#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 3.60 0.17 2.12 0.52 -0.79 -2.83 118.95 121.74 2fyh s ARG 2 Ca 0.00 -2.11 -0.12 0.00 -0.52 0.00 0.00 55.73 52.98 2fyh s ARG 2 Cb 0.00 -4.67 -0.07 0.00 0.52 0.00 0.00 34.95 30.74 2fyh s ARG 2 CO 0.00 -1.53 0.53 0.00 0.02 0.00 0.00 175.30 174.32 2fyh s ALA 3 N 1.43 3.59 -0.26 2.13 0.00 -0.86 0.44 121.76 128.22 2fyh s ALA 3 Ca 0.25 -0.21 -0.23 0.00 0.00 0.00 0.00 51.96 51.78 2fyh s ALA 3 Cb -0.08 -2.46 0.07 0.00 0.00 0.00 0.00 23.12 20.65 2fyh s ALA 3 CO -0.09 0.49 0.69 -0.59 0.00 0.00 0.00 175.76 176.26 2fyh s PHE 4 N -1.58 -0.81 -0.17 0.00 -0.12 -0.07 -2.22 117.98 113.01 2fyh s PHE 4 Ca 0.41 1.90 -0.17 0.00 -0.05 0.00 0.00 56.93 59.01 2fyh s PHE 4 Cb -0.14 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.53 2fyh s PHE 4 CO 0.20 -0.39 0.43 0.96 -0.05 0.00 0.00 175.22 176.37 2fyh s ILE 5 N 0.58 5.19 0.33 -4.49 -4.36 -0.98 -1.64 121.20 115.83 2fyh s ILE 5 Ca -0.02 0.80 0.07 0.00 -0.26 0.00 0.00 60.65 61.24 2fyh s ILE 5 Cb -0.05 -3.76 -0.07 0.00 1.25 0.00 0.00 42.46 39.83 2fyh s ILE 5 CO -0.02 0.27 -0.03 0.00 0.24 0.00 0.00 174.94 175.40 2fyh s ALA 6 N 1.08 2.69 -0.15 2.27 0.00 0.82 -0.24 121.76 128.23 2fyh s ALA 6 Ca 0.22 -2.07 -0.03 0.00 0.00 0.00 0.00 51.96 50.07 2fyh s ALA 6 Cb -0.15 0.21 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 2fyh s ALA 6 CO 0.08 -0.09 -0.06 0.42 0.00 0.00 0.00 175.76 176.11 2fyh s ILE 7 N -2.89 3.66 0.17 0.00 1.01 0.14 -1.91 121.20 121.37 2fyh s ILE 7 Ca 0.33 -0.44 -0.33 0.00 0.00 0.00 0.00 60.65 60.20 2fyh s ILE 7 Cb 0.06 -2.59 -0.14 0.00 0.01 0.00 0.00 42.46 39.79 2fyh s ILE 7 CO 0.15 0.50 1.45 -0.67 0.00 0.00 0.00 174.94 176.36 2fyh n ASP 8 N 3.58 2.58 -4.20 3.58 2.03 -1.26 -3.05 116.55 119.81 2fyh n ASP 8 Ca -0.18 1.11 -0.41 0.00 0.52 0.00 0.00 54.79 55.84 2fyh n ASP 8 Cb 0.52 -1.37 -0.06 0.00 -0.72 0.00 0.00 41.12 39.50 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 0.44 4.69 0.56 5.18 -7.23 -1.26 -4.94 120.40 117.84 2fyh s VAL 9 Ca 0.76 -3.01 -0.15 0.00 -1.81 0.00 0.00 61.98 57.77 2fyh s VAL 9 Cb -0.73 -3.94 -0.13 0.00 0.56 0.00 0.00 36.38 32.14 2fyh s VAL 9 CO 0.44 -1.00 -0.29 -1.54 -0.31 0.00 0.00 175.10 172.40 2fyh n SER 10 N 3.36 -3.75 -0.43 4.85 3.41 -1.26 -3.83 113.62 115.97 2fyh n SER 10 Ca 0.14 0.42 0.36 0.00 -0.26 0.00 0.00 58.87 59.53 2fyh n SER 10 Cb 0.41 -0.69 0.67 0.00 -0.26 0.00 0.00 64.21 64.34 2fyh n SER 10 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2fyh h GLU 11 N -0.28 0.12 -1.01 4.33 9.09 -1.98 0.44 114.58 125.29 2fyh h GLU 11 Ca -0.35 -0.01 0.24 0.00 0.05 0.00 0.00 59.36 59.28 2fyh h GLU 11 Cb 1.18 -0.03 -0.10 0.00 -1.65 0.00 0.00 28.75 28.15 2fyh h GLU 11 CO 0.30 0.08 0.63 0.66 0.05 0.00 0.00 179.01 180.73 2fyh h SER 12 N 0.12 0.60 0.00 3.06 4.64 -1.91 -0.35 113.55 119.71 2fyh h SER 12 Ca 0.73 0.10 -0.20 0.00 -0.47 0.00 0.00 61.79 61.95 2fyh h SER 12 Cb 2.46 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.52 2fyh h SER 12 CO -0.23 0.15 -1.14 0.58 -0.87 0.00 0.00 176.83 175.31 2fyh h VAL 13 N 0.55 0.83 -0.55 0.95 2.07 -0.36 -3.18 116.25 116.56 2fyh h VAL 13 Ca 0.60 -2.05 0.06 0.00 0.82 0.00 0.00 66.70 66.13 2fyh h VAL 13 Cb 1.24 1.99 -0.09 0.00 -1.52 0.00 0.00 31.29 32.91 2fyh h VAL 13 CO -0.37 0.28 -0.57 0.03 0.02 0.00 0.00 177.57 176.97 2fyh h ARG 14 N -1.00 -0.30 -0.43 1.57 3.08 -1.11 0.22 114.38 116.42 2fyh h ARG 14 Ca -0.30 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.74 2fyh h ARG 14 Cb 1.20 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.30 2fyh h ARG 14 CO -0.18 -0.20 0.14 0.22 -1.07 0.00 0.00 179.97 178.88 2fyh h ASP 15 N -0.31 0.56 0.74 7.04 3.58 -1.28 -1.90 116.42 124.85 2fyh h ASP 15 Ca 0.09 -0.07 -0.03 0.00 0.42 0.00 0.00 57.03 57.44 2fyh h ASP 15 Cb 0.55 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.45 2fyh h ASP 15 CO -0.68 0.53 -0.50 0.00 -2.88 0.00 0.00 179.24 175.72 2fyh h ALA 16 N 1.55 -1.25 -0.10 -0.78 0.00 -0.68 0.11 119.26 118.11 2fyh h ALA 16 Ca 0.15 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2fyh h ALA 16 Cb 0.17 0.64 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2fyh h ALA 16 CO -0.01 -1.22 -0.02 -0.07 0.00 0.00 0.00 179.25 177.93 2fyh h LEU 17 N -1.18 -0.08 -0.86 0.00 3.38 -0.72 -2.47 115.31 113.38 2fyh h LEU 17 Ca -0.10 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.02 2fyh h LEU 17 Cb 0.96 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.68 2fyh h LEU 17 CO 0.07 -0.02 0.49 0.58 0.09 0.00 0.00 178.44 179.64 2fyh h VAL 18 N 0.01 0.84 -0.81 1.22 2.07 -1.27 -1.13 116.25 117.18 2fyh h VAL 18 Ca 0.05 -0.26 0.17 0.00 0.82 0.00 0.00 66.70 67.47 2fyh h VAL 18 Cb 0.07 0.01 -0.10 0.00 -1.52 0.00 0.00 31.29 29.75 2fyh h VAL 18 CO -0.10 0.14 0.33 -0.09 0.02 0.00 0.00 177.57 177.87 2fyh h ARG 19 N 0.76 0.43 0.13 1.57 2.43 -0.28 -1.85 114.38 117.56 2fyh h ARG 19 Ca 0.44 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.58 2fyh h ARG 19 Cb 0.50 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2fyh h ARG 19 CO -0.30 0.28 -0.06 0.00 -1.51 0.00 0.00 179.97 178.39 2fyh h ALA 20 N 1.60 -0.17 -0.66 2.80 0.00 -1.15 -3.28 119.26 118.40 2fyh h ALA 20 Ca 0.46 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.27 2fyh h ALA 20 Cb 0.76 0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.53 2fyh h ALA 20 CO -0.44 -0.44 -0.46 1.96 0.00 0.00 0.00 179.25 179.87 2fyh h GLN 21 N -0.49 -0.09 -0.91 0.00 4.20 -0.97 0.44 115.11 117.30 2fyh h GLN 21 Ca -0.02 0.01 0.35 0.00 0.06 0.00 0.00 58.65 59.05 2fyh h GLN 21 Cb 0.39 0.02 -0.17 0.00 0.30 0.00 0.00 27.48 28.02 2fyh h GLN 21 CO 0.03 -0.06 0.39 -3.47 -0.67 0.00 0.00 178.83 175.05 2fyh n ASP 22 N -4.80 0.22 -0.02 1.46 2.03 -0.97 0.16 116.55 114.64 2fyh n ASP 22 Ca 0.00 1.52 -0.17 0.00 0.52 0.00 0.00 54.79 56.66 2fyh n ASP 22 Cb 0.22 -0.70 -0.08 0.00 -0.72 0.00 0.00 41.12 39.84 2fyh n ASP 22 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2fyh h TYR 23 N 0.00 0.90 0.61 -0.67 3.20 -0.28 -3.33 116.97 117.40 2fyh h TYR 23 Ca 0.72 -0.41 -0.02 0.00 3.14 0.00 0.00 58.73 62.16 2fyh h TYR 23 Cb 1.84 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.97 2fyh h TYR 23 CO -0.11 1.23 -0.51 0.82 -1.64 0.00 0.00 178.16 177.95 2fyh h ILE 24 N 0.31 0.00 -3.77 1.81 2.04 0.32 -3.49 117.51 114.74 2fyh h ILE 24 Ca -0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.87 2fyh h ILE 24 Cb 1.34 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 