#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 2.02 0.33 2.12 0.52 -0.04 -3.84 118.95 120.07 2fyh s ARG 2 Ca 0.00 0.30 -0.09 0.00 -0.52 0.00 0.00 55.73 55.41 2fyh s ARG 2 Cb 0.00 -4.85 -0.06 0.00 0.52 0.00 0.00 34.95 30.56 2fyh s ARG 2 CO 0.00 -3.91 0.67 0.00 0.02 0.00 0.00 175.30 172.08 2fyh s ALA 3 N 12.70 3.46 -0.20 2.13 0.00 -0.33 0.60 121.76 140.12 2fyh s ALA 3 Ca 0.84 -0.29 -0.28 0.00 0.00 0.00 0.00 51.96 52.23 2fyh s ALA 3 Cb -0.11 -2.55 0.12 0.00 0.00 0.00 0.00 23.12 20.58 2fyh s ALA 3 CO 0.07 0.18 0.99 -0.59 0.00 0.00 0.00 175.76 176.42 2fyh s PHE 4 N -2.16 -0.43 0.19 0.00 -0.71 -0.75 -2.01 117.98 112.11 2fyh s PHE 4 Ca 0.49 0.86 0.00 0.00 -1.04 0.00 0.00 56.93 57.24 2fyh s PHE 4 Cb -0.11 0.41 -0.04 0.00 -1.21 0.00 0.00 43.02 42.08 2fyh s PHE 4 CO 0.28 -0.31 0.36 0.96 -1.34 0.00 0.00 175.22 175.17 2fyh s ILE 5 N -0.59 5.24 0.10 -4.49 -4.36 -1.18 -2.00 121.20 113.93 2fyh s ILE 5 Ca -0.00 -0.45 -0.10 0.00 -0.26 0.00 0.00 60.65 59.84 2fyh s ILE 5 Cb -0.02 -3.73 0.01 0.00 1.25 0.00 0.00 42.46 39.96 2fyh s ILE 5 CO -0.01 -0.15 0.24 0.00 0.24 0.00 0.00 174.94 175.26 2fyh s ALA 6 N -1.83 -0.36 -0.42 2.27 0.00 0.10 -2.79 121.76 118.73 2fyh s ALA 6 Ca 0.37 -0.52 -0.11 0.00 0.00 0.00 0.00 51.96 51.70 2fyh s ALA 6 Cb -0.11 0.56 0.07 0.00 0.00 0.00 0.00 23.12 23.64 2fyh s ALA 6 CO 0.29 -0.55 0.28 0.42 0.00 0.00 0.00 175.76 176.20 2fyh s ILE 7 N -3.86 4.53 0.15 0.00 1.01 -0.78 -1.89 121.20 120.36 2fyh s ILE 7 Ca 0.06 -1.21 -0.22 0.00 0.00 0.00 0.00 60.65 59.28 2fyh s ILE 7 Cb 0.04 -3.70 -0.13 0.00 0.01 0.00 0.00 42.46 38.68 2fyh s ILE 7 CO -0.10 -0.46 0.41 -0.67 0.00 0.00 0.00 174.94 174.11 2fyh n ASP 8 N 5.00 -0.94 -3.89 3.58 2.03 -1.26 -3.84 116.55 117.23 2fyh n ASP 8 Ca -0.11 0.87 -0.30 0.00 0.52 0.00 0.00 54.79 55.78 2fyh n ASP 8 Cb 0.44 -0.73 -0.14 0.00 -0.72 0.00 0.00 41.12 39.97 2fyh n ASP 8 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2fyh s VAL 9 N -0.75 2.34 0.99 5.18 -7.23 -1.26 -4.94 120.40 114.73 2fyh s VAL 9 Ca 0.50 -3.26 -0.17 0.00 -1.81 0.00 0.00 61.98 57.24 2fyh s VAL 9 Cb -0.73 -2.62 -0.10 0.00 0.56 0.00 0.00 36.38 33.50 2fyh s VAL 9 CO 0.43 -0.85 -0.52 -0.24 -0.31 0.00 0.00 175.10 173.62 2fyh n SER 10 N 3.07 -4.67 -0.42 4.85 2.88 -1.26 -3.89 113.62 114.19 2fyh n SER 10 Ca 0.08 0.20 0.34 0.00 -1.33 0.00 0.00 58.87 58.15 2fyh n SER 10 Cb 0.33 -0.87 0.63 0.00 -0.75 0.00 0.00 64.21 63.55 2fyh n SER 10 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2fyh h GLU 11 N -1.18 0.15 -1.21 -1.46 4.11 -1.99 0.28 114.58 113.28 2fyh h GLU 11 Ca -0.44 -0.01 0.40 0.00 0.07 0.00 0.00 59.36 59.38 2fyh h GLU 11 Cb 1.30 -0.03 -0.13 0.00 0.50 0.00 0.00 28.75 30.39 2fyh h GLU 11 CO 0.26 0.10 0.76 1.03 0.07 0.00 0.00 179.01 181.23 2fyh h SER 12 N 0.16 0.31 0.00 3.06 0.87 -1.94 0.13 113.55 116.15 2fyh h SER 12 Ca 0.75 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 61.46 2fyh h SER 12 Cb 2.33 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 64.42 2fyh h SER 12 CO -0.34 -0.17 -0.88 0.52 -0.53 0.00 0.00 176.83 175.44 2fyh n VAL 13 N -4.79 1.44 -0.36 2.23 0.31 0.96 -4.11 118.33 114.01 2fyh n VAL 13 Ca 0.35 0.17 -0.05 0.00 -0.01 0.00 0.00 64.34 64.80 2fyh n VAL 13 Cb 1.29 -2.33 -0.01 0.00 -0.91 0.00 0.00 33.84 31.87 2fyh n VAL 13 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2fyh h ARG 14 N -0.97 -0.04 -0.75 5.55 3.08 -1.27 1.19 114.38 121.17 2fyh h ARG 14 Ca 0.00 0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.21 2fyh h ARG 14 Cb 0.88 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.89 2fyh h ARG 14 CO 0.00 -0.03 0.50 0.22 -1.07 0.00 0.00 179.97 179.60 2fyh h ASP 15 N -0.04 0.32 0.58 7.04 3.58 -0.99 -0.92 116.42 125.99 2fyh h ASP 15 Ca 0.27 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.71 2fyh h ASP 15 Cb 0.54 -0.04 0.01 0.00 1.72 0.00 0.00 39.33 41.56 2fyh h ASP 15 CO -0.92 0.16 -0.28 0.00 -2.88 0.00 0.00 179.24 175.32 2fyh h ALA 16 N 1.65 -0.79 -0.82 -0.78 0.00 0.12 -2.23 119.26 116.40 2fyh h ALA 16 Ca 0.37 -0.17 0.16 0.00 0.00 0.00 0.00 54.91 55.26 2fyh h ALA 16 Cb 0.95 0.30 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 2fyh h ALA 16 CO -0.10 -0.74 0.38 -0.07 0.00 0.00 0.00 179.25 178.72 2fyh h LEU 17 N -1.19 0.40 -0.81 0.00 3.38 -0.75 -0.11 115.31 116.23 2fyh h LEU 17 Ca -0.08 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2fyh h LEU 17 Cb 0.60 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 2fyh h LEU 17 CO 0.13 0.14 0.52 0.58 0.09 0.00 0.00 178.44 179.90 2fyh h VAL 18 N 0.51 1.21 -0.85 1.22 2.07 -1.22 -2.45 116.25 116.76 2fyh h VAL 18 Ca 0.46 -0.41 0.17 0.00 0.82 0.00 0.00 66.70 67.75 2fyh h VAL 18 Cb 0.72 0.04 -0.11 0.00 -1.52 0.00 0.00 31.29 30.42 2fyh h VAL 18 CO -0.41 0.21 0.39 -0.09 0.02 0.00 0.00 177.57 177.69 2fyh h ARG 19 N 1.10 0.48 -0.10 1.57 2.43 -0.37 -1.22 114.38 118.27 2fyh h ARG 19 Ca 0.29 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 2fyh h ARG 19 Cb -0.10 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.33 2fyh h ARG 19 CO -0.06 0.32 0.01 0.00 -1.51 0.00 0.00 179.97 178.73 2fyh h ALA 20 N 1.61 0.14 -0.22 2.80 0.00 -1.32 -3.20 119.26 119.06 2fyh h ALA 20 Ca 0.49 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.28 2fyh h ALA 20 Cb 0.80 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 2fyh h ALA 20 CO -0.43 -0.20 -0.49 1.96 0.00 0.00 0.00 179.25 180.08 2fyh h GLN 21 N -0.07 -0.47 -0.98 0.00 4.20 -1.01 0.44 115.11 117.22 2fyh h GLN 21 Ca 0.03 0.03 0.33 0.00 0.06 0.00 0.00 58.65 59.10 2fyh h GLN 21 Cb 0.30 0.11 -0.16 0.00 0.30 0.00 0.00 27.48 28.03 2fyh h GLN 21 CO 0.00 -0.31 0.40 0.22 -0.67 0.00 0.00 178.83 178.46 2fyh h ASP 22 N -0.49 0.17 -0.02 1.46 3.58 -1.43 0.22 116.42 119.91 2fyh h ASP 22 Ca 0.07 0.23 -0.01 0.00 0.42 0.00 0.00 57.03 57.74 2fyh h ASP 22 Cb 0.64 0.27 -0.00 0.00 1.72 0.00 0.00 39.33 41.96 2fyh h ASP 22 CO -0.47 -0.28 -0.03 0.22 -2.88 0.00 0.00 179.24 175.79 2fyh h TYR 23 N 0.13 0.07 -0.91 0.28 3.20 -1.01 -3.26 116.97 115.48 2fyh h TYR 23 Ca 0.71 -0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.72 2fyh h TYR 23 Cb 1.68 -0.01 -0.16 0.00 1.54 0.00 0.00 36.73 39.78 2fyh h TYR 23 CO -0.15 0.56 -0.33 0.82 -1.64 0.00 0.00 178.16 177.42 2fyh h ILE 24 N -0.44 0.05 -2.50 1.81 2.04 0.14 -3.47 117.51 115.14 2fyh h ILE 24 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2fyh h ILE 24 Cb 0.55 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2fyh h ILE 24 CO 0.01 0.00 -0.57 0.61 0.00 