#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 1.45 -0.37 0.03 6.06 -1.26 -4.89 118.95 119.96 1hom s ARG 1 Ca 0.00 0.22 -0.28 0.00 -2.50 0.00 0.00 55.73 53.18 1hom s ARG 1 Cb 0.00 -4.84 -0.04 0.00 0.06 0.00 0.00 34.95 30.13 1hom s ARG 1 CO 0.00 -4.80 2.05 0.21 -2.50 0.00 0.00 175.30 170.26 1hom s LYS 2 N 8.80 2.92 0.07 5.12 2.47 -1.26 -4.43 119.74 133.43 1hom s LYS 2 Ca 0.89 1.47 0.00 0.00 -1.56 0.00 0.00 55.97 56.77 1hom s LYS 2 Cb -0.11 -4.35 0.00 0.00 -1.46 0.00 0.00 37.83 31.91 1hom s LYS 2 CO 0.11 -2.34 0.00 -2.13 0.16 0.00 0.00 175.35 171.15 1hom n ARG 3 N 8.76 -1.10 0.00 4.03 0.63 -1.26 -5.11 116.66 122.61 1hom n ARG 3 Ca 0.27 0.94 0.00 0.00 -0.92 0.00 0.00 57.85 58.14 1hom n ARG 3 Cb 0.49 -0.86 0.00 0.00 0.45 0.00 0.00 32.46 32.53 1hom n ARG 3 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1hom n GLY 4 N -0.03 -1.80 3.58 5.14 0.00 -1.26 -5.16 105.19 105.66 1hom n GLY 4 Ca 0.00 0.66 -0.29 0.00 0.00 0.00 0.00 46.02 46.39 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 -0.74 0.00 1.61 1.81 -1.26 -5.06 118.95 115.32 1hom s ARG 5 Ca 0.00 0.28 0.00 0.00 -1.72 0.00 0.00 55.73 54.29 1hom s ARG 5 Cb 0.00 -1.62 0.00 0.00 -0.45 0.00 0.00 34.95 32.88 1hom s ARG 5 CO 0.00 -3.46 0.00 1.04 -0.68 0.00 0.00 175.30 172.20 1hom n GLN 6 N -4.65 0.00 0.00 3.54 3.00 -1.26 -4.99 117.38 113.02 1hom n GLN 6 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 1hom n GLN 6 Cb 0.58 -0.13 0.00 0.00 0.00 0.00 0.00 30.24 30.69 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 0.00 0.00 -3.88 5.09 5.66 -1.26 -4.98 114.28 114.91 1hom n THR 7 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 1hom n THR 7 Cb 0.00 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.71 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 0.23 0.41 1.09 2.02 -1.26 -5.15 117.35 114.69 1hom s TYR 8 Ca 0.00 -0.61 -0.10 0.00 -0.37 0.00 0.00 57.07 55.98 1hom s TYR 8 Cb 0.00 -0.01 -0.06 0.00 -0.40 0.00 0.00 41.96 41.49 1hom s TYR 8 CO 0.00 -0.66 0.77 0.95 -1.57 0.00 0.00 175.55 175.04 1hom s THR 9 N -3.91 4.79 0.21 -0.71 -4.23 -1.26 -4.98 115.64 105.55 1hom s THR 9 Ca 0.11 0.59 -0.11 0.00 -1.18 0.00 0.00 61.69 61.11 1hom s THR 9 Cb 0.04 -3.74 0.16 0.00 1.34 0.00 0.00 72.50 70.29 1hom s THR 9 CO -0.05 -0.55 1.70 -0.09 -0.54 0.00 0.00 174.62 175.09 1hom h ARG 10 N 1.17 0.23 -0.84 3.99 1.12 -2.02 -1.47 114.38 116.55 1hom h ARG 10 Ca -0.47 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 58.38 1hom h ARG 10 Cb 1.19 -0.05 -0.04 0.00 -0.01 0.00 0.00 29.97 31.06 1hom h