#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hom s ARG 1 N 0.00 1.15 -0.10 2.12 1.81 -1.26 -5.13 118.95 117.55 1hom s ARG 1 Ca 0.00 -0.79 -0.21 0.00 -1.72 0.00 0.00 55.73 53.02 1hom s ARG 1 Cb 0.00 -1.19 -0.04 0.00 -0.45 0.00 0.00 34.95 33.27 1hom s ARG 1 CO 0.00 0.30 0.60 0.15 -0.68 0.00 0.00 175.30 175.67 1hom s LYS 2 N -1.01 4.38 0.94 3.54 -0.14 -1.26 -5.10 119.74 121.10 1hom s LYS 2 Ca 0.04 0.68 -0.16 0.00 -1.36 0.00 0.00 55.97 55.17 1hom s LYS 2 Cb -0.08 -3.45 0.22 0.00 -1.68 0.00 0.00 37.83 32.84 1hom s LYS 2 CO 0.01 0.09 1.18 2.89 -0.76 0.00 0.00 175.35 178.77 1hom n ARG 3 N 3.79 -1.50 0.00 1.68 0.00 -1.26 -4.46 116.66 114.91 1hom n ARG 3 Ca -0.04 -1.84 0.00 0.00 -0.00 0.00 0.00 57.85 55.97 1hom n ARG 3 Cb 0.51 -1.30 0.00 0.00 -0.00 0.00 0.00 32.46 31.67 1hom n ARG 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1hom n GLY 4 N -3.19 1.63 3.57 2.89 0.00 -1.26 -4.83 105.19 103.99 1hom n GLY 4 Ca 0.15 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1hom n GLY 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hom s ARG 5 N 0.00 2.82 0.02 1.61 0.52 -1.26 -4.90 118.95 117.76 1hom s ARG 5 Ca 0.00 0.91 -0.05 0.00 -0.52 0.00 0.00 55.73 56.07 1hom s ARG 5 Cb 0.00 -4.34 -0.01 0.00 0.52 0.00 0.00 34.95 31.12 1hom s ARG 5 CO 0.00 -2.49 1.08 -0.56 0.02 0.00 0.00 175.30 173.35 1hom h GLN 6 N 14.55 -0.04 -6.86 3.54 3.07 -1.90 -3.46 115.11 124.01 1hom h GLN 6 Ca -0.28 0.00 -0.57 0.00 0.09 0.00 0.00 58.65 57.89 1hom h GLN 6 Cb 1.17 0.01 -0.15 0.00 0.08 0.00 0.00 27.48 28.59 1hom h GLN 6 CO 1.16 -0.03 -0.93 -2.37 0.09 0.00 0.00 178.83 176.74 1hom n THR 7 N -3.14 -1.78 -3.89 1.86 5.66 -1.26 -4.98 114.28 106.76 1hom n THR 7 Ca -0.00 -0.48 -0.31 0.00 -3.05 0.00 0.00 64.05 60.21 1hom n THR 7 Cb 0.05 -1.64 -0.04 0.00 -1.55 0.00 0.00 70.33 67.14 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 -4.18 3.51 0.52 1.09 2.02 -1.26 -5.10 117.35 113.96 1hom s TYR 8 Ca 0.03 0.29 -0.19 0.00 -0.37 0.00 0.00 57.07 56.83 1hom s TYR 8 Cb -0.02 -1.79 -0.07 0.00 -0.40 0.00 0.00 41.96 39.68 1hom s TYR 8 CO 0.96 0.57 1.06 0.95 -1.57 0.00 0.00 175.55 177.52 1hom s THR 9 N -1.53 3.65 0.26 -0.71 -4.23 -1.26 -4.89 115.64 106.93 1hom s THR 9 Ca 0.36 0.97 -0.01 0.00 -1.18 0.00 0.00 61.69 61.82 1hom s THR 9 Cb -0.13 -3.39 0.24 0.00 1.34 0.00 0.00 72.50 70.56 1hom s THR 9 CO 0.28 -0.28 1.77 -0.09 -0.54 0.00 0.00 174.62 175.75 1hom h ARG 10 N 1.21 0.63 0.34 3.99 9.65 -1.99 -0.65 114.38 127.57 1hom h ARG 10 Ca -0.49 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.34 1hom h ARG 10 Cb 1.23 -0.14 -0.00 