2fyh h ILE 24 CO 0.14 0.00 -1.04 0.61 0.00 0.00 0.00 178.15 177.86 2fyh n GLY 25 N -1.59 -3.91 2.65 5.37 0.00 -0.36 -4.72 105.19 102.64 2fyh n GLY 25 Ca -0.13 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.97 5.95 0.08 1.61 3.41 -1.26 -4.79 113.62 115.65 2fyh n SER 26 Ca -0.02 -3.77 -0.03 0.00 -0.26 0.00 0.00 58.87 54.79 2fyh n SER 26 Cb 0.53 -0.72 -0.02 0.00 -0.26 0.00 0.00 64.21 63.74 2fyh n SER 26 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2fyh h LYS 27 N 2.74 -0.21 0.19 4.33 3.64 -2.00 -3.39 116.57 121.87 2fyh h LYS 27 Ca 0.42 0.01 -0.32 0.00 -1.27 0.00 0.00 60.65 59.49 2fyh h LYS 27 Cb 0.55 0.05 0.02 0.00 -0.41 0.00 0.00 32.23 32.44 2fyh h LYS 27 CO 1.11 -0.14 -1.51 1.05 -2.27 0.00 0.00 179.45 177.69 2fyh h GLU 28 N -0.45 0.41 -6.06 1.90 9.09 -1.95 -3.46 114.58 114.05 2fyh h GLU 28 Ca -0.02 -0.70 -0.54 0.00 0.05 0.00 0.00 59.36 58.15 2fyh h GLU 28 Cb 0.17 0.26 -0.02 0.00 -1.65 0.00 0.00 28.75 27.50 2fyh h GLU 28 CO 0.04 1.32 -0.45 0.00 0.05 0.00 0.00 179.01 179.96 2fyh s ALA 29 N -2.61 3.96 -0.75 1.06 0.00 -1.26 -3.58 121.76 118.58 2fyh s ALA 29 Ca -0.10 -1.02 -0.02 0.00 0.00 0.00 0.00 51.96 50.82 2fyh s ALA 29 Cb 0.05 -1.80 0.19 0.00 0.00 0.00 0.00 23.12 21.56 2fyh s ALA 29 CO 0.90 0.53 0.59 0.21 0.00 0.00 0.00 175.76 177.99 2fyh s LYS 30 N -3.25 2.88 -0.19 0.00 2.47 0.76 -4.38 119.74 118.01 2fyh s LYS 30 Ca 0.35 -2.90 -0.05 0.00 -1.56 0.00 0.00 55.97 51.80 2fyh s LYS 30 Cb -0.11 -3.82 -0.03 0.00 -1.46 0.00 0.00 37.83 32.41 2fyh s LYS 30 CO 0.29 -1.22 0.01 0.42 0.16 0.00 0.00 175.35 175.00 2fyh s ILE 31 N -0.70 4.11 -0.77 5.43 1.01 -1.26 -1.03 121.20 127.99 2fyh s ILE 31 Ca 0.22 -0.26 -0.20 0.00 0.00 0.00 0.00 60.65 60.40 2fyh s ILE 31 Cb -0.14 -2.85 0.10 0.00 0.01 0.00 0.00 42.46 39.59 2fyh s ILE 31 CO -0.08 0.44 1.00 -0.75 0.00 0.00 0.00 174.94 175.54 2fyh s LYS 32 N 0.82 3.32 0.93 2.79 2.36 -0.93 -4.91 119.74 124.12 2fyh s LYS 32 Ca 0.01 -1.34 -0.11 0.00 -2.55 0.00 0.00 55.97 51.98 2fyh s LYS 32 Cb -0.14 -4.54 0.15 0.00 -1.05 0.00 0.00 37.83 32.25 2fyh s LYS 32 CO 0.02 -1.75 1.09 -0.06 1.55 0.00 0.00 175.35 176.20 2fyh s PHE 33 N 3.20 2.05 0.10 4.03 0.08 -1.26 -3.45 117.98 122.73 2fyh s PHE 33 Ca 0.25 1.39 0.06 0.00 0.12 0.00 0.00 56.93 58.75 2fyh s PHE 33 Cb -0.12 -3.17 -0.04 0.00 -0.57 0.00 0.00 43.02 39.11 2fyh s PHE 33 CO 0.01 -2.65 -0.06 0.08 -0.10 0.00 0.00 175.22 172.49 2fyh s VAL 34 N -2.80 3.63 1.00 -0.44 1.01 -0.75 -4.94 120.40 117.12 2fyh s VAL 34 Ca 0.65 -1.17 -0.21 0.00 0.00 0.00 0.00 61.98 61.25 2fyh s VAL 34 Cb -0.20 -2.72 -0.14 0.00 0.00 0.00 0.00 36.38 33.33 2fyh s VAL 34 CO 0.58 0.10 -0.94 -0.62 0.00 0.00 0.00 175.10 174.23 2fyh n GLU 35 N 0.62 -0.13 -0.00 2.72 -0.58 -1.26 -4.86 120.64 117.14 2fyh n GLU 35 Ca -0.12 -0.03 -0.17 0.00 -0.42 0.00 0.00 57.16 56.41 2fyh n GLU 35 Cb 0.52 -1.12 -0.11 0.00 -0.57 0.00 0.00 31.44 30.17 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 -1.12 0.39 -0.23 3.49 -0.00 -1.99 -3.13 114.38 111.79 2fyh h ARG 36 Ca -0.43 -0.40 0.00 0.00 -0.50 0.00 0.00 59.98 58.65 2fyh h ARG 36 Cb 1.34 0.11 0.00 0.00 0.00 0.00 0.00 29.97 31.42 2fyh h ARG 36 CO 0.24 1.07 0.00 -0.85 0.00 0.00 0.00 179.97 180.43 2fyh n GLU 37 N -4.26 0.98 -0.02 0.04 0.28 -1.26 -2.73 120.64 113.67 2fyh n GLU 37 Ca -0.10 0.00 0.05 0.00 -0.16 0.00 0.00 57.16 56.95 2fyh n GLU 37 Cb 0.64 -1.12 0.05 0.00 1.43 0.00 0.00 31.44 32.44 2fyh n GLU 37 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2fyh n ASN 38 N -0.38 1.89 -0.55 -1.84 5.03 -1.18 -4.46 115.26 113.77 2fyh n ASN 38 Ca 0.00 -1.46 0.06 0.00 0.87 0.00 0.00 54.58 54.05 2fyh n ASN 38 Cb 0.06 -0.02 0.17 0.00 -1.02 0.00 0.00 39.78 38.96 2fyh n ASN 38 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2fyh n PHE 39 N 0.49 0.38 -1.48 3.10 3.72 -1.11 -4.90 117.46 117.65 2fyh n PHE 39 Ca 0.06 -0.19 -0.49 0.00 -0.05 0.00 0.00 57.45 56.78 2fyh n PHE 39 Cb 0.25 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.73 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 0.36 1.70 -1.73 1.38 1.44 -1.26 -4.78 115.22 112.33 2fyh n HIS 40 Ca 0.11 0.18 -0.67 0.00 -2.01 0.00 0.00 57.72 55.33 2fyh n HIS 40 Cb 0.26 -2.58 -0.10 0.00 0.12 0.00 0.00 29.99 27.70 2fyh n HIS 40 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 2fyh n ILE 41 N 7.27 0.02 -2.35 0.61 5.41 -1.17 -4.44 119.36 124.71 2fyh n ILE 41 Ca 0.38 -0.00 -0.41 0.00 1.00 0.00 0.00 62.75 63.72 2fyh n ILE 41 Cb 0.28 -0.52 -0.03 0.00 -0.71 0.00 0.00 39.64 38.66 2fyh n ILE 41 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2fyh s THR 42 N 2.83 3.68 0.03 1.39 2.01 -1.26 0.27 115.64 124.59 2fyh s THR 42 Ca 1.03 0.52 -0.26 0.00 0.31 0.00 0.00 61.69 63.30 2fyh s THR 42 Cb -1.45 -4.43 -0.17 0.00 0.01 0.00 0.00 72.50 66.45 2fyh s THR 42 CO 0.79 -1.26 1.41 0.25 -0.69 0.00 0.00 174.62 175.12 2fyh h LEU 43 N 13.72 -0.28 -7.28 4.42 6.46 -0.92 -3.44 115.31 127.99 2fyh h LEU 43 Ca -0.27 -0.15 -0.10 0.00 -0.12 0.00 0.00 57.88 57.24 2fyh h LEU 43 Cb 1.10 0.07 -0.21 0.00 -0.73 0.00 0.00 40.66 40.89 2fyh h LEU 43 CO 1.20 0.00 -0.11 -0.75 -0.62 0.00 0.00 178.44 178.16 2fyh s LYS 44 N -5.13 0.72 -0.09 1.25 2.20 -1.06 -4.90 119.74 112.72 2fyh s LYS 44 Ca -0.15 0.27 -0.08 0.00 -0.36 0.00 0.00 55.97 55.65 2fyh s LYS 44 Cb 0.03 0.34 -0.04 0.00 -1.51 0.00 0.00 37.83 36.64 2fyh s LYS 44 CO 0.60 -0.17 0.19 0.12 -0.36 0.00 0.00 175.35 175.73 2fyh s PHE 45 N -0.65 3.62 -0.00 4.03 5.36 -1.26 -2.32 117.98 126.77 2fyh s PHE 45 Ca -0.07 0.62 -0.05 0.00 -0.96 0.00 0.00 56.93 56.46 2fyh s PHE 45 Cb -0.03 -2.01 -0.02 0.00 -0.34 0.00 0.00 43.02 40.63 2fyh s PHE 45 CO 0.04 0.72 -0.09 1.28 -1.46 0.00 0.00 175.22 175.71 2fyh n LEU 46 N 1.92 1.03 0.00 6.12 4.77 -1.05 -4.97 117.00 124.82 2fyh n LEU 46 Ca -0.19 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2fyh n LEU 46 Cb 0.54 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2fyh n LEU 46 CO 0.33 -0.56 0.00 0.61 -1.33 0.00 0.00 177.39 176.44 2fyh n GLY 47 N 2.74 0.96 3.73 -0.72 0.00 -0.94 -4.95 105.19 106.01 2fyh n GLY 47 Ca -0.04 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 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 4.27 -0.04 1.61 -6.30 -1.20 -2.04 118.70 115.00 2fyh s GLU 48 Ca 0.00 2.25 -0.14 0.00 -2.50 0.00 0.00 54.97 54.58 2fyh s GLU 48 Cb 0.00 -3.16 0.03 0.00 0.00 0.00 0.00 34.13 30.99 2fyh s GLU 48 CO 0.00 -0.47 0.32 0.42 0.02 0.00 0.00 175.26 175.55 2fyh s ILE 49 N 0.62 0.04 -0.07 -3.70 