ARG 10 CO 0.64 0.15 0.50 -0.92 -3.11 0.00 0.00 179.97 177.23 1hom h TYR 11 N 0.23 1.12 -0.24 2.20 3.20 -1.98 0.04 116.97 121.54 1hom h TYR 11 Ca 0.30 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.23 1hom h TYR 11 Cb 0.45 -0.37 -0.07 0.00 1.54 0.00 0.00 36.73 38.28 1hom h TYR 11 CO -0.26 0.75 -0.31 0.37 -1.64 0.00 0.00 178.16 177.06 1hom h GLN 12 N 1.16 -0.32 0.00 1.82 5.75 -1.67 -0.35 115.11 121.51 1hom h GLN 12 Ca 0.30 0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.82 1hom h GLN 12 Cb -0.04 0.07 -0.00 0.00 1.07 0.00 0.00 27.48 28.58 1hom h GLN 12 CO -0.06 -0.21 -0.03 1.15 -2.65 0.00 0.00 178.83 177.03 1hom h THR 13 N -0.33 0.08 0.59 2.39 2.02 -0.78 -0.52 112.91 116.37 1hom h THR 13 Ca 0.13 -0.70 -0.03 0.00 0.77 0.00 0.00 66.41 66.58 1hom h THR 13 Cb 0.53 1.64 0.01 0.00 -1.74 0.00 0.00 68.15 68.59 1hom h THR 13 CO -0.42 0.03 -0.28 -0.07 0.37 0.00 0.00 175.52 175.15 1hom h LEU 14 N 0.00 -0.67 -0.89 2.58 3.38 0.55 0.36 115.31 120.61 1hom h LEU 14 Ca -0.00 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1hom h LEU 14 Cb 0.64 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1hom h LEU 14 CO 0.00 -0.36 -0.13 -0.08 0.09 0.00 0.00 178.44 177.96 1hom h GLU 15 N -0.96 0.67 -0.02 1.13 4.57 -0.63 0.20 114.58 119.53 1hom h GLU 15 Ca -0.08 -0.22 0.03 0.00 -1.18 0.00 0.00 59.36 57.91 1hom h GLU 15 Cb 0.66 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 29.14 1hom h GLU 15 CO 0.13 0.78 -0.28 -0.07 -1.18 0.00 0.00 179.01 178.40 1hom h LEU 16 N 0.61 -0.83 -0.05 1.64 4.07 -1.19 0.09 115.31 119.64 1hom h LEU 16 Ca 0.10 0.11 -0.02 0.00 0.08 0.00 0.00 57.88 58.16 1hom h LEU 16 Cb 0.58 0.34 -0.00 0.00 1.08 0.00 0.00 40.66 42.66 1hom h LEU 16 CO 0.04 -0.34 -0.04 -0.33 -1.08 0.00 0.00 178.44 176.69 1hom h GLU 17 N -0.41 0.12 -0.52 1.13 5.08 0.56 -0.97 114.58 119.56 1hom h GLU 17 Ca 0.07 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1hom h GLU 17 Cb 0.51 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1hom h GLU 17 CO -0.25 0.53 0.14 1.57 -1.00 0.00 0.00 179.01 179.99 1hom h LYS 18 N -0.29 0.79 -0.30 2.33 5.09 -0.69 -2.54 116.57 120.95 1hom h LYS 18 Ca 0.01 -0.15 -0.07 0.00 0.09 0.00 0.00 60.65 60.53 1hom h LYS 18 Cb 0.50 -0.12 -0.01 0.00 0.10 0.00 0.00 32.23 32.69 1hom h LYS 18 CO 0.01 0.70 -0.07 1.49 -2.09 0.00 0.00 179.45 179.49 1hom h GLU 19 N 0.76 0.58 -0.78 0.07 4.57 -0.94 -2.80 114.58 116.04 1hom h GLU 19 Ca 0.17 -0.22 0.17 0.00 -1.18 0.00 0.00 59.36 58.30 1hom h GLU 19 Cb 0.26 -0.03 -0.11 0.00 -0.16 0.00 0.00 28.75 28.71 