0.00 -1.39 0.00 0.00 29.97 29.66 1hom h ARG 10 CO 0.58 0.42 -0.21 -0.92 2.80 0.00 0.00 179.97 182.64 1hom h TYR 11 N 0.65 -0.54 -0.26 2.20 3.20 -1.97 0.35 116.97 120.60 1hom h TYR 11 Ca 0.45 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.38 1hom h TYR 11 Cb 0.61 0.19 -0.06 0.00 1.54 0.00 0.00 36.73 39.01 1hom h TYR 11 CO -0.09 -0.32 -0.14 0.37 -1.64 0.00 0.00 178.16 176.34 1hom h GLN 12 N -0.52 -0.10 -0.45 1.82 4.15 -1.76 0.20 115.11 118.45 1hom h GLN 12 Ca -0.04 0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.33 1hom h GLN 12 Cb 0.43 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.12 1hom h GLN 12 CO 0.04 -0.07 0.02 1.15 -1.93 0.00 0.00 178.83 178.04 1hom h THR 13 N -0.11 1.23 -0.53 2.39 2.02 -1.06 -1.44 112.91 115.41 1hom h THR 13 Ca 0.14 -0.92 0.06 0.00 0.77 0.00 0.00 66.41 66.46 1hom h THR 13 Cb 0.32 0.87 -0.05 0.00 -1.74 0.00 0.00 68.15 67.54 1hom h THR 13 CO -0.33 0.32 0.24 0.25 0.37 0.00 0.00 175.52 176.37 1hom h LEU 14 N 0.68 0.31 -0.50 2.58 7.12 0.17 0.27 115.31 125.94 1hom h LEU 14 Ca 0.14 0.04 -0.15 0.00 0.13 0.00 0.00 57.88 58.05 1hom h LEU 14 Cb 0.40 -0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.51 1hom h LEU 14 CO 0.01 0.21 -0.35 -0.08 -0.13 0.00 0.00 178.44 178.10 1hom h GLU 15 N 0.46 0.84 -0.95 1.25 4.81 -0.26 0.16 114.58 120.89 1hom h GLU 15 Ca 0.24 -0.42 0.08 0.00 -0.13 0.00 0.00 59.36 59.14 1hom h GLU 15 Cb 0.21 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.52 1hom h GLU 15 CO -0.20 1.06 0.60 -0.07 -0.73 0.00 0.00 179.01 179.67 1hom h LEU 16 N 0.70 0.93 -0.31 1.64 4.07 -0.86 0.12 115.31 121.60 1hom h LEU 16 Ca 0.07 0.03 -0.12 0.00 0.08 0.00 0.00 57.88 57.93 1hom h LEU 16 Cb 0.92 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.48 1hom h LEU 16 CO 0.08 0.56 -0.26 -0.33 -1.08 0.00 0.00 178.44 177.42 1hom h GLU 17 N 1.04 0.73 -0.68 1.13 5.08 0.48 0.32 114.58 122.69 1hom h GLU 17 Ca 0.43 -0.37 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 1hom h GLU 17 Cb 0.27 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1hom h GLU 17 CO -0.21 0.98 0.21 0.87 -1.00 0.00 0.00 179.01 179.86 1hom h LYS 18 N 0.49 1.05 0.14 2.33 1.57 -0.50 0.27 116.57 121.92 1hom h LYS 18 Ca 0.06 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1hom h LYS 18 Cb 0.82 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1hom h LYS 18 CO 0.07 0.92 -0.07 1.49 -0.57 0.00 0.00 179.45 181.29 1hom h GLU 19 N 0.99 -0.19 -0.50 3.15 4.57 -0.68 -2.04 114.58 119.89 1hom h GLU 19 Ca 0.22 0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.46 1hom h GLU 19 Cb 0.31 