#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fyh s GLN 1 N 0.00 4.19 0.30 0.03 0.74 -1.26 -5.05 119.66 118.62 1fyh s GLN 1 Ca 0.00 0.55 -0.30 0.00 0.05 0.00 0.00 55.36 55.66 1fyh s GLN 1 Cb 0.00 -3.58 -0.12 0.00 1.10 0.00 0.00 33.01 30.41 1fyh s GLN 1 CO 0.00 -0.23 1.49 -0.25 -0.55 0.00 0.00 175.29 175.75 1fyh n ASP 2 N 5.03 3.44 -0.24 6.67 9.92 -1.26 -4.88 116.55 135.23 1fyh n ASP 2 Ca -0.02 1.17 0.16 0.00 -0.53 0.00 0.00 54.79 55.57 1fyh n ASP 2 Cb 0.50 -1.55 0.47 0.00 -0.64 0.00 0.00 41.12 39.90 1fyh n ASP 2 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 1fyh h PRO 3 N 3.98 0.49 0.00 -0.24 0.11 -2.02 -2.45 132.00 131.86 1fyh h PRO 3 Ca -0.47 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1fyh h PRO 3 Cb 1.25 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1fyh h PRO 3 CO 0.73 0.32 -0.02 0.10 -0.21 0.00 0.00 178.00 178.92 1fyh h TYR 4 N 0.50 0.00 -0.88 0.65 -0.00 -1.90 -3.03 116.97 112.31 1fyh h TYR 4 Ca 0.45 0.00 0.08 0.00 0.00 0.00 0.00 58.73 59.25 1fyh h TYR 4 Cb 0.96 0.00 -0.06 0.00 0.00 0.00 0.00 36.73 37.64 1fyh h TYR 4 CO -0.00 0.02 0.57 0.28 -0.00 0.00 0.00 178.16 179.03 1fyh h VAL 5 N 0.00 1.02 -0.00 -0.90 2.07 -1.81 -1.08 116.25 115.55 1fyh h VAL 5 Ca -0.00 -0.32 -0.16 0.00 0.82 0.00 0.00 66.70 67.04 1fyh h VAL 5 Cb 0.03 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.78 1fyh h VAL 5 CO 0.00 0.17 -0.76 0.50 0.02 0.00 0.00 177.57 177.51 1fyh h LYS 6 N 0.94 0.04 -0.00 1.57 3.64 -1.73 -1.16 116.57 119.87 1fyh h LYS 6 Ca 0.39 -0.04 -0.17 0.00 -1.27 0.00 0.00 60.65 59.57 1fyh h LYS 6 Cb 0.29 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1fyh h LYS 6 CO -0.15 0.78 -0.77 0.93 -2.27 0.00 0.00 179.45 177.96 1fyh h GLU 7 N 0.02 0.07 -0.42 1.90 4.39 -1.42 -2.66 114.58 116.46 1fyh h GLU 7 Ca -0.01 -0.07 -0.15 0.00 0.34 0.00 0.00 59.36 59.47 1fyh h GLU 7 Cb 1.34 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 30.00 1fyh h GLU 7 CO 0.10 0.81 -0.32 0.00 -1.16 0.00 0.00 179.01 178.43 1fyh h ALA 8 N 1.17 0.62 -0.10 3.43 0.00 -1.06 -1.40 119.26 121.92 1fyh h ALA 8 Ca -0.02 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 1fyh h ALA 8 Cb 1.36 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1fyh h ALA 8 CO 0.11 0.68 -0.17 0.93 0.00 0.00 0.00 179.25 180.80 1fyh h GLU 9 N 0.80 0.15 -0.37 0.00 4.39 -1.15 -0.23 114.58 118.17 1fyh h GLU 9 Ca 0.08 -0.04 -0.15 0.00 0.34 0.00 0.00 59.36 59.60 1fyh h GLU 9 Cb 0.91 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.54 1fyh h GLU 9 CO 0.09 0.32 -0.34 -0.97 -1.16 0.00 0.00 179.01 176.95 1fyh h ASN 10 N 0.15 0.95 0.14 1.42 -0.73 -1.36 -2.30 115.58 113.84 1fyh h ASN 10 Ca 0.03 -0.46 -0.16 0.00 1.87 0.00 0.00 56.30 57.58 1fyh h ASN 10 Cb 0.39 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.70 1fyh h ASN 10 CO 0.02 1.21 -0.58 -0.07 -0.37 0.00 0.00 177.43 177.64 1fyh h LEU 11 N 0.70 0.51 -0.47 0.34 3.38 -0.45 -2.28 115.31 117.03 1fyh h LEU 11 Ca 0.06 -0.28 0.03 0.00 0.09 0.00 0.00 57.88 57.78 1fyh h LEU 11 Cb 0.93 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 1fyh h LEU 11 CO 0.09 0.98 0.26 0.50 0.09 0.00 0.00 178.44 180.36 1fyh h LYS 12 N 0.34 0.51 -0.59 1.13 3.64 -0.88 -1.38 116.57 119.34 1fyh h LYS 12 Ca -0.00 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.24 1fyh h LYS 12 