1hom h GLU 19 CO -0.00 0.77 0.26 0.35 -1.18 0.00 0.00 179.01 179.21 1hom h PHE 20 N 0.35 0.43 -0.05 0.92 3.04 -0.75 0.33 116.94 121.20 1hom h PHE 20 Ca 0.08 0.04 -0.06 0.00 3.98 0.00 0.00 57.97 62.01 1hom h PHE 20 Cb 0.56 -0.07 -0.01 0.00 2.56 0.00 0.00 35.95 38.99 1hom h PHE 20 CO 0.05 -0.04 -0.25 0.45 -2.02 0.00 0.00 178.31 176.50 1hom h HIS 21 N 0.35 0.08 -0.13 0.41 3.86 -1.40 -2.84 115.15 115.48 1hom h HIS 21 Ca 0.45 -0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.49 1hom h HIS 21 Cb 0.77 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 29.23 1hom h HIS 21 CO -0.21 0.32 -0.52 0.74 0.86 0.00 0.00 177.93 179.12 1hom h PHE 22 N 0.07 0.78 -2.84 2.45 -1.00 -0.27 -3.46 116.94 112.69 1hom h PHE 22 Ca 0.01 -0.33 -0.18 0.00 2.81 0.00 0.00 57.97 60.28 1hom h PHE 22 Cb 0.48 -0.13 -0.30 0.00 3.61 0.00 0.00 35.95 39.62 1hom h PHE 22 CO 0.00 1.11 -0.46 0.54 -1.61 0.00 0.00 178.31 177.90 1hom s ASN 23 N -6.73 -0.06 -0.10 2.17 4.22 0.66 -5.04 114.94 110.06 1hom s ASN 23 Ca -0.12 0.67 0.09 0.00 -2.14 0.00 0.00 52.86 51.35 1hom s ASN 23 Cb 0.06 0.70 0.42 0.00 1.28 0.00 0.00 41.25 43.71 1hom s ASN 23 CO 0.84 -0.21 1.20 -1.14 -2.04 0.00 0.00 177.10 175.76 1hom n ARG 24 N 4.82 2.82 -3.73 3.55 0.63 -1.23 -4.23 116.66 119.28 1hom n ARG 24 Ca -0.15 -1.64 -0.12 0.00 -0.92 0.00 0.00 57.85 55.02 1hom n ARG 24 Cb 0.52 -1.77 -0.12 0.00 0.45 0.00 0.00 32.46 31.54 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 -1.83 -0.36 0.28 -0.14 2.02 -1.26 -5.13 117.35 110.94 1hom s TYR 25 Ca 0.29 0.83 0.01 0.00 -0.37 0.00 0.00 57.07 57.83 1hom s TYR 25 Cb 0.20 0.08 -0.04 0.00 -0.40 0.00 0.00 41.96 41.81 1hom s TYR 25 CO 0.11 -0.23 0.47 -0.51 -1.57 0.00 0.00 175.55 173.82 1hom s LEU 26 N 1.07 4.14 0.08 -1.29 1.43 -1.26 -5.06 118.68 117.78 1hom s LEU 26 Ca -0.08 0.37 0.02 0.00 -1.03 0.00 0.00 54.13 53.41 1hom s LEU 26 Cb -0.09 -3.19 -0.04 0.00 0.03 0.00 0.00 46.19 42.91 1hom s LEU 26 CO -0.07 -0.18 -0.07 0.42 0.23 0.00 0.00 176.35 176.68 1hom s THR 27 N -2.12 0.60 0.28 5.49 -4.23 -1.26 -4.98 115.64 109.43 1hom s THR 27 Ca 0.38 -1.62 0.02 0.00 -1.18 0.00 0.00 61.69 59.30 1hom s THR 27 Cb -0.10 -1.29 0.28 0.00 1.34 0.00 0.00 72.50 72.73 1hom s THR 27 CO 0.32 -0.71 1.70 -0.09 -0.54 0.00 0.00 174.62 175.31 1hom h ARG 28 N 3.52 0.39 0.00 3.99 2.43 -2.00 0.68 114.38 123.40 1hom h ARG 28 Ca -0.35 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 1hom h ARG 28 Cb 1.18 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1hom h ARG 28 CO 0.56 0.26 0.00 -2.13 -1.51 0.00 0.00 