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.89 1hom h GLU 19 CO -0.01 0.04 0.24 0.35 -1.18 0.00 0.00 179.01 178.46 1hom h PHE 20 N -0.39 0.44 -0.63 0.92 3.04 -0.30 0.10 116.94 120.12 1hom h PHE 20 Ca -0.02 0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.00 1hom h PHE 20 Cb 0.31 -0.13 -0.05 0.00 2.56 0.00 0.00 35.95 38.65 1hom h PHE 20 CO -0.01 0.21 0.36 1.25 -2.02 0.00 0.00 178.31 178.10 1hom h HIS 21 N 0.47 0.67 -0.29 0.41 2.76 -0.85 -2.16 115.15 116.16 1hom h HIS 21 Ca 0.22 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.35 1hom h HIS 21 Cb 0.14 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.89 1hom h HIS 21 CO -0.11 0.34 -0.07 0.74 -1.30 0.00 0.00 177.93 177.53 1hom h PHE 22 N 0.68 0.63 -2.54 5.26 0.04 -0.94 -3.43 116.94 116.64 1hom h PHE 22 Ca 0.27 -0.13 -0.45 0.00 2.80 0.00 0.00 57.97 60.46 1hom h PHE 22 Cb 0.13 -0.15 -0.37 0.00 2.20 0.00 0.00 35.95 37.75 1hom h PHE 22 CO -0.07 0.75 -0.72 0.54 -0.60 0.00 0.00 178.31 178.21 1hom s ASN 23 N -6.16 2.79 0.00 2.17 2.20 0.31 -5.01 114.94 111.24 1hom s ASN 23 Ca -0.13 -1.07 0.23 0.00 -0.94 0.00 0.00 52.86 50.95 1hom s ASN 23 Cb 0.08 -0.01 1.37 0.00 -2.00 0.00 0.00 41.25 40.70 1hom s ASN 23 CO 0.78 -0.42 1.88 -1.14 -2.94 0.00 0.00 177.10 175.25 1hom n ARG 24 N 5.27 0.98 -4.46 3.55 0.63 -1.00 -4.19 116.66 117.45 1hom n ARG 24 Ca -0.04 0.00 -0.20 0.00 -0.92 0.00 0.00 57.85 56.69 1hom n ARG 24 Cb 0.44 -1.37 -0.15 0.00 0.45 0.00 0.00 32.46 31.84 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 -2.00 1.00 -0.04 -0.14 1.51 -1.26 -4.98 117.35 111.43 1hom s TYR 25 Ca 0.35 -0.20 0.00 0.00 -1.01 0.00 0.00 57.07 56.20 1hom s TYR 25 Cb 0.16 -0.64 -0.03 0.00 -0.11 0.00 0.00 41.96 41.34 1hom s TYR 25 CO 0.27 -0.01 -0.01 -0.51 -1.11 0.00 0.00 175.55 174.18 1hom s LEU 26 N -0.35 3.50 0.54 -1.29 1.43 -1.26 -5.10 118.68 116.14 1hom s LEU 26 Ca 0.04 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 1hom s LEU 26 Cb -0.05 -1.90 0.02 0.00 0.03 0.00 0.00 46.19 44.30 1hom s LEU 26 CO -0.00 0.33 0.77 0.42 0.23 0.00 0.00 176.35 178.09 1hom s THR 27 N -0.98 3.02 0.11 5.49 -4.23 -1.26 -4.89 115.64 112.90 1hom s THR 27 Ca 0.16 -0.57 -0.31 0.00 -1.18 0.00 0.00 61.69 59.79 1hom s THR 27 Cb -0.11 -3.14 -0.10 0.00 1.34 0.00 0.00 72.50 70.48 1hom s THR 27 CO 0.06 -0.10 1.59 -0.09 -0.54 0.00 0.00 174.62 175.53 1hom h ARG 28 N 0.10 -0.63 0.20 3.99 1.12 -2.00 -0.04 114.38 117.11 1hom h ARG 28 Ca -0.43 0.04 0.01 0.00 -1.11 0.00 0.00 59.98 58.49 1hom h ARG 28 Cb 1.29 0.14 -0.03 0.00 -0.01 0.00 0.00 29.97 31.36 1hom h ARG 28 CO 0.54 -0.42 -0.26 -0.09 -3.11 0.00 0.00 179.97 176.63 1hom h ARG 29 N -0.65 -0.50 -0.90 0.20 9.65 -2.00 -1.51 114.38 118.67 1hom h ARG 29 Ca 0.02 0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.92 1hom h ARG 29 Cb 0.68 0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 29.33 1hom h ARG 29 CO -0.25 -0.33 0.52 -0.09 2.80 0.00 0.00 179.97 182.62 1hom h ARG 30 N -0.52 1.24 -0.83 0.20 2.43 -1.92 0.72 114.38 115.70 1hom h ARG 30 Ca 0.01 -0.13 0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1hom h ARG 30 Cb 0.51 -0.25 -0.06 0.00 -0.42 0.00 0.00 29.97 29.75 1hom h ARG 30 CO -0.10 0.88 0.51 0.00 -1.51 0.00 0.00 179.97 179.75 1hom h ARG 31 N 1.25 0.91 -0.11 0.20 3.08 -0.75 0.24 114.38 119.20 1hom h ARG 31 Ca 0.32 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.32 1hom h ARG 31 Cb -0.01 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.82 1hom h ARG 31 CO -0.06 0.60 0.04 0.82 -1.07 0.00 0.00 179.97 180.31 1hom h ILE 32 N 0.94 0.98 -0.92 2.04 1.08 0.16 0.21 117.51 121.99 1hom h ILE 32 Ca 0.36 -0.03 0.08 0.00 -0.39 0.00 0.00 64.86 64.88 1hom h ILE 32 Cb 0.16 0.87 -0.07 0.00 -3.07 0.00 0.00 36.82 34.71 1hom h ILE 32 CO -0.17 0.02 0.57 -0.33 -0.69 0.00 0.00 178.15 177.55 1hom h GLU 33 N 0.10 0.95 -0.07 2.37 4.39 -0.78 -1.88 114.58 119.66 1hom h GLU 33 Ca 0.05 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.62 1hom h GLU 33 Cb 0.02 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.46 1hom h GLU 33 CO -0.05 0.63 -0.24 0.82 -1.16 0.00 0.00 179.01 179.01 1hom h ILE 34 N 0.98 1.43 -0.32 3.13 1.08 0.24 0.99 117.51 125.05 1hom h ILE 34 Ca 0.42 -1.64 0.07 0.00 -0.39 0.00 0.00 64.86 63.32 1hom h ILE 34 Cb 0.29 2.31 -0.07 0.00 -3.07 0.00 0.00 36.82 36.29 1hom h ILE 34 CO -0.21 0.46 -0.11 0.00 -0.69 0.00 0.00 178.15 177.60 1hom h ALA 35 N 0.44 0.17 0.56 1.87 0.00 -0.55 -0.90 119.26 120.85 1hom h ALA 35 Ca -0.01 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1hom h ALA 35 Cb 0.88 0.30 0.01 0.00 0.00 0.00 0.00 17.79 18.97 1hom h ALA 35 CO 0.05 -0.49 -0.27 0.45 0.00 0.00 0.00 179.25 178.99 1hom h HIS 36 N -0.04 -0.70 -0.41 0.00 3.86 -1.19 0.14 115.15 116.80 1hom h HIS 36 Ca 0.16 -0.02 0.06 0.00 -1.16 0.00 0.00 60.37 59.41 1hom h HIS 36 Cb 0.29 0.23 -0.09 0.00 1.06 0.00 0.00 27.41 28.90 1hom h HIS 36 CO -0.33 -0.40 -0.50 0.00 0.86 0.00 0.00 177.93 177.56 1hom h ALA 37 N -0.47 -0.62 -0.29 2.45 0.00 -0.39 -0.44 119.26 119.50 1hom h ALA 37 Ca -0.08 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1hom h ALA 37 Cb 0.62 1.03 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1hom h ALA 