Cb 1.12 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 1fyh h LYS 12 CO 0.10 0.34 -0.04 0.87 -2.27 0.00 0.00 179.45 178.45 1fyh h LYS 13 N 0.52 1.07 -0.84 1.90 1.57 -1.31 0.30 116.57 119.78 1fyh h LYS 13 Ca 0.19 -0.36 0.06 0.00 -1.87 0.00 0.00 60.65 58.68 1fyh h LYS 13 Cb 0.05 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.22 1fyh h LYS 13 CO -0.11 1.06 0.55 -0.92 -0.57 0.00 0.00 179.45 179.46 1fyh h TYR 14 N 0.96 0.94 -0.53 -1.35 3.20 -0.93 -2.07 116.97 117.19 1fyh h TYR 14 Ca 0.16 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.06 1fyh h TYR 14 Cb 0.61 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.56 1fyh h TYR 14 CO 0.04 0.50 0.00 1.19 -1.64 0.00 0.00 178.16 178.25 1fyh n PHE 15 N -4.48 0.71 -3.59 -3.82 3.01 -0.57 -4.91 117.46 103.81 1fyh n PHE 15 Ca 0.12 -0.36 -0.27 0.00 1.01 0.00 0.00 57.45 57.96 1fyh n PHE 15 Cb 0.20 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.67 1fyh n PHE 15 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1fyh n ASN 16 N 1.05 -4.04 -0.23 4.37 3.02 -0.78 -4.86 115.26 113.79 1fyh n ASN 16 Ca 0.18 -0.56 0.06 0.00 -0.03 0.00 0.00 54.58 54.22 1fyh n ASN 16 Cb 0.45 -3.30 0.26 0.00 -0.61 0.00 0.00 39.78 36.58 1fyh n ASN 16 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fyh n ALA 17 N -3.90 2.52 -0.32 5.41 0.00 0.06 -3.30 120.51 120.98 1fyh n ALA 17 Ca 0.01 -0.25 0.10 0.00 0.00 0.00 0.00 53.44 53.30 1fyh n ALA 17 Cb 0.53 -1.10 0.28 0.00 0.00 0.00 0.00 19.45 19.17 1fyh n ALA 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fyh n GLY 18 N 0.81 2.56 3.78 0.00 0.00 -1.26 -4.72 105.19 106.36 1fyh n GLY 18 Ca 0.09 -0.70 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 1fyh n GLY 18 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1fyh s HIS 19 N -1.01 3.87 0.65 1.61 5.04 -1.21 -4.98 115.29 119.27 1fyh s HIS 19 Ca 0.43 1.52 0.36 0.00 -1.54 0.00 0.00 55.06 55.84 1fyh s HIS 19 Cb 0.22 -2.69 2.02 0.00 0.04 0.00 0.00 32.58 32.17 1fyh s HIS 19 CO 0.29 0.52 2.19 0.66 -2.34 0.00 0.00 174.74 176.06 1fyh h SER 20 N 4.46 0.00 0.17 9.88 4.64 -1.93 -1.02 113.55 129.76 1fyh h SER 20 Ca -0.48 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.82 1fyh h SER 20 Cb 1.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1fyh h SER 20 CO 0.66 0.00 -0.12 0.44 -0.87 0.00 0.00 176.83 176.93 1fyh h ASP 21 N 0.00 0.00 0.11 4.97 3.32 -1.96 -2.11 116.42 120.75 1fyh h ASP 21 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1fyh h ASP 21 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1fyh h ASP 21 CO -0.00 0.12 0.00 1.62 -1.72 0.00 0.00 179.24 179.26 1fyh h VAL 22 N 0.00 0.00 0.00 -1.35 3.04 -1.53 -2.47 116.25 113.94 1fyh h VAL 22 Ca -0.00 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.63 1fyh h VAL 22 Cb 0.24 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.55 1fyh h VAL 22 CO 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.58 1fyh n ALA 23 N -2.06 2.15 -1.86 3.17 0.00 -0.79 -4.82 120.51 116.29 1fyh n ALA 23 Ca -0.02 -0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.00 1fyh n ALA 23 Cb 0.09 -1.45 -0.02 0.00 0.00 0.00 0.00 19.45 18.07 1fyh n ALA 23 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fyh s ASP 24 N -4.46 6.70 -0.36 0.00 1.01 -0.93 -4.31 116.67 114.31 1fyh s ASP 24 Ca 0.09 2.66 -0.01 