0.00 0.00 178.15 178.19 2fyh n GLY 25 N -1.50 -4.39 2.80 5.37 0.00 -0.93 -4.83 105.19 101.71 2fyh n GLY 25 Ca 0.10 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 45.12 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 0.18 6.82 -0.11 1.61 3.41 -1.26 -4.53 113.62 119.73 2fyh n SER 26 Ca 0.00 -3.79 -0.13 0.00 -0.26 0.00 0.00 58.87 54.69 2fyh n SER 26 Cb 0.00 -0.94 -0.12 0.00 -0.26 0.00 0.00 64.21 62.89 2fyh n SER 26 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 2fyh n LYS 27 N -0.45 0.75 -0.09 4.33 0.00 -1.26 -4.77 118.16 116.67 2fyh n LYS 27 Ca 0.49 0.08 -0.12 0.00 -0.00 0.00 0.00 58.31 58.77 2fyh n LYS 27 Cb 0.33 -1.46 -0.04 0.00 -0.00 0.00 0.00 35.03 33.85 2fyh n LYS 27 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2fyh n GLU 28 N -2.99 0.52 -3.64 -1.58 -0.58 -1.26 -4.94 120.64 106.15 2fyh n GLU 28 Ca -0.37 0.35 -0.36 0.00 -0.42 0.00 0.00 57.16 56.36 2fyh n GLU 28 Cb 0.99 -1.55 -0.07 0.00 -0.57 0.00 0.00 31.44 30.24 2fyh n GLU 28 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2fyh s ALA 29 N -2.75 3.69 -0.43 0.62 0.00 -1.26 -3.19 121.76 118.44 2fyh s ALA 29 Ca -0.26 -0.51 -0.28 0.00 0.00 0.00 0.00 51.96 50.92 2fyh s ALA 29 Cb 0.05 -2.26 0.03 0.00 0.00 0.00 0.00 23.12 20.94 2fyh s ALA 29 CO 0.39 0.28 1.06 0.21 0.00 0.00 0.00 175.76 177.70 2fyh s LYS 30 N -0.11 3.77 -0.06 0.00 2.36 0.54 -4.59 119.74 121.65 2fyh s LYS 30 Ca 0.16 0.59 0.00 0.00 -2.55 0.00 0.00 55.97 54.16 2fyh s LYS 30 Cb -0.13 -3.87 0.02 0.00 -1.05 0.00 0.00 37.83 32.81 2fyh s LYS 30 CO 0.04 -1.21 -0.04 0.42 1.55 0.00 0.00 175.35 176.11 2fyh s ILE 31 N 4.06 0.57 -1.05 5.43 1.01 -1.26 -0.84 121.20 129.12 2fyh s ILE 31 Ca 0.44 -0.08 -0.15 0.00 0.00 0.00 0.00 60.65 60.86 2fyh s ILE 31 Cb -0.09 -0.63 0.17 0.00 0.01 0.00 0.00 42.46 41.92 2fyh s ILE 31 CO 0.26 0.26 1.22 -0.75 0.00 0.00 0.00 174.94 175.93 2fyh s LYS 32 N 1.33 3.86 1.23 2.79 2.47 -0.66 -4.90 119.74 125.85 2fyh s LYS 32 Ca -0.04 -2.30 -0.17 0.00 -1.56 0.00 0.00 55.97 51.89 2fyh s LYS 32 Cb -0.14 -4.90 0.26 0.00 -1.46 0.00 0.00 37.83 31.60 2fyh s LYS 32 CO -0.02 -1.68 0.64 1.19 0.16 0.00 0.00 175.35 175.64 2fyh n PHE 33 N 5.58 -2.10 -4.37 4.03 3.72 -1.26 -3.68 117.46 119.38 2fyh n PHE 33 Ca 0.28 -0.24 -0.27 0.00 -0.05 0.00 0.00 57.45 57.17 2fyh n PHE 33 Cb 0.45 -1.53 -0.11 0.00 -0.94 0.00 0.00 39.48 37.35 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 2.59 1.05 -4.37 1.01 -0.88 -4.90 120.40 112.65 2fyh s VAL 34 Ca 0.61 -1.84 -0.22 0.00 0.00 0.00 0.00 61.98 60.53 2fyh s VAL 34 Cb -0.17 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 2fyh s VAL 34 CO 0.60 -0.06 -0.73 -0.62 0.00 0.00 0.00 175.10 174.30 2fyh n GLU 35 N 0.38 -0.87 0.13 2.72 1.02 -1.26 -4.89 120.64 117.86 2fyh n GLU 35 Ca -0.13 -0.25 -0.24 0.00 -0.02 0.00 0.00 57.16 56.52 2fyh n GLU 35 Cb 0.55 -1.34 -0.16 0.00 -0.02 0.00 0.00 31.44 30.47 2fyh n GLU 35 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2fyh h ARG 36 N -1.60 0.49 -0.84 3.49 3.08 -2.00 -3.24 114.38 113.76 2fyh h ARG 36 Ca -0.44 -0.84 0.00 0.00 0.07 0.00 0.00 59.98 58.77 2fyh h ARG 36 Cb 1.32 0.31 0.00 0.00 0.08 0.00 0.00 29.97 31.68 2fyh h ARG 36 CO 0.28 1.40 0.00 0.39 -1.07 0.00 0.00 179.97 180.98 2fyh n GLU 37 N -3.81 1.58 -0.09 0.04 1.02 -1.26 -3.14 120.64 114.98 2fyh n GLU 37 Ca -0.16 -0.49 0.04 0.00 -0.02 0.00 0.00 57.16 56.53 2fyh n GLU 37 Cb 1.04 -1.56 0.06 0.00 -0.02 0.00 0.00 31.44 30.96 2fyh n GLU 37 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2fyh n ASN 38 N 0.07 1.69 -1.12 1.62 3.02 -1.22 -4.65 115.26 114.66 2fyh n ASN 38 Ca 0.04 -2.32 0.10 0.00 -0.03 0.00 0.00 54.58 52.37 2fyh n ASN 38 Cb 0.37 -0.19 0.27 0.00 -0.61 0.00 0.00 39.78 39.62 2fyh n ASN 38 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2fyh n PHE 39 N -0.76 0.77 -1.69 3.10 3.72 -1.19 -4.88 117.46 116.54 2fyh n PHE 39 Ca 0.06 -0.38 -0.44 0.00 -0.05 0.00 0.00 57.45 56.64 2fyh n PHE 39 Cb 0.48 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.99 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 1.29 2.49 -1.64 1.38 1.44 -1.26 -4.86 115.22 114.06 2fyh n HIS 40 Ca 0.20 0.12 -0.42 0.00 -2.01 0.00 0.00 57.72 55.61 2fyh n HIS 40 Cb 0.52 -2.62 -0.03 0.00 0.12 0.00 0.00 29.99 27.99 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 1.38 3.01 -0.92 0.61 1.01 -1.25 -4.74 121.20 120.31 2fyh s ILE 41 Ca 0.79 0.01 -0.25 0.00 0.00 0.00 0.00 60.65 61.21 2fyh s ILE 41 Cb -0.60 -3.01 -0.06 0.00 0.01 0.00 0.00 42.46 38.81 2fyh s ILE 41 CO 0.37 -0.01 1.97 -0.89 0.00 0.00 0.00 174.94 176.38 2fyh s THR 42 N 6.28 3.43 0.16 2.92 2.01 -1.26 -1.87 115.64 127.31 2fyh s THR 42 Ca 0.94 -0.39 -0.23 0.00 0.31 0.00 0.00 61.69 62.33 2fyh s THR 42 Cb -0.38 -3.99 0.04 0.00 0.01 0.00 0.00 72.50 68.18 2fyh s THR 42 CO 0.39 -0.90 1.61 0.25 -0.69 0.00 0.00 174.62 175.28 2fyh h LEU 43 N 18.14 -0.99 -7.37 4.42 6.46 -1.85 -3.45 115.31 130.67 2fyh h LEU 43 Ca 0.10 0.17 -0.09 0.00 -0.12 0.00 0.00 57.88 57.94 2fyh h LEU 43 Cb 1.00 0.46 -0.18 0.00 -0.73 0.00 0.00 40.66 41.21 2fyh h LEU 43 CO 1.20 -0.32 -0.12 -1.59 -0.62 0.00 0.00 178.44 176.99 2fyh s LYS 44 N -6.02 0.85 0.04 1.25 0.00 -1.25 -4.82 119.74 109.79 2fyh s LYS 44 Ca -0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 55.97 55.60 2fyh s LYS 44 Cb 0.13 0.38 -0.04 0.00 0.00 0.00 0.00 37.83 38.30 2fyh s LYS 44 CO 0.68 -0.27 0.20 0.12 0.00 0.00 0.00 175.35 176.08 2fyh s PHE 45 N -1.90 3.53 0.05 1.78 5.36 -1.26 -3.09 117.98 122.45 2fyh s PHE 45 Ca -0.09 0.29 -0.03 0.00 -0.96 0.00 0.00 56.93 56.14 2fyh s PHE 45 Cb -0.02 -1.79 -0.01 0.00 -0.34 0.00 0.00 43.02 40.86 2fyh s PHE 45 CO 0.02 0.61 -0.06 1.28 -1.46 0.00 0.00 175.22 175.61 2fyh n LEU 46 N 0.53 1.24 0.00 6.12 4.77 -1.10 -4.98 117.00 123.59 2fyh n LEU 46 Ca -0.07 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2fyh n LEU 46 Cb 0.52 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 2fyh n LEU 46 CO 0.49 -0.67 0.00 0.61 -1.33 0.00 0.00 177.39 176.49 2fyh n GLY 47 N 3.14 0.99 3.72 -0.72 0.00 -0.85 -4.80 105.19 106.66 2fyh n GLY 47 Ca -0.02 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 43.98 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 4.43 0.02 1.61 2.12 -1.26 -1.18 118.70 124.44 2fyh s GLU 48 Ca 0.00 1.79 0.00 0.00 0.36 0.00 0.00 54.97 57.12 2fyh s GLU 48 Cb 0.00 -3.33 -0.02 0.00 0.26 0.00 0.00 34.13 31.04 2fyh s GLU 48 CO 0.00 -0.25 -0.03 0.42 -0.54 0.00 0.00 175.26 174.86 2fyh s ILE 49 N 0.96 0.12 -0.01 -3.70 1.01 -1.25 -4.98 