1.01 -1.13 -4.98 121.20 113.00 2fyh s ILE 49 Ca 0.64 -0.36 -0.20 0.00 0.00 0.00 0.00 60.65 60.73 2fyh s ILE 49 Cb -0.41 -0.58 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 2fyh s ILE 49 CO 0.36 -0.20 0.56 0.42 0.00 0.00 0.00 174.94 176.09 2fyh s THR 50 N -0.95 5.06 0.28 2.92 -4.23 -1.26 -4.64 115.64 112.81 2fyh s THR 50 Ca -0.10 1.16 0.17 0.00 -1.18 0.00 0.00 61.69 61.73 2fyh s THR 50 Cb -0.05 -3.90 0.28 0.00 1.34 0.00 0.00 72.50 70.17 2fyh s THR 50 CO 0.03 0.35 1.14 1.21 -0.54 0.00 0.00 174.62 176.81 2fyh n GLU 51 N 3.33 -0.04 0.04 3.99 2.13 -1.26 -0.64 120.64 128.19 2fyh n GLU 51 Ca -0.06 0.98 -0.02 0.00 0.66 0.00 0.00 57.16 58.72 2fyh n GLU 51 Cb 0.51 -1.79 -0.01 0.00 0.27 0.00 0.00 31.44 30.43 2fyh n GLU 51 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2fyh h GLU 52 N 0.00 -0.11 -1.26 5.31 5.08 -2.03 -3.24 114.58 118.32 2fyh h GLU 52 Ca 0.62 0.01 0.45 0.00 -1.00 0.00 0.00 59.36 59.44 2fyh h GLU 52 Cb 1.72 0.03 -0.14 0.00 0.50 0.00 0.00 28.75 30.86 2fyh h GLU 52 CO -0.51 -0.07 0.79 1.04 -1.00 0.00 0.00 179.01 179.26 2fyh n GLN 53 N -2.53 -0.04 -0.34 2.33 1.13 0.18 -0.85 117.38 117.27 2fyh n GLN 53 Ca -0.01 1.23 -0.10 0.00 -1.94 0.00 0.00 57.00 56.17 2fyh n GLN 53 Cb 0.05 -2.38 -0.09 0.00 0.11 0.00 0.00 30.24 27.93 2fyh n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2fyh h ALA 54 N 1.60 -0.53 -1.25 -1.58 0.00 -1.19 1.01 119.26 117.31 2fyh h ALA 54 Ca 0.84 0.09 0.36 0.00 0.00 0.00 0.00 54.91 56.20 2fyh h ALA 54 Cb 2.63 1.30 -0.07 0.00 0.00 0.00 0.00 17.79 21.65 2fyh h ALA 54 CO -0.50 -0.89 0.87 1.05 0.00 0.00 0.00 179.25 179.79 2fyh h GLU 55 N -0.06 0.10 -0.19 0.00 4.11 -1.14 0.28 114.58 117.69 2fyh h GLU 55 Ca 0.13 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 59.54 2fyh h GLU 55 Cb 0.39 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2fyh h GLU 55 CO -0.79 0.07 0.06 1.49 0.07 0.00 0.00 179.01 179.90 2fyh h GLU 56 N 0.10 0.30 -0.60 1.06 4.81 0.96 -1.95 114.58 119.27 2fyh h GLU 56 Ca 0.64 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.77 2fyh h GLU 56 Cb 2.28 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 31.59 2fyh h GLU 56 CO -0.13 0.41 0.23 0.82 -0.73 0.00 0.00 179.01 179.61 2fyh h ILE 57 N 0.14 1.23 0.60 2.32 5.03 -0.07 -2.85 117.51 123.91 2fyh h ILE 57 Ca 0.06 -0.75 -0.03 0.00 -0.12 0.00 0.00 64.86 64.03 2fyh h ILE 57 Cb 0.24 0.60 -0.00 0.00 -3.03 0.00 0.00 36.82 34.62 2fyh h ILE 57 CO -0.00 0.29 -0.37 0.11 -0.68 0.00 0.00 178.15 177.50 2fyh h LYS 58 N 0.84 -0.87 -1.15 2.37 1.57 -1.26 -1.99 116.57 116.09 2fyh h LYS 58 Ca 0.20 0.06 0.37 0.00 -1.87 0.00 0.00 60.65 59.41 2fyh h LYS 58 Cb 0.23 0.20 -0.14 0.00 0.08 0.00 0.00 32.23 32.60 2fyh h LYS 58 CO -0.01 -0.58 0.70 1.57 -0.57 0.00 0.00 179.45 180.56 2fyh h LYS 59 N -0.90 0.19 -0.04 3.15 2.10 -1.38 0.35 116.57 120.04 2fyh h LYS 59 Ca -0.08 -0.01 -0.00 0.00 -2.00 0.00 0.00 60.65 58.55 2fyh h LYS 59 Cb 0.72 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 32.01 2fyh h LYS 59 CO 0.08 0.12 0.01 0.82 -2.00 0.00 0.00 179.45 178.49 2fyh h ILE 60 N 0.19 1.17 -0.75 0.07 2.04 -1.20 -3.03 117.51 116.01 2fyh h ILE 60 Ca 0.77 -0.50 0.05 0.00 1.00 0.00 0.00 64.86 66.17 2fyh h ILE 60 Cb 2.11 1.43 -0.05 0.00 -0.74 0.00 0.00 36.82 39.57 2fyh h ILE 60 CO -0.50 0.14 0.46 -0.07 0.00 0.00 0.00 178.15 178.17 2fyh h LEU 61 N -0.13 0.72 -0.77 1.44 3.38 0.39 -2.01 115.31 118.33 2fyh h LEU 61 Ca 0.01 0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.17 2fyh h LEU 61 Cb 0.21 -0.14 -0.13 0.00 0.09 0.00 0.00 40.66 40.69 2fyh h LEU 61 CO -0.00 0.48 0.04 -0.08 0.09 0.00 0.00 178.44 178.97 2fyh h GLU 62 N 0.86 0.12 0.46 1.13 4.57 -1.16 0.20 114.58 120.76 2fyh h GLU 62 Ca 0.32 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.47 2fyh h GLU 62 Cb 0.10 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 2fyh h GLU 62 CO -0.14 0.08 -0.22 0.87 -1.18 0.00 0.00 179.01 178.41 2fyh h LYS 63 N 0.12 -0.60 -0.30 1.92 1.57 -1.40 -3.11 116.57 114.77 2fyh h LYS 63 Ca 0.43 0.04 0.03 0.00 -1.87 0.00 0.00 60.65 59.28 2fyh h LYS 63 Cb 0.77 0.14 -0.05 0.00 0.08 0.00 0.00 32.23 33.17 2fyh h LYS 63 CO -0.66 -0.40 -0.30 0.82 -0.57 0.00 0.00 179.45 178.34 2fyh h ILE 64 N -1.13 0.00 0.00 1.86 2.04 -0.95 0.84 117.51 120.17 2fyh h ILE 64 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2fyh h ILE 64 Cb 0.47 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 2fyh h ILE 64 CO 0.10 0.00 0.62 0.00 0.00 0.00 0.00 178.15 178.87 2fyh h ALA 65 N -0.52 1.62 0.00 1.87 0.00 -0.76 0.14 119.26 121.61 2fyh h ALA 65 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2fyh h ALA 65 Cb 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2fyh h ALA 65 CO -0.37 -0.62 -0.66 -0.22 0.00 0.00 0.00 179.25 177.39 2fyh h LYS 66 N 0.00 0.00 0.00 0.00 3.64 0.66 -3.33 116.57 117.54 2fyh h LYS 66 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2fyh h LYS 66 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 2fyh h LYS 66 CO 0.00 0.90 0.00 1.57 -2.27 0.00 0.00 179.45 179.65 2fyh h LYS 67 N -1.00 0.00 -6.15 1.90 2.10 0.14 -3.42 116.57 110.15 2fyh h LYS 67 Ca -0.18 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 57.94 2fyh h LYS 67 Cb 1.08 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.37 2fyh h LYS 67 CO -0.11 0.00 -0.51 0.71 -2.00 0.00 0.00 179.45 177.55 2fyh s TYR 68 N -3.92 3.30 0.53 0.07 2.02 -0.57 -5.10 117.35 113.68 2fyh s TYR 68 Ca -0.04 0.01 0.07 0.00 -0.37 0.00 0.00 57.07 56.74 2fyh s TYR 68 Cb 0.10 -1.55 0.04 0.00 -0.40 0.00 0.00 41.96 40.16 2fyh s TYR 68 CO 0.33 0.51 0.50 0.15 -1.57 0.00 0.00 175.55 175.46 2fyh s LYS 69 N -3.41 2.31 -0.35 -0.62 -0.14 -1.26 -4.89 119.74 111.37 2fyh s LYS 69 Ca 0.33 -1.86 -0.29 0.00 -1.36 0.00 0.00 55.97 52.80 2fyh s LYS 69 Cb -0.10 -2.28 0.02 0.00 -1.68 0.00 0.00 37.83 33.80 2fyh s LYS 69 CO 0.26 -0.61 1.08 0.15 -0.76 0.00 0.00 175.35 175.47 2fyh s LYS 70 N -4.35 3.99 0.02 1.68 1.02 -1.26 -5.00 119.74 115.84 2fyh s LYS 70 Ca 0.43 0.95 -0.10 0.00 0.02 0.00 0.00 55.97 57.28 2fyh s LYS 70 Cb -0.03 -3.77 -0.05 0.00 -0.52 0.00 0.00 37.83 33.45 2fyh s LYS 70 CO 0.27 -0.99 0.33 -1.58 -0.92 0.00 0.00 175.35 172.45 2fyh s HIS 71 N 3.80 3.62 -0.44 3.18 2.46 -1.25 -4.89 115.29 121.76 2fyh s HIS 71 Ca 0.46 0.74 -0.10 0.00 0.47 0.00 0.00 55.06 56.62 2fyh s HIS 71 Cb -0.11 -2.11 0.09 0.00 -0.13 0.00 0.00 32.58 30.32 2fyh s HIS 71 CO 0.19 0.60 0.30 -2.00 -2.47 0.00 0.00 174.74 171.36 2fyh s GLU 72 N -1.57 2.62 0.54 2.88 2.12 -1.26 -1.62 118.70 122.41 2fyh s GLU 72 Ca 0.27 -1.54 0.03 0.00 0.36 0.00 0.00 54.97 54.09 2fyh s GLU 72 Cb -0.14 -3.87 0.02 0.00 0.26 0.00 0.00 34.13 30.40 2fyh s GLU 72 CO 0.15 -1.04 0.21 0.14 -0.54 0.00 0.00 175.26 174.18 2fyh s VAL 73 N 1.43 1.29 0.09 3.70 -7.23 -1.04 -4.99 120.40 113.67 2fyh s VAL 73 Ca 0.04 -1.74 0.04 0.00 -1.81 0.00 0.00 61.98 58.51 2fyh s VAL 73 Cb -0.24 -2.