0.00 0.71 0.00 0.00 52.55 56.00 1fyh s ASP 24 Cb 0.12 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.40 1fyh s ASP 24 CO 0.55 -0.64 0.31 0.59 0.21 0.00 0.00 175.17 176.19 1fyh n ASN 25 N 1.89 -2.98 -0.08 0.27 5.03 -1.26 -4.97 115.26 113.15 1fyh n ASN 25 Ca 0.05 -0.22 0.00 0.00 0.87 0.00 0.00 54.58 55.27 1fyh n ASN 25 Cb 0.41 -2.05 0.00 0.00 -1.02 0.00 0.00 39.78 37.12 1fyh n ASN 25 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1fyh n GLY 26 N -1.28 0.77 3.61 7.41 0.00 -1.26 -4.92 105.19 109.52 1fyh n GLY 26 Ca -0.05 -0.84 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 1fyh n GLY 26 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fyh s THR 27 N 0.00 3.25 -0.21 2.61 -4.23 -1.26 -5.00 115.64 110.80 1fyh s THR 27 Ca 0.00 -2.02 -0.21 0.00 -1.18 0.00 0.00 61.69 58.29 1fyh s THR 27 Cb 0.00 -2.73 -0.18 0.00 1.34 0.00 0.00 72.50 70.93 1fyh s THR 27 CO 0.00 -0.38 0.17 0.18 -0.54 0.00 0.00 174.62 174.05 1fyh n LEU 28 N -0.84 1.86 -0.01 4.79 4.77 -1.26 -4.84 117.00 121.46 1fyh n LEU 28 Ca -0.06 0.43 -0.01 0.00 -0.03 0.00 0.00 56.01 56.34 1fyh n LEU 28 Cb 0.59 -0.96 -0.02 0.00 -2.33 0.00 0.00 43.42 40.71 1fyh n LEU 28 CO 0.40 0.23 -0.57 0.49 -1.33 0.00 0.00 177.39 176.61 1fyh n PHE 29 N -4.44 0.00 -0.29 -1.77 3.72 -1.26 -4.78 117.46 108.64 1fyh n PHE 29 Ca -0.31 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.03 1fyh n PHE 29 Cb 0.66 -0.10 0.07 0.00 -0.94 0.00 0.00 39.48 39.16 1fyh n PHE 29 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1fyh h LEU 30 N 0.00 1.06 -0.22 4.37 3.38 -1.95 -2.23 115.31 119.71 1fyh h LEU 30 Ca -0.06 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1fyh h LEU 30 Cb 1.12 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1fyh h LEU 30 CO -0.00 0.92 -0.01 1.23 0.09 0.00 0.00 178.44 180.67 1fyh h GLY 31 N 1.13 0.43 0.90 0.83 0.00 -1.89 -2.71 103.07 101.77 1fyh h GLY 31 Ca 0.27 -0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.29 1fyh h GLY 31 CO -0.03 0.30 0.04 -2.22 0.00 0.00 0.00 176.54 174.63 1fyh h ILE 32 N 0.16 0.97 -0.89 2.60 2.04 -1.85 -2.62 117.51 117.92 1fyh h ILE 32 Ca 0.06 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 65.95 1fyh h ILE 32 Cb 0.41 0.86 -0.06 0.00 -0.74 0.00 0.00 36.82 37.29 1fyh h ILE 32 CO 0.01 0.02 0.56 -0.07 0.00 0.00 0.00 178.15 178.67 1fyh h LEU 33 N 0.10 0.90 -1.84 1.44 3.38 -1.41 -2.22 115.31 115.66 1fyh h LEU 33 Ca 0.05 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.06 1fyh h LEU 33 Cb 0.03 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1fyh h LEU 33 CO -0.06 0.58 0.16 0.11 0.09 0.00 0.00 178.44 179.32 1fyh h LYS 34 N 1.03 0.20 0.00 1.13 1.57 -1.13 -2.17 116.57 117.21 1fyh h LYS 34 Ca 0.39 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 1fyh h LYS 34 Cb 0.15 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1fyh h LYS 34 CO -0.17 0.14 0.00 -0.91 -0.57 0.00 0.00 179.45 177.94 1fyh h ASN 35 N 0.21 0.00 -3.30 0.86 2.35 -1.25 -3.43 115.58 111.02 1fyh h ASN 35 Ca 0.10 0.00 -0.66 0.00 -0.55 0.00 0.00 56.30 55.19 1fyh h ASN 35 Cb 0.13 0.00 -0.29 0.00 0.05 0.00 0.00 38.32 38.21 1fyh h ASN 35 CO -0.02 0.00 -0.79 0.26 -1.65 0.00 0.00 177.43 175.24 1fyh s TRP 36 N -3.67 2.80 -0.11 1.19 0.52 -0.82 -5.00 118.94 113.85 1fyh s TRP 36 Ca 0.00 -0.91 -0.01 0.00 0.02 0.00 