121.20 113.34 2fyh s ILE 49 Ca 0.58 -0.78 -0.08 0.00 0.00 0.00 0.00 60.65 60.36 2fyh s ILE 49 Cb -0.30 -0.24 -0.05 0.00 0.01 0.00 0.00 42.46 41.88 2fyh s ILE 49 CO 0.30 -0.42 0.28 0.42 0.00 0.00 0.00 174.94 175.52 2fyh s THR 50 N -1.24 5.28 0.38 2.92 -4.23 -1.26 -4.92 115.64 112.57 2fyh s THR 50 Ca -0.13 0.33 0.22 0.00 -1.18 0.00 0.00 61.69 60.93 2fyh s THR 50 Cb -0.09 -3.56 0.39 0.00 1.34 0.00 0.00 72.50 70.58 2fyh s THR 50 CO -0.01 0.45 1.61 -0.33 -0.54 0.00 0.00 174.62 175.81 2fyh h GLU 51 N 4.31 0.10 -0.31 3.99 5.08 -2.01 0.82 114.58 126.55 2fyh h GLU 51 Ca -0.51 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 57.83 2fyh h GLU 51 Cb 1.21 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2fyh h GLU 51 CO 0.63 0.07 0.15 0.93 -1.00 0.00 0.00 179.01 179.79 2fyh h GLU 52 N 0.10 0.44 -0.03 2.33 5.08 -2.04 -2.78 114.58 117.68 2fyh h GLU 52 Ca 0.82 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.97 2fyh h GLU 52 Cb 2.22 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 31.38 2fyh h GLU 52 CO -0.62 0.41 -0.62 1.96 -1.00 0.00 0.00 179.01 179.14 2fyh h GLN 53 N 0.37 0.12 -1.66 2.33 7.50 0.08 -3.18 115.11 120.67 2fyh h GLN 53 Ca 0.11 -0.09 0.52 0.00 0.50 0.00 0.00 58.65 59.69 2fyh h GLN 53 Cb 0.11 0.01 -0.11 0.00 0.05 0.00 0.00 27.48 27.54 2fyh h GLN 53 CO -0.01 0.70 1.13 0.00 -1.50 0.00 0.00 178.83 179.15 2fyh n ALA 54 N -2.45 1.61 0.11 3.87 0.00 0.77 0.24 120.51 124.65 2fyh n ALA 54 Ca -0.02 0.77 -0.19 0.00 0.00 0.00 0.00 53.44 54.01 2fyh n ALA 54 Cb 0.62 -1.10 -0.12 0.00 0.00 0.00 0.00 19.45 18.85 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 0.43 -0.23 0.00 -0.00 -1.66 -3.27 114.58 109.85 2fyh h GLU 55 Ca 0.91 -0.64 0.00 0.00 -0.00 0.00 0.00 59.36 59.63 2fyh h GLU 55 Cb 3.28 0.22 -0.01 0.00 -0.00 0.00 0.00 28.75 32.24 2fyh h GLU 55 CO -0.26 1.28 0.15 0.93 -0.00 0.00 0.00 179.01 181.12 2fyh h GLU 56 N 0.16 0.30 -0.26 1.06 4.39 0.29 -1.40 114.58 119.11 2fyh h GLU 56 Ca -0.16 -0.02 0.06 0.00 0.34 0.00 0.00 59.36 59.58 2fyh h GLU 56 Cb 1.94 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 30.45 2fyh h GLU 56 CO 0.22 0.20 -0.16 0.82 -1.16 0.00 0.00 179.01 178.93 2fyh h ILE 57 N 0.31 0.53 -0.15 3.13 5.03 -1.43 0.18 117.51 125.11 2fyh h ILE 57 Ca 0.09 0.00 0.01 0.00 -0.12 0.00 0.00 64.86 64.84 2fyh h ILE 57 Cb -0.03 0.53 -0.01 0.00 -3.03 0.00 0.00 36.82 34.28 2fyh h ILE 57 CO -0.02 0.00 0.06 0.11 -0.68 0.00 0.00 178.15 177.62 2fyh h LYS 58 N -0.14 0.14 0.06 2.37 1.57 -1.56 -2.39 116.57 116.62 2fyh h LYS 58 Ca 0.14 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.94 2fyh h LYS 58 Cb 0.35 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 2fyh h LYS 58 CO -0.35 0.09 -0.31 0.87 -0.57 0.00 0.00 179.45 179.19 2fyh h LYS 59 N 0.15 -0.47 -0.47 3.15 1.79 -0.70 -1.47 116.57 118.55 2fyh h LYS 59 Ca 0.06 0.03 0.09 0.00 -2.18 0.00 0.00 60.65 58.66 2fyh h LYS 59 Cb 0.02 0.11 -0.10 0.00 -1.58 0.00 0.00 32.23 30.68 2fyh h LYS 59 CO -0.05 -0.31 -0.27 0.82 -1.08 0.00 0.00 179.45 178.55 2fyh h ILE 60 N -0.49 0.28 -0.32 1.86 2.04 -0.82 -1.20 117.51 118.85 2fyh h ILE 60 Ca 0.05 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.97 2fyh h ILE 60 Cb 0.55 0.28 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 2fyh h ILE 60 CO -0.22 0.00 -0.09 -0.07 0.00 0.00 0.00 178.15 177.77 2fyh h LEU 61 N -0.17 -0.33 -0.90 1.44 3.38 -1.03 -1.41 115.31 116.29 2fyh h LEU 61 Ca 0.21 0.10 0.25 0.00 0.09 0.00 0.00 57.88 58.53 2fyh h LEU 61 Cb 0.51 0.21 -0.15 0.00 0.09 0.00 0.00 40.66 41.32 2fyh h LEU 61 CO -0.57 -0.12 0.18 -0.08 0.09 0.00 0.00 178.44 177.94 2fyh h GLU 62 N -0.01 0.13 0.13 1.13 4.57 -0.16 0.73 114.58 121.11 2fyh h GLU 62 Ca 0.16 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.32 2fyh h GLU 62 Cb 0.25 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 2fyh h GLU 62 CO -0.34 0.09 -0.06 0.87 -1.18 0.00 0.00 179.01 178.39 2fyh h LYS 63 N 0.14 -0.17 0.44 1.92 1.57 -1.00 -2.86 116.57 116.61 2fyh h LYS 63 Ca 0.57 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.34 2fyh h LYS 63 Cb 1.17 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2fyh h LYS 63 CO -0.73 0.23 -0.23 0.82 -0.57 0.00 0.00 179.45 178.96 2fyh h ILE 64 N -0.62 0.00 -1.41 1.86 2.04 -0.12 0.33 117.51 119.60 2fyh h ILE 64 Ca -0.02 0.00 0.41 0.00 1.00 0.00 0.00 64.86 66.25 2fyh h ILE 64 Cb 0.47 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.50 2fyh h ILE 64 CO 0.03 0.00 1.16 0.00 0.00 0.00 0.00 178.15 179.34 2fyh h ALA 65 N -1.64 3.31 0.09 1.87 0.00 0.24 1.32 119.26 124.46 2fyh h ALA 65 Ca -0.06 -0.05 -0.31 0.00 0.00 0.00 0.00 54.91 54.49 2fyh h ALA 65 Cb 0.49 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2fyh h ALA 65 CO 0.09 -1.89 -1.67 -0.22 0.00 0.00 0.00 179.25 175.56 2fyh h LYS 66 N 0.00 0.19 0.00 0.00 1.63 -1.19 -3.31 116.57 113.88 2fyh h LYS 66 Ca 0.67 -0.32 0.00 0.00 -0.85 0.00 0.00 60.65 60.15 2fyh h LYS 66 Cb 2.98 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 34.73 2fyh h LYS 66 CO -0.01 0.99 0.00 1.57 -3.45 0.00 0.00 179.45 178.55 2fyh h LYS 67 N 0.05 0.00 -6.08 1.90 5.09 0.56 -3.44 116.57 114.66 2fyh h LYS 67 Ca -0.29 0.00 -0.52 0.00 0.09 0.00 0.00 60.65 59.93 2fyh h LYS 67 Cb 2.01 0.00 -0.05 0.00 0.10 0.00 0.00 32.23 34.30 2fyh h LYS 67 CO 0.12 0.00 -0.40 0.71 -2.09 0.00 0.00 179.45 177.80 2fyh s TYR 68 N -3.36 2.53 0.46 0.07 2.02 0.07 -5.06 117.35 114.08 2fyh s TYR 68 Ca 0.05 -0.56 0.04 0.00 -0.37 0.00 0.00 57.07 56.23 2fyh s TYR 68 Cb 0.09 -2.09 -0.04 0.00 -0.40 0.00 0.00 41.96 39.52 2fyh s TYR 68 CO 0.47 -0.10 0.04 0.15 -1.57 0.00 0.00 175.55 174.55 2fyh s LYS 69 N -4.10 2.10 -0.40 -0.62 1.02 -1.26 -4.91 119.74 111.58 2fyh s LYS 69 Ca 0.45 -2.20 -0.16 0.00 0.02 0.00 0.00 55.97 54.08 2fyh s LYS 69 Cb -0.01 -1.65 0.01 0.00 -0.52 0.00 0.00 37.83 35.66 2fyh s LYS 69 CO 0.26 -0.22 0.36 -1.59 -0.92 0.00 0.00 175.35 173.24 2fyh s LYS 70 N -3.83 3.14 0.42 1.68 -2.85 -1.26 -4.98 119.74 112.07 2fyh s LYS 70 Ca 0.23 -0.80 0.07 0.00 -1.00 0.00 0.00 55.97 54.48 2fyh s LYS 70 Cb 0.05 -3.94 0.01 0.00 -2.06 0.00 0.00 37.83 31.89 2fyh s LYS 70 CO 0.12 -0.74 0.57 -1.58 0.10 0.00 0.00 175.35 173.82 2fyh s HIS 71 N 1.92 2.86 -0.51 1.78 2.46 -1.26 -4.83 115.29 117.71 2fyh s HIS 71 Ca 0.09 -0.35 -0.11 0.00 0.47 0.00 0.00 55.06 55.17 2fyh s HIS 71 Cb -0.18 -2.35 0.13 0.00 -0.13 0.00 0.00 32.58 30.05 2fyh s HIS 71 CO 0.12 -0.39 0.40 -2.00 -2.47 0.00 0.00 174.74 170.40 2fyh s GLU 72 N -4.35 2.65 0.27 2.88 2.12 -1.26 -2.81 118.70 118.20 2fyh s GLU 72 Ca 0.54 -1.81 0.06 0.00 0.36 0.00 0.00 54.97 54.11 2fyh s GLU 72 Cb -0.10 -4.03 -0.02 0.00 0.26 0.00 0.00 34.13 30.24 2fyh s GLU 72 CO 0.33 -1.23 0.39 0.14 -0.54 0.00 0.00 175.26 174.35 2fyh s VAL 73 N 1.32 4.79 0.22 3.70 -7.23 -0.30 -4.91 120.40 118.00 2fyh s VAL 73 Ca 0.06 -1.02 0.10 0.00 -1.81 0.00 0.00 61.98 59.31 2fyh s VAL 73 Cb -0.26 -3.68 -0.04 0.00 0.56 0.00 0.00 36.38 32.96 2fyh s VAL 73 CO -0.00 -0.27 -0.10 0.21 -0.31 0.00 0.00 175.10 174.63 2fyh s ASN 74 N -4.04 4.17 -0.22 4.85 3.84 -1.26 -1.35 114.94 120.93 2fyh s ASN 74 Ca 0.38 -0.69 0.01 0.00 0.21 0.00 0.00 52.86 52.77 2fyh s ASN 74 Cb -0.09 -0.65 0.05 0.00 -0.55 0.00 0.00 41.25 40.01 2fyh s ASN 74 CO 0.29 0.07 -0.09 0.54 -2.79 0.00 0.00 177.10 175.12 2fyh s VAL 75 N -2.01 1.72 -0.11 -5.21 0.11 -0.52 -0.32 120.40 114.07 2fyh s VAL 75 Ca 0.27 -1.18 -0.30 0.00 -2.93 0.00 0.00 61.98 57.84 2fyh s VAL 75 Cb -0.07 -1.85 0.09 0.00 -1.53 0.00 0.00 36.38 33.01 2fyh s VAL 75 CO 0.16 0.06 0.77 -0.60 -3.33 0.00 0.00 175.10 172.17 2fyh s ARG 76 N 1.34 0.91 0.00 1.54 3.52 -1.18 -2.67 118.95 122.41 2fyh s ARG 76 Ca -0.04 0.33 0.00 0.00 -0.13 0.00 0.00 55.73 55.89 2fyh s ARG 76 Cb -0.18 0.43 0.00 0.00 -1.56 0.00 0.00 34.95 33.64 2fyh s ARG 76 CO -0.07 -0.26 0.00 0.41 -0.81 0.00 0.00 175.30 174.57 2fyh n GLY 77 N 1.11 1.02 2.73 8.12 0.00 -1.26 -4.44 105.19 112.47 2fyh n GLY 77 Ca -0.16 -1.49 -0.17 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.31 -0.08 0.46 -0.61 1.01 -1.26 0.29 121.20 119.71 2fyh s ILE 78 Ca 0.00 0.30 0.07 0.00 0.00 0.00 0.00 60.65 61.03 2fyh s ILE 78 Cb 0.00 -0.11 0.00 0.00 0.01 0.00 0.00 42.46 42.36 2fyh s ILE 78 CO 0.00 0.13 0.42 -0.83 0.00 0.00 0.00 174.94 174.65 2fyh s GLY 79 N 1.52 2.16 0.12 6.18 0.00 -0.35 -4.83 107.32 112.12 2fyh s GLY 79 Ca -0.03 -1.77 -0.00 0.00 0.00 0.00 0.00 44.72 42.92 2fyh s GLY 79 CO -0.03 -1.76 0.02 -1.34 0.00 0.00 0.00 173.10 169.99 2fyh s VAL 80 N -2.56 0.30 0.04 1.40 -7.23 -1.26 -2.83 120.40 108.26 2fyh s VAL 80 Ca 0.46 -1.91 -0.08 0.00 -1.81 0.00 0.00 61.98 58.64 2fyh s VAL 80 Cb -0.03 -1.93 -0.00 0.00 0.56 0.00 0.00 36.38 34.98 2fyh s VAL 80 CO 0.27 -0.61 0.16 -0.36 -0.31 0.00 0.00 175.10 174.25 2fyh s PHE 81 N -3.90 0.10 -0.18 2.82 0.08 -1.16 -4.07 117.98 111.67 2fyh s PHE 81 Ca 0.20 -0.34 0.29 0.00 0.12 0.00 0.00 56.93 57.19 2fyh s PHE 81 Cb 0.07 -0.07 1.20 0.00 -0.57 0.00 0.00 43.02 43.66 2fyh s PHE 81 CO -0.01 -0.40 1.85 -1.00 -0.10 0.00 0.00 175.22 175.56 2fyh h PRO 82 N 3.55 0.00 -1.87 0.24 0.13 -1.90 0.92 132.00 133.06 2fyh h PRO 82 Ca -0.32 0.00 0.19 0.00 -0.87 0.00 0.00 66.00 65.00 2fyh h PRO 82 Cb 1.19 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.16 2fyh h PRO 82 CO 0.49 0.00 0.66 0.54 -0.23 0.00 0.00 178.00 179.45 2fyh s ASN 83 N -4.93 -0.23 0.13 1.44 6.03 -1.22 -5.05 114.94 111.11 2fyh s ASN 83 Ca 0.02 -0.03 -0.30 0.00 -1.03 0.00 0.00 52.86 51.52 2fyh s ASN 83 Cb 0.09 0.27 -0.07 0.00 -3.03 0.00 0.00 41.25 38.51 2fyh s ASN 83 CO 0.46 -0.44 1.57 -0.65 -2.03 0.00 0.00 177.10 176.01 2fyh h PRO 84 N 2.00 -0.45 -0.98 3.55 0.11 -1.93 -0.57 132.00 133.73 2fyh h PRO 84 Ca -0.17 0.03 0.41 0.00 0.11 0.00 0.00 66.00 66.39 2fyh h PRO 84 Cb 1.20 0.10 -0.18 0.00 0.11 0.00 0.00 31.00 32.24 2fyh h PRO 84 CO 0.27 -0.30 0.53 0.27 -0.21 0.00 0.00 178.00 178.55 2fyh n ASN 85 N -5.42 0.34 -3.64 -2.05 6.94 -1.26 -3.21 115.26 106.96 2fyh n ASN 85 Ca -0.04 1.63 -0.29 0.00 -0.02 0.00 0.00 54.58 55.86 2fyh n ASN 85 Cb 0.36 -0.79 -0.14 0.00 -2.36 0.00 0.00 39.78 36.85 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 -5.50 1.35 -0.11 -2.53 5.04 -0.24 -5.11 117.35 110.26 2fyh s TYR 86 Ca -0.09 -1.79 -0.25 0.00 -2.44 0.00 0.00 57.07 52.51 2fyh s TYR 86 Cb 0.33 -1.46 -0.03 0.00 0.35 0.00 0.00 41.96 41.16 2fyh s TYR 86 CO 0.77 -0.83 0.77 0.08 -1.34 0.00 0.00 175.55 175.00 2fyh s VAL 87 N 1.19 4.96 0.00 3.14 1.01 -1.13 -3.41 120.40 126.17 2fyh s VAL 87 Ca 0.14 1.56 0.00 0.00 0.00 0.00 0.00 61.98 63.68 2fyh s VAL 87 Cb -0.21 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.07 2fyh s VAL 87 CO -0.13 0.15 0.00 0.54 0.00 0.00 0.00 175.10 175.66 2fyh n ARG 88 N 4.41 1.97 -3.84 2.72 5.12 0.30 -4.86 116.66 122.48 2fyh n ARG 88 Ca 0.02 0.00 -0.22 0.00 -1.93 0.00 0.00 57.85 55.72 2fyh n ARG 88 Cb 0.50 -0.89 -0.17 0.00 -1.16 0.00 0.00 32.46 30.74 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 0.35 -0.06 1.55 1.01 -1.08 -1.66 120.40 118.73 2fyh s VAL 89 Ca 0.00 0.10 -0.15 0.00 0.00 0.00 0.00 61.98 61.93 2fyh s VAL 89 Cb 0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 2fyh s VAL 89 CO 0.00 0.24 0.40 -0.63 0.00 0.00 0.00 175.10 175.11 2fyh s ILE 90 N 1.71 5.12 -0.10 2.22 1.01 -0.86 -2.99 121.20 127.31 2fyh s ILE 90 Ca 0.01 0.81 -0.18 0.00 0.00 0.00 0.00 60.65 61.30 2fyh s ILE 90 Cb -0.13 -3.72 0.04 0.00 0.01 0.00 0.00 42.46 38.66 2fyh s ILE 90 CO -0.04 0.48 0.44 -1.66 0.00 0.00 0.00 174.94 174.16 2fyh s TRP 91 N -0.35 -0.41 0.58 3.97 1.48 -1.13 -1.08 118.94 121.99 2fyh s TRP 91 Ca 0.23 0.89 -0.00 0.00 -1.06 0.00 0.00 56.10 56.15 2fyh s TRP 91 Cb -0.16 0.18 0.04 0.00 -1.16 0.00 0.00 33.47 32.37 2fyh s TRP 91 CO 0.11 -0.34 0.82 0.00 -4.06 0.00 0.00 176.95 173.48 2fyh s ALA 92 N -0.49 3.73 0.13 2.67 0.00 0.78 -1.21 121.76 127.38 2fyh s ALA 92 Ca -0.06 -1.22 0.08 0.00 0.00 0.00 0.00 51.96 50.76 2fyh s ALA 92 Cb -0.03 -2.19 -0.04 0.00 0.00 0.00 0.00 23.12 20.85 2fyh s ALA 92 CO 0.03 -0.85 -0.20 0.20 0.00 0.00 0.00 175.76 174.94 2fyh s GLY 93 N -4.43 1.32 -0.02 0.00 0.00 0.14 -1.63 107.32 102.69 2fyh s GLY 93 Ca 0.57 -1.35 -0.01 0.00 0.00 0.00 0.00 44.72 43.94 2fyh s GLY 93 CO 0.40 -1.36 0.06 0.14 0.00 0.00 0.00 173.10 172.34 2fyh s VAL 94 N -1.47 4.65 0.78 1.40 1.01 -0.75 -3.10 120.40 122.91 2fyh s VAL 94 Ca 0.10 -0.37 -0.13 0.00 0.00 0.00 0.00 61.98 61.58 2fyh s VAL 94 Cb -0.08 -3.09 0.19 0.00 0.00 0.00 0.00 36.38 33.40 2fyh s VAL 94 CO 0.05 0.41 0.78 -0.62 0.00 0.00 0.00 175.10 175.72 2fyh n GLU 95 N 1.41 -2.00 -0.77 2.72 -0.58 0.56 -4.70 120.64 117.28 2fyh n GLU 95 Ca -0.15 -1.23 -0.22 0.00 -0.42 0.00 0.00 57.16 55.15 2fyh n GLU 95 Cb 0.53 -1.05 -0.08 0.00 -0.57 0.00 0.00 31.44 30.28 2fyh n GLU 95 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2fyh n ASN 96 N -4.06 0.16 -2.13 1.62 6.94 -1.26 -4.71 115.26 111.80 2fyh n ASN 96 Ca 0.10 0.10 -0.25 0.00 -0.02 0.00 0.00 54.58 54.52 2fyh n ASN 96 Cb 0.39 -0.48 0.02 0.00 -2.36 0.00 0.00 39.78 37.35 2fyh n ASN 96 