#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fyh s ARG 2 N 0.00 3.81 0.65 3.17 1.70 -0.95 -3.15 118.95 124.17 2fyh s ARG 2 Ca 0.00 -2.62 -0.11 0.00 -0.47 0.00 0.00 55.73 52.53 2fyh s ARG 2 Cb 0.00 -4.56 -0.02 0.00 -0.57 0.00 0.00 34.95 29.80 2fyh s ARG 2 CO 0.00 -1.36 1.05 0.00 -1.08 0.00 0.00 175.30 173.91 2fyh s ALA 3 N 0.10 2.97 -0.25 7.88 0.00 -1.17 -2.32 121.76 128.97 2fyh s ALA 3 Ca 0.25 -0.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.85 2fyh s ALA 3 Cb -0.09 -3.09 0.14 0.00 0.00 0.00 0.00 23.12 20.08 2fyh s ALA 3 CO -0.08 -0.87 1.11 -0.59 0.00 0.00 0.00 175.76 175.32 2fyh s PHE 4 N -3.17 -0.35 -0.07 0.00 -0.12 -0.38 -2.40 117.98 111.50 2fyh s PHE 4 Ca 0.56 0.77 -0.12 0.00 -0.05 0.00 0.00 56.93 58.09 2fyh s PHE 4 Cb -0.12 0.42 -0.05 0.00 -0.63 0.00 0.00 43.02 42.64 2fyh s PHE 4 CO 0.54 -0.22 0.30 0.96 -0.05 0.00 0.00 175.22 176.76 2fyh s ILE 5 N -0.28 5.23 0.13 -4.49 -4.36 -0.85 -1.90 121.20 114.68 2fyh s ILE 5 Ca 0.03 0.59 0.00 0.00 -0.26 0.00 0.00 60.65 61.01 2fyh s ILE 5 Cb -0.03 -3.60 -0.04 0.00 1.25 0.00 0.00 42.46 40.04 2fyh s ILE 5 CO -0.06 0.56 0.00 0.00 0.24 0.00 0.00 174.94 175.69 2fyh s ALA 6 N -0.79 1.00 -0.22 2.27 0.00 0.69 -0.79 121.76 123.93 2fyh s ALA 6 Ca 0.20 -1.45 -0.08 0.00 0.00 0.00 0.00 51.96 50.63 2fyh s ALA 6 Cb -0.15 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.48 2fyh s ALA 6 CO 0.09 -0.37 0.08 0.42 0.00 0.00 0.00 175.76 175.98 2fyh s ILE 7 N -3.82 4.68 0.41 0.00 1.01 -0.37 -1.89 121.20 121.22 2fyh s ILE 7 Ca 0.19 -0.06 -0.24 0.00 0.00 0.00 0.00 60.65 60.55 2fyh s ILE 7 Cb 0.07 -3.15 -0.12 0.00 0.01 0.00 0.00 42.46 39.27 2fyh s ILE 7 CO -0.00 0.39 0.78 -0.67 0.00 0.00 0.00 174.94 175.44 2fyh n ASP 8 N 4.21 0.19 -3.98 3.58 -0.08 -1.26 -3.12 116.55 116.09 2fyh n ASP 8 Ca -0.16 0.98 -0.31 0.00 -1.51 0.00 0.00 54.79 53.79 2fyh n ASP 8 Cb 0.52 -1.23 -0.13 0.00 2.34 0.00 0.00 41.12 42.62 2fyh n ASP 8 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 2fyh s VAL 9 N -1.35 2.81 0.66 5.18 -7.23 -1.26 -4.91 120.40 114.29 2fyh s VAL 9 Ca 0.63 -3.25 -0.16 0.00 -1.81 0.00 0.00 61.98 57.40 2fyh s VAL 9 Cb -0.59 -2.92 -0.14 0.00 0.56 0.00 0.00 36.38 33.29 2fyh s VAL 9 CO 0.57 -0.81 -0.38 -1.20 -0.31 0.00 0.00 175.10 172.96 2fyh n SER 10 N 3.19 -4.30 -0.30 4.85 7.64 -1.26 -3.93 113.62 119.50 2fyh n SER 10 Ca 0.06 0.42 -0.00 0.00 1.01 0.00 0.00 58.87 60.35 2fyh n SER 10 Cb 0.33 -0.74 0.06 0.00 -1.01 0.00 0.00 64.21 62.85 2fyh n SER 10 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2fyh h GLU 11 N -0.40 -0.04 -0.73 1.43 4.39 -1.98 0.11 114.58 117.36 2fyh h GLU 11 Ca -0.39 0.00 0.15 0.00 0.34 0.00 0.00 59.36 59.47 2fyh h GLU 11 Cb 1.27 0.01 -0.14 0.00 -0.10 0.00 0.00 28.75 29.79 2fyh h GLU 11 CO 0.31 -0.03 -0.15 0.45 -1.16 0.00 0.00 179.01 178.43 2fyh n SER 12 N -5.50 -0.24 0.00 1.42 2.88 -1.26 -0.15 113.62 110.78 2fyh n SER 12 Ca 0.10 1.25 -0.10 0.00 -1.33 0.00 0.00 58.87 58.78 2fyh n SER 12 Cb 0.40 -0.39 -0.08 0.00 -0.75 0.00 0.00 64.21 63.39 2fyh n SER 12 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2fyh h VAL 13 N 0.00 1.01 -0.78 2.46 2.07 -1.05 -2.08 116.25 117.88 2fyh h VAL 13 Ca 0.36 -1.44 0.13 0.00 0.82 0.00 0.00 66.70 66.57 2fyh h VAL 13 Cb 0.59 1.79 -0.13 0.00 -1.52 0.00 0.00 31.29 32.01 2fyh h VAL 13 CO -0.74 0.30 -0.37 0.03 0.02 0.00 0.00 177.57 176.81 2fyh h ARG 14 N -0.89 -0.09 -0.09 1.57 3.08 0.04 0.53 114.38 118.53 2fyh h ARG 14 Ca -0.01 0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 2fyh h ARG 14 Cb 0.57 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 2fyh h ARG 14 CO 0.02 -0.06 -0.41 0.22 -1.07 0.00 0.00 179.97 178.67 2fyh h ASP 15 N -0.09 0.20 0.53 7.04 1.82 -0.67 -2.18 116.42 123.07 2fyh h ASP 15 Ca 0.28 -0.08 -0.03 0.00 -0.39 0.00 0.00 57.03 56.81 2fyh h ASP 15 Cb 0.57 -0.06 0.01 0.00 0.68 0.00 0.00 39.33 40.53 2fyh h ASP 15 CO -0.82 0.60 -0.25 0.00 -1.61 0.00 0.00 179.24 177.15 2fyh h ALA 16 N 1.41 -0.71 -0.04 -0.78 0.00 0.66 0.12 119.26 119.93 2fyh h ALA 16 Ca 0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2fyh h ALA 16 Cb 0.80 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2fyh h ALA 16 CO 0.06 -0.89 0.01 -0.07 0.00 0.00 0.00 179.25 178.36 2fyh h LEU 17 N -0.72 0.05 -0.95 0.00 3.38 -0.80 -2.92 115.31 113.35 2fyh h LEU 17 Ca -0.07 -0.18 0.11 0.00 0.09 0.00 0.00 57.88 57.83 2fyh h LEU 17 Cb 0.55 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.21 2fyh h LEU 17 CO 0.12 0.21 0.59 0.58 0.09 0.00 0.00 178.44 180.03 2fyh h VAL 18 N -0.12 0.94 -0.71 1.22 2.07 -1.37 -1.80 116.25 116.48 2fyh h VAL 18 Ca 0.01 -0.33 0.15 0.00 0.82 0.00 0.00 66.70 67.35 2fyh h VAL 18 Cb 0.18 -0.10 -0.11 0.00 -1.52 0.00 0.00 31.29 29.74 2fyh h VAL 18 CO -0.00 0.18 0.16 -0.09 0.02 0.00 0.00 177.57 177.84 2fyh h ARG 19 N 0.96 0.26 0.05 1.57 2.43 -0.56 -1.41 114.38 117.67 2fyh h ARG 19 Ca 0.46 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.61 2fyh h ARG 19 Cb 0.41 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2fyh h ARG 19 CO -0.25 0.17 -0.02 0.00 -1.51 0.00 0.00 179.97 178.36 2fyh h ALA 20 N 1.59 -0.06 -0.51 2.80 0.00 -1.32 -3.12 119.26 118.63 2fyh h ALA 20 Ca 0.39 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.33 2fyh h ALA 20 Cb 0.66 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.37 2fyh h ALA 20 CO -0.49 -0.48 -0.38 1.96 0.00 0.00 0.00 179.25 179.85 2fyh h GLN 21 N -0.17 -0.23 -0.83 0.00 4.20 -1.09 0.60 115.11 117.59 2fyh h GLN 21 Ca -0.01 0.02 0.20 0.00 0.06 0.00 0.00 58.65 58.92 2fyh h GLN 21 Cb 0.15 0.05 -0.15 0.00 0.30 0.00 0.00 27.48 27.84 2fyh h GLN 21 CO 0.01 -0.15 0.02 0.22 -0.67 0.00 0.00 178.83 178.25 2fyh h ASP 22 N -0.24 -0.38 -0.39 1.46 3.58 -1.35 0.53 116.42 119.63 2fyh h ASP 22 Ca 0.18 0.22 -0.09 0.00 0.42 0.00 0.00 57.03 57.76 2fyh h ASP 22 Cb 0.56 0.38 -0.02 0.00 1.72 0.00 0.00 39.33 41.97 2fyh h ASP 22 CO -0.63 -0.22 -0.07 0.22 -2.88 0.00 0.00 179.24 175.66 2fyh h TYR 23 N 0.09 0.90 0.80 0.28 3.20 -0.93 -3.25 116.97 118.06 2fyh h TYR 23 Ca 0.47 -0.15 -0.04 0.00 3.14 0.00 0.00 58.73 62.15 2fyh h TYR 23 Cb 0.86 -0.23 0.01 0.00 1.54 0.00 0.00 36.73 38.91 2fyh h TYR 23 CO -0.44 0.86 -0.38 0.82 -1.64 0.00 0.00 178.16 177.37 2fyh h ILE 24 N 0.75 0.00 -1.97 1.81 2.04 0.16 -3.49 117.51 116.81 2fyh h ILE 24 Ca 0.13 -0.15 0.23 0.00 1.00 0.00 0.00 64.86 66.07 2fyh h ILE 24 Cb 0.55 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.56 2fyh h ILE 24 CO 0.03 0.00 -0.45 0.61 0.00 0.00 0.00 178.15 178.34 2fyh n GLY 25 N -1.09 -2.10 2.61 5.37 0.00 0.13 -4.77 