0.00 56.10 55.21 1fyh s TRP 36 Cb 0.10 -1.89 -0.07 0.00 -1.15 0.00 0.00 33.47 30.46 1fyh s TRP 36 CO 0.45 -0.40 -0.11 1.63 0.02 0.00 0.00 176.95 178.55 1fyh n LYS 37 N 3.95 0.27 -1.89 4.98 5.02 -1.26 -4.74 118.16 124.49 1fyh n LYS 37 Ca -0.19 0.08 -0.41 0.00 -2.02 0.00 0.00 58.31 55.77 1fyh n LYS 37 Cb 0.52 -1.15 -0.02 0.00 -0.02 0.00 0.00 35.03 34.37 1fyh n LYS 37 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1fyh s GLU 38 N -2.22 4.19 0.49 1.97 0.41 -1.26 -4.83 118.70 117.45 1fyh s GLU 38 Ca -0.15 2.46 0.17 0.00 -0.41 0.00 0.00 54.97 57.03 1fyh s GLU 38 Cb 0.04 -3.04 1.21 0.00 -1.78 0.00 0.00 34.13 30.56 1fyh s GLU 38 CO 0.24 -0.50 2.08 0.93 -0.49 0.00 0.00 175.26 177.52 1fyh h GLU 39 N 4.34 0.13 -0.36 1.61 4.39 -1.99 -1.47 114.58 121.24 1fyh h GLU 39 Ca -0.48 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.11 1fyh h GLU 39 Cb 1.22 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 1fyh h GLU 39 CO 0.74 0.09 -0.22 0.77 -1.16 0.00 0.00 179.01 179.22 1fyh h SER 40 N 0.14 0.71 -0.29 1.42 0.02 -1.97 0.04 113.55 113.62 1fyh h SER 40 Ca 0.12 -0.25 -0.15 0.00 -0.84 0.00 0.00 61.79 60.67 1fyh h SER 40 Cb 0.31 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1fyh h SER 40 CO -0.02 0.92 -0.38 0.44 -1.14 0.00 0.00 176.83 176.65 1fyh h ASP 41 N 0.61 0.89 -0.33 3.07 3.32 -1.67 -2.83 116.42 119.48 1fyh h ASP 41 Ca 0.09 -0.40 -0.05 0.00 0.02 0.00 0.00 57.03 56.68 1fyh h ASP 41 Cb 0.71 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1fyh h ASP 41 CO 0.05 1.16 -0.00 0.03 -1.72 0.00 0.00 179.24 178.77 1fyh h ARG 42 N 0.69 0.59 -0.48 3.56 3.08 -1.03 -3.11 114.38 117.68 1fyh h ARG 42 Ca 0.06 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 1fyh h ARG 42 Cb 0.95 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.92 1fyh h ARG 42 CO 0.09 0.72 0.12 0.87 -1.07 0.00 0.00 179.97 180.69 1fyh h LYS 43 N 0.40 0.73 -0.14 0.04 1.79 -0.95 0.16 116.57 118.60 1fyh h LYS 43 Ca 0.09 -0.14 -0.08 0.00 -2.18 0.00 0.00 60.65 58.34 1fyh h LYS 43 Cb 0.45 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 1fyh h LYS 43 CO 0.02 0.66 -0.29 -0.84 -1.08 0.00 0.00 179.45 177.92 1fyh h ILE 44 N 0.71 1.26 0.15 1.86 3.07 -1.47 -1.32 117.51 121.76 1fyh h ILE 44 Ca 0.16 -1.22 -0.22 0.00 1.55 0.00 0.00 64.86 65.13 1fyh h ILE 44 Cb 0.27 1.47 0.02 0.00 -0.27 0.00 0.00 36.82 38.31 1fyh h ILE 44 CO -0.00 0.37 -0.93 0.24 -1.05 0.00 0.00 178.15 176.77 1fyh h MET 45 N 0.23 0.38 -0.43 0.16 2.86 -1.37 -3.30 114.93 113.46 1fyh h MET 45 Ca 0.03 -0.60 -0.05 0.00 -2.06 0.00 0.00 59.70 57.03 1fyh h MET 45 Cb 0.63 0.22 -0.02 0.00 0.06 0.00 0.00 31.60 32.49 1fyh h MET 45 CO 0.05 1.27 0.08 1.96 1.06 0.00 0.00 176.91 181.33 1fyh h GLN 46 N -0.21 0.66 -0.71 1.72 4.20 -0.68 -2.30 115.11 117.79 1fyh h GLN 46 Ca -0.16 -0.13 0.08 0.00 0.06 0.00 0.00 58.65 58.51 1fyh h GLN 46 Cb 1.72 -0.10 -0.07 0.00 0.30 0.00 0.00 27.48 29.33 1fyh h GLN 46 CO 0.18 0.62 0.37 1.03 -0.67 0.00 0.00 178.83 180.36 1fyh h SER 47 N 0.63 0.51 -0.06 1.46 0.87 -1.33 0.85 113.55 116.49 1fyh h SER 47 Ca 0.14 0.05 -0.14 0.00 -1.23 0.00 0.00 61.79 60.61 1fyh h SER 47 Cb 0.28 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 1fyh h SER 47 CO 0.00 0.31 -0.43 1.56 -0.53 0.00 0.00 176.83 177.74 1fyh h GLN 48 N 0.65 0.59 -0.29 2.24 1.08 -1.54 -2.48 