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.63 2fyh s VAL 73 CO 0.02 0.00 -0.11 0.21 -0.31 0.00 0.00 175.10 174.91 2fyh s ASN 74 N -4.11 1.49 -0.26 4.85 3.84 -1.26 -2.03 114.94 117.46 2fyh s ASN 74 Ca 0.17 -0.77 -0.04 0.00 0.21 0.00 0.00 52.86 52.43 2fyh s ASN 74 Cb -0.01 -0.00 0.01 0.00 -0.55 0.00 0.00 41.25 40.69 2fyh s ASN 74 CO 0.11 -0.22 0.00 0.54 -2.79 0.00 0.00 177.10 174.74 2fyh s VAL 75 N -2.18 3.49 -0.15 -5.21 0.11 -0.33 -0.54 120.40 115.59 2fyh s VAL 75 Ca 0.04 -0.70 -0.30 0.00 -2.93 0.00 0.00 61.98 58.09 2fyh s VAL 75 Cb -0.05 -2.72 0.11 0.00 -1.53 0.00 0.00 36.38 32.19 2fyh s VAL 75 CO 0.01 0.23 0.90 -0.60 -3.33 0.00 0.00 175.10 172.31 2fyh s ARG 76 N 1.45 0.73 0.00 1.54 3.52 -1.10 -3.01 118.95 122.08 2fyh s ARG 76 Ca 0.03 0.26 0.00 0.00 -0.13 0.00 0.00 55.73 55.89 2fyh s ARG 76 Cb -0.16 0.35 0.00 0.00 -1.56 0.00 0.00 34.95 33.58 2fyh s ARG 76 CO -0.01 -0.21 0.00 0.41 -0.81 0.00 0.00 175.30 174.68 2fyh n GLY 77 N 1.02 -0.81 3.20 8.12 0.00 -1.26 -4.37 105.19 111.09 2fyh n GLY 77 Ca -0.13 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.19 1.97 0.40 -0.61 1.01 -1.26 0.10 121.20 122.63 2fyh s ILE 78 Ca 0.00 -0.97 0.08 0.00 0.00 0.00 0.00 60.65 59.75 2fyh s ILE 78 Cb 0.00 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.74 2fyh s ILE 78 CO 0.00 0.54 0.33 -0.83 0.00 0.00 0.00 174.94 174.98 2fyh s GLY 79 N 0.33 2.11 0.07 6.18 0.00 -0.03 -4.90 107.32 111.09 2fyh s GLY 79 Ca -0.18 -1.88 0.00 0.00 0.00 0.00 0.00 44.72 42.67 2fyh s GLY 79 CO 0.08 -1.71 -0.05 -1.34 0.00 0.00 0.00 173.10 170.08 2fyh s VAL 80 N -2.46 0.43 0.03 1.40 -7.23 -1.26 -2.74 120.40 108.58 2fyh s VAL 80 Ca 0.46 -1.82 -0.05 0.00 -1.81 0.00 0.00 61.98 58.75 2fyh s VAL 80 Cb -0.03 -1.53 -0.01 0.00 0.56 0.00 0.00 36.38 35.37 2fyh s VAL 80 CO 0.27 -0.91 0.09 -0.36 -0.31 0.00 0.00 175.10 173.88 2fyh s PHE 81 N -3.65 0.19 0.24 2.82 0.08 -1.20 -4.17 117.98 112.30 2fyh s PHE 81 Ca 0.08 -0.48 0.22 0.00 0.12 0.00 0.00 56.93 56.88 2fyh s PHE 81 Cb 0.06 -0.14 0.96 0.00 -0.57 0.00 0.00 43.02 43.33 2fyh s PHE 81 CO -0.07 -0.35 1.86 -1.00 -0.10 0.00 0.00 175.22 175.56 2fyh h PRO 82 N 3.76 0.00 -3.04 0.24 0.13 -1.90 0.32 132.00 131.50 2fyh h PRO 82 Ca -0.32 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.77 2fyh h PRO 82 Cb 1.19 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.19 2fyh h PRO 82 CO 0.49 0.26 0.12 -0.80 -0.23 0.00 0.00 178.00 177.84 2fyh s ASN 83 N -6.33 -0.48 0.10 1.44 0.01 -1.11 -5.05 114.94 103.53 2fyh s ASN 83 Ca -0.01 -0.04 -0.28 0.00 -0.71 0.00 0.00 52.86 51.82 2fyh s ASN 83 Cb 0.12 0.56 -0.10 0.00 0.41 0.00 0.00 41.25 42.23 2fyh s ASN 83 CO 0.65 -0.91 1.45 -0.65 -1.51 0.00 0.00 177.10 176.14 2fyh h PRO 84 N 2.20 -0.44 -1.19 -0.60 0.11 -1.93 0.10 132.00 130.25 2fyh h PRO 84 Ca -0.33 0.03 0.34 0.00 0.11 0.00 0.00 66.00 66.15 2fyh h PRO 84 Cb 1.28 0.10 -0.05 0.00 0.11 0.00 0.00 31.00 32.44 2fyh h PRO 84 CO 0.41 -0.29 0.95 -0.97 -0.21 0.00 0.00 178.00 177.89 2fyh h ASN 85 N -0.45 0.00 -3.10 -2.05 -1.24 -1.99 -3.17 115.58 103.57 2fyh h ASN 85 Ca 0.03 0.00 -0.59 0.00 0.71 0.00 0.00 56.30 56.45 2fyh h ASN 85 Cb 0.55 0.00 -0.40 0.00 0.73 0.00 0.00 38.32 39.20 2fyh h ASN 85 CO -0.39 0.00 -0.78 -0.47 -1.29 0.00 0.00 177.43 174.50 2fyh s TYR 86 N -4.80 1.42 0.02 0.67 6.14 0.33 -5.09 117.35 116.05 2fyh s TYR 86 Ca -0.05 -1.96 -0.22 0.00 0.64 0.00 0.00 57.07 55.48 2fyh s TYR 86 Cb 0.21 -1.48 -0.06 0.00 0.42 0.00 0.00 41.96 41.06 2fyh s TYR 86 CO 0.73 -0.82 0.66 0.08 0.64 0.00 0.00 175.55 176.85 2fyh s VAL 87 N 0.89 4.82 0.00 3.14 1.01 -1.09 -2.75 120.40 126.41 2fyh s VAL 87 Ca 0.16 1.40 0.00 0.00 0.00 0.00 0.00 61.98 63.54 2fyh s VAL 87 Cb -0.22 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.15 2fyh s VAL 87 CO -0.05 0.41 0.00 0.54 0.00 0.00 0.00 175.10 175.99 2fyh n ARG 88 N 2.67 0.83 -3.68 2.72 5.12 0.11 -4.86 116.66 119.57 2fyh n ARG 88 Ca -0.05 0.00 -0.22 0.00 -1.93 0.00 0.00 57.85 55.65 2fyh n ARG 88 Cb 0.51 -0.66 -0.18 0.00 -1.16 0.00 0.00 32.46 30.97 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 -1.32 -0.00 -0.04 1.55 1.01 -1.09 -1.49 120.40 119.00 2fyh s VAL 89 Ca 0.00 0.24 -0.23 0.00 0.00 0.00 0.00 61.98 61.99 2fyh s VAL 89 Cb 0.00 -0.32 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 2fyh s VAL 89 CO 0.00 0.10 0.68 -0.63 0.00 0.00 0.00 175.10 175.25 2fyh s ILE 90 N 2.12 4.98 -0.07 2.22 1.01 -0.29 -3.23 121.20 127.94 2fyh s ILE 90 Ca 0.04 1.41 -0.11 0.00 0.00 0.00 0.00 60.65 61.99 2fyh s ILE 90 Cb -0.13 -4.02 0.02 0.00 0.01 0.00 0.00 42.46 38.34 2fyh s ILE 90 CO -0.05 0.30 0.28 -1.66 0.00 0.00 0.00 174.94 173.82 2fyh s TRP 91 N 0.46 -0.24 0.56 3.97 1.48 -1.11 -0.41 118.94 123.67 2fyh s TRP 91 Ca 0.36 0.53 -0.01 0.00 -1.06 0.00 0.00 56.10 55.92 2fyh s TRP 91 Cb -0.18 0.09 0.03 0.00 -1.16 0.00 0.00 33.47 32.25 2fyh s TRP 91 CO 0.18 -0.24 0.82 0.00 -4.06 0.00 0.00 176.95 173.65 2fyh s ALA 92 N -0.45 3.65 0.09 2.67 0.00 0.85 -0.85 121.76 127.72 2fyh s ALA 92 Ca -0.06 -1.12 0.08 0.00 0.00 0.00 0.00 51.96 50.86 2fyh s ALA 92 Cb -0.04 -2.