179.97 177.15 1hom n ARG 29 N -5.04 0.00 0.23 0.20 0.63 -1.26 -0.56 116.66 110.86 1hom n ARG 29 Ca 0.21 0.35 0.07 0.00 -0.92 0.00 0.00 57.85 57.56 1hom n ARG 29 Cb 0.61 -1.24 0.56 0.00 0.45 0.00 0.00 32.46 32.84 1hom n ARG 29 CO 0.00 0.00 0.00 0.07 -2.51 0.00 0.00 177.63 175.19 1hom h ARG 30 N 0.00 0.00 -0.09 -0.14 0.11 -1.79 0.35 114.38 112.83 1hom h ARG 30 Ca 0.00 0.00 0.04 0.00 0.10 0.00 0.00 59.98 60.12 1hom h ARG 30 Cb 0.00 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.04 1hom h ARG 30 CO 0.00 0.16 -0.16 -0.09 0.10 0.00 0.00 179.97 179.98 1hom h ARG 31 N 0.00 -0.21 -0.40 0.08 9.65 -0.97 0.27 114.38 122.80 1hom h ARG 31 Ca -0.00 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1hom h ARG 31 Cb 0.29 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.90 1hom h ARG 31 CO 0.02 -0.14 0.25 0.82 2.80 0.00 0.00 179.97 183.73 1hom h ILE 32 N -0.21 1.12 -0.97 1.20 1.08 0.21 -0.15 117.51 119.79 1hom h ILE 32 Ca 0.08 -0.25 0.10 0.00 -0.39 0.00 0.00 64.86 64.41 1hom h ILE 32 Cb 0.33 0.57 -0.08 0.00 -3.07 0.00 0.00 36.82 34.56 1hom h ILE 32 CO -0.22 0.12 0.61 -0.33 -0.69 0.00 0.00 178.15 177.64 1hom h GLU 33 N 0.53 0.97 0.01 2.37 4.39 -0.79 -2.31 114.58 119.74 1hom h GLU 33 Ca 0.14 -0.06 -0.26 0.00 0.34 0.00 0.00 59.36 59.53 1hom h GLU 33 Cb -0.03 -0.22 0.02 0.00 -0.10 0.00 0.00 28.75 28.42 1hom h GLU 33 CO -0.03 0.64 -1.02 0.82 -1.16 0.00 0.00 179.01 178.26 1hom h ILE 34 N 1.00 1.32 -0.30 3.13 2.04 0.14 -0.01 117.51 124.83 1hom h ILE 34 Ca 0.47 -2.33 0.07 0.00 1.00 0.00 0.00 64.86 64.07 1hom h ILE 34 Cb 0.40 2.41 -0.08 0.00 -0.74 0.00 0.00 36.82 38.82 1hom h ILE 34 CO -0.24 0.71 -0.24 0.00 0.00 0.00 0.00 178.15 178.37 1hom h ALA 35 N 0.51 -0.09 -0.34 1.87 0.00 -0.68 0.06 119.26 120.59 1hom h ALA 35 Ca -0.12 0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 1hom h ALA 35 Cb 1.67 0.53 -0.00 0.00 0.00 0.00 0.00 17.79 19.99 1hom h ALA 35 CO 0.19 -0.65 -0.46 0.45 0.00 0.00 0.00 179.25 178.78 1hom h HIS 36 N -0.22 1.11 0.42 0.00 3.86 -1.29 0.42 115.15 119.44 1hom h HIS 36 Ca 0.15 -0.36 -0.02 0.00 -1.16 0.00 0.00 60.37 58.98 1hom h HIS 36 Cb 0.46 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 28.71 1hom h HIS 36 CO -0.42 1.19 -0.25 0.00 0.86 0.00 0.00 177.93 179.31 1hom h ALA 37 N 0.74 -1.10 0.00 2.45 0.00 -0.61 -3.33 119.26 117.42 1hom h ALA 37 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1hom h ALA 37 Cb 1.06 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1hom h ALA 37 CO 0.11 -1.07 -0.57 1.28 0.00 0.00 0.00 179.25 179.00 