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2fyh n ASP 97 N 5.41 4.93 -0.19 0.53 5.75 -1.26 -4.61 116.55 127.11 2fyh n ASP 97 Ca 0.34 -3.74 -0.09 0.00 -0.01 0.00 0.00 54.79 51.28 2fyh n ASP 97 Cb 0.01 -0.38 -0.05 0.00 -1.03 0.00 0.00 41.12 39.68 2fyh n ASP 97 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2fyh h GLU 98 N 2.27 -0.25 -0.15 0.11 4.39 -2.00 -1.45 114.58 117.50 2fyh h GLU 98 Ca 0.36 0.02 0.03 0.00 0.34 0.00 0.00 59.36 60.11 2fyh h GLU 98 Cb 1.38 0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 30.02 2fyh h GLU 98 CO 0.80 -0.17 -0.54 0.82 -1.16 0.00 0.00 179.01 178.76 2fyh h ILE 99 N -0.26 0.01 -0.77 3.13 1.08 -2.00 -1.71 117.51 116.99 2fyh h ILE 99 Ca 0.16 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.77 2fyh h ILE 99 Cb 0.57 0.01 -0.14 0.00 -3.07 0.00 0.00 36.82 34.18 2fyh h ILE 99 CO -0.66 0.00 -0.26 0.40 -0.69 0.00 0.00 178.15 176.94 2fyh h ILE 100 N -0.57 0.17 -0.22 -0.67 2.04 -1.75 0.06 117.51 116.56 2fyh h ILE 100 Ca 0.04 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.95 2fyh h ILE 100 Cb 0.68 0.17 -0.07 0.00 -0.74 0.00 0.00 36.82 36.86 2fyh h ILE 100 CO -0.45 0.00 -0.31 0.11 0.00 0.00 0.00 178.15 177.51 2fyh h LYS 101 N -0.04 -0.32 -0.27 2.37 1.57 -0.43 0.29 116.57 119.74 2fyh h LYS 101 Ca 0.34 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 59.21 2fyh h LYS 101 Cb 0.58 0.07 -0.08 0.00 0.08 0.00 0.00 32.23 32.88 2fyh h LYS 101 CO -0.80 -0.21 -0.27 0.87 -0.57 0.00 0.00 179.45 178.46 2fyh h LYS 102 N -0.33 -0.26 -0.93 3.15 1.57 -0.34 -0.74 116.57 118.70 2fyh h LYS 102 Ca 0.12 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.94 2fyh h LYS 102 Cb 0.53 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.85 2fyh h LYS 102 CO -0.40 -0.17 0.61 0.82 -0.57 0.00 0.00 179.45 179.74 2fyh h ILE 103 N -0.27 1.22 -0.39 1.86 2.04 -0.66 -0.62 117.51 120.69 2fyh h ILE 103 Ca 0.14 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.59 2fyh h ILE 103 Cb 0.49 -0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 2fyh h ILE 103 CO -0.42 0.22 0.26 0.00 0.00 0.00 0.00 178.15 178.21 2fyh h ALA 104 N 1.43 1.75 0.19 1.87 0.00 0.93 0.11 119.26 125.54 2fyh h ALA 104 Ca 0.35 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.92 2fyh h ALA 104 Cb -0.10 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 17.56 2fyh h ALA 104 CO -0.08 0.23 -1.40 -0.22 0.00 0.00 0.00 179.25 177.77 2fyh h LYS 105 N 0.51 0.40 -0.38 0.00 1.63 -0.28 -3.06 116.57 115.39 2fyh h LYS 105 Ca 0.15 -0.68 -0.08 0.00 -0.85 0.00 0.00 60.65 59.18 2fyh h LYS 105 Cb -0.02 0.25 -0.01 0.00 -0.60 0.00 0.00 32.23 31.85 2fyh h LYS 105 CO -0.03 1.32 -0.08 1.49 -3.45 0.00 0.00 179.45 178.70 2fyh h GLU 106 N 0.11 0.73 -0.10 1.90 4.57 -0.60 0.33 114.58 121.52 2fyh h GLU 106 Ca -0.21 -0.28 -0.00 0.00 -1.18 0.00 0.00 59.36 57.69 2fyh h GLU 106 Cb 2.07 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 30.62 2fyh h GLU 106 CO 0.23 0.87 0.06 0.82 -1.18 0.00 0.00 179.01 179.81 2fyh h ILE 107 N 0.54 1.09 0.25 2.32 2.04 -0.90 -2.80 117.51 120.04 2fyh h ILE 107 Ca 0.10 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2fyh h ILE 107 Cb 0.60 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2fyh h ILE 107 CO 0.04 0.08 -0.12 -0.78 0.00 0.00 0.00 178.15 177.36 2fyh h ASP 108 N 0.08 -0.28 -0.83 1.72 1.82 -1.52 -2.72 116.42 114.69 2fyh h ASP 108 Ca 0.04 -0.25 0.19 0.00 -0.39 0.00 0.00 57.03 56.62 2fyh h ASP 108 Cb 0.07 0.07 -0.16 0.00 0.68 0.00 0.00 39.33 40.00 2fyh h ASP 108 CO -0.01 0.19 -0.13 -0.67 -1.61 0.00 0.00 179.24 177.02 2fyh n ASP 109 N -5.03 -0.22 -0.01 2.28 -0.08 0.11 0.57 116.55 114.18 2fyh n ASP 109 Ca -0.08 1.42 -0.13 0.00 -1.51 0.00 0.00 54.79 54.49 2fyh n ASP 109 Cb 0.26 -0.46 -0.09 0.00 2.34 0.00 0.00 41.12 43.17 2fyh n ASP 109 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2fyh h GLU 110 N 0.00 0.05 -0.13 -0.67 4.39 -1.53 -2.91 114.58 113.79 2fyh h GLU 110 Ca 0.44 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 60.15 2fyh h GLU 110 Cb 0.76 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.40 2fyh h GLU 110 CO -0.83 0.41 0.12 -0.07 -1.16 0.00 0.00 179.01 177.48 2fyh h LEU 111 N -0.31 0.00 -1.80 1.33 3.38 0.46 -1.30 115.31 117.07 2fyh h LEU 111 Ca 0.01 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2fyh h LEU 111 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2fyh h LEU 111 CO 0.00 0.00 0.46 0.00 0.09 0.00 0.00 178.44 179.00 2fyh h ALA 112 N 1.87 1.74 0.19 1.53 0.00 0.22 0.19 119.26 125.00 2fyh h ALA 112 Ca 0.06 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.64 2fyh h ALA 112 Cb 0.30 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.12 2fyh h ALA 112 CO -0.00 -0.56 -1.53 -0.22 0.00 0.00 0.00 179.25 176.93 2fyh h LYS 113 N 0.00 0.39 0.00 0.00 1.63 -1.39 -3.32 116.57 113.88 2fyh h LYS 113 Ca 0.09 -0.67 -0.03 0.00 -0.85 0.00 0.00 60.65 59.18 2fyh h LYS 113 Cb 1.02 0.25 -0.00 0.00 -0.60 0.00 0.00 32.23 32.90 2fyh h LYS 113 CO -0.00 1.32 -0.16 -0.07 -3.45 0.00 0.00 179.45 177.09 2fyh h LEU 114 N -0.01 0.00 0.00 5.20 3.38 -0.81 -3.46 115.31 119.61 2fyh h LEU 114 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2fyh h LEU 114 Cb 2.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.76 2fyh h LEU 114 CO 0.18 0.16 0.00 0.61 0.09 0.00 0.00 178.44 179.48 2fyh n GLY 115 N -0.29 0.41 2.97 0.83 0.00 -0.46 -5.14 105.19 103.50 2fyh n GLY 115 Ca -0.01 -0.74 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 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 0.29 0.54 1.61 0.40 -1.13 -4.98 117.98 114.70 2fyh s PHE 116 Ca 0.00 -0.35 -0.20 0.00 -0.60 0.00 0.00 56.93 55.77 2fyh s PHE 116 Cb 0.00 -0.19 -0.06 0.00 0.51 0.00 0.00 43.02 43.28 2fyh s PHE 116 CO 0.00 -0.11 1.18 0.21 0.70 0.00 0.00 175.22 177.20 2fyh s LYS 117 N -1.00 3.33 -0.18 0.44 2.20 -1.26 -4.25 119.74 119.01 2fyh s LYS 117 Ca -0.09 1.77 -0.02 0.00 -0.36 0.00 0.00 55.97 57.26 2fyh s LYS 117 Cb -0.07 -2.11 -0.01 0.00 -1.51 0.00 0.00 37.83 34.14 2fyh s LYS 117 CO -0.00 -0.90 -0.09 0.21 -0.36 0.00 0.00 175.35 174.20 2fyh s LYS 118 N -3.11 3.33 -0.38 4.03 2.20 -1.26 -4.88 119.74 119.66 2fyh s LYS 118 Ca 0.72 -0.67 -0.14 0.00 -0.36 0.00 0.00 55.97 55.51 2fyh s LYS 118 Cb -0.28 -2.82 0.00 0.00 -1.51 0.00 0.00 37.83 33.22 2fyh s LYS 118 CO 0.32 -0.06 0.29 -1.83 -0.36 0.00 0.00 175.35 173.71 2fyh s GLU 119 N 1.08 3.22 0.00 4.03 -1.05 -1.26 -5.00 118.70 119.72 2fyh s GLU 119 Ca 0.00 -0.81 0.00 0.00 -0.15 0.00 0.00 