37 CO 0.13 -0.97 0.00 1.28 0.00 0.00 0.00 179.25 179.69 1hom n LEU 38 N -5.40 1.92 -4.24 0.00 7.99 -0.38 -4.92 117.00 111.98 1hom n LEU 38 Ca -0.02 -0.90 -0.36 0.00 -0.01 0.00 0.00 56.01 54.72 1hom n LEU 38 Cb 0.35 -0.19 -0.03 0.00 -0.11 0.00 0.00 43.42 43.43 1hom n LEU 38 CO 0.02 0.45 -0.07 0.00 -1.51 0.00 0.00 177.39 176.28 1hom s LEU 40 N -7.25 3.31 0.14 0.00 1.02 0.30 -4.99 118.68 111.22 1hom s LEU 40 Ca 0.66 -0.70 0.09 0.00 0.02 0.00 0.00 54.13 54.20 1hom s LEU 40 Cb -0.36 -2.02 -0.04 0.00 0.02 0.00 0.00 46.19 43.79 1hom s LEU 40 CO 0.94 -1.10 -0.14 0.42 0.02 0.00 0.00 176.35 176.49 1hom s THR 41 N -2.55 3.04 0.37 5.49 -4.23 -1.26 -4.38 115.64 112.13 1hom s THR 41 Ca 0.58 -1.55 0.07 0.00 -1.18 0.00 0.00 61.69 59.62 1hom s THR 41 Cb -0.07 -2.45 0.30 0.00 1.34 0.00 0.00 72.50 71.63 1hom s THR 41 CO 0.36 0.01 1.94 1.05 -0.54 0.00 0.00 174.62 177.45 1hom h GLU 42 N 3.38 0.68 0.21 3.99 9.09 -1.96 0.50 114.58 130.48 1hom h GLU 42 Ca -0.48 -0.04 -0.01 0.00 0.05 0.00 0.00 59.36 58.88 1hom h GLU 42 Cb 1.18 -0.15 0.00 0.00 -1.65 0.00 0.00 28.75 28.13 1hom h GLU 42 CO 0.50 0.45 -0.10 -0.09 0.05 0.00 0.00 179.01 179.82 1hom h ARG 43 N 0.70 -0.27 0.00 1.06 1.12 -1.99 0.19 114.38 115.19 1hom h ARG 43 Ca 0.33 0.02 -0.12 0.00 -1.11 0.00 0.00 59.98 59.10 1hom h ARG 43 Cb 0.38 0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 30.39 1hom h ARG 43 CO -0.12 -0.17 -0.59 -0.56 -3.11 0.00 0.00 179.97 175.42 1hom h GLN 44 N -0.29 0.00 -0.34 0.20 3.07 -1.60 -1.50 115.11 114.66 1hom h GLN 44 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.69 1hom h GLN 44 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.77 1hom h GLN 44 CO 0.05 0.59 0.12 0.82 0.09 0.00 0.00 178.83 180.50 1hom h ILE 45 N 0.00 1.19 -0.35 1.86 1.08 -0.81 0.43 117.51 120.92 1hom h ILE 45 Ca -0.01 -0.61 0.07 0.00 -0.39 0.00 0.00 64.86 63.92 1hom h ILE 45 Cb 1.09 0.97 -0.07 0.00 -3.07 0.00 0.00 36.82 35.74 1hom h ILE 45 CO 0.08 0.21 -0.11 0.50 -0.69 0.00 0.00 178.15 178.14 1hom h LYS 46 N 0.39 -0.04 0.08 2.37 3.64 -0.20 0.20 116.57 123.01 1hom h LYS 46 Ca 0.11 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1hom h LYS 46 Cb 0.21 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1hom h LYS 46 CO -0.01 -0.02 -0.14 0.82 -2.27 0.00 0.00 179.45 177.83 1hom h ILE 47 N -0.04 0.67 -0.46 2.00 5.03 -0.81 0.28 117.51 124.19 1hom h ILE 47 Ca 0.17 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.89 1hom h ILE 47 Cb 0.30 0.67 -0.02 0.00 -3.03 0.00 0.00 36.82 34.74 1hom h ILE 47 CO -0.38 0.00 0.21 -0.25 -0.68 0.00 0.00 178.15 177.05 