1hom n LEU 38 N -3.87 0.55 -1.65 0.00 4.32 -0.03 -4.98 117.00 111.35 1hom n LEU 38 Ca -0.08 -0.03 -0.04 0.00 -0.02 0.00 0.00 56.01 55.84 1hom n LEU 38 Cb 0.26 -0.22 0.02 0.00 -1.62 0.00 0.00 43.42 41.86 1hom n LEU 38 CO 0.18 0.12 0.02 0.00 -1.22 0.00 0.00 177.39 176.49 1hom n LEU 40 N -1.79 0.00 -4.05 0.00 4.32 -1.05 -5.06 117.00 109.37 1hom n LEU 40 Ca -0.06 -1.63 -0.09 0.00 -0.02 0.00 0.00 56.01 54.21 1hom n LEU 40 Cb 0.54 0.68 -0.09 0.00 -1.62 0.00 0.00 43.42 42.93 1hom n LEU 40 CO 0.15 -0.26 -0.17 0.42 -1.22 0.00 0.00 177.39 176.31 1hom s THR 41 N -2.50 0.09 0.02 -5.08 -4.23 -1.26 -4.40 115.64 98.28 1hom s THR 41 Ca 0.15 -1.64 -0.28 0.00 -1.18 0.00 0.00 61.69 58.75 1hom s THR 41 Cb 0.01 -1.89 -0.16 0.00 1.34 0.00 0.00 72.50 71.80 1hom s THR 41 CO 0.11 -0.43 1.18 -0.08 -0.54 0.00 0.00 174.62 174.86 1hom h GLU 42 N 2.73 -0.88 -0.74 3.99 4.57 -1.98 -0.17 114.58 122.10 1hom h GLU 42 Ca -0.33 0.06 0.17 0.00 -1.18 0.00 0.00 59.36 58.07 1hom h GLU 42 Cb 1.21 0.20 -0.13 0.00 -0.16 0.00 0.00 28.75 29.87 1hom h GLU 42 CO 0.55 -0.56 0.01 0.00 -1.18 0.00 0.00 179.01 177.82 1hom h ARG 43 N -1.18 0.11 0.15 1.92 2.47 -1.99 0.92 114.38 116.78 1hom h ARG 43 Ca -0.09 -0.01 -0.23 0.00 -1.26 0.00 0.00 59.98 58.39 1hom h ARG 43 Cb 0.73 -0.02 0.03 0.00 -1.65 0.00 0.00 29.97 29.05 1hom h ARG 43 CO 0.15 0.07 -0.99 -0.56 0.56 0.00 0.00 179.97 179.20 1hom h GLN 44 N 0.11 0.41 -0.68 0.04 3.07 -1.99 -2.94 115.11 113.12 1hom h GLN 44 Ca 0.40 -0.64 -0.06 0.00 0.09 0.00 0.00 58.65 58.44 1hom h GLN 44 Cb 0.70 0.23 -0.03 0.00 0.08 0.00 0.00 27.48 28.46 1hom h GLN 44 CO -0.64 1.29 0.18 0.82 0.09 0.00 0.00 178.83 180.57 1hom h ILE 45 N -0.15 1.26 0.06 1.86 2.04 -0.46 0.47 117.51 122.58 1hom h ILE 45 Ca -0.17 -0.92 0.03 0.00 1.00 0.00 0.00 64.86 64.80 1hom h ILE 45 Cb 1.76 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 38.32 1hom h ILE 45 CO 0.19 0.35 -0.38 0.11 0.00 0.00 0.00 178.15 178.42 1hom h LYS 46 N 1.03 -0.56 -0.53 2.37 1.79 -0.93 0.18 116.57 119.92 1hom h LYS 46 Ca 0.22 0.04 0.11 0.00 -2.18 0.00 0.00 60.65 58.83 1hom h LYS 46 Cb 0.33 0.13 -0.10 0.00 -1.58 0.00 0.00 32.23 31.01 1hom h LYS 46 CO -0.00 -0.37 -0.08 0.82 -1.08 0.00 0.00 179.45 178.74 1hom h ILE 47 N -0.58 0.51 0.30 1.86 2.04 -1.22 0.38 117.51 120.79 1hom h ILE 47 Ca 0.04 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1hom h ILE 47 Cb 0.63 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 1hom h ILE 47 CO -0.26 0.01 -0.14 -0.25 0.00 0.00 0.00 178.15 177.51 1hom h TRP 48 N 0.04 -0.37 -0.92 1.37 