54.97 54.01 2fyh s GLU 119 Cb -0.15 -3.90 0.00 0.00 -0.44 0.00 0.00 34.13 29.64 2fyh s GLU 119 CO -0.02 -0.62 0.93 0.41 0.95 0.00 0.00 175.26 176.91 2fyh n GLY 120 N 5.12 -2.72 3.59 -3.83 0.00 -1.26 -4.43 105.19 101.65 2fyh n GLY 120 Ca -0.11 0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 2fyh n GLY 120 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2fyh s ASN 121 N -2.30 6.46 0.05 1.61 2.47 -1.26 -5.06 114.94 116.91 2fyh s ASN 121 Ca 0.00 0.29 -0.04 0.00 0.42 0.00 0.00 52.86 53.53 2fyh s ASN 121 Cb 0.00 -2.32 -0.05 0.00 -1.45 0.00 0.00 41.25 37.43 2fyh s ASN 121 CO 0.00 -0.52 0.27 0.12 -3.72 0.00 0.00 177.10 173.24 2fyh s PHE 122 N 2.64 3.54 -0.04 0.43 5.36 -1.26 -5.10 117.98 123.53 2fyh s PHE 122 Ca 0.24 0.46 0.01 0.00 -0.96 0.00 0.00 56.93 56.68 2fyh s PHE 122 Cb -0.15 -1.91 0.02 0.00 -0.34 0.00 0.00 43.02 40.64 2fyh s PHE 122 CO 0.13 0.57 -0.03 0.08 -1.46 0.00 0.00 175.22 174.51 2fyh s VAL 123 N -1.44 0.43 -0.62 3.12 1.01 -1.26 -5.06 120.40 116.58 2fyh s VAL 123 Ca 0.32 -0.04 -0.24 0.00 0.00 0.00 0.00 61.98 62.02 2fyh s VAL 123 Cb -0.13 -0.49 0.05 0.00 0.00 0.00 0.00 36.38 35.82 2fyh s VAL 123 CO 0.21 0.21 1.02 0.00 0.00 0.00 0.00 175.10 176.54 2fyh s ALA 124 N 1.07 3.07 0.11 5.51 0.00 -1.26 -4.99 121.76 125.26 2fyh s ALA 124 Ca -0.09 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.43 2fyh s ALA 124 Cb -0.14 -3.88 -0.04 0.00 0.00 0.00 0.00 23.12 19.06 2fyh s ALA 124 CO -0.01 -2.68 0.03 -3.38 0.00 0.00 0.00 175.76 169.72 2fyh s HIS 125 N 4.34 0.77 -0.19 0.00 -3.43 -1.26 -1.81 115.29 113.72 2fyh s HIS 125 Ca 0.29 -1.18 -0.04 0.00 -0.80 0.00 0.00 55.06 53.34 2fyh s HIS 125 Cb -0.13 -0.46 0.06 0.00 -1.43 0.00 0.00 32.58 30.62 2fyh s HIS 125 CO 0.16 -0.46 0.07 0.42 -2.00 0.00 0.00 174.74 172.92 2fyh s ILE 126 N -3.99 0.22 -0.14 -5.38 1.09 -0.64 -4.37 121.20 107.98 2fyh s ILE 126 Ca 0.19 -0.39 -0.29 0.00 -1.10 0.00 0.00 60.65 59.05 2fyh s ILE 126 Cb 0.08 -0.82 -0.04 0.00 -1.06 0.00 0.00 42.46 40.61 2fyh s ILE 126 CO -0.02 -0.27 1.74 -0.89 -0.10 0.00 0.00 174.94 175.40 2fyh s THR 127 N 1.99 3.50 0.07 2.92 2.01 -1.26 -0.15 115.64 124.72 2fyh s THR 127 Ca 0.01 0.58 -0.03 0.00 0.31 0.00 0.00 61.69 62.56 2fyh s THR 127 Cb -0.17 -3.47 -0.27 0.00 0.01 0.00 0.00 72.50 68.60 2fyh s THR 127 CO -0.10 -0.16 1.11 -0.07 -0.69 0.00 0.00 174.62 174.72 2fyh h LEU 128 N 11.54 0.37 0.00 4.42 3.38 -1.46 -3.47 115.31 130.09 2fyh h LEU 128 Ca -0.38 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.18 2fyh h LEU 128 Cb 1.18 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2fyh h LEU 128 CO 0.98 1.32 0.00 0.61 0.09 0.00 0.00 178.44 181.44 2fyh n GLY 129 N 1.53 -1.46 3.32 0.83 0.00 -1.21 -2.08 105.19 106.13 2fyh n GLY 129 Ca -0.09 -1.03 -0.28 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.48 1.50 -0.22 1.61 0.52 -1.24 -2.04 118.95 117.60 2fyh s ARG 130 Ca 0.00 -1.13 -0.13 0.00 -0.52 0.00 0.00 55.73 53.96 2fyh s ARG 130 Cb 0.00 -1.74 -0.04 0.00 0.52 0.00 0.00 34.95 33.68 2fyh s ARG 130 CO 0.00 0.43 0.27 0.08 0.02 0.00 0.00 175.30 176.10 2fyh s VAL 131 N -0.91 5.29 -0.17 3.52 1.01 -0.66 -1.65 120.40 126.82 2fyh s VAL 131 Ca 0.10 0.42 -0.14 0.00 0.00 0.00 0.00 61.98 62.36 2fyh s VAL 131 Cb -0.10 -3.60 -0.07 0.00 0.00 0.00 0.00 36.38 32.61 2fyh s VAL 131 CO 0.03 0.30 -0.19 0.29 0.00 0.00 0.00 175.10 175.53 2fyh n LYS 132 N 4.39 0.50 -3.66 2.72 4.76 -0.02 -4.88 118.16 121.96 2fyh n LYS 132 Ca -0.12 0.42 -0.12 0.00 -2.87 0.00 0.00 58.31 55.62 2fyh n LYS 132 Cb 0.52 -1.61 -0.08 0.00 -1.84 0.00 0.00 35.03 32.02 2fyh n LYS 132 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 2fyh s PHE 133 N -2.47 -0.75 0.09 2.13 -0.12 -1.25 -5.00 117.98 110.60 2fyh s PHE 133 Ca -0.23 1.73 0.03 0.00 -0.05 0.00 0.00 56.93 58.42 2fyh s PHE 133 Cb 0.04 0.31 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 2fyh s PHE 133 CO 0.35 -0.37 -0.10 0.54 -0.05 0.00 0.00 175.22 175.59 2fyh s VAL 134 N 0.66 0.88 -0.18 -2.49 0.11 -1.26 -0.34 120.40 117.78 2fyh s VAL 134 Ca -0.03 -1.54 0.05 0.00 -2.93 0.00 0.00 61.98 57.53 2fyh s VAL 134 Cb -0.05 -1.24 -0.15 0.00 -1.53 0.00 0.00 36.38 33.41 2fyh s VAL 134 CO -0.04 -0.52 -0.10 0.29 -3.33 0.00 0.00 175.10 171.39 2fyh n LYS 135 N 0.72 0.81 -3.11 1.54 4.01 -1.19 -4.92 118.16 116.01 2fyh n LYS 135 Ca -0.17 0.08 -0.41 0.00 -0.51 0.00 0.00 58.31 57.29 2fyh n LYS 135 Cb 0.57 -1.40 -0.06 0.00 -0.51 0.00 0.00 35.03 33.63 2fyh n LYS 135 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2fyh s ASP 136 N -5.60 6.51 -0.02 4.39 2.15 -1.26 -4.97 116.67 117.87 2fyh s ASP 136 Ca -0.21 0.49 -0.00 0.00 0.43 0.00 0.00 52.55 53.26 2fyh s ASP 136 Cb 0.06 -2.33 -0.00 0.00 -0.30 0.00 0.00 42.92 40.35 2fyh s ASP 136 CO 0.51 -0.46 -0.01 0.50 -0.17 0.00 0.00 175.17 175.54 2fyh h LYS 137 N 8.13 0.00 -0.91 4.34 3.64 -2.00 -3.36 116.57 126.40 2fyh h LYS 137 Ca -0.27 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.23 2fyh h LYS 137 Cb 1.12 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.81 2fyh h LYS 137 CO 0.80 0.00 -0.44 1.28 -2.27 0.00 0.00 179.45 178.81 2fyh n LEU 138 N -2.55 -0.77 -0.32 5.20 4.77 -1.26 0.79 117.00 122.87 2fyh n LEU 138 Ca -0.00 1.61 0.25 0.00 -0.03 0.00 0.00 56.01 57.84 2fyh n LEU 138 Cb 0.01 -0.29 0.47 0.00 -2.33 0.00 0.00 43.42 41.28 2fyh n LEU 138 CO 0.01 -1.38 0.93 0.61 -1.33 0.00 0.00 177.39 176.23 2fyh n GLY 139 N -1.34 -0.94 0.43 -0.72 0.00 -1.26 -0.50 105.19 100.86 2fyh n GLY 139 Ca 0.06 0.84 -0.12 0.00 0.00 0.00 0.00 46.02 46.80 2fyh n GLY 139 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fyh h LEU 140 N 0.00 -1.67 0.38 0.99 3.38 0.24 0.39 115.31 119.03 2fyh h LEU 140 Ca 0.74 0.23 -0.02 0.00 0.09 0.00 0.00 57.88 58.92 2fyh h LEU 140 Cb 1.83 0.69 0.00 0.00 0.09 0.00 0.00 40.66 43.27 2fyh h LEU 140 CO -0.81 -0.40 -0.18 0.00 0.09 0.00 0.00 178.44 177.14 2fyh h ALA 141 N 0.10 -0.51 -1.18 1.53 0.00 -0.88 -2.40 119.26 115.93 2fyh h ALA 141 Ca 0.09 -0.14 0.43 0.00 0.00 0.00 0.00 54.91 55.30 2fyh h ALA 141 Cb 0.61 0.20 -0.16 0.00 0.00 0.00 0.00 17.79 18.44 2fyh h ALA 141 CO -0.56 -0.49 0.71 0.52 0.00 0.00 0.00 179.25 179.42 2fyh h MET 142 N -1.10 0.05 0.32 0.00 2.86 -1.07 0.97 114.93 116.97 2fyh h MET 142 Ca -0.05 -0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 2fyh h MET 142 Cb 0.44 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.09 2fyh h MET 142 CO 0.09 0.03 -0.15 -0.22 1.06 0.00 0.00 176.91 177.71 2fyh h LYS 143 N 0.05 -0.42 -1.05 1.72 3.64 -0.24 -3.26 