105.19 105.35 2fyh n GLY 25 Ca -0.13 -1.28 -0.13 0.00 0.00 0.00 0.00 46.02 44.48 2fyh n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fyh n SER 26 N -3.34 2.37 0.08 1.61 3.41 -1.26 -4.85 113.62 111.65 2fyh n SER 26 Ca -0.01 -2.91 -0.08 0.00 -0.26 0.00 0.00 58.87 55.61 2fyh n SER 26 Cb 0.40 -0.50 -0.05 0.00 -0.26 0.00 0.00 64.21 63.80 2fyh n SER 26 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2fyh h LYS 27 N 2.82 -0.28 0.09 4.33 1.57 -2.01 -3.40 116.57 119.68 2fyh h LYS 27 Ca 0.01 0.02 -0.34 0.00 -1.87 0.00 0.00 60.65 58.46 2fyh h LYS 27 Cb 1.15 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 2fyh h LYS 27 CO 0.55 -0.01 -1.90 0.39 -0.57 0.00 0.00 179.45 177.92 2fyh n GLU 28 N -4.97 0.71 -3.87 3.15 4.71 -1.26 -4.93 120.64 114.19 2fyh n GLU 28 Ca -0.06 0.32 -0.33 0.00 -0.01 0.00 0.00 57.16 57.08 2fyh n GLU 28 Cb 0.21 -1.70 -0.05 0.00 -1.01 0.00 0.00 31.44 28.89 2fyh n GLU 28 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2fyh s ALA 29 N -2.52 3.95 -0.47 0.62 0.00 -1.26 -3.39 121.76 118.69 2fyh s ALA 29 Ca -0.25 -0.75 -0.13 0.00 0.00 0.00 0.00 51.96 50.84 2fyh s ALA 29 Cb 0.07 -1.91 0.09 0.00 0.00 0.00 0.00 23.12 21.37 2fyh s ALA 29 CO 0.72 0.76 0.37 0.21 0.00 0.00 0.00 175.76 177.81 2fyh s LYS 30 N -2.17 2.79 -0.16 0.00 2.36 0.08 -4.32 119.74 118.32 2fyh s LYS 30 Ca 0.31 -1.52 0.01 0.00 -2.55 0.00 0.00 55.97 52.21 2fyh s LYS 30 Cb -0.13 -4.03 0.02 0.00 -1.05 0.00 0.00 37.83 32.65 2fyh s LYS 30 CO 0.22 -1.09 -0.15 0.42 1.55 0.00 0.00 175.35 176.30 2fyh s ILE 31 N 1.52 1.69 -1.18 5.43 1.01 -1.26 -0.25 121.20 128.16 2fyh s ILE 31 Ca 0.04 -0.74 -0.15 0.00 0.00 0.00 0.00 60.65 59.79 2fyh s ILE 31 Cb -0.25 -1.59 0.14 0.00 0.01 0.00 0.00 42.46 40.77 2fyh s ILE 31 CO 0.03 0.44 1.45 -0.54 0.00 0.00 0.00 174.94 176.33 2fyh s LYS 32 N 1.43 3.99 1.22 2.79 1.02 -0.58 -4.90 119.74 124.72 2fyh s LYS 32 Ca 0.04 -2.32 -0.17 0.00 0.02 0.00 0.00 55.97 53.54 2fyh s LYS 32 Cb -0.13 -5.14 0.25 0.00 -0.52 0.00 0.00 37.83 32.29 2fyh s LYS 32 CO -0.11 -1.87 0.59 1.19 -0.92 0.00 0.00 175.35 174.23 2fyh n PHE 33 N 6.37 -2.08 -4.13 3.18 3.72 -1.26 -3.57 117.46 119.69 2fyh n PHE 33 Ca 0.37 -0.22 -0.33 0.00 -0.05 0.00 0.00 57.45 57.23 2fyh n PHE 33 Cb 0.44 -1.53 -0.07 0.00 -0.94 0.00 0.00 39.48 37.39 2fyh n PHE 33 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2fyh s VAL 34 N -2.24 4.62 1.00 -4.37 1.01 -0.25 -4.88 120.40 115.29 2fyh s VAL 34 Ca 0.60 -0.47 -0.15 0.00 0.00 0.00 0.00 61.98 61.96 2fyh s VAL 34 Cb -0.16 -3.11 0.13 0.00 0.00 0.00 0.00 36.38 33.23 2fyh s VAL 34 CO 0.59 0.33 0.12 -0.62 0.00 0.00 0.00 175.10 175.53 2fyh n GLU 35 N 1.15 -1.91 0.10 2.72 -0.58 -1.26 -4.88 120.64 115.97 2fyh n GLU 35 Ca -0.13 -0.56 -0.23 0.00 -0.42 0.00 0.00 57.16 55.82 2fyh n GLU 35 Cb 0.53 -1.46 -0.15 0.00 -0.57 0.00 0.00 31.44 29.78 2fyh n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2fyh h ARG 36 N -2.44 0.43 -0.83 3.49 3.08 -1.99 -3.28 114.38 112.85 2fyh h ARG 36 Ca -0.29 -0.74 0.00 0.00 0.07 0.00 0.00 59.98 59.01 2fyh h ARG 36 Cb 0.88 0.28 0.00 0.00 0.08 0.00 0.00 29.97 31.21 2fyh h ARG 36 CO 0.19 1.36 0.00 0.39 -1.07 0.00 0.00 179.97 180.84 2fyh n GLU 37 N -3.77 1.35 -0.64 0.04 4.71 -1.26 -3.09 120.64 117.98 2fyh n GLU 37 Ca -0.20 -0.30 0.03 0.00 -0.01 0.00 0.00 57.16 56.68 2fyh n GLU 37 Cb 1.03 -1.50 0.04 0.00 -1.01 0.00 0.00 31.44 30.01 2fyh n GLU 37 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2fyh n ASN 38 N 0.01 0.75 -1.16 1.62 4.13 -1.24 -4.77 115.26 114.60 2fyh n ASN 38 Ca 0.03 -2.33 0.09 0.00 1.68 0.00 0.00 54.58 54.05 2fyh n ASN 38 Cb 0.30 -0.29 0.27 0.00 -1.54 0.00 0.00 39.78 38.53 2fyh n ASN 38 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2fyh n PHE 39 N -0.23 0.87 -1.64 3.10 3.72 -1.18 -4.79 117.46 117.32 2fyh n PHE 39 Ca 0.05 -0.42 -0.37 0.00 -0.05 0.00 0.00 57.45 56.66 2fyh n PHE 39 Cb 0.78 -0.03 0.06 0.00 -0.94 0.00 0.00 39.48 39.35 2fyh n PHE 39 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 176.76 174.32 2fyh n HIS 40 N 1.23 1.06 -2.91 1.38 1.44 -1.26 -4.92 115.22 111.23 2fyh n HIS 40 Ca 0.20 0.43 -0.43 0.00 -2.01 0.00 0.00 57.72 55.92 2fyh n HIS 40 Cb 0.55 -2.16 -0.05 0.00 0.12 0.00 0.00 29.99 28.45 2fyh n HIS 40 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2fyh s ILE 41 N -1.49 4.64 -0.62 0.61 1.01 -1.18 -4.89 121.20 119.28 2fyh s ILE 41 Ca 0.78 0.78 -0.26 0.00 0.00 0.00 0.00 60.65 61.94 2fyh s ILE 41 Cb -0.40 -4.30 -0.06 0.00 0.01 0.00 0.00 42.46 37.71 2fyh s ILE 41 CO 0.45 -0.60 2.16 -0.89 0.00 0.00 0.00 174.94 176.06 2fyh s THR 42 N 3.32 3.18 0.05 2.92 2.01 -1.26 -1.24 115.64 124.62 2fyh s THR 42 Ca 0.33 0.04 -0.20 0.00 0.31 0.00 0.00 61.69 62.16 2fyh s THR 42 Cb -0.12 -3.47 -0.13 0.00 0.01 0.00 0.00 72.50 68.79 2fyh s THR 42 CO 0.20 -0.45 1.40 0.25 -0.69 0.00 0.00 174.62 175.33 2fyh h LEU 43 N 18.61 0.35 -7.07 4.42 6.46 -1.30 -3.45 115.31 133.33 2fyh h LEU 43 Ca -0.18 -0.42 -0.02 0.00 -0.12 0.00 0.00 57.88 57.14 2fyh h LEU 43 Cb 1.17 -0.10 -0.23 0.00 -0.73 0.00 0.00 40.66 40.77 2fyh h LEU 43 CO 1.17 0.69 -0.09 -0.75 -0.62 0.00 0.00 178.44 178.84 2fyh s LYS 44 N -4.55 0.60 -0.00 1.25 2.36 -1.06 -4.89 119.74 113.45 2fyh s LYS 44 Ca -0.14 1.08 -0.15 0.00 -2.55 0.00 0.00 55.97 54.22 2fyh s LYS 44 Cb 0.06 0.09 -0.06 0.00 -1.05 0.00 0.00 37.83 36.87 2fyh s LYS 44 CO 0.74 -0.15 0.41 0.12 1.55 0.00 0.00 175.35 178.02 2fyh s PHE 45 N 1.57 3.73 -0.09 4.03 5.36 -1.26 -2.01 117.98 129.31 2fyh s PHE 45 Ca -0.10 1.00 -0.10 0.00 -0.96 0.00 0.00 56.93 56.77 2fyh s PHE 45 Cb -0.06 -2.30 -0.03 0.00 -0.34 0.00 0.00 43.02 40.29 2fyh s PHE 45 CO -0.18 0.63 -0.20 1.28 -1.46 0.00 0.00 175.22 175.30 2fyh n LEU 46 N 1.86 1.24 0.00 6.12 4.77 -1.01 -4.99 117.00 125.00 2fyh n LEU 46 Ca -0.14 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2fyh n LEU 46 Cb 0.52 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 2fyh n LEU 46 CO 0.38 -0.40 0.00 0.61 -1.33 0.00 0.00 177.39 176.64 2fyh n GLY 47 N 1.84 0.86 3.66 -0.72 0.00 -1.11 -4.92 105.19 104.80 2fyh n GLY 47 Ca -0.08 -1.48 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 2fyh n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fyh s GLU 48 N 0.00 4.17 0.04 1.61 2.56 -1.26 -3.03 118.70 122.80 2fyh s GLU 48 Ca 0.00 2.29 0.01 0.00 0.00 0.00 0.00 54.97 57.27 2fyh s GLU 48 Cb 0.00 -4.01 -0.03 0.00 2.00 0.00 0.00 34.13 32.09 2fyh s GLU 48 CO 0.00 -0.87 -0.05 0.42 -0.56 0.00 0.00 175.26 174.20 2fyh s ILE 49 N 4.09 0.38 -0.10 -3.70 1.01 -1.19 -5.02 121.20 116.67 2fyh s ILE 49 Ca 0.77 -1.23 -0.03 