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.80 2fyh s ALA 92 CO 0.02 -0.79 -0.20 0.20 0.00 0.00 0.00 175.76 174.99 2fyh s GLY 93 N -4.39 1.17 0.03 0.00 0.00 0.29 -1.59 107.32 102.83 2fyh s GLY 93 Ca 0.56 -1.19 0.02 0.00 0.00 0.00 0.00 44.72 44.11 2fyh s GLY 93 CO 0.40 -1.18 0.04 0.14 0.00 0.00 0.00 173.10 172.50 2fyh s VAL 94 N -1.12 4.35 0.83 1.40 1.01 -0.84 -2.72 120.40 123.31 2fyh s VAL 94 Ca 0.05 -0.66 -0.14 0.00 0.00 0.00 0.00 61.98 61.23 2fyh s VAL 94 Cb -0.10 -3.01 0.20 0.00 0.00 0.00 0.00 36.38 33.48 2fyh s VAL 94 CO 0.04 0.27 0.81 -0.62 0.00 0.00 0.00 175.10 175.59 2fyh n GLU 95 N 0.99 -2.16 -0.95 2.72 1.02 0.30 -4.74 120.64 117.81 2fyh n GLU 95 Ca -0.12 -1.28 -0.36 0.00 -0.02 0.00 0.00 57.16 55.38 2fyh n GLU 95 Cb 0.52 -1.11 -0.09 0.00 -0.02 0.00 0.00 31.44 30.74 2fyh n GLU 95 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2fyh n ASN 96 N -4.16 0.39 -2.38 1.62 5.15 -1.26 -4.76 115.26 109.85 2fyh n ASN 96 Ca 0.11 0.33 -0.24 0.00 -0.60 0.00 0.00 54.58 54.17 2fyh n ASN 96 Cb 0.41 -0.64 0.01 0.00 -0.53 0.00 0.00 39.78 39.03 2fyh n ASN 96 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2fyh n ASP 97 N 6.18 4.48 0.00 1.20 5.75 -1.26 -4.72 116.55 128.18 2fyh n ASP 97 Ca 0.42 -3.62 -0.03 0.00 -0.01 0.00 0.00 54.79 51.55 2fyh n ASP 97 Cb -0.01 -0.43 -0.02 0.00 -1.03 0.00 0.00 41.12 39.63 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 2.51 -0.10 -0.99 0.11 4.57 -1.99 0.18 114.58 118.87 2fyh h GLU 98 Ca 0.28 0.01 0.26 0.00 -1.18 0.00 0.00 59.36 58.73 2fyh h GLU 98 Cb 1.10 0.02 -0.18 0.00 -0.16 0.00 0.00 28.75 29.53 2fyh h GLU 98 CO 0.79 -0.07 -0.02 -0.89 -1.18 0.00 0.00 179.01 177.64 2fyh n ILE 99 N -3.02 -0.41 -0.28 2.32 2.08 -1.26 0.15 119.36 118.93 2fyh n ILE 99 Ca -0.01 2.19 -0.06 0.00 0.56 0.00 0.00 62.75 65.42 2fyh n ILE 99 Cb 0.06 -3.17 0.06 0.00 -0.75 0.00 0.00 39.64 35.85 2fyh n ILE 99 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 2fyh h ILE 100 N 0.00 1.26 0.76 1.39 2.04 -1.76 -1.97 117.51 119.23 2fyh h ILE 100 Ca 0.58 -0.83 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 2fyh h ILE 100 Cb 1.16 0.35 0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2fyh h ILE 100 CO -0.94 0.34 -0.37 0.11 0.00 0.00 0.00 178.15 177.29 2fyh h LYS 101 N 1.13 -0.98 -1.00 2.37 1.57 0.44 -0.20 116.57 119.90 2fyh h LYS 101 Ca 0.26 0.07 0.22 0.00 -1.87 0.00 0.00 60.65 59.32 2fyh h LYS 101 Cb 0.23 0.22 -0.10 0.00 0.08 0.00 0.00 32.23 32.66 2fyh h LYS 101 CO -0.02 -0.64 0.62 1.57 -0.57 0.00 0.00 179.45 180.41 2fyh h LYS 102 N -1.20 0.59 0.25 3.15 2.10 -0.95 -1.58 116.57 118.92 2fyh h LYS 102 Ca -0.10 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.50 2fyh h LYS 102 Cb 0.80 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 2fyh h LYS 102 CO 0.17 0.39 -0.12 0.82 -2.00 0.00 0.00 179.45 178.71 2fyh h ILE 103 N 0.61 0.79 -1.11 0.07 2.04 -1.23 -2.67 117.51 116.00 2fyh h ILE 103 Ca 0.58 -0.71 0.31 0.00 1.00 0.00 0.00 64.86 66.04 2fyh h ILE 103 Cb 1.13 1.17 -0.08 0.00 -0.74 0.00 0.00 36.82 38.30 2fyh h ILE 103 CO -0.36 0.14 0.75 0.00 0.00 0.00 0.00 178.15 178.69 2fyh h ALA 104 N -0.12 2.60 -0.17 1.87 0.00 -0.09 0.24 119.26 123.59 2fyh h ALA 104 Ca -0.03 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 2fyh h ALA 104 Cb 0.49 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2fyh h ALA 104 CO 0.06 -1.00 -0.32 -0.22 0.00 0.00 0.00 179.25 177.77 2fyh h LYS 105 N 0.22 0.51 -0.19 0.00 1.63 -1.27 -2.86 116.57 114.62 2fyh h LYS 105 Ca 0.60 -0.33 -0.01 0.00 -0.85 0.00 0.00 60.65 60.07 2fyh h LYS 105 Cb 1.87 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 33.53 2fyh h LYS 105 CO -0.20 0.93 0.09 1.49 -3.45 0.00 0.00 179.45 178.32 2fyh h GLU 106 N 0.15 0.28 -0.72 1.90 4.57 -0.26 0.26 114.58 120.77 2fyh h GLU 106 Ca 0.01 -0.04 0.10 0.00 -1.18 0.00 0.00 59.36 58.25 2fyh h GLU 106 Cb 0.91 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 29.40 2fyh h GLU 106 CO 0.07 0.30 0.47 0.82 -1.18 0.00 0.00 179.01 179.49 2fyh h ILE 107 N 0.19 0.92 0.07 2.32 2.04 -1.16 -1.18 117.51 120.71 2fyh h ILE 107 Ca 0.07 -0.20 -0.26 0.00 1.00 0.00 0.00 64.86 65.46 2fyh h ILE 107 Cb 0.11 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 2fyh h ILE 107 CO -0.01 0.11 -1.26 -0.78 0.00 0.00 0.00 178.15 176.21 2fyh h ASP 108 N 0.59 0.23 -0.98 1.72 1.82 -1.21 -3.10 116.42 115.49 2fyh h ASP 108 Ca 0.33 -0.28 0.08 0.00 -0.39 0.00 0.00 57.03 56.77 2fyh h ASP 108 Cb 0.51 -0.08 -0.07 0.00 0.68 0.00 0.00 39.33 40.37 2fyh h ASP 108 CO -0.11 1.22 0.63 0.44 -1.61 0.00 0.00 179.24 179.81 2fyh h ASP 109 N 0.04 0.97 0.01 2.28 3.32 0.75 0.25 116.42 124.05 2fyh h ASP 109 Ca -0.13 0.02 -0.20 0.00 0.02 0.00 0.00 57.03 56.75 2fyh h ASP 109 Cb 1.91 -0.19 0.02 0.00 0.22 0.00 0.00 39.33 41.29 2fyh h ASP 109 CO 0.16 0.60 -0.77 -0.33 -1.72 0.00 0.00 179.24 177.18 2fyh h GLU 110 N 1.09 0.51 -0.85 3.56 5.08 -1.54 -3.29 114.58 119.14 2fyh h GLU 110 Ca 0.43 -0.56 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 2fyh h GLU 110 Cb 0.25 0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 2fyh h GLU 110 CO -0.18 1.19 0.41 -0.07 -1.00 0.00 0.00 179.01 179.36 2fyh h LEU 111 N 0.05 1.11 -1.47 1.33 3.38 -1.35 -2.63 115.31 115.73 2fyh h LEU 111 Ca -0.10 -0.13 0.49 0.00 0.09 0.00 0.00 57.88 58.23 2fyh h LEU 111 Cb 1.47 -0.29 -0.13 0.00 0.09 0.00 0.00 40.66 41.80 2fyh h LEU 111 CO 0.15 0.93 0.97 0.00 0.09 0.00 0.00 178.44 180.58 2fyh n ALA 112 N -2.42 1.45 -0.07 1.53 0.00 0.85 0.16 120.51 122.00 2fyh n ALA 112 Ca 0.09 0.84 -0.14 0.00 0.00 0.00 0.00 53.44 54.23 2fyh n ALA 112 Cb 0.14 -1.08 -0.06 0.00 0.00 0.00 0.00 19.45 18.46 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 0.59 0.00 0.00 3.64 -1.64 -3.02 116.57 116.14 2fyh h LYS 113 Ca 0.89 -0.33 -0.03 0.00 -1.27 0.00 0.00 60.65 59.91 2fyh h LYS 113 Cb 2.99 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 34.83 2fyh h LYS 113 CO -0.40 0.93 -0.16 -0.07 -2.27 0.00 0.00 179.45 177.48 2fyh h LEU 114 N 0.28 0.00 0.00 5.20 3.38 0.14 -3.45 115.31 120.87 2fyh h LEU 114 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2fyh h LEU 114 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2fyh h LEU 114 CO 0.07 0.16 0.00 0.61 0.09 0.00 0.00 178.44 179.37 2fyh n GLY 115 N -0.77 0.83 3.58 0.83 0.00 -0.47 -5.14 105.19 104.05 2fyh n GLY 115 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.48 2.43 0.12 1.61 0.08 -1.16 -4.98 117.98 115.60 2fyh s PHE 116 Ca 0.00 -0.63 0.05 0.00 0.12 0.00 0.00 56.93 56.47 2fyh s PHE 116 Cb 0.00 -1.60 -0.04 0.00 -0.57 0.00 0.00 43.02 40.81 2fyh s PHE 116 CO 0.00 0.47 0.06 0.21 -0.10 0.00 0.00 175.22 175.86 2fyh s LYS 117 N -3.69 2.72 -0.01 0.44 2.20 -1.26 -4.31 119.74 115.83 2fyh s LYS 117 Ca 0.34 -0.84 0.02 0.00 -0.36 0.00 0.00 55.97 55.13 2fyh s LYS 117 Cb 0.07 -2.60 0.00 0.00 -1.51 0.00 0.00 37.83 33.80 2fyh s LYS 117 CO 0.17 0.52 -0.06 -1.59 -0.36 0.00 0.00 175.35 174.04 2fyh s LYS 118 N -2.64 0.57 -0.25 4.03 -2.85 -1.26 -4.94 119.74 112.41 2fyh s LYS 118 Ca 0.28 -0.19 -0.11 0.00 -1.00 0.00 0.00 55.97 54.96 2fyh s LYS 118 Cb -0.11 -0.57 -0.05 0.00 -2.06 0.00 0.00 37.83 35.04 2fyh s LYS 118 CO 0.21 0.08 0.16 -2.00 0.10 0.00 0.00 175.35 173.90 2fyh s GLU 119 N 0.13 4.04 0.17 1.78 2.12 -1.26 -5.00 118.70 120.67 2fyh s GLU 119 Ca -0.01 -0.29 -0.23 0.00 0.36 0.00 0.00 54.97 54.81 2fyh s GLU 119 Cb -0.06 -3.56 0.06 0.00 0.26 0.00 