116.57 117.01 2fyh h LYS 143 Ca 0.84 0.03 0.28 0.00 -1.27 0.00 0.00 60.65 60.54 2fyh h LYS 143 Cb 2.43 0.09 -0.12 0.00 -0.41 0.00 0.00 32.23 34.23 2fyh h LYS 143 CO -0.60 -0.18 0.65 -0.07 -2.27 0.00 0.00 179.45 176.98 2fyh h LEU 144 N -1.06 0.52 -1.14 5.20 3.38 -0.38 0.39 115.31 122.22 2fyh h LEU 144 Ca -0.04 0.12 0.18 0.00 0.09 0.00 0.00 57.88 58.23 2fyh h LEU 144 Cb 0.43 0.05 -0.09 0.00 0.09 0.00 0.00 40.66 41.14 2fyh h LEU 144 CO 0.07 0.03 0.61 0.50 0.09 0.00 0.00 178.44 179.75 2fyh h LYS 145 N 0.42 0.68 -0.11 1.13 3.64 -0.99 0.74 116.57 122.09 2fyh h LYS 145 Ca 0.66 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.80 2fyh h LYS 145 Cb 1.54 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 33.22 2fyh h LYS 145 CO -0.42 0.45 -0.69 0.93 -2.27 0.00 0.00 179.45 177.46 2fyh h GLU 146 N 0.70 0.66 -0.18 1.90 4.39 -0.30 -3.08 114.58 118.67 2fyh h GLU 146 Ca 0.54 -0.56 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2fyh h GLU 146 Cb 0.91 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 2fyh h GLU 146 CO -0.31 1.18 0.00 1.28 -1.16 0.00 0.00 179.01 180.00 2fyh n LEU 147 N -4.06 1.13 0.09 1.33 4.32 -0.31 -2.55 117.00 116.94 2fyh n LEU 147 Ca -0.08 -0.54 0.05 0.00 -0.02 0.00 0.00 56.01 55.42 2fyh n LEU 147 Cb 0.70 -0.12 -0.01 0.00 -1.62 0.00 0.00 43.42 42.37 2fyh n LEU 147 CO 0.50 0.27 0.06 0.00 -1.22 0.00 0.00 177.39 177.00 2fyh h ALA 148 N 3.54 0.65 0.00 -1.18 0.00 0.53 -3.35 119.26 119.44 2fyh h ALA 148 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2fyh h ALA 148 Cb 0.29 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2fyh h ALA 148 CO 0.00 0.51 -0.91 0.09 0.00 0.00 0.00 179.25 178.93 2fyh n ASN 149 N -2.92 4.56 -4.51 0.00 3.02 -1.23 -4.36 115.26 109.83 2fyh n ASN 149 Ca -0.03 -0.02 -0.43 0.00 -0.03 0.00 0.00 54.58 54.07 2fyh n ASN 149 Cb 0.71 0.95 -0.07 0.00 -0.61 0.00 0.00 39.78 40.76 2fyh n ASN 149 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2fyh n GLU 150 N -1.41 0.98 -1.27 3.52 0.00 -1.06 -4.84 120.64 116.56 2fyh n GLU 150 Ca 0.00 0.17 -0.32 0.00 0.00 0.00 0.00 57.16 57.01 2fyh n GLU 150 Cb 0.00 -2.72 0.10 0.00 0.00 0.00 0.00 31.44 28.83 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 9.37 4.14 -0.03 4.31 2.15 -1.26 -4.52 116.67 130.83 2fyh s ASP 151 Ca 1.09 2.11 0.02 0.00 0.43 0.00 0.00 52.55 56.21 2fyh s ASP 151 Cb -0.64 -2.56 -0.03 0.00 -0.30 0.00 0.00 42.92 39.39 2fyh s ASP 151 CO 0.40 -2.29 0.00 0.49 -0.17 0.00 0.00 175.17 173.60 2fyh n PHE 152 N -3.23 0.00 0.00 -5.34 3.72 -1.09 -5.04 117.46 106.49 2fyh n PHE 152 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2fyh n PHE 152 Cb 0.52 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 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 2.94 0.74 3.44 1.37 0.00 -1.21 -4.73 105.19 107.75 2fyh n GLY 153 Ca -0.04 -1.88 -0.12 0.00 0.00 0.00 0.00 46.02 43.97 2fyh n GLY 153 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fyh s SER 154 N -4.00 0.39 0.02 1.61 1.04 -1.26 -1.43 113.70 110.07 2fyh s SER 154 Ca 0.00 -1.27 -0.29 0.00 0.48 0.00 0.00 55.95 54.87 2fyh s SER 154 Cb 0.00 0.56 0.11 0.00 0.10 0.00 0.00 66.02 66.79 2fyh s SER 154 CO 0.00 -1.12 1.22 0.72 0.98 0.00 0.00 173.24 175.05 2fyh s PHE 155 N -3.70 -0.05 -0.04 5.02 -0.71 -0.46 -4.81 117.98 113.22 2fyh s PHE 155 Ca 0.30 -0.09 0.06 0.00 -1.04 0.00 0.00 56.93 56.16 2fyh s PHE 155 Cb 0.01 0.57 -0.01 0.00 -1.21 0.00 0.00 43.02 42.38 2fyh s PHE 155 CO 0.14 -0.39 -0.24 0.42 -1.34 0.00 0.00 175.22 173.82 2fyh s ILE 156 N -2.57 1.92 -0.67 -4.49 1.01 -1.26 -1.14 121.20 114.00 2fyh s ILE 156 Ca 0.14 -1.01 -0.26 0.00 0.00 0.00 0.00 60.65 59.53 2fyh s ILE 156 Cb 0.03 -1.62 0.04 0.00 0.01 0.00 0.00 42.46 40.93 2fyh s ILE 156 CO -0.03 0.54 1.13 -0.69 0.00 0.00 0.00 174.94 175.90 2fyh s VAL 157 N -0.26 4.03 0.00 2.92 1.01 -1.12 -4.86 120.40 122.12 2fyh s VAL 157 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.24 2fyh s VAL 157 Cb -0.12 -4.77 0.00 0.00 0.00 0.00 0.00 36.38 31.49 2fyh s VAL 157 CO 0.02 -1.56 0.00 -0.62 0.00 0.00 0.00 175.10 172.94 2fyh n GLU 158 N 8.50 0.00 -2.98 2.72 4.71 -1.26 -4.14 120.64 128.19 2fyh n GLU 158 Ca 0.02 0.06 -0.20 0.00 -0.01 0.00 0.00 57.16 57.02 2fyh n GLU 158 Cb 0.48 -0.54 0.07 0.00 -1.01 0.00 0.00 31.44 30.44 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 -3.05 4.61 0.08 0.62 0.00 -1.26 -4.87 121.76 117.89 2fyh s ALA 159 Ca 0.00 -2.15 0.03 0.00 0.00 0.00 0.00 51.96 49.84 2fyh s ALA 159 Cb 0.00 -1.51 -0.03 0.00 0.00 0.00 0.00 23.12 21.58 2fyh s ALA 159 CO 0.00 -1.00 -0.09 0.42 0.00 0.00 0.00 175.76 175.09 2fyh s ILE 160 N -2.76 0.79 -0.02 0.00 1.01 -1.05 -4.59 121.20 114.57 2fyh s ILE 160 Ca 0.63 -1.58 0.03 0.00 0.00 0.00 0.00 60.65 59.73 2fyh s ILE 160 Cb -0.05 -1.27 -0.00 0.00 0.01 0.00 0.00 42.46 41.15 2fyh s ILE 160 CO 0.40 -0.60 -0.11 -0.70 0.00 0.00 0.00 174.94 173.94 2fyh s GLU 161 N -2.77 1.00 -0.14 2.79 2.12 -0.79 -1.99 118.70 118.91 2fyh s GLU 161 Ca 0.03 -0.39 0.02 0.00 0.36 0.00 0.00 54.97 55.00 2fyh s GLU 161 Cb -0.02 -0.95 0.01 0.00 0.26 0.00 0.00 34.13 33.43 2fyh s GLU 161 CO -0.01 0.21 -0.22 -1.17 -0.54 0.00 0.00 175.26 173.53 2fyh s LEU 162 N -0.10 2.09 0.40 2.70 2.96 -0.04 -0.72 118.68 125.96 2fyh s LEU 162 Ca 0.02 -0.60 0.04 0.00 -0.22 0.00 0.00 54.13 53.37 2fyh s LEU 162 Cb -0.06 -1.43 -0.05 0.00 0.50 0.00 0.00 46.19 45.15 2fyh s LEU 162 CO 0.00 0.08 0.05 -0.54 -1.32 0.00 0.00 176.35 174.62 2fyh s LYS 163 N 0.83 1.89 0.39 1.98 1.02 -0.85 -0.59 119.74 124.41 2fyh s LYS 163 Ca -0.07 -2.11 0.05 0.00 0.02 0.00 0.00 55.97 53.87 2fyh s LYS 163 Cb -0.15 -1.13 -0.06 0.00 -0.52 0.00 0.00 37.83 35.97 2fyh s LYS 163 CO -0.02 -0.25 0.03 -1.59 -0.92 0.00 0.00 175.35 172.61 2fyh s LYS 164 N -3.81 1.87 -0.10 1.68 -2.85 0.48 -1.81 119.74 115.21 2fyh s LYS 164 Ca 0.28 -2.07 -0.04 0.00 -1.00 0.00 0.00 55.97 53.14 2fyh s LYS 164 Cb 0.06 -1.28 0.05 0.00 -2.06 0.00 0.00 37.83 34.60 2fyh s LYS 164 CO 0.14 -0.16 0.20 0.45 0.10 0.00 0.00 175.35 176.08 2fyh s SER 165 N -3.64 0.46 -0.24 0.03 0.15 0.20 -3.73 113.70 106.93 2fyh s SER 165 Ca 0.32 0.43 -0.03 0.00 0.70 0.00 0.00 55.95 57.37 2fyh s SER 165 Cb 0.08 0.42 0.08 0.00 -1.71 0.00 0.00 66.02 64.89 2fyh s SER 165 CO 0.15 -0.23 0.09 -0.89 1.20 0.00 0.00 173.24 173.56 2fyh s THR 166 N 2.15 0.26 0.26 6.45 2.01 -0.74 -0.86 115.64 125.18 2fyh s THR 166 Ca 0.00 -0.68 -0.30 0.00 0.31 0.00 0.00 61.69 61.03 2fyh s THR 166 Cb -0.12 -1.02 -0.09 0.00 0.01 0.00 0.00 72.50 71.28 2fyh