115.11 115.35 1fyh h GLN 48 Ca 0.34 -0.31 -0.12 0.00 -1.45 0.00 0.00 58.65 57.11 1fyh h GLN 48 Cb 0.31 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1fyh h GLN 48 CO -0.24 0.91 -0.27 0.82 -0.95 0.00 0.00 178.83 179.10 1fyh h ILE 49 N 0.48 1.30 -0.65 2.54 2.04 -0.85 -2.39 117.51 119.97 1fyh h ILE 49 Ca 0.04 -1.44 -0.08 0.00 1.00 0.00 0.00 64.86 64.38 1fyh h ILE 49 Cb 0.94 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 1fyh h ILE 49 CO 0.08 0.46 0.11 0.58 0.00 0.00 0.00 178.15 179.38 1fyh h VAL 50 N 0.45 1.26 0.00 1.67 2.07 -0.83 -1.94 116.25 118.94 1fyh h VAL 50 Ca 0.05 -1.03 -0.08 0.00 0.82 0.00 0.00 66.70 66.46 1fyh h VAL 50 Cb 0.84 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1fyh h VAL 50 CO 0.07 0.39 -0.36 0.77 0.02 0.00 0.00 177.57 178.45 1fyh h SER 51 N 1.00 0.00 -0.19 0.57 4.64 -1.44 -2.06 113.55 116.08 1fyh h SER 51 Ca 0.20 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.50 1fyh h SER 51 Cb 0.44 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 1fyh h SER 51 CO 0.01 0.36 0.06 0.15 -0.87 0.00 0.00 176.83 176.54 1fyh h PHE 52 N 0.00 0.31 -0.18 4.77 3.04 -0.94 -1.71 116.94 122.23 1fyh h PHE 52 Ca -0.00 -0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.90 1fyh h PHE 52 Cb 0.81 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 39.23 1fyh h PHE 52 CO 0.00 0.40 0.08 1.88 -2.02 0.00 0.00 178.31 178.64 1fyh h TYR 53 N 0.13 0.27 -0.88 0.41 0.05 -1.15 -1.89 116.97 113.91 1fyh h TYR 53 Ca 0.06 -0.02 0.11 0.00 0.05 0.00 0.00 58.73 58.93 1fyh h TYR 53 Cb 0.24 -0.08 -0.07 0.00 1.01 0.00 0.00 36.73 37.83 1fyh h TYR 53 CO 0.00 0.32 0.57 0.74 -1.05 0.00 0.00 178.16 178.75 1fyh h PHE 54 N 0.15 0.91 -0.22 4.88 0.04 -1.30 -0.41 116.94 120.98 1fyh h PHE 54 Ca 0.06 0.03 -0.18 0.00 2.80 0.00 0.00 57.97 60.68 1fyh h PHE 54 Cb 0.16 -0.29 -0.00 0.00 2.20 0.00 0.00 35.95 38.02 1fyh h PHE 54 CO -0.01 0.39 -0.58 0.87 -0.60 0.00 0.00 178.31 178.38 1fyh h LYS 55 N 0.82 0.70 -0.21 1.51 1.57 -1.04 -2.24 116.57 117.68 1fyh h LYS 55 Ca 0.42 -0.46 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1fyh h LYS 55 Cb 0.50 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1fyh h LYS 55 CO -0.18 1.08 0.10 1.25 -0.57 0.00 0.00 179.45 181.13 1fyh h LEU 56 N 0.53 0.27 -1.81 2.94 5.85 -0.52 -2.59 115.31 119.99 1fyh h LEU 56 Ca 0.00 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 1fyh h LEU 56 Cb 1.16 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 1fyh h LEU 56 CO 0.12 0.31 -0.13 -0.26 -0.34 0.00 0.00 178.44 178.13 1fyh h PHE 57 N 0.21 0.00 -0.50 1.25 0.04 -1.08 -2.40 116.94 114.46 1fyh h PHE 57 Ca 0.07 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.81 1fyh h PHE 57 Cb 0.11 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.23 1fyh h PHE 57 CO -0.03 0.13 0.17 0.87 -0.60 0.00 0.00 178.31 178.85 1fyh h LYS 58 N 0.00 0.73 0.00 1.51 6.56 -0.99 -2.40 116.57 121.98 1fyh h LYS 58 Ca -0.00 -0.12 -0.00 0.00 -1.06 0.00 0.00 60.65 59.47 1fyh h LYS 58 Cb 0.25 -0.13 -0.00 0.00 -0.57 0.00 0.00 32.23 31.78 1fyh h LYS 58 CO 0.02 0.63 -0.01 -0.91 -2.06 0.00 0.00 179.45 177.12 1fyh h ASN 59 N 0.72 0.00 -0.21 0.86 2.35 -1.37 -2.53 115.58 115.41 1fyh h ASN 59 Ca 0.17 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 1fyh h ASN 59 Cb 0.20 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.53 