0.00 34.13 30.84 2fyh s GLU 119 CO -0.00 0.01 1.60 0.78 -0.54 0.00 0.00 175.26 177.11 2fyh h GLY 120 N 7.70 -0.21 -5.37 -1.50 0.00 -2.03 -3.39 103.07 98.27 2fyh h GLY 120 Ca -0.37 0.39 -0.58 0.00 0.00 0.00 0.00 47.33 46.77 2fyh h GLY 120 CO 0.63 -0.21 -0.12 0.21 0.00 0.00 0.00 176.54 177.06 2fyh s ASN 121 N -5.08 6.75 -0.02 0.19 2.47 -1.26 -5.07 114.94 112.92 2fyh s ASN 121 Ca -0.15 0.89 -0.03 0.00 0.42 0.00 0.00 52.86 53.99 2fyh s ASN 121 Cb 0.14 -2.30 -0.04 0.00 -1.45 0.00 0.00 41.25 37.59 2fyh s ASN 121 CO 0.68 0.03 0.18 0.12 -3.72 0.00 0.00 177.10 174.40 2fyh s PHE 122 N 0.39 3.56 -0.19 0.43 2.19 -1.26 -5.09 117.98 118.01 2fyh s PHE 122 Ca 0.27 0.39 -0.04 0.00 0.33 0.00 0.00 56.93 57.88 2fyh s PHE 122 Cb -0.16 -1.85 0.08 0.00 -1.31 0.00 0.00 43.02 39.78 2fyh s PHE 122 CO 0.12 0.66 0.15 0.08 1.83 0.00 0.00 175.22 178.05 2fyh s VAL 123 N -1.29 -0.20 -0.55 3.12 1.01 -1.26 -5.10 120.40 116.14 2fyh s VAL 123 Ca 0.26 -0.16 -0.25 0.00 0.00 0.00 0.00 61.98 61.83 2fyh s VAL 123 Cb -0.13 -0.64 0.04 0.00 0.00 0.00 0.00 36.38 35.66 2fyh s VAL 123 CO 0.17 -0.26 0.97 0.00 0.00 0.00 0.00 175.10 175.97 2fyh s ALA 124 N 2.22 3.15 0.22 5.51 0.00 -1.26 -5.00 121.76 126.59 2fyh s ALA 124 Ca 0.04 -1.15 0.01 0.00 0.00 0.00 0.00 51.96 50.86 2fyh s ALA 124 Cb -0.16 -3.76 -0.05 0.00 0.00 0.00 0.00 23.12 19.15 2fyh s ALA 124 CO -0.11 -2.39 0.07 -3.38 0.00 0.00 0.00 175.76 169.95 2fyh s HIS 125 N 4.05 1.35 -0.23 0.00 -3.43 -1.26 -1.98 115.29 113.79 2fyh s HIS 125 Ca 0.32 -1.17 -0.03 0.00 -0.80 0.00 0.00 55.06 53.39 2fyh s HIS 125 Cb -0.12 -0.77 0.07 0.00 -1.43 0.00 0.00 32.58 30.34 2fyh s HIS 125 CO 0.21 -0.36 0.08 0.42 -2.00 0.00 0.00 174.74 173.09 2fyh s ILE 126 N -3.80 0.33 -0.23 -5.38 1.09 -0.62 -4.09 121.20 108.50 2fyh s ILE 126 Ca 0.33 -0.66 -0.29 0.00 -1.10 0.00 0.00 60.65 58.94 2fyh s ILE 126 Cb 0.07 -1.03 -0.04 0.00 -1.06 0.00 0.00 42.46 40.40 2fyh s ILE 126 CO 0.10 -0.41 1.94 -0.89 -0.10 0.00 0.00 174.94 175.58 2fyh s THR 127 N 1.93 3.29 0.03 2.92 2.01 -1.26 -0.11 115.64 124.45 2fyh s THR 127 Ca 0.04 0.31 -0.16 0.00 0.31 0.00 0.00 61.69 62.18 2fyh s THR 127 Cb -0.17 -3.35 -0.32 0.00 0.01 0.00 0.00 72.50 68.67 2fyh s THR 127 CO -0.17 -0.19 1.03 -0.07 -0.69 0.00 0.00 174.62 174.53 2fyh h LEU 128 N 13.52 0.82 0.00 4.42 3.38 -1.08 -3.46 115.31 132.91 2fyh h LEU 128 Ca -0.38 -0.88 0.00 0.00 0.09 0.00 0.00 57.88 56.71 2fyh h LEU 128 Cb 1.20 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2fyh h LEU 128 CO 0.99 1.63 0.00 0.61 0.09 0.00 0.00 178.44 181.76 2fyh n GLY 129 N 1.56 -0.54 3.42 0.83 0.00 -1.19 -1.81 105.19 107.47 2fyh n GLY 129 Ca -0.15 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.61 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 -2.00 2.14 -0.58 1.61 0.52 -1.22 -1.13 118.95 118.29 2fyh s ARG 130 Ca 0.00 -0.92 -0.25 0.00 -0.52 0.00 0.00 55.73 54.04 2fyh s ARG 130 Cb 0.00 -2.17 0.04 0.00 0.52 0.00 0.00 34.95 33.34 2fyh s ARG 130 CO 0.00 0.56 1.02 0.08 0.02 0.00 0.00 175.30 176.98 2fyh s VAL 131 N -0.80 4.26 -0.06 3.52 1.01 -0.56 -2.20 120.40 125.58 2fyh s VAL 131 Ca 0.13 0.36 -0.16 0.00 0.00 0.00 0.00 61.98 62.31 2fyh s VAL 131 Cb -0.10 -4.61 -0.11 0.00 0.00 0.00 0.00 36.38 31.55 2fyh s VAL 131 CO 0.02 -1.24 0.64 0.50 0.00 0.00 0.00 175.10 175.03 2fyh h LYS 132 N 9.43 -0.29 -2.34 2.72 3.64 -1.40 -3.47 116.57 124.85 2fyh h LYS 132 Ca -0.26 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.08 2fyh h LYS 132 Cb 1.07 0.07 -0.24 0.00 -0.41 0.00 0.00 32.23 32.72 2fyh h LYS 132 CO 1.13 -0.00 -0.13 -0.59 -2.27 0.00 0.00 179.45 177.58 2fyh s PHE 133 N -3.05 -0.80 0.04 1.91 -0.12 -1.21 -5.03 117.98 109.72 2fyh s PHE 133 Ca -0.09 1.67 0.03 0.00 -0.05 0.00 0.00 56.93 58.49 2fyh s PHE 133 Cb 0.00 0.41 -0.02 0.00 -0.63 0.00 0.00 43.02 42.79 2fyh s PHE 133 CO 0.32 -0.41 -0.09 0.54 -0.05 0.00 0.00 175.22 175.52 2fyh s VAL 134 N 1.34 0.69 -0.14 -2.49 0.11 -1.26 -0.17 120.40 118.47 2fyh s VAL 134 Ca -0.08 -0.92 -0.03 0.00 -2.93 0.00 0.00 61.98 58.01 2fyh s VAL 134 Cb -0.06 -0.68 -0.08 0.00 -1.53 0.00 0.00 36.38 34.02 2fyh s VAL 134 CO -0.14 -0.20 -0.16 0.29 -3.33 0.00 0.00 175.10 171.57 2fyh n LYS 135 N 1.81 0.33 -2.70 1.54 5.02 -1.23 -4.89 118.16 118.04 2fyh n LYS 135 Ca -0.20 0.11 -0.42 0.00 -2.02 0.00 0.00 58.31 55.78 2fyh n LYS 135 Cb 0.55 -1.15 -0.03 0.00 -0.02 0.00 0.00 35.03 34.38 2fyh n LYS 135 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2fyh s ASP 136 N -5.82 6.18 0.04 4.39 1.01 -1.26 -4.90 116.67 116.31 2fyh s ASP 136 Ca -0.20 -0.75 -0.33 0.00 0.71 0.00 0.00 52.55 51.98 2fyh s ASP 136 Cb 0.06 -2.49 -0.18 0.00 1.01 0.00 0.00 42.92 41.32 2fyh s ASP 136 CO 0.29 -1.63 1.39 0.11 0.21 0.00 0.00 175.17 175.54 2fyh h LYS 137 N 9.79 -1.12 -0.86 8.23 1.57 -1.99 -3.10 116.57 129.08 2fyh h LYS 137 Ca -0.26 0.08 0.19 0.00 -1.87 0.00 0.00 60.65 58.78 2fyh h LYS 137 Cb 1.06 0.25 -0.16 0.00 0.08 0.00 0.00 32.23 33.46 2fyh h LYS 137 CO 1.24 -0.74 -0.12 -0.07 -0.57 0.00 0.00 179.45 179.18 2fyh h LEU 138 N -1.28 -0.64 -1.35 2.94 3.38 -2.00 0.49 115.31 116.84 2fyh h LEU 138 Ca -0.12 0.25 0.40 0.00 0.09 0.00 0.00 57.88 58.50 2fyh h LEU 138 Cb 0.89 0.49 -0.13 0.00 0.09 0.00 0.00 40.66 42.00 2fyh h LEU 138 CO 0.20 -0.28 0.79 1.23 0.09 0.00 0.00 178.44 180.47 2fyh h GLY 139 N 0.02 1.39 0.61 0.83 0.00 -1.95 0.16 103.07 104.14 2fyh h GLY 139 Ca 0.45 -0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.61 2fyh h GLY 139 CO -0.85 -0.38 -0.29 1.41 0.00 0.00 0.00 176.54 176.42 2fyh h LEU 140 N 0.15 -0.70 0.81 3.11 3.38 -0.08 -2.65 115.31 119.34 2fyh h LEU 140 Ca 0.78 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.73 2fyh h LEU 140 Cb 2.32 0.18 0.01 0.00 0.09 0.00 0.00 40.66 43.26 2fyh h LEU 140 CO -0.43 -0.47 -0.39 0.00 0.09 0.00 0.00 178.44 177.24 2fyh h ALA 141 N -1.57 -1.23 -1.17 1.53 0.00 -1.25 -1.65 119.26 113.92 2fyh h ALA 141 Ca -0.08 -0.24 0.40 0.00 0.00 0.00 0.00 54.91 54.99 2fyh h ALA 141 Cb 0.63 0.42 -0.11 0.00 0.00 0.00 0.00 17.79 18.73 2fyh h ALA 141 CO 0.14 -1.15 0.76 -1.33 0.00 0.00 0.00 179.25 177.67 2fyh n MET 142 N -5.05 -0.03 -0.01 0.00 2.81 0.45 0.41 117.12 115.70 2fyh n MET 142 Ca -0.13 1.02 -0.07 0.00 -1.81 0.00 0.00 57.70 56.71 2fyh n MET 142 Cb 0.43 -2.03 -0.05 0.00 -0.71 0.00 0.00 33.22 30.85 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 -0.09 -0.84 0.03 3.64 -1.16 -3.32 116.57 114.83 2fyh h LYS 143 Ca 0.73 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 