0.00 0.00 0.00 0.00 60.65 60.15 2fyh s ILE 49 Cb -0.36 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.32 2fyh s ILE 49 CO 0.32 -0.56 0.04 0.42 0.00 0.00 0.00 174.94 175.16 2fyh s THR 50 N -2.03 4.61 0.29 2.92 -4.23 -1.26 -4.44 115.64 111.49 2fyh s THR 50 Ca -0.07 -0.13 0.19 0.00 -1.18 0.00 0.00 61.69 60.50 2fyh s THR 50 Cb -0.06 -2.97 0.30 0.00 1.34 0.00 0.00 72.50 71.12 2fyh s THR 50 CO -0.02 0.59 1.11 -0.62 -0.54 0.00 0.00 174.62 175.14 2fyh n GLU 51 N 2.26 -0.03 0.09 3.99 4.71 -1.26 -0.27 120.64 130.13 2fyh n GLU 51 Ca -0.19 0.93 -0.04 0.00 -0.01 0.00 0.00 57.16 57.85 2fyh n GLU 51 Cb 0.54 -1.75 -0.02 0.00 -1.01 0.00 0.00 31.44 29.20 2fyh n GLU 51 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 2fyh h GLU 52 N 0.00 -0.25 -1.04 3.49 5.08 -2.03 -3.26 114.58 116.58 2fyh h GLU 52 Ca 0.61 0.02 0.36 0.00 -1.00 0.00 0.00 59.36 59.35 2fyh h GLU 52 Cb 1.81 0.06 -0.15 0.00 0.50 0.00 0.00 28.75 30.96 2fyh h GLU 52 CO -0.43 -0.17 0.59 1.96 -1.00 0.00 0.00 179.01 179.96 2fyh h GLN 53 N -0.44 0.20 -0.78 2.33 1.08 -1.03 -1.22 115.11 115.26 2fyh h GLN 53 Ca -0.03 -0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.23 2fyh h GLN 53 Cb 0.20 -0.05 -0.09 0.00 -0.05 0.00 0.00 27.48 27.49 2fyh h GLN 53 CO 0.04 0.13 -0.46 0.00 -0.95 0.00 0.00 178.83 177.60 2fyh n ALA 54 N -2.31 -0.50 0.17 3.87 0.00 -0.22 0.20 120.51 121.73 2fyh n ALA 54 Ca 0.34 0.66 0.17 0.00 0.00 0.00 0.00 53.44 54.61 2fyh n ALA 54 Cb 1.12 -0.02 0.78 0.00 0.00 0.00 0.00 19.45 21.34 2fyh n ALA 54 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2fyh h GLU 55 N 0.00 0.00 0.56 0.00 4.11 -1.34 -2.31 114.58 115.60 2fyh h GLU 55 Ca 0.12 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.53 2fyh h GLU 55 Cb 0.32 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.57 2fyh h GLU 55 CO -0.73 0.00 -0.27 1.49 0.07 0.00 0.00 179.01 179.57 2fyh h GLU 56 N 0.00 -0.73 0.49 1.06 4.57 0.22 -2.90 114.58 117.29 2fyh h GLU 56 Ca 0.11 0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.33 2fyh h GLU 56 Cb 0.55 0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 2fyh h GLU 56 CO -0.00 -0.46 -0.51 0.82 -1.18 0.00 0.00 179.01 177.68 2fyh h ILE 57 N -0.83 0.02 -0.80 2.32 5.03 -0.81 -2.85 117.51 119.59 2fyh h ILE 57 Ca -0.08 0.00 0.10 0.00 -0.12 0.00 0.00 64.86 64.76 2fyh h ILE 57 Cb 0.61 0.02 -0.11 0.00 -3.03 0.00 0.00 36.82 34.30 2fyh h ILE 57 CO 0.13 0.00 -0.39 0.29 -0.68 0.00 0.00 178.15 177.50 2fyh n LYS 58 N -5.56 -0.26 -0.25 2.37 5.02 -1.13 0.91 118.16 119.25 2fyh n LYS 58 Ca -0.12 1.22 0.01 0.00 -2.02 0.00 0.00 58.31 57.40 2fyh n LYS 58 Cb 0.46 -1.80 0.08 0.00 -0.02 0.00 0.00 35.03 33.75 2fyh n LYS 58 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2fyh h LYS 59 N 0.00 -0.00 0.10 1.97 1.79 -1.29 -0.30 116.57 118.84 2fyh h LYS 59 Ca 0.21 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.68 2fyh h LYS 59 Cb 0.41 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 2fyh h LYS 59 CO -0.77 -0.00 -0.09 0.82 -1.08 0.00 0.00 179.45 178.33 2fyh h ILE 60 N -0.00 0.81 -0.90 1.86 2.04 0.63 -1.83 117.51 120.11 2fyh h ILE 60 Ca 0.35 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.46 2fyh h ILE 60 Cb 0.53 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 2fyh h ILE 60 CO -0.75 0.00 0.64 -0.07 0.00 0.00 0.00 178.15 177.97 2fyh h LEU 61 N -0.20 0.06 -0.43 1.44 3.38 0.14 0.49 115.31 120.19 2fyh h LEU 61 Ca -0.00 0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.80 2fyh h LEU 61 Cb 0.18 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2fyh h LEU 61 CO -0.01 0.02 -0.78 -0.08 0.09 0.00 0.00 178.44 177.68 2fyh h GLU 62 N 0.06 0.17 0.00 1.13 4.57 -0.41 0.14 114.58 120.24 2fyh h GLU 62 Ca 0.43 -0.16 -0.17 0.00 -1.18 0.00 0.00 59.36 58.29 2fyh h GLU 62 Cb 1.64 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 30.24 2fyh h GLU 62 CO -0.03 0.86 -0.81 0.87 -1.18 0.00 0.00 179.01 178.72 2fyh h LYS 63 N 0.10 0.00 0.00 1.92 1.57 0.34 -3.23 116.57 117.28 2fyh h LYS 63 Ca -0.03 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 2fyh h LYS 63 Cb 1.36 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.66 2fyh h LYS 63 CO 0.12 0.81 -0.69 0.82 -0.57 0.00 0.00 179.45 179.94 2fyh h ILE 64 N 0.00 0.56 -0.03 1.86 2.04 -1.01 -2.89 117.51 118.05 2fyh h ILE 64 Ca -0.01 -1.61 0.01 0.00 1.00 0.00 0.00 64.86 64.25 2fyh h ILE 64 Cb 1.54 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 38.87 2fyh h ILE 64 CO 0.11 0.19 0.59 0.00 0.00 0.00 0.00 178.15 179.04 2fyh h ALA 65 N -0.69 1.62 0.00 1.87 0.00 -0.87 0.97 119.26 122.16 2fyh h ALA 65 Ca -0.14 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.55 2fyh h ALA 65 Cb 0.81 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 2fyh h ALA 65 CO -0.08 -0.61 -2.19 0.36 0.00 0.00 0.00 179.25 176.73 2fyh n LYS 66 N -2.78 0.67 0.20 0.00 -0.00 -1.22 -4.23 118.16 110.81 2fyh n LYS 66 Ca -0.01 -0.07 0.13 0.00 -0.00 0.00 0.00 58.31 58.36 2fyh n LYS 66 Cb 0.63 -1.54 0.28 0.00 -0.00 0.00 0.00 35.03 34.41 2fyh n LYS 66 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.40 178.97 2fyh h LYS 67 N 0.00 0.00 -6.21 -1.58 2.10 0.11 -3.45 116.57 107.54 2fyh h LYS 67 Ca -0.32 0.00 -0.55 0.00 -2.00 0.00 0.00 60.65 57.79 2fyh h LYS 67 Cb 1.74 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 33.00 2fyh h LYS 67 CO 0.02 0.00 -0.57 0.71 -2.00 0.00 0.00 179.45 177.61 2fyh s TYR 68 N -3.23 3.06 0.52 0.07 2.02 -0.04 -5.07 117.35 114.68 2fyh s TYR 68 Ca 0.07 -0.09 0.08 0.00 -0.37 0.00 0.00 57.07 56.77 2fyh s TYR 68 Cb 0.07 -1.42 0.06 0.00 -0.40 0.00 0.00 41.96 40.27 2fyh s TYR 68 CO 0.63 0.53 0.72 0.15 -1.57 0.00 0.00 175.55 176.01 2fyh s LYS 69 N -3.45 2.48 -0.44 -0.62 -0.14 -1.26 -4.90 119.74 111.42 2fyh s LYS 69 Ca 0.31 -1.44 -0.17 0.00 -1.36 0.00 0.00 55.97 53.31 2fyh s LYS 69 Cb -0.09 -2.67 0.03 0.00 -1.68 0.00 0.00 37.83 33.42 2fyh s LYS 69 CO 0.23 -0.66 0.42 0.15 -0.76 0.00 0.00 175.35 174.73 2fyh s LYS 70 N -4.57 3.05 0.35 1.68 3.01 -1.26 -4.99 119.74 117.01 2fyh s LYS 70 Ca 0.59 -0.93 0.05 0.00 -1.01 0.00 0.00 55.97 54.68 2fyh s LYS 70 Cb -0.07 -4.01 -0.01 0.00 -1.01 0.00 0.00 37.83 32.72 2fyh s LYS 70 CO 0.37 -0.90 0.50 -1.58 0.51 0.00 0.00 175.35 174.25 2fyh s HIS 71 N 2.01 3.18 -0.22 3.18 2.46 -1.26 -4.90 115.29 119.74 2fyh s HIS 71 Ca 0.10 -0.10 -0.06 0.00 0.47 0.00 0.00 55.06 55.46 2fyh s HIS 71 Cb -0.19 -2.01 -0.03 0.00 -0.13 0.00 0.00 32.58 30.23 2fyh s HIS 71 CO 0.12 -0.02 0.03 -2.00 -2.47 0.00 0.00 174.74 170.39 2fyh s GLU 72 N -4.23 3.65 0.26 2.88 2.12 -1.26 -3.04 118.70 