1fyh h ASN 59 CO -0.01 0.01 -0.06 0.49 -1.65 0.00 0.00 177.43 176.20 1fyh n PHE 60 N -3.25 0.69 0.03 1.19 3.72 -0.91 -4.75 117.46 114.19 1fyh n PHE 60 Ca -0.03 -1.17 0.04 0.00 -0.05 0.00 0.00 57.45 56.24 1fyh n PHE 60 Cb 0.10 -0.33 0.42 0.00 -0.94 0.00 0.00 39.48 38.74 1fyh n PHE 60 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1fyh h LYS 61 N 1.08 0.47 -0.59 -1.08 2.10 -1.41 -2.28 116.57 114.85 1fyh h LYS 61 Ca 0.07 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 1fyh h LYS 61 Cb 1.37 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1fyh h LYS 61 CO 0.20 0.35 0.00 -0.25 -2.00 0.00 0.00 179.45 177.76 1fyh n ASP 62 N -4.44 3.37 -4.42 7.07 8.00 -1.26 -4.71 116.55 120.16 1fyh n ASP 62 Ca 0.02 -2.26 -0.45 0.00 0.71 0.00 0.00 54.79 52.81 1fyh n ASP 62 Cb 0.10 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.12 40.73 1fyh n ASP 62 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1fyh s ASP 63 N -0.81 6.83 0.44 -2.24 -1.08 -0.86 -4.92 116.67 114.03 1fyh s ASP 63 Ca 0.36 -2.54 0.19 0.00 -0.52 0.00 0.00 52.55 50.04 1fyh s ASP 63 Cb 0.22 -2.35 1.14 0.00 -1.46 0.00 0.00 42.92 40.48 1fyh s ASP 63 CO 0.18 -0.83 1.87 1.56 0.52 0.00 0.00 175.17 178.47 1fyh h GLN 64 N 8.03 0.33 0.00 4.34 4.20 -1.86 -2.77 115.11 127.38 1fyh h GLN 64 Ca 0.19 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.85 1fyh h GLN 64 Cb 0.98 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.68 1fyh h GLN 64 CO 1.07 0.22 -0.15 0.66 -0.67 0.00 0.00 178.83 179.96 1fyh h SER 65 N 0.34 0.00 -0.14 1.46 4.64 -1.97 -3.09 113.55 114.79 1fyh h SER 65 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1fyh h SER 65 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1fyh h SER 65 CO -0.15 0.15 0.00 2.30 -0.87 0.00 0.00 176.83 178.26 1fyh n ILE 66 N -3.74 0.35 -0.18 0.95 -5.35 -1.05 -4.66 119.36 105.68 1fyh n ILE 66 Ca -0.02 -0.68 0.06 0.00 -0.27 0.00 0.00 62.75 61.85 1fyh n ILE 66 Cb 0.26 0.98 0.35 0.00 -1.74 0.00 0.00 39.64 39.49 1fyh n ILE 66 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 1fyh h GLN 67 N 2.29 0.74 -0.40 6.28 1.08 -1.48 -1.47 115.11 122.15 1fyh h GLN 67 Ca 0.00 -0.04 -0.08 0.00 -1.45 0.00 0.00 58.65 57.08 1fyh h GLN 67 Cb 0.59 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.84 1fyh h GLN 67 CO 0.00 0.49 -0.05 -0.22 -0.95 0.00 0.00 178.83 178.10 1fyh h LYS 68 N 0.76 0.74 -0.26 1.46 1.63 -1.83 -1.80 116.57 117.27 1fyh h LYS 68 Ca 0.31 -0.26 -0.02 0.00 -0.85 0.00 0.00 60.65 59.83 1fyh h LYS 68 Cb 0.25 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.82 1fyh h LYS 68 CO -0.10 0.85 0.10 0.77 -3.45 0.00 0.00 179.45 177.62 1fyh h SER 69 N 0.55 0.35 -0.74 4.20 0.02 -1.69 -2.20 113.55 114.05 1fyh h SER 69 Ca 0.11 -0.17 0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1fyh h SER 69 Cb 0.55 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.96 1fyh h SER 69 CO 0.03 0.43 0.48 0.58 -1.14 0.00 0.00 176.83 177.21 1fyh h VAL 70 N 0.26 1.16 -0.41 2.27 2.07 -1.24 -1.84 116.25 118.52 1fyh h VAL 70 Ca 0.09 -0.33 -0.11 0.00 0.82 0.00 0.00 66.70 67.17 1fyh h VAL 70 Cb 0.18 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 1fyh h VAL 70 CO -0.01 0.18 -0.17 -0.08 0.02 0.00 0.00 177.57 177.51 1fyh h GLU 71 N 0.97 0.77 0.00 1.57 4.57 -1.28 0.01 114.58 