1hom h TRP 48 N -0.27 0.67 -0.44 1.37 7.01 -0.48 0.96 115.95 124.76 1hom h TRP 48 Ca 0.02 -0.04 -0.03 0.00 2.11 0.00 0.00 58.89 60.95 1hom h TRP 48 Cb 0.29 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.13 1hom h TRP 48 CO -0.16 0.55 0.14 0.74 -2.79 0.00 0.00 178.44 176.93 1hom h PHE 49 N 0.60 0.71 -0.33 2.65 -1.00 -0.51 0.19 116.94 119.25 1hom h PHE 49 Ca 0.16 -0.07 0.05 0.00 2.81 0.00 0.00 57.97 60.91 1hom h PHE 49 Cb 0.15 -0.21 -0.04 0.00 3.61 0.00 0.00 35.95 39.45 1hom h PHE 49 CO -0.00 0.64 0.06 0.37 -1.61 0.00 0.00 178.31 177.77 1hom h GLN 50 N 0.58 0.17 -0.37 1.51 -0.00 -0.22 -0.10 115.11 116.69 1hom h GLN 50 Ca 0.14 -0.01 0.03 0.00 -0.00 0.00 0.00 58.65 58.81 1hom h GLN 50 Cb 0.26 -0.04 -0.03 0.00 0.00 0.00 0.00 27.48 27.67 1hom h GLN 50 CO -0.01 0.11 0.18 -0.91 0.00 0.00 0.00 178.83 178.21 1hom h ASN 51 N 0.18 0.27 0.15 -0.69 2.35 -0.51 -0.53 115.58 116.80 1hom h ASN 51 Ca 0.15 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 1hom h ASN 51 Cb 0.17 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1hom h ASN 51 CO -0.21 0.20 -0.19 0.03 -1.65 0.00 0.00 177.43 175.61 1hom h ARG 52 N 0.38 0.10 0.00 0.81 3.08 0.59 -2.87 114.38 116.46 1hom h ARG 52 Ca 0.15 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.11 1hom h ARG 52 Cb 0.06 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1hom h ARG 52 CO -0.11 0.29 -1.49 2.89 -1.07 0.00 0.00 179.97 180.48 1hom n ARG 53 N -4.27 0.63 -1.69 0.04 -4.01 -0.17 -4.58 116.66 102.61 1hom n ARG 53 Ca -0.02 0.05 -0.41 0.00 -1.04 0.00 0.00 57.85 56.43 1hom n ARG 53 Cb 0.28 -1.71 0.01 0.00 -3.04 0.00 0.00 32.46 28.00 1hom n ARG 53 CO 0.00 0.00 0.00 -0.12 -3.04 0.00 0.00 177.63 174.47 1hom n MET 54 N -2.62 1.90 -0.60 2.89 0.00 -0.22 -0.47 117.12 118.00 1hom n MET 54 Ca -0.06 0.67 0.00 0.00 -0.00 0.00 0.00 57.70 58.31 1hom n MET 54 Cb 0.67 -2.34 0.00 0.00 0.00 0.00 0.00 33.22 31.55 1hom n MET 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1hom n LYS 55 N 0.11 0.00 0.00 2.12 4.81 -1.26 -4.75 118.16 119.19 1hom n LYS 55 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 1hom n LYS 55 Cb 0.39 -2.78 0.00 0.00 0.02 0.00 0.00 35.03 32.66 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 -2.00 0.00 1.03 5.64 -0.00 -0.31 -4.41 117.44 117.39 1hom n TRP 56 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1hom n TRP 56 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 1hom n TRP 56 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1hom n LYS 57 N -2.05 0.78 -0.10 5.87 5.02 0.37 -0.46 118.16 127.60 1hom n LYS 57 