119.08 2fyh s GLU 72 Ca 0.44 -0.49 0.05 0.00 0.36 0.00 0.00 54.97 55.33 2fyh s GLU 72 Cb -0.10 -3.18 -0.06 0.00 0.26 0.00 0.00 34.13 31.06 2fyh s GLU 72 CO 0.32 -0.05 -0.03 0.14 -0.54 0.00 0.00 175.26 175.11 2fyh s VAL 73 N 1.20 1.34 0.31 3.70 -7.23 -0.59 -4.98 120.40 114.15 2fyh s VAL 73 Ca 0.04 -2.07 0.10 0.00 -1.81 0.00 0.00 61.98 58.24 2fyh s VAL 73 Cb -0.14 -2.43 -0.06 0.00 0.56 0.00 0.00 36.38 34.31 2fyh s VAL 73 CO 0.02 -0.29 -0.10 0.21 -0.31 0.00 0.00 175.10 174.63 2fyh s ASN 74 N -3.38 3.84 -0.22 4.85 3.84 -1.26 -1.10 114.94 121.50 2fyh s ASN 74 Ca 0.29 -1.05 0.01 0.00 0.21 0.00 0.00 52.86 52.32 2fyh s ASN 74 Cb 0.05 -0.41 0.05 0.00 -0.55 0.00 0.00 41.25 40.39 2fyh s ASN 74 CO 0.11 -0.11 -0.09 0.54 -2.79 0.00 0.00 177.10 174.76 2fyh s VAL 75 N -2.53 1.70 -0.02 -5.21 0.11 0.06 0.23 120.40 114.73 2fyh s VAL 75 Ca 0.32 -1.20 -0.26 0.00 -2.93 0.00 0.00 61.98 57.91 2fyh s VAL 75 Cb -0.01 -1.85 0.06 0.00 -1.53 0.00 0.00 36.38 33.04 2fyh s VAL 75 CO 0.17 0.03 0.57 -0.60 -3.33 0.00 0.00 175.10 171.94 2fyh s ARG 76 N 1.34 0.97 0.00 1.54 3.52 -1.08 -2.13 118.95 123.12 2fyh s ARG 76 Ca -0.04 0.08 0.00 0.00 -0.13 0.00 0.00 55.73 55.64 2fyh s ARG 76 Cb -0.18 0.45 0.00 0.00 -1.56 0.00 0.00 34.95 33.66 2fyh s ARG 76 CO -0.07 -0.31 0.00 0.41 -0.81 0.00 0.00 175.30 174.52 2fyh n GLY 77 N 0.90 0.78 2.88 8.12 0.00 -1.25 -4.29 105.19 112.31 2fyh n GLY 77 Ca -0.19 -1.63 -0.14 0.00 0.00 0.00 0.00 46.02 44.05 2fyh n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fyh s ILE 78 N -2.62 -0.06 0.19 -0.61 1.01 -1.26 -0.36 121.20 117.49 2fyh s ILE 78 Ca 0.00 0.20 0.06 0.00 0.00 0.00 0.00 60.65 60.91 2fyh s ILE 78 Cb 0.00 -0.20 -0.04 0.00 0.01 0.00 0.00 42.46 42.23 2fyh s ILE 78 CO 0.00 0.08 0.11 -0.83 0.00 0.00 0.00 174.94 174.30 2fyh s GLY 79 N 1.22 1.65 0.25 6.18 0.00 0.75 -4.90 107.32 112.47 2fyh s GLY 79 Ca -0.08 -1.32 0.07 0.00 0.00 0.00 0.00 44.72 43.39 2fyh s GLY 79 CO -0.05 -1.34 -0.09 -1.34 0.00 0.00 0.00 173.10 170.28 2fyh s VAL 80 N -1.86 1.65 0.01 1.40 -7.23 -1.26 -2.24 120.40 110.87 2fyh s VAL 80 Ca 0.31 -2.16 -0.14 0.00 -1.81 0.00 0.00 61.98 58.18 2fyh s VAL 80 Cb -0.09 -2.29 0.02 0.00 0.56 0.00 0.00 36.38 34.58 2fyh s VAL 80 CO 0.22 -0.41 0.30 -0.36 -0.31 0.00 0.00 175.10 174.54 2fyh s PHE 81 N -3.02 -0.14 0.12 2.82 0.08 -1.20 -4.19 117.98 112.45 2fyh s PHE 81 Ca 0.27 0.13 0.34 0.00 0.12 0.00 0.00 56.93 57.78 2fyh s PHE 81 Cb 0.02 0.09 1.40 0.00 -0.57 0.00 0.00 43.02 43.96 2fyh s PHE 81 CO 0.10 -0.43 2.00 -1.00 -0.10 0.00 0.00 175.22 175.78 2fyh h PRO 82 N 3.61 0.00 -2.16 0.24 0.13 -1.91 0.29 132.00 132.21 2fyh h PRO 82 Ca -0.30 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.98 2fyh h PRO 82 Cb 1.19 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 2fyh h PRO 82 CO 0.43 0.00 0.55 0.54 -0.23 0.00 0.00 178.00 179.28 2fyh s ASN 83 N -5.68 -0.28 0.10 1.44 6.03 -1.19 -5.05 114.94 110.30 2fyh s ASN 83 Ca 0.01 -0.10 -0.27 0.00 -1.03 0.00 0.00 52.86 51.47 2fyh s ASN 83 Cb 0.09 0.37 -0.10 0.00 -3.03 0.00 0.00 41.25 38.58 2fyh s ASN 83 CO 0.54 -0.63 1.44 -0.65 -2.03 0.00 0.00 177.10 175.77 2fyh h PRO 84 N 2.00 -0.41 -1.19 3.55 0.11 -1.93 -0.50 132.00 133.63 2fyh h PRO 84 Ca -0.22 0.03 0.43 0.00 0.11 0.00 0.00 66.00 66.36 2fyh h PRO 84 Cb 1.23 0.09 -0.15 0.00 0.11 0.00 0.00 31.00 32.29 2fyh h PRO 84 CO 0.29 -0.27 0.73 0.27 -0.21 0.00 0.00 178.00 178.80 2fyh n ASN 85 N -4.85 0.25 -3.66 -2.05 6.94 -1.26 -3.12 115.26 107.51 2fyh n ASN 85 Ca -0.04 1.41 -0.29 0.00 -0.02 0.00 0.00 54.58 55.63 2fyh n ASN 85 Cb 0.29 -0.69 -0.14 0.00 -2.36 0.00 0.00 39.78 36.89 2fyh n ASN 85 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 2fyh s TYR 86 N -5.26 1.42 -0.12 -2.53 5.04 -0.21 -5.11 117.35 110.58 2fyh s TYR 86 Ca -0.08 -1.77 -0.20 0.00 -2.44 0.00 0.00 57.07 52.58 2fyh s TYR 86 Cb 0.30 -1.51 -0.04 0.00 0.35 0.00 0.00 41.96 41.06 2fyh s TYR 86 CO 0.76 -0.84 0.58 0.08 -1.34 0.00 0.00 175.55 174.79 2fyh s VAL 87 N 1.28 5.11 0.00 3.14 1.01 -1.13 -3.18 120.40 126.63 2fyh s VAL 87 Ca 0.13 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.26 2fyh s VAL 87 Cb -0.20 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.27 2fyh s VAL 87 CO -0.16 0.26 0.00 0.54 0.00 0.00 0.00 175.10 175.74 2fyh n ARG 88 N 3.97 0.00 -4.02 2.72 5.12 0.08 -4.85 116.66 119.68 2fyh n ARG 88 Ca -0.04 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.59 2fyh n ARG 88 Cb 0.51 -0.75 -0.17 0.00 -1.16 0.00 0.00 32.46 30.90 2fyh n ARG 88 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2fyh s VAL 89 N -1.79 1.41 -0.24 1.55 1.01 -1.14 -0.72 120.40 120.49 2fyh s VAL 89 Ca 0.00 -0.54 -0.18 0.00 0.00 0.00 0.00 61.98 61.26 2fyh s VAL 89 Cb 0.00 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 2fyh s VAL 89 CO 0.00 0.43 0.53 -0.63 0.00 0.00 0.00 175.10 175.43 2fyh s ILE 90 N 1.51 5.07 0.00 2.22 1.01 -0.34 -3.25 121.20 127.43 2fyh s ILE 90 Ca 0.04 0.94 0.02 0.00 0.00 0.00 0.00 60.65 61.65 2fyh s ILE 90 Cb -0.13 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.49 2fyh s ILE 90 CO -0.09 0.11 -0.07 -1.66 0.00 0.00 0.00 174.94 173.23 2fyh s TRP 91 N 2.07 0.60 0.47 3.97 1.48 -0.95 -0.15 118.94 126.42 2fyh s TRP 91 Ca 0.23 -0.17 -0.03 0.00 -1.06 0.00 0.00 56.10 55.07 2fyh s TRP 91 Cb -0.16 -0.38 -0.02 0.00 -1.16 0.00 0.00 33.47 31.76 2fyh s TRP 91 CO 0.09 -0.02 0.73 0.00 -4.06 0.00 0.00 176.95 173.69 2fyh s ALA 92 N -0.36 3.54 -0.03 2.67 0.00 -0.64 -0.18 121.76 126.78 2fyh s ALA 92 Ca 0.00 -0.79 0.06 0.00 0.00 0.00 0.00 51.96 51.23 2fyh s ALA 92 Cb -0.04 -2.36 -0.01 0.00 0.00 0.00 0.00 23.12 20.71 2fyh s ALA 92 CO -0.00 -0.39 -0.20 0.20 0.00 0.00 0.00 175.76 175.36 2fyh s GLY 93 N -4.17 1.03 0.17 0.00 0.00 0.51 -1.79 107.32 103.07 2fyh s GLY 93 Ca 0.48 -0.87 -0.07 0.00 0.00 0.00 0.00 44.72 44.27 2fyh s GLY 93 CO 0.41 -0.64 0.44 0.14 0.00 0.00 0.00 173.10 173.45 2fyh s VAL 94 N -0.32 5.08 0.73 1.40 1.01 -0.72 -2.63 120.40 124.95 2fyh s VAL 94 Ca 0.04 0.19 -0.12 0.00 0.00 0.00 0.00 61.98 62.09 2fyh s VAL 94 Cb -0.10 -3.62 0.18 0.00 0.00 0.00 0.00 36.38 32.84 2fyh s VAL 94 CO 0.00 0.00 0.70 -0.62 0.00 0.00 0.00 175.10 175.19 2fyh n GLU 95 N 0.01 -2.03 -0.53 2.72 1.02 0.14 -4.76 120.64 117.21 2fyh n GLU 95 Ca -0.01 -1.12 -0.23 0.00 -0.02 0.00 0.00 57.16 55.78 2fyh n GLU 95 Cb 0.52 -0.98 -0.04 0.00 -0.02 0.00 0.00 31.44 30.92 2fyh n GLU 95 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2fyh n ASN 96 N -4.03 0.34 -2.08 1.62 0.23 -1.26 -4.71 115.26 105.37 2fyh n ASN 96 Ca 0.10 0.33 -0.06 0.00 -0.53 0.00 0.00 54.58 