60.19 2fyh h LYS 143 Cb 2.39 0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 34.13 2fyh h LYS 143 CO -0.35 0.27 -0.49 1.28 -2.27 0.00 0.00 179.45 177.88 2fyh n LEU 144 N -4.80 -0.89 -0.29 5.20 4.77 0.16 0.55 117.00 121.71 2fyh n LEU 144 Ca -0.05 1.51 0.04 0.00 -0.03 0.00 0.00 56.01 57.48 2fyh n LEU 144 Cb 0.20 -0.20 0.12 0.00 -2.33 0.00 0.00 43.42 41.20 2fyh n LEU 144 CO 0.15 -1.22 0.71 0.11 -1.33 0.00 0.00 177.39 175.81 2fyh h LYS 145 N 0.00 0.01 -0.80 3.23 1.57 -1.60 0.52 116.57 119.50 2fyh h LYS 145 Ca 0.13 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2fyh h LYS 145 Cb 0.34 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.60 2fyh h LYS 145 CO -0.79 0.01 0.51 0.93 -0.57 0.00 0.00 179.45 179.54 2fyh h GLU 146 N 0.01 0.96 -0.99 3.15 4.39 0.01 -2.22 114.58 119.90 2fyh h GLU 146 Ca 0.41 -0.06 -0.67 0.00 0.34 0.00 0.00 59.36 59.38 2fyh h GLU 146 Cb 0.65 -0.22 -0.30 0.00 -0.10 0.00 0.00 28.75 28.79 2fyh h GLU 146 CO -0.84 0.64 0.78 1.28 -1.16 0.00 0.00 179.01 179.71 2fyh n LEU 147 N -4.59 7.55 -0.08 1.33 4.32 0.16 -4.10 117.00 121.59 2fyh n LEU 147 Ca 0.10 -4.31 -0.09 0.00 -0.02 0.00 0.00 56.01 51.69 2fyh n LEU 147 Cb 0.09 -0.94 -0.11 0.00 -1.62 0.00 0.00 43.42 40.84 2fyh n LEU 147 CO 0.33 1.50 -1.02 0.00 -1.22 0.00 0.00 177.39 176.99 2fyh n ALA 148 N -0.91 1.63 -0.02 -1.18 0.00 0.31 -4.15 120.51 116.18 2fyh n ALA 148 Ca 0.62 -0.92 0.02 0.00 0.00 0.00 0.00 53.44 53.15 2fyh n ALA 148 Cb 0.69 -0.02 -0.07 0.00 0.00 0.00 0.00 19.45 20.04 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 -2.69 2.89 -3.90 0.00 3.02 -1.26 -4.12 115.26 109.20 2fyh n ASN 149 Ca -0.27 0.00 -0.54 0.00 -0.03 0.00 0.00 54.58 53.74 2fyh n ASN 149 Cb 0.94 1.17 -0.08 0.00 -0.61 0.00 0.00 39.78 41.21 2fyh n ASN 149 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2fyh n GLU 150 N -1.99 0.00 -2.97 3.52 1.02 -1.26 -4.77 120.64 114.19 2fyh n GLU 150 Ca -0.06 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.69 2fyh n GLU 150 Cb 0.43 -1.26 -0.06 0.00 -0.02 0.00 0.00 31.44 30.53 2fyh n GLU 150 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2fyh s ASP 151 N 1.45 7.37 -0.20 1.62 2.15 -1.26 -4.39 116.67 123.40 2fyh s ASP 151 Ca 0.83 1.62 0.03 0.00 0.43 0.00 0.00 52.55 55.46 2fyh s ASP 151 Cb -1.18 -2.50 -0.15 0.00 -0.30 0.00 0.00 42.92 38.80 2fyh s ASP 151 CO 0.60 0.17 -0.16 0.49 -0.17 0.00 0.00 175.17 176.11 2fyh n PHE 152 N 1.81 0.00 0.00 -5.34 3.72 -1.16 -5.03 117.46 111.46 2fyh n PHE 152 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 2fyh n PHE 152 Cb 0.49 -0.81 0.00 0.00 -0.94 0.00 0.00 39.48 38.22 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 2.43 0.95 3.19 1.37 0.00 -1.22 -4.58 105.19 107.34 2fyh n GLY 153 Ca -0.36 -1.92 -0.10 0.00 0.00 0.00 0.00 46.02 43.64 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 0.22 -0.11 1.61 0.01 -1.26 -1.19 113.70 108.98 2fyh s SER 154 Ca 0.00 -1.24 -0.30 0.00 1.31 0.00 0.00 55.95 55.72 2fyh s SER 154 Cb 0.00 0.34 0.12 0.00 0.21 0.00 0.00 66.02 66.70 2fyh s SER 154 CO 0.00 -0.79 1.01 0.72 0.41 0.00 0.00 173.24 174.59 2fyh s PHE 155 N -4.08 -0.30 -0.21 2.43 -0.12 -0.86 -4.85 117.98 109.99 2fyh s PHE 155 Ca 0.29 0.36 -0.07 0.00 -0.05 0.00 0.00 56.93 57.45 2fyh s PHE 155 Cb 0.07 0.50 -0.04 0.00 -0.63 0.00 0.00 43.02 42.92 2fyh s PHE 155 CO 0.05 -0.38 0.06 0.42 -0.05 0.00 0.00 175.22 175.33 2fyh s ILE 156 N -2.06 4.56 -0.67 -4.49 1.01 -1.26 -2.49 121.20 115.80 2fyh s ILE 156 Ca 0.03 -0.10 -0.27 0.00 0.00 0.00 0.00 60.65 60.31 2fyh s ILE 156 Cb -0.01 -3.09 0.01 0.00 0.01 0.00 0.00 42.46 39.38 2fyh s ILE 156 CO -0.04 0.40 1.53 -0.69 0.00 0.00 0.00 174.94 176.14 2fyh s VAL 157 N 0.94 3.58 -0.04 2.92 1.01 -0.64 -4.82 120.40 123.35 2fyh s VAL 157 Ca 0.04 0.35 -0.03 0.00 0.00 0.00 0.00 61.98 62.33 2fyh s VAL 157 Cb -0.14 -4.48 -0.01 0.00 0.00 0.00 0.00 36.38 31.75 2fyh s VAL 157 CO 0.03 -1.42 -0.07 -0.62 0.00 0.00 0.00 175.10 173.02 2fyh n GLU 158 N 9.24 0.11 -2.81 2.72 1.02 -1.26 -3.84 120.64 125.82 2fyh n GLU 158 Ca 0.11 0.09 -0.20 0.00 -0.02 0.00 0.00 57.16 57.14 2fyh n GLU 158 Cb 0.50 -0.74 0.03 0.00 -0.02 0.00 0.00 31.44 31.22 2fyh n GLU 158 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2fyh s ALA 159 N -2.98 4.20 0.11 0.62 0.00 -1.26 -4.85 121.76 117.61 2fyh s ALA 159 Ca -0.06 -1.55 0.08 0.00 0.00 0.00 0.00 51.96 50.43 2fyh s ALA 159 Cb 0.01 -1.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 2fyh s ALA 159 CO 0.08 -0.62 -0.18 0.42 0.00 0.00 0.00 175.76 175.46 2fyh s ILE 160 N -2.62 1.61 0.04 0.00 1.01 -1.06 -4.62 121.20 115.57 2fyh s ILE 160 Ca 0.57 -1.62 0.06 0.00 0.00 0.00 0.00 60.65 59.67 2fyh s ILE 160 Cb -0.10 -1.55 -0.02 0.00 0.01 0.00 0.00 42.46 40.80 2fyh s ILE 160 CO 0.37 -0.19 -0.18 -0.70 0.00 0.00 0.00 174.94 174.24 2fyh s GLU 161 N -2.19 1.20 -0.15 2.79 2.12 -0.80 -2.49 118.70 119.18 2fyh s GLU 161 Ca 0.08 -0.86 -0.01 0.00 0.36 0.00 0.00 54.97 54.53 2fyh s GLU 161 Cb -0.08 -1.27 0.04 0.00 0.26 0.00 0.00 34.13 33.08 2fyh s GLU 161 CO 0.04 0.32 -0.03 -1.17 -0.54 0.00 0.00 175.26 173.88 2fyh s LEU 162 N -1.16 1.32 0.25 2.70 2.96 -0.70 -0.13 118.68 123.93 2fyh s LEU 162 Ca 0.05 -0.55 0.11 0.00 -0.22 0.00 0.00 54.13 53.52 2fyh s LEU 162 Cb -0.08 -0.77 -0.05 0.00 0.50 0.00 0.00 46.19 45.79 2fyh s LEU 162 CO 0.02 -0.20 -0.16 -0.75 -1.32 0.00 0.00 176.35 173.94 2fyh s LYS 163 N 1.74 1.81 0.48 1.98 2.20 -0.65 -0.66 119.74 126.64 2fyh s LYS 163 Ca 0.02 -1.60 0.04 0.00 -0.36 0.00 0.00 55.97 54.07 2fyh s LYS 163 Cb -0.15 -1.90 -0.02 0.00 -1.51 0.00 0.00 37.83 34.25 2fyh s LYS 163 CO -0.07 0.36 0.15 -1.59 -0.36 0.00 0.00 175.35 173.83 2fyh s LYS 164 N -3.32 2.19 -0.08 4.03 -2.85 -0.35 -0.89 119.74 118.47 2fyh s LYS 164 Ca 0.28 -2.13 -0.04 0.00 -1.00 0.00 0.00 55.97 53.08 2fyh s LYS 164 Cb -0.06 -1.80 0.04 0.00 -2.06 0.00 0.00 37.83 33.95 2fyh s LYS 164 CO 0.15 -0.32 0.18 -1.12 0.10 0.00 0.00 175.35 174.34 2fyh s SER 165 N -3.96 0.01 -0.31 0.03 0.01 0.17 -3.66 113.70 105.99 2fyh s SER 165 Ca 0.25 0.39 -0.02 0.00 1.31 0.00 0.00 55.95 57.89 2fyh s SER 165 Cb 0.02 0.30 0.10 0.00 0.21 0.00 0.00 66.02 66.65 2fyh s SER 165 CO 0.14 -0.18 0.11 -0.89 0.41 0.00 0.00 173.24 172.84 2fyh s THR 166 N 1.47 0.61 0.13 1.44 2.01 -0.57 -1.89 115.64 118.84 2fyh s THR 166 Ca -0.07 -1.25 -0.31 0.00 0.31 0.00 0.00 61.69 60.38 2fyh s THR 166 Cb -0.11 -1.47 -0.08 0.00 0.01 0.00 0.00 72.50 70.84 2fyh s THR 166 CO -0.07 -0.70 1.34 -0.76 -0.69 0.00 0.00 174.62 173.74 2fyh s LEU 167 N 1.72 4.38 0.08 4.42 1.43 -1.26 -1.35 118.68 128.10 2fyh s LEU 167 Ca 0.10 2.31 0.03 0.00 -1.03 0.00 0.00 54.13 55.54 2fyh s LEU 167 Cb -0.17 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.42 2fyh s LEU 167 CO -0.28 -0.59 -0.08 0.42 0.23 0.00 0.00 176.35 176.05 2fyh s THR 168 N 0.80 0.74 0.50 5.49 -4.23 -0.73 -4.93 115.64 113.28 2fyh s THR 168 Ca 0.62 -1.60 0.32 0.00 -1.18 0.00 0.00 61.69 59.84 2fyh s THR 168 Cb -0.36 -1.28 0.51 0.00 1.34 0.00 0.00 72.50 72.71 2fyh s THR 168 CO 0.32 -0.63 1.78 -0.65 -0.54 0.00 0.00 174.62 174.90 2fyh h PRO 169 N 3.58 0.10 0.00 3.99 0.11 -2.03 0.76 132.00 138.51 2fyh h PRO 169 Ca -0.36 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.60 2fyh h PRO 169 Cb 1.18 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2fyh h PRO 169 CO 0.54 0.07 -0.69 0.87 -0.21 0.00 0.00 178.00 178.58 2fyh h LYS 170 N 0.11 0.00 0.00 1.05 1.57 -2.00 -3.49 116.57 113.80 2fyh h LYS 170 Ca 0.60 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.38 2fyh h LYS 170 Cb 2.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.44 2fyh h LYS 170 CO -0.10 0.64 0.00 0.41 -0.57 0.00 0.00 179.45 179.83 2fyh n GLY 171 N 1.27 1.71 3.69 3.86 0.00 0.26 -5.11 105.19 110.88 2fyh n GLY 171 Ca 0.01 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.85 4.28 -0.17 1.61 0.04 -1.26 -1.77 135.00 135.88 2fyh s PRO 172 Ca 0.00 2.03 -0.09 0.00 0.04 0.00 0.00 61.00 62.98 2fyh s PRO 172 Cb 0.00 -3.50 -0.05 0.00 0.04 0.00 0.00 34.50 30.99 2fyh s PRO 172 CO 0.00 -0.56 0.13 0.42 0.04 0.00 0.00 177.00 177.03 2fyh s ILE 173 N 2.13 5.45 -0.05 0.56 -1.09 -0.45 -4.95 121.20 122.79 2fyh s ILE 173 Ca 0.65 0.20 0.03 0.00 -2.23 0.00 0.00 60.65 59.30 2fyh s ILE 173 Cb -0.34 -3.44 0.01 0.00 -1.58 0.00 0.00 42.46 37.11 2fyh s ILE 173 CO 0.28 0.51 -0.13 -0.31 -1.23 0.00 0.00 174.94 174.05 2fyh s TYR 174 N -0.16 1.47 -0.12 3.97 1.51 -1.26 -1.52 117.35 121.24 2fyh s TYR 174 Ca 0.11 -0.49 -0.27 0.00 -1.01 0.00 0.00 57.07 55.41 2fyh s TYR 174 Cb -0.11 -1.05 0.06 0.00 -0.11 0.00 0.00 41.96 40.75 2fyh s TYR 174 CO 0.00 -0.22 0.64 -2.00 -1.11 0.00 0.00 175.55 172.86 2fyh s GLU 175 N 0.41 0.92 0.45 -0.62 2.12 -1.24 -5.03 118.70 115.71 2fyh s GLU 175 Ca -0.10 0.47 -0.22 0.00 0.36 0.00 0.00 54.97 55.48 2fyh s GLU 175 Cb -0.14 0.44 -0.09 0.00 0.26 0.00 0.00 34.13 34.61 2fyh s GLU 175 CO 0.03 -0.23 1.04 0.99 -0.54 0.00 0.00 175.26 176.56 2fyh s THR 176 N -0.62 3.75 -0.06 -1.70 2.01 -1.26 -1.21 115.64 116.56 2fyh s THR 176 Ca -0.07 1.20 -0.01 0.00 0.31 0.00 0.00 61.69 63.11 2fyh s THR 176 Cb -0.02 -3.55 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2fyh s THR 176 CO 0.06 -0.13 -0.06 0.18 -0.69 0.00 0.00 174.62 173.98 2fyh n LEU 177 N -0.58 1.72 -3.98 4.42 4.77 0.17 -4.85 117.00 118.67 2fyh n LEU 177 Ca 0.07 0.02 -0.16 0.00 -0.03 0.00 0.00 56.01 55.92 2fyh n LEU 177 Cb 0.51 -0.18 -0.14 0.00 -2.33 0.00 0.00 43.42 41.28 2fyh n LEU 177 CO 0.42 0.36 -0.40 0.00 -1.33 0.00 0.00 177.39 176.43 2fyh s ALA 178 N -2.11 0.49 -0.20 -1.18 0.00 -1.03 -5.05 121.76 112.68 2fyh s ALA 178 Ca -0.08 -0.33 -0.03 0.00 0.00 0.00 0.00 51.96 51.52 2fyh s ALA 178 Cb 0.02 -0.09 0.06 0.00 0.00 0.00 0.00 23.12 23.12 2fyh s ALA 178 CO 0.11 0.09 0.05 1.03 0.00 0.00 0.00 175.76 177.05 2fyh s ARG 179 N -0.37 0.51 -0.53 0.00 1.81 -1.26 -1.71 118.95 117.39 2fyh s ARG 179 Ca 0.00 -0.39 -0.11 0.00 -1.72 0.00 0.00 55.73 53.52 2fyh s ARG 179 Cb -0.03 -2.01 0.13 0.00 -0.45 0.00 0.00 34.95 32.60 2fyh s ARG 179 CO -0.00 -0.68 0.43 -0.06 -0.68 0.00 0.00 175.30 174.30 2fyh s PHE 180 N 1.92 3.43 -0.26 -0.53 0.08 -1.04 -5.05 117.98 116.52 2fyh s PHE 180 Ca 0.01 -1.84 -0.11 0.00 0.12 0.00 0.00 56.93 55.11 2fyh s PHE 180 Cb -0.17 -3.57 -0.05 0.00 -0.57 0.00 0.00 43.02 38.66 2fyh s PHE 180 CO -0.10 -0.99 0.17 -2.00 -0.10 0.00 0.00 175.22 172.20 2fyh s GLU 181 N 1.18 4.01 -0.03 0.44 2.12 -1.26 -2.56 118.70 122.60 2fyh s GLU 181 Ca 0.07 -0.29 -0.13 0.00 0.36 0.00 0.00 54.97 54.98 2fyh s GLU 181 Cb -0.25 -3.59 -0.07 0.00 0.26 0.00 0.00 34.13 30.47 2fyh s GLU 181 CO -0.01 -0.05 0.58 -0.07 -0.54 0.00 0.00 175.26 175.17 2fyh h LEU 182 N 7.91 -0.40 -8.07 2.70 3.38 -1.97 -3.49 115.31 115.36 2fyh h LEU 182 Ca -0.37 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 2fyh h LEU 182 Cb 1.18 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 2fyh h LEU 182 CO 0.61 -0.01 0.19 -0.55 0.09 0.00 0.00 178.44 178.76 2fyh s SER 183 N -4.69 0.05 0.14 -0.43 0.15 -1.26 -5.14 113.70 102.51 2fyh s SER 183 Ca -0.07 -1.06 0.05 0.00 0.70 0.00 0.00 55.95 55.58 2fyh s SER 183 Cb 0.01 0.79 -0.04 0.00 -1.71 0.00 0.00 66.02 65.07 2fyh s SER 183 CO 0.21 -1.54 0.06 -1.83 1.20 0.00 0.00 173.24 171.33 2fyh s GLU 184 N -2.84 2.66 -0.42 5.44 -1.05 -1.26 -5.05 118.70 116.18 2fyh s GLU 184 Ca 0.17 -0.91 -0.07 0.00 -0.15 0.00 0.00 54.97 54.00 2fyh s GLU 184 Cb -0.05 -2.54 0.09 0.00 -0.44 0.00 0.00 34.13 31.19 2fyh s GLU 184 CO 0.11 0.50 0.25 -1.58 0.95 0.00 0.00 175.26 175.49 2fyh s HIS 185 N -1.60 3.40 0.00 4.83 5.65 -1.26 -4.84 115.29 121.47 2fyh s HIS 185 Ca 0.28 -1.78 0.00 0.00 0.25 0.00 0.00 55.06 53.81 2fyh s HIS 185 Cb -0.10 -3.04 0.00 0.00 -1.18 0.00 0.00 32.58 28.25 2fyh s HIS 185 CO 0.21 -0.89 0.00 0.72 -0.65 0.00 0.00 174.74 174.12 2fyh n HIS 186 N 4.83 0.00 -0.33 3.88 8.25 -1.26 -4.81 115.22 125.79 2fyh n HIS 186 Ca -0.08 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.49 2fyh n HIS 186 Cb 0.42 0.14 0.23 0.00 1.12 0.00 0.00 29.99 31.90 2fyh n HIS 186 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2fyh n HIS 187 N -2.64 0.52 -4.31 4.41 -0.00 -1.26 -4.01 115.22 107.94 2fyh n HIS 187 Ca 0.00 1.13 -0.34 0.00 0.46 0.00 0.00 57.72 58.97 2fyh n HIS 187 Cb 0.31 -1.15 -0.13 0.00 -0.12 0.00 0.00 29.99 28.90 2fyh n HIS 187 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2fyh s HIS 188 N -5.99 2.96 -0.07 1.57 5.65 -1.26 -5.01 115.29 113.13 2fyh s HIS 188 Ca -0.13 -0.57 -0.25 0.00 0.25 0.00 0.00 55.06 54.36 2fyh s HIS 188 Cb 0.27 -1.99 -0.25 0.00 -1.18 0.00 0.00 32.58 29.43 2fyh s HIS 188 CO 0.73 -0.24 0.95 1.25 -0.65 0.00 0.00 174.74 176.77 2fyh h HIS 189 N 7.20 0.21 0.00 3.88 2.76 -1.92 -3.48 115.15 123.79 2fyh h HIS 189 Ca -0.33 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 2fyh h HIS 189 Cb 1.19 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 30.13 2fyh h HIS 189 CO 0.55 0.98 0.00 -2.39 -1.30 0.00 0.00 177.93 175.77