s THR 166 CO -0.07 -0.48 1.09 -0.76 -0.69 0.00 0.00 174.62 173.72 2fyh s LEU 167 N 1.96 4.55 0.04 4.42 1.43 -1.26 -0.72 118.68 129.10 2fyh s LEU 167 Ca 0.05 2.23 -0.05 0.00 -1.03 0.00 0.00 54.13 55.33 2fyh s LEU 167 Cb -0.17 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.42 2fyh s LEU 167 CO -0.20 -0.13 0.08 0.42 0.23 0.00 0.00 176.35 176.74 2fyh s THR 168 N -1.05 0.15 0.42 5.49 -4.23 -0.77 -4.93 115.64 110.72 2fyh s THR 168 Ca 0.45 -1.21 0.23 0.00 -1.18 0.00 0.00 61.69 59.98 2fyh s THR 168 Cb -0.31 -1.00 0.43 0.00 1.34 0.00 0.00 72.50 72.95 2fyh s THR 168 CO 0.40 -0.66 1.75 -0.65 -0.54 0.00 0.00 174.62 174.91 2fyh h PRO 169 N 3.55 0.29 0.00 3.99 0.11 -2.02 0.83 132.00 138.75 2fyh h PRO 169 Ca -0.33 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.72 2fyh h PRO 169 Cb 1.18 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2fyh h PRO 169 CO 0.53 0.19 -0.19 0.87 -0.21 0.00 0.00 178.00 179.18 2fyh h LYS 170 N 0.29 0.00 0.00 1.05 1.79 -2.01 -3.49 116.57 114.21 2fyh h LYS 170 Ca 0.63 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.10 2fyh h LYS 170 Cb 1.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.42 2fyh h LYS 170 CO -0.28 0.19 0.00 0.41 -1.08 0.00 0.00 179.45 178.69 2fyh n GLY 171 N 1.13 2.23 3.77 3.86 0.00 0.29 -5.12 105.19 111.35 2fyh n GLY 171 Ca 0.03 -1.62 -0.38 0.00 0.00 0.00 0.00 46.02 44.05 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 -1.79 4.01 -0.17 1.61 0.04 -1.26 -1.85 135.00 135.58 2fyh s PRO 172 Ca 0.00 1.88 -0.00 0.00 0.04 0.00 0.00 61.00 62.91 2fyh s PRO 172 Cb 0.00 -2.66 0.00 0.00 0.04 0.00 0.00 34.50 31.89 2fyh s PRO 172 CO 0.00 -0.37 -0.15 0.42 0.04 0.00 0.00 177.00 176.94 2fyh s ILE 173 N -1.40 2.60 -0.14 0.56 -1.09 0.10 -4.92 121.20 116.92 2fyh s ILE 173 Ca 0.58 -0.78 0.02 0.00 -2.23 0.00 0.00 60.65 58.24 2fyh s ILE 173 Cb -0.31 -2.11 0.00 0.00 -1.58 0.00 0.00 42.46 38.46 2fyh s ILE 173 CO 0.40 0.51 -0.20 -0.31 -1.23 0.00 0.00 174.94 174.10 2fyh s TYR 174 N 1.06 2.68 -0.03 3.97 1.51 -1.26 -1.79 117.35 123.49 2fyh s TYR 174 Ca -0.01 -1.19 -0.11 0.00 -1.01 0.00 0.00 57.07 54.75 2fyh s TYR 174 Cb -0.15 -1.82 0.02 0.00 -0.11 0.00 0.00 41.96 39.91 2fyh s TYR 174 CO -0.04 -0.53 0.25 -2.00 -1.11 0.00 0.00 175.55 172.12 2fyh s GLU 175 N 0.71 0.53 0.28 -0.62 2.12 -1.24 -5.00 118.70 115.48 2fyh s GLU 175 Ca -0.09 -0.13 -0.27 0.00 0.36 0.00 0.00 54.97 54.85 2fyh s GLU 175 Cb -0.16 0.24 -0.09 0.00 0.26 0.00 0.00 34.13 34.37 2fyh s GLU 175 CO 0.01 -0.13 0.92 0.99 -0.54 0.00 0.00 175.26 176.51 2fyh s THR 176 N -1.01 4.19 -0.12 -1.70 2.01 -1.26 -0.39 115.64 117.36 2fyh s THR 176 Ca -0.11 1.88 0.04 0.00 0.31 0.00 0.00 61.69 63.81 2fyh s THR 176 Cb -0.05 -4.12 -0.10 0.00 0.01 0.00 0.00 72.50 68.24 2fyh s THR 176 CO 0.03 0.29 -0.06 0.18 -0.69 0.00 0.00 174.62 174.36 2fyh n LEU 177 N 0.94 1.88 -3.65 4.42 4.77 0.24 -4.89 117.00 120.72 2fyh n LEU 177 Ca -0.00 -0.05 -0.15 0.00 -0.03 0.00 0.00 56.01 55.79 2fyh n LEU 177 Cb 0.49 -0.20 -0.08 0.00 -2.33 0.00 0.00 43.42 41.30 2fyh n LEU 177 CO 0.46 0.56 0.26 0.00 -1.33 0.00 0.00 177.39 177.33 2fyh s ALA 178 N -2.26 -1.37 -0.16 -1.18 0.00 -1.06 -5.04 121.76 110.69 2fyh s ALA 178 Ca -0.13 1.25 -0.03 0.00 0.00 0.00 0.00 51.96 53.04 2fyh s ALA 178 Cb 0.04 -0.46 0.05 0.00 0.00 0.00 0.00 23.12 22.76 2fyh s ALA 178 CO 0.36 -0.29 0.06 1.03 0.00 0.00 0.00 175.76 176.91 2fyh s ARG 179 N -0.45 0.36 -0.59 0.00 0.52 -1.26 -0.86 118.95 116.65 2fyh s ARG 179 Ca -0.06 -0.17 -0.15 0.00 -0.52 0.00 0.00 55.73 54.83 2fyh s ARG 179 Cb -0.03 -1.76 0.15 0.00 0.52 0.00 0.00 34.95 33.83 2fyh s ARG 179 CO 0.04 -0.59 0.54 -0.06 0.02 0.00 0.00 175.30 175.25 2fyh s PHE 180 N 2.01 3.37 -0.33 -0.53 0.08 -0.84 -5.04 117.98 116.70 2fyh s PHE 180 Ca 0.01 -1.50 -0.12 0.00 0.12 0.00 0.00 56.93 55.44 2fyh s PHE 180 Cb -0.16 -3.77 -0.02 0.00 -0.57 0.00 0.00 43.02 38.50 2fyh s PHE 180 CO -0.08 -1.01 0.22 -2.00 -0.10 0.00 0.00 175.22 172.26 2fyh s GLU 181 N 1.27 3.56 0.08 0.44 2.12 -1.26 -2.54 118.70 122.36 2fyh s GLU 181 Ca 0.06 -0.60 -0.28 0.00 0.36 0.00 0.00 54.97 54.52 2fyh s GLU 181 Cb -0.26 -3.76 -0.17 0.00 0.26 0.00 0.00 34.13 30.20 2fyh s GLU 181 CO 0.00 -0.40 1.67 -0.07 -0.54 0.00 0.00 175.26 175.93 2fyh h LEU 182 N 8.46 -0.41 -9.92 2.70 3.38 -1.96 -3.44 115.31 114.11 2fyh h LEU 182 Ca -0.32 0.01 -0.45 0.00 0.09 0.00 0.00 57.88 57.21 2fyh h LEU 182 Cb 1.16 0.11 0.22 0.00 0.09 0.00 0.00 40.66 42.24 2fyh h LEU 182 CO 0.62 -0.29 -0.48 -0.24 0.09 0.00 0.00 178.44 178.14 2fyh n SER 183 N -5.30 -1.97 -0.00 -0.43 2.88 -1.26 -4.97 113.62 102.58 2fyh n SER 183 Ca -0.11 -0.11 0.05 0.00 -1.33 0.00 0.00 58.87 57.37 2fyh n SER 183 Cb 0.21 -1.14 -0.06 0.00 -0.75 0.00 0.00 64.21 62.47 2fyh n SER 183 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2fyh n GLU 184 N -3.61 1.58 -4.39 -1.46 0.00 -1.26 -5.05 120.64 106.46 2fyh n GLU 184 Ca 0.02 -0.06 -0.22 0.00 0.00 0.00 0.00 57.16 56.91 2fyh n GLU 184 Cb 0.57 -1.12 -0.08 0.00 0.00 0.00 0.00 31.44 30.81 2fyh n GLU 184 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.13 173.75 2fyh s HIS 185 N -2.37 1.71 -0.28 -1.84 -3.43 -1.26 -5.17 115.29 102.65 2fyh s HIS 185 Ca -0.01 -1.42 -0.26 0.00 -0.80 0.00 0.00 55.06 52.57 2fyh s HIS 185 Cb 0.06 -0.93 0.16 0.00 -1.43 0.00 0.00 32.58 30.43 2fyh s HIS 185 CO 0.38 -0.53 1.22 -1.58 -2.00 0.00 0.00 174.74 172.23 2fyh s HIS 186 N -3.41 -0.27 -1.26 0.38 2.46 -1.26 -4.99 115.29 106.94 2fyh s HIS 186 Ca 0.32 0.63 -0.06 0.00 0.47 0.00 0.00 55.06 56.43 2fyh s HIS 186 Cb 0.03 0.43 0.01 0.00 -0.13 0.00 0.00 32.58 32.92 2fyh s HIS 186 CO 0.19 -0.14 1.09 1.58 -2.47 0.00 0.00 174.74 174.99 2fyh n HIS 187 N 1.76 -2.58 -0.86 3.88 -0.00 -1.26 -4.98 115.22 111.18 2fyh n HIS 187 Ca -0.11 0.96 -0.29 0.00 -0.00 0.00 0.00 57.72 58.28 2fyh n HIS 187 Cb 0.57 -4.93 0.24 0.00 -0.00 0.00 0.00 29.99 25.86 2fyh n HIS 187 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2fyh s HIS 188 N -3.32 0.76 0.82 1.57 -0.00 -1.26 -5.04 115.29 108.82 2fyh s HIS 188 Ca 0.38 0.73 -0.11 0.00 -0.00 0.00 0.00 55.06 56.07 2fyh s HIS 188 Cb -0.17 -3.23 0.11 0.00 -0.00 0.00 0.00 32.58 29.30 2fyh s HIS 188 CO 0.70 -3.92 1.16 -1.01 -0.00 0.00 0.00 174.74 171.68 2fyh s HIS 189 N -2.75 2.42 -1.37 0.38 3.76 -1.26 -5.29 115.29 111.18 2fyh s HIS 189 Ca 0.69 0.45 0.00 0.00 -0.15 0.00 0.00 55.06 56.04 2fyh s HIS 189 Cb -0.15 -3.56 0.00 0.00 1.11 0.00 0.00 32.58 29.98 2fyh s HIS 189 CO 0.58 -1.93 0.34 -2.39 -0.85 0.00 0.00 174.74 170.49