54.41 2fyh n ASN 96 Cb 0.36 -0.31 0.06 0.00 -2.08 0.00 0.00 39.78 37.80 2fyh n ASN 96 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2fyh n ASP 97 N 2.06 2.56 -0.04 0.53 5.75 -1.26 -4.55 116.55 121.59 2fyh n ASP 97 Ca 0.15 -2.80 -0.10 0.00 -0.01 0.00 0.00 54.79 52.03 2fyh n ASP 97 Cb -0.02 -0.41 -0.07 0.00 -1.03 0.00 0.00 41.12 39.59 2fyh n ASP 97 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 2fyh h GLU 98 N 2.01 -0.34 -0.85 0.11 4.81 -2.00 0.19 114.58 118.52 2fyh h GLU 98 Ca 0.02 0.02 0.22 0.00 -0.13 0.00 0.00 59.36 59.49 2fyh h GLU 98 Cb 1.42 0.08 -0.14 0.00 0.63 0.00 0.00 28.75 30.74 2fyh h GLU 98 CO 0.33 -0.22 0.18 0.82 -0.73 0.00 0.00 179.01 179.38 2fyh h ILE 99 N -0.35 0.33 -0.75 2.32 1.08 -2.01 0.29 117.51 118.42 2fyh h ILE 99 Ca 0.03 -0.07 0.01 0.00 -0.39 0.00 0.00 64.86 64.45 2fyh h ILE 99 Cb 0.44 0.12 -0.04 0.00 -3.07 0.00 0.00 36.82 34.27 2fyh h ILE 99 CO -0.34 0.03 0.49 0.40 -0.69 0.00 0.00 178.15 178.05 2fyh h ILE 100 N 0.19 1.17 0.37 -0.67 2.04 -1.57 -2.80 117.51 116.24 2fyh h ILE 100 Ca 0.51 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 66.03 2fyh h ILE 100 Cb 1.00 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2fyh h ILE 100 CO -0.65 0.18 -0.36 0.11 0.00 0.00 0.00 178.15 177.43 2fyh h LYS 101 N 1.00 -0.73 -0.54 2.37 1.57 0.15 -0.89 116.57 119.50 2fyh h LYS 101 Ca 0.28 0.05 0.09 0.00 -1.87 0.00 0.00 60.65 59.20 2fyh h LYS 101 Cb -0.08 0.17 -0.10 0.00 0.08 0.00 0.00 32.23 32.29 2fyh h LYS 101 CO -0.07 -0.48 -0.41 0.87 -0.57 0.00 0.00 179.45 178.79 2fyh h LYS 102 N -0.75 -0.23 -0.24 3.15 1.57 -1.25 0.38 116.57 119.20 2fyh h LYS 102 Ca -0.03 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.82 2fyh h LYS 102 Cb 0.67 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.98 2fyh h LYS 102 CO -0.05 -0.15 -0.10 0.82 -0.57 0.00 0.00 179.45 179.39 2fyh h ILE 103 N -0.23 0.66 -0.67 1.86 2.04 -1.31 0.19 117.51 120.05 2fyh h ILE 103 Ca 0.18 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.19 2fyh h ILE 103 Cb 0.56 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 2fyh h ILE 103 CO -0.66 0.00 0.46 0.00 0.00 0.00 0.00 178.15 177.95 2fyh h ALA 104 N 1.15 2.25 0.03 1.87 0.00 0.24 0.23 119.26 125.03 2fyh h ALA 104 Ca 0.13 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2fyh h ALA 104 Cb 0.25 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.03 2fyh h ALA 104 CO -0.29 -0.43 -0.32 -0.22 0.00 0.00 0.00 179.25 178.00 2fyh h LYS 105 N 0.27 0.15 0.10 0.00 1.63 0.60 -3.11 116.57 116.21 2fyh h LYS 105 Ca 0.32 -0.21 -0.00 0.00 -0.85 0.00 0.00 60.65 59.91 2fyh h LYS 105 Cb 0.89 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 2fyh h LYS 105 CO -0.07 1.03 -0.05 1.49 -3.45 0.00 0.00 179.45 178.39 2fyh h GLU 106 N -0.61 -0.12 -0.58 1.90 4.57 0.06 0.20 114.58 119.99 2fyh h GLU 106 Ca -0.05 0.01 0.12 0.00 -1.18 0.00 0.00 59.36 58.25 2fyh h GLU 106 Cb 1.16 0.03 -0.09 0.00 -0.16 0.00 0.00 28.75 29.69 2fyh h GLU 106 CO 0.06 -0.04 0.05 0.82 -1.18 0.00 0.00 179.01 178.72 2fyh h ILE 107 N -0.17 0.58 0.18 2.32 2.04 -0.71 -2.48 117.51 119.26 2fyh h ILE 107 Ca -0.01 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 2fyh h ILE 107 Cb 0.14 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2fyh h ILE 107 CO 0.02 0.03 -0.09 -0.78 0.00 0.00 0.00 178.15 177.34 2fyh h ASP 108 N 0.17 -0.20 -0.74 1.72 1.82 -1.44 -2.99 116.42 114.75 2fyh h ASP 108 Ca 0.30 -0.28 0.19 0.00 -0.39 0.00 0.00 57.03 56.85 2fyh h ASP 108 Cb 0.47 0.05 -0.14 0.00 0.68 0.00 0.00 39.33 40.39 2fyh h ASP 108 CO -0.45 0.21 -0.04 -0.67 -1.61 0.00 0.00 179.24 176.67 2fyh n ASP 109 N -5.02 -0.14 -0.12 2.28 2.03 0.67 0.23 116.55 116.48 2fyh n ASP 109 Ca -0.09 1.26 -0.12 0.00 0.52 0.00 0.00 54.79 56.36 2fyh n ASP 109 Cb 0.25 -0.44 -0.02 0.00 -0.72 0.00 0.00 41.12 40.19 2fyh n ASP 109 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2fyh h GLU 110 N 0.00 0.84 -0.81 -0.67 4.39 -1.49 -3.12 114.58 113.72 2fyh h GLU 110 Ca 0.42 -0.39 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 2fyh h GLU 110 Cb 0.82 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.42 2fyh h GLU 110 CO -0.71 1.03 0.45 -0.07 -1.16 0.00 0.00 179.01 178.54 2fyh h LEU 111 N 0.64 1.01 -0.85 1.33 3.38 0.30 -2.74 115.31 118.39 2fyh h LEU 111 Ca 0.08 -0.10 0.35 0.00 0.09 0.00 0.00 57.88 58.30 2fyh h LEU 111 Cb 0.81 -0.26 -0.15 0.00 0.09 0.00 0.00 40.66 41.16 2fyh h LEU 111 CO 0.07 0.82 0.46 0.00 0.09 0.00 0.00 178.44 179.87 2fyh n ALA 112 N -2.38 0.87 -0.13 1.53 0.00 0.88 0.24 120.51 121.52 2fyh n ALA 112 Ca 0.08 0.85 -0.11 0.00 0.00 0.00 0.00 53.44 54.25 2fyh n ALA 112 Cb 0.09 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.67 2fyh n ALA 112 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2fyh h LYS 113 N 0.00 0.77 0.00 0.00 1.63 -1.64 -2.88 116.57 114.45 2fyh h LYS 113 Ca 0.71 -0.31 -0.05 0.00 -0.85 0.00 0.00 60.65 60.15 2fyh h LYS 113 Cb 1.90 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 33.48 2fyh h LYS 113 CO -0.64 0.92 -0.23 -0.07 -3.45 0.00 0.00 179.45 175.99 2fyh h LEU 114 N 0.58 0.00 0.00 5.20 3.38 0.30 -3.46 115.31 121.31 2fyh h LEU 114 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2fyh h LEU 114 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2fyh h LEU 114 CO 0.04 0.23 0.00 0.61 0.09 0.00 0.00 178.44 179.41 2fyh n GLY 115 N -0.82 0.57 3.17 0.83 0.00 -0.31 -5.13 105.19 103.50 2fyh n GLY 115 Ca -0.02 -0.38 -0.17 0.00 0.00 0.00 0.00 46.02 45.45 2fyh n GLY 115 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fyh s PHE 116 N 0.00 1.17 -0.06 1.61 0.40 -1.21 -4.98 117.98 114.91 2fyh s PHE 116 Ca 0.00 -0.50 -0.15 0.00 -0.60 0.00 0.00 56.93 55.67 2fyh s PHE 116 Cb 0.00 -0.65 -0.05 0.00 0.51 0.00 0.00 43.02 42.83 2fyh s PHE 116 CO 0.00 0.05 0.40 0.21 0.70 0.00 0.00 175.22 176.58 2fyh s LYS 117 N -2.00 4.07 -0.03 0.44 2.47 -1.26 -4.15 119.74 119.27 2fyh s LYS 117 Ca -0.00 0.36 0.02 0.00 -1.56 0.00 0.00 55.97 54.78 2fyh s LYS 117 Cb -0.08 -3.31 -0.03 0.00 -1.46 0.00 0.00 37.83 32.95 2fyh s LYS 117 CO 0.02 0.49 -0.06 -1.59 0.16 0.00 0.00 175.35 174.36 2fyh s LYS 118 N -0.40 2.67 -0.23 4.03 -2.85 -1.26 -5.02 119.74 116.68 2fyh s LYS 118 Ca 0.23 -0.62 -0.12 0.00 -1.00 0.00 0.00 55.97 54.45 2fyh s LYS 118 Cb -0.16 -2.56 -0.05 0.00 -2.06 0.00 0.00 37.83 33.01 2fyh s LYS 118 CO 0.11 0.64 0.24 -2.00 0.10 0.00 0.00 175.35 174.43 2fyh s GLU 119 N -1.12 4.09 0.07 1.78 2.12 -1.26 -5.01 118.70 119.37 2fyh s GLU 119 Ca 0.15 -0.13 -0.28 0.00 0.36 0.00 0.00 54.97 55.06 2fyh s GLU 119 Cb -0.11 -3.55 -0.13 0.00 0.26 0.00 0.00 34.13 30.60 2fyh s GLU 119 CO 0.05 -0.00 1.45 0.78 -0.54 0.00 0.00 175.26 176.99 2fyh h GLY 120 N 7.67 -1.17 -7.18 -1.50 0.00 -2.03 -3.38 103.07 95.48 2fyh h GLY 120 Ca -0.37 0.57 -0.66 0.00 0.00 0.00 0.00 47.33 46.88 2fyh h GLY 120 CO 0.66 -0.34 0.03 0.54 0.00 0.00 0.00 176.54 177.44 2fyh s ASN 121 N -4.05 6.31 0.07 0.19 4.22 -1.26 -5.05 114.94 115.37 2fyh s ASN 121 Ca -0.14 -0.28 -0.20 0.00 -2.14 0.00 0.00 52.86 50.10 2fyh s ASN 121 Cb 0.04 -2.29 -0.07 0.00 1.28 0.00 0.00 41.25 40.21 2fyh s ASN 121 CO 0.48 -0.66 0.59 0.12 -2.04 0.00 0.00 177.10 175.59 2fyh s PHE 122 N 2.60 3.80 -0.12 1.54 2.19 -1.26 -5.07 117.98 121.65 2fyh s PHE 122 Ca 0.20 1.29 -0.02 0.00 0.33 0.00 0.00 56.93 58.73 2fyh s PHE 122 Cb -0.15 -2.53 0.04 0.00 -1.31 0.00 0.00 43.02 39.07 2fyh s PHE 122 CO 0.16 0.55 0.03 0.08 1.83 0.00 0.00 175.22 177.87 2fyh s VAL 123 N -0.98 0.32 -0.56 3.12 1.01 -1.26 -5.06 120.40 116.99 2fyh s VAL 123 Ca 0.30 -0.11 -0.28 0.00 0.00 0.00 0.00 61.98 61.88 2fyh s VAL 123 Cb -0.20 -0.67 0.03 0.00 0.00 0.00 0.00 36.38 35.54 2fyh s VAL 123 CO 0.19 0.02 1.23 0.00 0.00 0.00 0.00 175.10 176.55 2fyh s ALA 124 N 1.98 2.98 0.08 5.51 0.00 -1.26 -4.98 121.76 126.06 2fyh s ALA 124 Ca 0.03 -0.74 -0.02 0.00 0.00 0.00 0.00 51.96 51.22 2fyh s ALA 124 Cb -0.14 -4.03 -0.04 0.00 0.00 0.00 0.00 23.12 18.91 2fyh s ALA 124 CO -0.06 -2.66 0.02 -3.38 0.00 0.00 0.00 175.76 169.68 2fyh s HIS 125 N 5.10 0.57 -0.27 0.00 -3.43 -1.26 -1.75 115.29 114.25 2fyh s HIS 125 Ca 0.46 -1.05 -0.01 0.00 -0.80 0.00 0.00 55.06 53.65 2fyh s HIS 125 Cb -0.08 -0.37 0.09 0.00 -1.43 0.00 0.00 32.58 30.79 2fyh s HIS 125 CO 0.26 -0.44 0.07 0.42 -2.00 0.00 0.00 174.74 173.04 2fyh s ILE 126 N -3.95 0.86 -0.30 -5.38 1.09 -0.74 -4.30 121.20 108.47 2fyh s ILE 126 Ca 0.11 -1.17 -0.31 0.00 -1.10 0.00 0.00 60.65 58.18 2fyh s ILE 126 Cb 0.07 -1.52 -0.08 0.00 -1.06 0.00 0.00 42.46 39.87 2fyh s ILE 126 CO -0.07 -0.50 2.22 0.41 -0.10 0.00 0.00 174.94 176.91 2fyh n THR 127 N 4.88 0.24 -0.02 2.92 -1.04 -1.26 -1.61 114.28 118.39 2fyh n THR 127 Ca -0.05 -0.37 -0.17 0.00 -2.04 0.00 0.00 64.05 61.41 2fyh n THR 127 Cb 0.44 -2.10 -0.07 0.00 -1.82 0.00 0.00 70.33 66.77 2fyh n THR 127 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2fyh h LEU 128 N 13.96 0.94 0.00 -4.42 3.38 -0.89 -3.45 115.31 124.83 2fyh h LEU 128 Ca -0.33 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.02 2fyh h LEU 128 Cb 1.28 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2fyh h LEU 128 CO 1.00 1.42 0.00 0.61 0.09 0.00 0.00 178.44 181.56 2fyh n GLY 129 N 0.72 -1.35 3.24 0.83 0.00 -1.05 -1.09 105.19 106.48 2fyh n GLY 129 Ca -0.08 -1.00 -0.24 0.00 0.00 0.00 0.00 46.02 44.70 2fyh n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fyh s ARG 130 N -1.47 1.23 -0.16 1.61 0.52 -1.23 -1.20 118.95 118.25 2fyh s ARG 130 Ca 0.00 -0.95 -0.18 0.00 -0.52 0.00 0.00 55.73 54.07 2fyh s ARG 130 Cb 0.00 -1.35 -0.04 0.00 0.52 0.00 0.00 34.95 34.08 2fyh s ARG 130 CO 0.00 0.34 0.50 0.08 0.02 0.00 0.00 175.30 176.23 2fyh s VAL 131 N -0.90 5.15 -0.13 3.52 1.01 0.10 -1.53 120.40 127.63 2fyh s VAL 131 Ca 0.06 0.95 -0.11 0.00 0.00 0.00 0.00 61.98 62.88 2fyh s VAL 131 Cb -0.09 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 2fyh s VAL 131 CO 0.02 0.25 -0.21 1.17 0.00 0.00 0.00 175.10 176.34 2fyh n LYS 132 N 4.21 0.38 -3.72 2.72 3.00 0.66 -4.91 118.16 120.50 2fyh n LYS 132 Ca -0.06 0.32 -0.12 0.00 -0.00 0.00 0.00 58.31 58.45 2fyh n LYS 132 Cb 0.51 -1.36 -0.11 0.00 0.00 0.00 0.00 35.03 34.06 2fyh n LYS 132 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.40 176.81 2fyh s PHE 133 N -2.23 -0.48 0.06 5.64 -0.12 -1.25 -5.01 117.98 114.59 2fyh s PHE 133 Ca -0.17 1.08 0.04 0.00 -0.05 0.00 0.00 56.93 57.82 2fyh s PHE 133 Cb 0.02 0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.56 2fyh s PHE 133 CO 0.25 -0.28 -0.11 0.54 -0.05 0.00 0.00 175.22 175.58 2fyh s VAL 134 N 1.08 0.84 -0.12 -2.49 0.11 -1.26 -0.74 120.40 117.82 2fyh s VAL 134 Ca -0.07 -1.26 -0.06 0.00 -2.93 0.00 0.00 61.98 57.66 2fyh s VAL 134 Cb -0.08 -0.91 -0.05 0.00 -1.53 0.00 0.00 36.38 33.81 2fyh s VAL 134 CO -0.09 -0.34 -0.16 0.29 -3.33 0.00 0.00 175.10 171.47 2fyh n LYS 135 N 1.25 0.27 -2.44 1.54 5.02 -1.22 -4.94 118.16 117.64 2fyh n LYS 135 Ca -0.21 0.12 -0.43 0.00 -2.02 0.00 0.00 58.31 55.77 2fyh n LYS 135 Cb 0.55 -0.95 -0.02 0.00 -0.02 0.00 0.00 35.03 34.59 2fyh n LYS 135 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2fyh s ASP 136 N -6.12 6.39 -0.02 4.39 2.15 -1.26 -4.91 116.67 117.28 2fyh s ASP 136 Ca -0.17 0.59 -0.10 0.00 0.43 0.00 0.00 52.55 53.30 2fyh s ASP 136 Cb 0.06 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 40.09 2fyh s ASP 136 CO 0.22 -1.44 0.57 0.11 -0.17 0.00 0.00 175.17 174.46 2fyh h LYS 137 N 10.30 -0.34 -0.87 4.34 6.56 -2.00 -3.31 116.57 131.25 2fyh h LYS 137 Ca -0.26 0.02 0.15 0.00 -1.06 0.00 0.00 60.65 59.50 2fyh h LYS 137 Cb 1.09 0.08 -0.15 0.00 -0.57 0.00 0.00 32.23 32.68 2fyh h LYS 137 CO 1.12 -0.23 -0.30 1.28 -2.06 0.00 0.00 179.45 179.26 2fyh n LEU 138 N -3.92 -0.49 -0.32 2.94 4.77 -1.26 0.11 117.00 118.84 2fyh n LEU 138 Ca -0.04 1.51 0.21 0.00 -0.03 0.00 0.00 56.01 57.66 2fyh n LEU 138 Cb 0.14 -0.38 0.41 0.00 -2.33 0.00 0.00 43.42 41.26 2fyh n LEU 138 CO 0.11 -1.39 1.00 1.23 -1.33 0.00 0.00 177.39 177.01 2fyh h GLY 139 N 0.00 1.77 0.17 -0.72 0.00 -1.98 0.99 103.07 103.30 2fyh h GLY 139 Ca 0.34 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2fyh h GLY 139 CO -0.87 -0.52 -0.33 1.41 0.00 0.00 0.00 176.54 176.22 2fyh h LEU 140 N 0.17 -0.97 0.95 3.11 3.38 0.76 -0.84 115.31 121.87 2fyh h LEU 140 Ca 0.68 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.70 2fyh h LEU 140 Cb 1.55 0.34 0.01 0.00 0.09 0.00 0.00 40.66 42.66 2fyh h LEU 140 CO -0.70 -0.38 -0.45 0.00 0.09 0.00 0.00 178.44 176.99 2fyh h ALA 141 N -1.03 -1.27 -1.07 1.53 0.00 -1.26 -2.35 119.26 113.81 2fyh h ALA 141 Ca -0.02 -0.28 0.41 0.00 0.00 0.00 0.00 54.91 55.02 2fyh h ALA 141 Cb 0.51 0.49 -0.15 0.00 0.00 0.00 0.00 17.79 18.65 2fyh h ALA 141 CO -0.13 -1.18 0.64 -1.33 0.00 0.00 0.00 179.25 177.25 2fyh n MET 142 N -5.61 -0.05 0.20 0.00 2.81 0.22 -0.20 117.12 114.49 2fyh n MET 142 Ca -0.16 1.21 -0.10 0.00 -1.81 0.00 0.00 57.70 56.85 2fyh n MET 142 Cb 0.50 -2.27 -0.05 0.00 -0.71 0.00 0.00 33.22 30.69 2fyh n MET 142 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 2fyh h LYS 143 N 0.00 -0.55 -0.94 0.03 3.64 -0.88 -3.16 116.57 114.70 2fyh h LYS 143 Ca 0.79 0.04 0.15 0.00 -1.27 