 -1.26 -4.65 114.28 103.03 1hom n THR 62 Ca -0.18 1.42 -0.47 0.00 -2.04 0.00 0.00 64.05 62.78 1hom n THR 62 Cb 0.60 -4.36 -0.03 0.00 -1.82 0.00 0.00 70.33 64.73 1hom n THR 62 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1hom n LYS 63 N 0.82 0.36 -2.74 -2.82 4.81 -1.26 -4.82 118.16 112.50 1hom n LYS 63 Ca 0.00 0.13 -0.04 0.00 -0.87 0.00 0.00 58.31 57.53 1hom n LYS 63 Cb 0.00 -1.23 0.07 0.00 0.02 0.00 0.00 35.03 33.89 1hom n LYS 63 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1hom n GLY 64 N 1.80 1.71 3.64 3.14 0.00 -1.26 -5.11 105.19 109.11 1hom n GLY 64 Ca 0.16 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 1hom n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1hom s GLU 65 N -2.33 3.89 -0.05 1.61 2.56 -1.26 -4.90 118.70 118.23 1hom s GLU 65 Ca 0.23 2.35 -0.24 0.00 0.00 0.00 0.00 54.97 57.31 1hom s GLU 65 Cb 0.39 -4.18 -0.23 0.00 2.00 0.00 0.00 34.13 32.12 1hom s GLU 65 CO -0.04 -1.23 1.05 -1.00 -0.56 0.00 0.00 175.26 173.48 1hom h PRO 66 N 11.47 0.17 0.00 4.30 0.13 -2.05 -3.57 132.00 142.45 1hom h PRO 66 Ca -0.45 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 1hom h PRO 66 Cb 1.22 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1hom h PRO 66 CO 0.95 0.89 0.00 0.41 -0.23 0.00 0.00 178.00 180.02