7.01 -0.46 -0.76 115.95 121.87 1hom h TRP 48 Ca 0.26 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.34 1hom h TRP 48 Cb 0.41 0.12 -0.06 0.00 -2.10 0.00 0.00 29.16 27.53 1hom h TRP 48 CO -0.40 -0.20 0.59 0.74 -2.79 0.00 0.00 178.44 176.39 1hom h PHE 49 N -0.45 1.03 0.01 2.65 -1.00 -0.35 -0.08 116.94 118.75 1hom h PHE 49 Ca -0.04 0.03 -0.00 0.00 2.81 0.00 0.00 57.97 60.77 1hom h PHE 49 Cb 0.34 -0.34 0.00 0.00 3.61 0.00 0.00 35.95 39.57 1hom h PHE 49 CO -0.04 0.50 -0.00 0.37 -1.61 0.00 0.00 178.31 177.53 1hom h GLN 50 N 0.98 -0.01 -0.47 1.51 4.15 0.14 0.18 115.11 121.59 1hom h GLN 50 Ca 0.41 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.81 1hom h GLN 50 Cb 0.31 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.98 1hom h GLN 50 CO -0.17 0.17 0.21 -2.95 -1.93 0.00 0.00 178.83 174.16 1hom h ASN 51 N -0.19 0.63 -0.63 -0.69 7.08 -0.77 -2.47 115.58 118.54 1hom h ASN 51 Ca -0.00 -0.15 0.13 0.00 -3.08 0.00 0.00 56.30 53.20 1hom h ASN 51 Cb 0.18 -0.16 -0.04 0.00 -2.08 0.00 0.00 38.32 36.22 1hom h ASN 51 CO 0.00 0.61 0.43 -0.09 -2.08 0.00 0.00 177.43 176.30 1hom h ARG 52 N 0.62 0.28 -0.38 4.14 2.43 -0.68 -1.48 114.38 119.31 1hom h ARG 52 Ca 0.16 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.17 1hom h ARG 52 Cb 0.16 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1hom h ARG 52 CO -0.02 0.18 -0.32 0.00 -1.51 0.00 0.00 179.97 178.30 1hom h ARG 53 N 0.29 0.85 -6.74 0.20 2.47 -0.18 -3.40 114.38 107.86 1hom h ARG 53 Ca 0.30 -0.41 -0.53 0.00 -1.26 0.00 0.00 59.98 58.09 1hom h ARG 53 Cb 0.80 -0.01 0.06 0.00 -1.65 0.00 0.00 29.97 29.17 1hom h ARG 53 CO -0.07 1.05 0.82 1.41 0.56 0.00 0.00 179.97 183.74 1hom s MET 54 N -4.46 4.21 0.00 0.04 -2.45 -0.56 -0.91 119.30 115.18 1hom s MET 54 Ca -0.10 2.40 0.00 0.00 -1.25 0.00 0.00 55.69 56.74 1hom s MET 54 Cb 0.12 -3.09 0.00 0.00 1.25 0.00 0.00 34.83 33.11 1hom s MET 54 CO 0.86 -0.52 0.00 1.17 1.05 0.00 0.00 175.02 177.58 1hom n LYS 55 N 2.59 0.00 0.04 4.11 0.00 -1.26 -4.81 118.16 118.83 1hom n LYS 55 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 58.31 58.37 1hom n LYS 55 Cb 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.41 1hom n LYS 55 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.40 179.75 1hom h TRP 56 N 0.00 -0.16 0.00 5.64 7.01 -1.33 -2.42 115.95 124.69 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 0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.11 1hom h TRP 56 CO 0.00 -0.10 0.00 0.36 -2.79 0.00 0.00 178.44 175.91 1hom n LYS 57 N -3.98 0.65 -0.01 2.65 