0.00 0.00 60.65 60.36 2fyh h LYS 143 Cb 2.31 0.13 -0.15 0.00 -0.41 0.00 0.00 32.23 34.10 2fyh h LYS 143 CO -0.58 -0.32 -0.37 1.28 -2.27 0.00 0.00 179.45 177.19 2fyh n LEU 144 N -5.16 -0.61 -0.29 5.20 4.77 0.72 0.13 117.00 121.75 2fyh n LEU 144 Ca -0.08 1.65 0.09 0.00 -0.03 0.00 0.00 56.01 57.64 2fyh n LEU 144 Cb 0.25 -0.38 0.24 0.00 -2.33 0.00 0.00 43.42 41.21 2fyh n LEU 144 CO 0.20 -1.48 1.07 0.11 -1.33 0.00 0.00 177.39 175.96 2fyh h LYS 145 N 0.00 0.50 -0.52 3.23 1.57 -1.48 0.26 116.57 120.13 2fyh h LYS 145 Ca 0.33 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 59.01 2fyh h LYS 145 Cb 0.56 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 2fyh h LYS 145 CO -0.94 0.33 0.04 0.93 -0.57 0.00 0.00 179.45 179.24 2fyh h GLU 146 N 0.51 0.84 -0.89 3.15 4.39 0.10 -2.92 114.58 119.77 2fyh h GLU 146 Ca 0.49 -0.22 -0.62 0.00 0.34 0.00 0.00 59.36 59.35 2fyh h GLU 146 Cb 0.78 -0.10 -0.33 0.00 -0.10 0.00 0.00 28.75 28.99 2fyh h GLU 146 CO -0.43 0.82 0.25 1.28 -1.16 0.00 0.00 179.01 179.77 2fyh n LEU 147 N -4.23 6.61 -0.11 1.33 4.32 0.35 -4.29 117.00 120.97 2fyh n LEU 147 Ca 0.03 -4.42 -0.16 0.00 -0.02 0.00 0.00 56.01 51.43 2fyh n LEU 147 Cb 0.28 -0.74 -0.13 0.00 -1.62 0.00 0.00 43.42 41.21 2fyh n LEU 147 CO 0.41 1.68 -1.25 0.00 -1.22 0.00 0.00 177.39 177.01 2fyh n ALA 148 N -0.86 1.41 -0.03 -1.18 0.00 0.63 -4.44 120.51 116.04 2fyh n ALA 148 Ca 0.55 -1.11 0.01 0.00 0.00 0.00 0.00 53.44 52.89 2fyh n ALA 148 Cb 0.80 -0.18 -0.10 0.00 0.00 0.00 0.00 19.45 19.98 2fyh n ALA 148 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2fyh n ASN 149 N -3.17 2.03 -3.52 0.00 4.13 -1.26 -4.15 115.26 109.31 2fyh n ASN 149 Ca -0.42 0.00 -0.50 0.00 1.68 0.00 0.00 54.58 55.35 2fyh n ASN 149 Cb 1.03 1.22 -0.07 0.00 -1.54 0.00 0.00 39.78 40.42 2fyh n ASN 149 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 2fyh n GLU 150 N -2.18 0.00 -3.05 3.52 0.00 -1.26 -4.66 120.64 113.01 2fyh n GLU 150 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 57.16 56.75 2fyh n GLU 150 Cb 0.60 -1.12 -0.04 0.00 0.00 0.00 0.00 31.44 30.88 2fyh n GLU 150 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2fyh s ASP 151 N 1.84 6.56 -0.08 4.31 2.15 -1.26 -4.20 116.67 125.99 2fyh s ASP 151 Ca 0.77 1.06 0.05 0.00 0.43 0.00 0.00 52.55 54.85 2fyh s ASP 151 Cb -1.09 -2.29 -0.08 0.00 -0.30 0.00 0.00 42.92 39.16 2fyh s ASP 151 CO 0.58 -0.30 -0.01 0.49 -0.17 0.00 0.00 175.17 175.76 2fyh n PHE 152 N -0.96 0.00 0.00 -5.34 3.72 -0.90 -4.99 117.46 108.98 2fyh n PHE 152 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 2fyh n PHE 152 Cb 0.54 -0.37 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 2fyh n PHE 152 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2fyh n GLY 153 N 2.72 0.90 3.20 1.37 0.00 -1.24 -4.56 105.19 107.58 2fyh n GLY 153 Ca -0.14 -1.95 -0.09 0.00 0.00 0.00 0.00 46.02 43.84 2fyh n GLY 153 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fyh s SER 154 N -4.00 0.13 0.17 1.61 0.01 -1.26 -0.76 113.70 109.60 2fyh s SER 154 Ca 0.00 -0.65 -0.24 0.00 1.31 0.00 0.00 55.95 56.37 2fyh s SER 154 Cb 0.00 0.33 0.06 0.00 0.21 0.00 0.00 66.02 66.62 2fyh s SER 154 CO 0.00 -0.71 0.92 0.72 0.41 0.00 0.00 173.24 174.58 2fyh s PHE 155 N -3.77 -0.14 -0.14 2.43 -0.12 -0.26 -4.96 117.98 111.02 2fyh s PHE 155 Ca 0.04 -0.19 -0.01 0.00 -0.05 0.00 0.00 56.93 56.72 2fyh s PHE 155 Cb 0.05 0.65 -0.02 0.00 -0.63 0.00 0.00 43.02 43.07 2fyh s PHE 155 CO -0.10 -0.89 -0.10 0.42 -0.05 0.00 0.00 175.22 174.49 2fyh s ILE 156 N -3.39 3.30 -0.70 -4.49 1.01 -1.26 -1.55 121.20 114.12 2fyh s ILE 156 Ca 0.12 -0.57 -0.25 0.00 0.00 0.00 0.00 60.65 59.95 2fyh s ILE 156 Cb -0.02 -2.41 0.05 0.00 0.01 0.00 0.00 42.46 40.09 2fyh s ILE 156 CO 0.03 0.52 1.12 -0.69 0.00 0.00 0.00 174.94 175.92 2fyh s VAL 157 N 0.35 4.03 -0.00 2.92 1.01 -1.17 -4.85 120.40 122.68 2fyh s VAL 157 Ca -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.89 2fyh s VAL 157 Cb -0.15 -4.80 -0.00 0.00 0.00 0.00 0.00 36.38 31.42 2fyh s VAL 157 CO 0.05 -1.66 -0.00 -0.62 0.00 0.00 0.00 175.10 172.87 2fyh n GLU 158 N 8.52 0.01 -2.26 2.72 4.71 -1.26 -4.41 120.64 128.67 2fyh n GLU 158 Ca -0.00 0.03 -0.26 0.00 -0.01 0.00 0.00 57.16 56.92 2fyh n GLU 158 Cb 0.47 -0.54 0.13 0.00 -1.01 0.00 0.00 31.44 30.49 2fyh n GLU 158 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2fyh s ALA 159 N -3.00 3.03 0.09 0.62 0.00 -1.26 -4.90 121.76 116.35 2fyh s ALA 159 Ca -0.00 -1.36 0.05 0.00 0.00 0.00 0.00 51.96 50.65 2fyh s ALA 159 Cb 0.00 -2.42 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 2fyh s ALA 159 CO 0.00 -1.80 -0.13 0.42 0.00 0.00 0.00 175.76 174.26 2fyh s ILE 160 N -3.45 1.12 -0.07 0.00 1.01 -0.78 -4.69 121.20 114.33 2fyh s ILE 160 Ca 0.68 -1.53 0.02 0.00 0.00 0.00 0.00 60.65 59.82 2fyh s ILE 160 Cb -0.06 -1.29 0.02 0.00 0.01 0.00 0.00 42.46 41.14 2fyh s ILE 160 CO 0.48 -0.39 -0.10 -0.70 0.00 0.00 0.00 174.94 174.23 2fyh s GLU 161 N -2.33 1.58 -0.19 2.79 -6.30 -0.79 -2.42 118.70 111.04 2fyh s GLU 161 Ca 0.03 -0.35 -0.01 0.00 -2.50 0.00 0.00 54.97 52.14 2fyh s GLU 161 Cb -0.06 -1.39 0.00 0.00 0.00 0.00 0.00 34.13 32.68 2fyh s GLU 161 CO 0.02 -0.05 -0.13 -1.17 0.02 0.00 0.00 175.26 173.95 2fyh s LEU 162 N 0.92 2.51 0.15 2.70 2.96 -0.54 -0.22 118.68 127.16 2fyh s LEU 162 Ca -0.10 -0.51 0.07 0.00 -0.22 0.00 0.00 54.13 53.38 2fyh s LEU 162 Cb -0.15 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 2fyh s LEU 162 CO 0.01 0.01 -0.16 -0.54 -1.32 0.00 0.00 176.35 174.34 2fyh s LYS 163 N 1.29 1.19 0.11 1.98 1.02 -0.80 -1.29 119.74 123.23 2fyh s LYS 163 Ca 0.04 -1.36 0.07 0.00 0.02 0.00 0.00 55.97 54.73 2fyh s LYS 163 Cb -0.14 -1.15 -0.03 0.00 -0.52 0.00 0.00 37.83 35.98 2fyh s LYS 163 CO -0.07 0.23 -0.17 -1.59 -0.92 0.00 0.00 175.35 172.83 2fyh s LYS 164 N -2.84 1.04 -0.03 1.68 -2.85 0.69 -1.24 119.74 116.17 2fyh s LYS 164 Ca 0.14 -1.15 0.06 0.00 -1.00 0.00 0.00 55.97 54.02 2fyh s LYS 164 Cb -0.05 -1.12 -0.02 0.00 -2.06 0.00 0.00 37.83 34.58 2fyh s LYS 164 CO 0.05 0.24 -0.22 0.45 0.10 0.00 0.00 175.35 175.97 2fyh s SER 165 N -2.07 3.35 -0.29 0.03 0.15 -0.98 -1.69 113.70 112.20 2fyh s SER 165 Ca 0.06 -0.39 -0.02 0.00 0.70 0.00 0.00 55.95 56.29 2fyh s SER 165 Cb -0.08 -0.55 0.10 0.00 -1.71 0.00 0.00 66.02 63.77 2fyh s SER 165 CO 0.04 0.32 0.10 -0.89 1.20 0.00 0.00 173.24 174.01 2fyh s THR 166 N -0.59 0.50 0.09 6.45 2.01 0.45 -2.25 115.64 122.30 2fyh s THR 166 Ca 0.09 -1.09 -0.31 0.00 0.31 0.00 0.00 61.69 60.69 2fyh s THR 166 Cb -0.11 -1.36 -0.08 0.00 0.01 0.00 0.00 72.50 70.97 