121.19 1fyh h GLU 71 Ca 0.28 -0.29 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 1fyh h GLU 71 Cb -0.07 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1fyh h GLU 71 CO -0.08 0.90 -0.37 1.79 -1.18 0.00 0.00 179.01 180.07 1fyh h THR 72 N 0.69 0.79 -0.06 0.32 1.35 -1.09 -0.71 112.91 114.21 1fyh h THR 72 Ca 0.10 -1.60 -0.03 0.00 -0.55 0.00 0.00 66.41 64.34 1fyh h THR 72 Cb 0.67 2.02 -0.00 0.00 -1.73 0.00 0.00 68.15 69.11 1fyh h THR 72 CO 0.05 0.36 -0.06 0.40 -0.25 0.00 0.00 175.52 176.02 1fyh h ILE 73 N 0.00 1.38 -0.52 6.82 1.08 -0.93 -2.26 117.51 123.08 1fyh h ILE 73 Ca -0.00 -1.24 0.03 0.00 -0.39 0.00 0.00 64.86 63.26 1fyh h ILE 73 Cb 0.99 2.08 -0.04 0.00 -3.07 0.00 0.00 36.82 36.78 1fyh h ILE 73 CO 0.05 0.34 0.29 0.11 -0.69 0.00 0.00 178.15 178.25 1fyh h LYS 74 N -0.31 0.56 -0.32 2.37 1.57 -0.96 -1.18 116.57 118.29 1fyh h LYS 74 Ca 0.01 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1fyh h LYS 74 Cb 0.58 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1fyh h LYS 74 CO 0.02 0.37 0.03 1.49 -0.57 0.00 0.00 179.45 180.78 1fyh h GLU 75 N 0.58 0.49 0.00 3.15 4.57 -1.13 -1.81 114.58 120.42 1fyh h GLU 75 Ca 0.22 -0.09 -0.10 0.00 -1.18 0.00 0.00 59.36 58.21 1fyh h GLU 75 Cb 0.08 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 1fyh h GLU 75 CO -0.12 0.50 -0.45 0.22 -1.18 0.00 0.00 179.01 177.97 1fyh h ASP 76 N 0.47 0.00 -0.08 1.04 3.58 -0.69 -2.53 116.42 118.21 1fyh h ASP 76 Ca 0.11 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.39 1fyh h ASP 76 Cb 0.27 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.31 1fyh h ASP 76 CO 0.00 0.45 -0.52 0.24 -2.88 0.00 0.00 179.24 176.54 1fyh h MET 77 N 0.00 0.66 -0.52 0.28 2.86 -0.71 -2.04 114.93 115.45 1fyh h MET 77 Ca -0.00 -0.40 0.03 0.00 -2.06 0.00 0.00 59.70 57.26 1fyh h MET 77 Cb 1.04 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.70 1fyh h MET 77 CO 0.06 1.02 0.31 -0.91 1.06 0.00 0.00 176.91 178.44 1fyh h ASN 78 N 0.51 0.49 0.09 1.22 4.21 -1.12 0.33 115.58 121.31 1fyh h ASN 78 Ca 0.02 0.01 -0.00 0.00 1.21 0.00 0.00 56.30 57.53 1fyh h ASN 78 Cb 1.08 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 38.19 1fyh h ASN 78 CO 0.10 0.34 -0.04 0.58 -1.29 0.00 0.00 177.43 177.12 1fyh h VAL 79 N 0.60 1.14 -0.24 2.81 2.07 -1.38 -0.65 116.25 120.61 1fyh h VAL 79 Ca 0.21 -0.94 -0.09 0.00 0.82 0.00 0.00 66.70 66.70 1fyh h VAL 79 Cb 0.04 1.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.55 1fyh h VAL 79 CO -0.11 0.23 -0.20 0.11 0.02 0.00 0.00 177.57 177.62 1fyh h LYS 80 N -0.56 0.56 0.03 1.57 1.57 -1.28 -2.54 116.57 115.92 1fyh h LYS 80 Ca -0.01 -0.28 -0.34 0.00 -1.87 0.00 0.00 60.65 58.15 1fyh h LYS 80 Cb 0.46 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.73 1fyh h LYS 80 CO 0.02 0.87 -2.04 0.34 -0.57 0.00 0.00 179.45 178.06 1fyh n PHE 81 N -4.40 0.68 0.52 -1.35 7.35 0.11 -4.26 117.46 116.11 1fyh n PHE 81 Ca -0.04 0.20 0.08 0.00 -0.76 0.00 0.00 57.45 56.93 1fyh n PHE 81 Cb 0.41 -1.11 0.09 0.00 0.35 0.00 0.00 39.48 39.22 1fyh n PHE 81 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1fyh n PHE 82 N -3.09 0.10 -2.87 -5.13 3.72 -0.90 -4.97 117.46 104.32 1fyh n PHE 82 Ca -0.28 -0.08 -0.21 0.00 -0.05 0.00 0.00 57.45 56.83 1fyh n PHE 82 Cb 1.07 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.62 