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1hom n LYS 57 Cb 0.00 -1.26 0.01 0.00 -0.02 0.00 0.00 35.03 33.75 1hom n LYS 57 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1hom n LYS 58 N -0.08 0.46 0.00 1.97 4.76 -1.26 -4.92 118.16 119.09 1hom n LYS 58 Ca 0.00 -0.82 0.00 0.00 -2.87 0.00 0.00 58.31 54.62 1hom n LYS 58 Cb 0.13 -0.61 0.00 0.00 -1.84 0.00 0.00 35.03 32.71 1hom n LYS 58 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1hom n GLU 59 N -0.13 2.51 -0.31 1.97 1.02 -0.47 -4.85 120.64 120.38 1hom n GLU 59 Ca 0.01 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.29 1hom n GLU 59 Cb 0.51 -0.31 0.31 0.00 -0.02 0.00 0.00 31.44 31.93 1hom n GLU 59 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 1hom h ASN 60 N 0.00 -0.12 0.00 1.62 -0.00 -0.97 -3.36 115.58 112.75 1hom h ASN 60 Ca 0.00 0.22 0.00 0.00 -0.00 0.00 0.00 56.30 56.52 1hom h ASN 60 Cb 0.00 0.33 0.00 0.00 -0.00 0.00 0.00 38.32 38.65 1hom h ASN 60 CO 0.00 -0.23 0.00 2.29 -0.00 0.00 0.00 177.43 179.49 1hom n LYS 61 N -5.30 0.00 -2.94 6.67 2.85 -1.26 -5.11 118.16 113.07 1hom n LYS 61 Ca 0.23 0.00 -0.12 0.00 -1.05 0.00 0.00 58.31 57.37 1hom n LYS 61 Cb 0.75 0.00 0.01 0.00 -0.65 0.00 0.00 35.03 35.14 1hom n LYS 61 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1hom n THR 62 N -0.65 -2.27 -1.71 0.58 -2.24 -1.26 -4.84 114.28 101.88 1hom n THR 62 Ca 0.00 0.30 -0.62 0.00 -2.27 0.00 0.00 64.05 61.46 1hom n THR 62 Cb 0.00 -2.74 -0.08 0.00 -2.10 0.00 0.00 70.33 65.41 1hom n THR 62 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1hom n LYS 63 N 0.72 0.59 0.00 -0.78 4.81 -1.26 -4.90 118.16 117.33 1hom n LYS 63 Ca -0.03 0.22 0.00 0.00 -0.87 0.00 0.00 58.31 57.63 1hom n LYS 63 Cb 0.49 -1.81 0.00 0.00 0.02 0.00 0.00 35.03 33.73 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 3.88 -2.49 3.71 3.14 0.00 -1.26 -4.66 105.19 107.51 1hom n GLY 64 Ca 0.28 0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.92 1hom n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hom s GLU 65 N -2.90 4.42 -0.18 1.61 0.41 -1.26 -5.01 118.70 115.80 1hom s GLU 65 Ca 0.00 0.85 -0.29 0.00 -0.41 0.00 0.00 54.97 55.12 1hom s GLU 65 Cb 0.00 -3.45 -0.03 0.00 -1.78 0.00 0.00 34.13 28.87 1hom s GLU 65 CO 0.00 0.05 1.60 -1.25 -0.49 0.00 0.00 175.26 175.18 1hom s PRO 66 N 0.85 3.89 0.00 0.39 0.04 -1.26 -5.24 135.00 133.67 1hom s PRO 66 Ca 0.37 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.17 1hom s PRO 66 Cb -0.17 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.35 1hom s PRO 66 CO 0.17 -1.18 0.00 0.41 0.04 0.00 0.00 177.00 176.45