2fyh s THR 166 CO -0.00 -0.65 1.49 -0.76 -0.69 0.00 0.00 174.62 174.00 2fyh s LEU 167 N 1.82 4.36 0.14 4.42 1.43 -1.26 -1.21 118.68 128.38 2fyh s LEU 167 Ca 0.09 2.38 0.05 0.00 -1.03 0.00 0.00 54.13 55.62 2fyh s LEU 167 Cb -0.17 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 2fyh s LEU 167 CO -0.28 -0.75 -0.12 0.42 0.23 0.00 0.00 176.35 175.85 2fyh s THR 168 N 1.68 1.24 0.51 5.49 -4.23 -0.49 -4.92 115.64 114.92 2fyh s THR 168 Ca 0.68 -1.94 0.33 0.00 -1.18 0.00 0.00 61.69 59.58 2fyh s THR 168 Cb -0.38 -1.72 0.52 0.00 1.34 0.00 0.00 72.50 72.26 2fyh s THR 168 CO 0.30 -0.62 1.79 -0.65 -0.54 0.00 0.00 174.62 174.90 2fyh h PRO 169 N 3.04 0.08 0.09 3.99 0.11 -2.04 0.42 132.00 137.70 2fyh h PRO 169 Ca -0.38 -0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.47 2fyh h PRO 169 Cb 1.19 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2fyh h PRO 169 CO 0.59 0.05 -1.20 1.57 -0.21 0.00 0.00 178.00 178.79 2fyh h LYS 170 N 0.08 0.20 0.00 1.05 2.10 -2.00 -3.50 116.57 114.51 2fyh h LYS 170 Ca 0.58 -0.34 0.00 0.00 -2.00 0.00 0.00 60.65 58.89 2fyh h LYS 170 Cb 2.12 0.13 0.00 0.00 -0.90 0.00 0.00 32.23 33.58 2fyh h LYS 170 CO -0.08 1.15 0.00 0.41 -2.00 0.00 0.00 179.45 178.93 2fyh n GLY 171 N 1.49 0.10 3.67 0.07 0.00 0.15 -5.11 105.19 105.57 2fyh n GLY 171 Ca -0.07 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 2fyh n GLY 171 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fyh s PRO 172 N -1.98 4.22 -0.10 1.61 0.04 -1.26 -1.40 135.00 136.14 2fyh s PRO 172 Ca 0.00 2.03 -0.11 0.00 0.04 0.00 0.00 61.00 62.96 2fyh s PRO 172 Cb 0.00 -3.79 -0.05 0.00 0.04 0.00 0.00 34.50 30.70 2fyh s PRO 172 CO 0.00 -0.73 0.24 0.42 0.04 0.00 0.00 177.00 176.97 2fyh s ILE 173 N 3.34 5.33 -0.17 0.56 -1.09 -0.35 -4.95 121.20 123.87 2fyh s ILE 173 Ca 0.67 0.45 -0.00 0.00 -2.23 0.00 0.00 60.65 59.54 2fyh s ILE 173 Cb -0.31 -3.53 0.04 0.00 -1.58 0.00 0.00 42.46 37.08 2fyh s ILE 173 CO 0.26 0.56 -0.06 -0.31 -1.23 0.00 0.00 174.94 174.16 2fyh s TYR 174 N -0.72 1.79 0.12 3.97 1.51 -1.26 -0.41 117.35 122.34 2fyh s TYR 174 Ca 0.17 -1.15 0.03 0.00 -1.01 0.00 0.00 57.07 55.11 2fyh s TYR 174 Cb -0.13 -1.35 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 2fyh s TYR 174 CO 0.06 -0.63 -0.09 -2.00 -1.11 0.00 0.00 175.55 171.78 2fyh s GLU 175 N 1.60 0.92 0.15 -0.62 2.56 -0.68 -5.01 118.70 117.62 2fyh s GLU 175 Ca 0.00 -1.32 -0.11 0.00 0.00 0.00 0.00 54.97 53.54 2fyh s GLU 175 Cb -0.15 -0.46 -0.07 0.00 2.00 0.00 0.00 34.13 35.45 2fyh s GLU 175 CO -0.08 0.05 0.50 0.99 -0.56 0.00 0.00 175.26 176.16 2fyh s THR 176 N -3.12 4.95 -0.10 -1.70 2.01 -1.26 -0.23 115.64 116.20 2fyh s THR 176 Ca 0.11 0.60 -0.01 0.00 0.31 0.00 0.00 61.69 62.70 2fyh s THR 176 Cb 0.02 -3.68 -0.06 0.00 0.01 0.00 0.00 72.50 68.79 2fyh s THR 176 CO -0.01 0.17 -0.10 0.18 -0.69 0.00 0.00 174.62 174.16 2fyh n LEU 177 N 0.56 2.36 -3.87 4.42 4.77 -0.41 -4.85 117.00 119.97 2fyh n LEU 177 Ca -0.04 -0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.82 2fyh n LEU 177 Cb 0.52 -0.34 -0.13 0.00 -2.33 0.00 0.00 43.42 41.14 2fyh n LEU 177 CO 0.43 0.54 -0.33 0.00 -1.33 0.00 0.00 177.39 176.70 2fyh s ALA 178 N -2.20 -0.05 -0.24 -1.18 0.00 -1.05 -5.04 121.76 112.00 2fyh s ALA 178 Ca -0.14 -0.00 -0.03 0.00 0.00 0.00 0.00 51.96 51.79 2fyh s ALA 178 Cb 0.04 -0.02 0.08 0.00 0.00 0.00 0.00 23.12 23.22 2fyh s ALA 178 CO 0.22 -0.03 0.08 0.50 0.00 0.00 0.00 175.76 176.53 2fyh s ARG 179 N -0.18 0.45 -0.46 0.00 3.52 -1.26 -1.47 118.95 119.54 2fyh s ARG 179 Ca -0.02 -0.54 -0.06 0.00 -0.13 0.00 0.00 55.73 54.98 2fyh s ARG 179 Cb -0.01 -1.79 0.12 0.00 -1.56 0.00 0.00 34.95 31.71 2fyh s ARG 179 CO -0.00 -0.82 0.29 -0.06 -0.81 0.00 0.00 175.30 173.90 2fyh s PHE 180 N 1.91 3.51 -0.12 5.12 0.08 -1.01 -5.06 117.98 122.41 2fyh s PHE 180 Ca 0.05 -2.20 -0.10 0.00 0.12 0.00 0.00 56.93 54.79 2fyh s PHE 180 Cb -0.17 -3.35 -0.05 0.00 -0.57 0.00 0.00 43.02 38.88 2fyh s PHE 180 CO -0.20 -0.97 0.22 -2.00 -0.10 0.00 0.00 175.22 172.17 2fyh s GLU 181 N 1.13 3.80 0.04 0.44 2.56 -1.26 -1.87 118.70 123.54 2fyh s GLU 181 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 54.97 55.01 2fyh s GLU 181 Cb -0.24 -3.28 -0.01 0.00 2.00 0.00 0.00 34.13 32.60 2fyh s GLU 181 CO -0.03 0.59 -0.07 1.28 -0.56 0.00 0.00 175.26 176.47 2fyh n LEU 182 N 2.49 1.24 -4.15 2.70 4.77 -1.26 -5.00 117.00 117.79 2fyh n LEU 182 Ca -0.17 0.17 -0.35 0.00 -0.03 0.00 0.00 56.01 55.64 2fyh n LEU 182 Cb 0.53 -0.41 0.07 0.00 -2.33 0.00 0.00 43.42 41.28 2fyh n LEU 182 CO 0.35 -0.65 -0.91 -0.24 -1.33 0.00 0.00 177.39 174.61 2fyh n SER 183 N -3.65 -4.47 -4.13 -1.43 2.88 -1.26 -5.02 113.62 96.54 2fyh n SER 183 Ca -0.03 0.22 -0.11 0.00 -1.33 0.00 0.00 58.87 57.62 2fyh n SER 183 Cb 0.10 -0.91 -0.09 0.00 -0.75 0.00 0.00 64.21 62.56 2fyh n SER 183 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2fyh s GLU 184 N -2.61 1.23 -0.57 -1.46 2.02 -1.26 -5.12 118.70 110.94 2fyh s GLU 184 Ca 0.46 -1.48 0.02 0.00 0.02 0.00 0.00 54.97 53.99 2fyh s GLU 184 Cb -0.18 0.32 0.14 0.00 0.10 0.00 0.00 34.13 34.51 2fyh s GLU 184 CO 0.77 -0.43 0.33 -3.38 0.02 0.00 0.00 175.26 172.57 2fyh s HIS 185 N -4.10 3.27 -0.09 1.61 -3.43 -1.26 -4.89 115.29 106.41 2fyh s HIS 185 Ca 0.31 -3.09 -0.10 0.00 -0.80 0.00 0.00 55.06 51.38 2fyh s HIS 185 Cb 0.05 -2.91 -0.04 0.00 -1.43 0.00 0.00 32.58 28.25 2fyh s HIS 185 CO 0.09 -0.75 -0.21 0.72 -2.00 0.00 0.00 174.74 172.59 2fyh n HIS 186 N 3.08 0.00 -3.91 0.38 8.25 -1.26 -4.89 115.22 116.87 2fyh n HIS 186 Ca 0.07 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.25 2fyh n HIS 186 Cb 0.34 -0.35 -0.13 0.00 1.12 0.00 0.00 29.99 30.97 2fyh n HIS 186 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2fyh s HIS 187 N -2.50 3.44 -0.60 4.41 -3.43 -1.26 -4.95 115.29 110.40 2fyh s HIS 187 Ca -0.18 -3.29 0.04 0.00 -0.80 0.00 0.00 55.06 50.83 2fyh s HIS 187 Cb 0.04 -2.72 0.15 0.00 -1.43 0.00 0.00 32.58 28.61 2fyh s HIS 187 CO 0.26 -0.60 0.37 -1.58 -2.00 0.00 0.00 174.74 171.20 2fyh s HIS 188 N -1.12 3.18 -1.49 0.38 5.04 -1.26 -4.85 115.29 115.17 2fyh s HIS 188 Ca 0.23 -3.16 -0.16 0.00 -1.54 0.00 0.00 55.06 50.43 2fyh s HIS 188 Cb -0.11 -2.61 0.16 0.00 0.04 0.00 0.00 32.58 30.06 2fyh s HIS 188 CO -0.12 -0.65 0.39 0.72 -2.34 0.00 0.00 174.74 172.74 2fyh n HIS 189 N 2.59 -0.97 1.01 3.88 8.25 -1.26 -5.21 115.22 123.51 2fyh n HIS 189 Ca 0.13 0.55 0.12 0.00 -0.26 0.00 0.00 57.72 58.26 2fyh n HIS 189 Cb 0.34 -1.68 0.11 0.00 1.12 0.00 0.00 29.99 29.88 2fyh n HIS 189 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56