2.85 -0.09 -0.76 118.16 119.46 1hom n LYS 57 Ca -0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 1hom n LYS 57 Cb 0.07 -1.02 0.00 0.00 -0.65 0.00 0.00 35.03 33.43 1hom n LYS 57 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 1hom n LYS 58 N -0.52 0.50 -1.28 -1.58 -0.00 -1.26 -4.89 118.16 109.15 1hom n LYS 58 Ca 0.00 -0.69 -0.06 0.00 -0.00 0.00 0.00 58.31 57.57 1hom n LYS 58 Cb 0.00 -0.59 -0.04 0.00 -0.00 0.00 0.00 35.03 34.41 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 -0.09 0.22 -3.25 -1.58 1.02 -0.84 -4.91 120.64 111.21 1hom n GLU 59 Ca 0.00 -1.08 -0.04 0.00 -0.02 0.00 0.00 57.16 56.02 1hom n GLU 59 Cb 0.46 0.46 -0.04 0.00 -0.02 0.00 0.00 31.44 32.31 1hom n GLU 59 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1hom s ASN 60 N -1.07 -0.44 0.00 1.62 0.02 0.06 -4.85 114.94 110.28 1hom s ASN 60 Ca 0.03 -0.33 0.00 0.00 -1.02 0.00 0.00 52.86 51.54 1hom s ASN 60 Cb 0.08 1.47 0.00 0.00 0.02 0.00 0.00 41.25 42.82 1hom s ASN 60 CO -0.03 -0.31 0.00 1.17 0.02 0.00 0.00 177.10 177.96 1hom n LYS 61 N 5.19 0.00 -1.30 -0.60 4.81 -1.26 -4.72 118.16 120.28 1hom n LYS 61 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 1hom n LYS 61 Cb 0.51 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.56 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 -2.69 -2.95 3.15 -2.24 -1.26 -4.92 114.28 103.37 1hom n THR 62 Ca 0.00 1.31 -0.36 0.00 -2.27 0.00 0.00 64.05 62.73 1hom n THR 62 Cb 0.00 -2.11 -0.06 0.00 -2.10 0.00 0.00 70.33 66.06 1hom n THR 62 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1hom s LYS 63 N -5.03 4.34 0.00 -0.78 -0.14 -1.26 -4.78 119.74 112.08 1hom s LYS 63 Ca 0.00 1.04 0.00 0.00 -1.36 0.00 0.00 55.97 55.65 1hom s LYS 63 Cb 0.00 -2.71 0.00 0.00 -1.68 0.00 0.00 37.83 33.44 1hom s LYS 63 CO 0.00 0.27 0.00 0.41 -0.76 0.00 0.00 175.35 175.27 1hom n GLY 64 N 0.36 -0.86 3.19 -3.33 0.00 -1.26 -5.05 105.19 98.23 1hom n GLY 64 Ca 0.01 0.37 -0.40 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 2.59 0.68 1.61 2.12 -1.26 -5.09 118.70 119.35 1hom s GLU 65 Ca 0.00 -2.04 -0.09 0.00 0.36 0.00 0.00 54.97 53.20 1hom s GLU 65 Cb 0.00 -3.91 0.03 0.00 0.26 0.00 0.00 34.13 30.50 1hom s GLU 65 CO 0.00 -1.19 1.03 -1.25 -0.54 0.00 0.00 175.26 173.31 1hom s PRO 66 N 0.85 2.70 0.00 4.30 0.04 -1.26 -5.16 135.00 136.46 1hom s PRO 66 Ca 0.10 0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.33 1hom s PRO 66 Cb -0.22 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1hom s PRO 66 CO -0.03 -1.02 0.00 0.41 0.04 0.00 0.00 177.00 176.41