1fyh n PHE 82 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1fyh n ASN 83 N 0.90 -5.59 -1.45 4.37 5.15 -0.83 -1.74 115.26 116.07 1fyh n ASN 83 Ca 0.10 -0.20 -0.19 0.00 -0.60 0.00 0.00 54.58 53.70 1fyh n ASN 83 Cb 0.41 -4.58 -0.08 0.00 -0.53 0.00 0.00 39.78 35.01 1fyh n ASN 83 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1fyh n SER 84 N -2.32 -5.40 -4.54 1.20 7.64 -0.31 -4.95 113.62 104.95 1fyh n SER 84 Ca -0.14 0.47 -0.43 0.00 1.01 0.00 0.00 58.87 59.78 1fyh n SER 84 Cb 0.63 -4.56 -0.05 0.00 -1.01 0.00 0.00 64.21 59.21 1fyh n SER 84 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1fyh s ASN 85 N -2.76 6.40 0.19 6.43 3.84 -0.71 -4.94 114.94 123.39 1fyh s ASN 85 Ca 0.00 -0.17 -0.10 0.00 0.21 0.00 0.00 52.86 52.81 1fyh s ASN 85 Cb 0.00 -2.41 0.12 0.00 -0.55 0.00 0.00 41.25 38.40 1fyh s ASN 85 CO 0.00 -1.04 1.75 0.50 -2.79 0.00 0.00 177.10 175.52 1fyh h LYS 86 N 9.11 1.04 -0.39 0.43 3.64 -1.92 -2.55 116.57 125.93 1fyh h LYS 86 Ca -0.25 -0.19 -0.11 0.00 -1.27 0.00 0.00 60.65 58.83 1fyh h LYS 86 Cb 1.08 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.72 1fyh h LYS 86 CO 1.02 0.86 -0.19 -0.22 -2.27 0.00 0.00 179.45 178.65 1fyh h LYS 87 N 0.99 0.75 -0.50 1.90 3.64 -1.98 -0.57 116.57 120.80 1fyh h LYS 87 Ca 0.23 -0.28 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1fyh h LYS 87 Cb 0.21 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1fyh h LYS 87 CO -0.02 0.89 0.20 -0.22 -2.27 0.00 0.00 179.45 178.03 1fyh h LYS 88 N 0.67 0.75 -0.58 1.90 3.64 -1.90 -1.29 116.57 119.75 1fyh h LYS 88 Ca 0.10 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 1fyh h LYS 88 Cb 0.68 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 1fyh h LYS 88 CO 0.05 0.66 0.11 -0.09 -2.27 0.00 0.00 179.45 177.91 1fyh h ARG 89 N 0.67 0.96 -0.49 1.90 9.65 -1.35 -2.16 114.38 123.56 1fyh h ARG 89 Ca 0.17 -0.25 -0.04 0.00 -1.10 0.00 0.00 59.98 58.75 1fyh h ARG 89 Cb 0.19 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.63 1fyh h ARG 89 CO -0.01 0.90 0.13 -0.44 2.80 0.00 0.00 179.97 183.35 1fyh h ASP 90 N 0.86 0.73 -0.58 -3.80 3.32 -0.91 -1.04 116.42 115.01 1fyh h ASP 90 Ca 0.18 -0.22 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1fyh h ASP 90 Cb 0.40 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 1fyh h ASP 90 CO 0.01 0.76 0.26 0.44 -1.72 0.00 0.00 179.24 178.99 1fyh h ASP 91 N 0.67 0.77 -0.33 6.45 3.32 -1.18 -1.76 116.42 124.35 1fyh h ASP 91 Ca 0.16 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1fyh h ASP 91 Cb 0.30 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1fyh h ASP 91 CO -0.00 0.70 0.21 0.15 -1.72 0.00 0.00 179.24 178.57 1fyh h PHE 92 N 0.78 0.43 -0.64 4.55 3.04 -1.27 -2.18 116.94 121.65 1fyh h PHE 92 Ca 0.20 0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.18 1fyh h PHE 92 Cb 0.14 -0.14 -0.04 0.00 2.56 0.00 0.00 35.95 38.47 1fyh h PHE 92 CO 0.00 0.29 0.40 1.49 -2.02 0.00 0.00 178.31 178.47 1fyh h GLU 93 N 0.43 0.76 -0.55 1.11 4.57 -0.94 -1.62 114.58 118.35 1fyh h GLU 93 Ca 0.12 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 1fyh h GLU 93 Cb -0.02 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.38 1fyh h GLU 93 CO -0.02 0.50 0.32 0.87 -1.18 0.00 0.00 179.01 179.50 1fyh h LYS 94 N 0.79 0.76 -0.88 1.92 1.57 -1.11 -2.47 116.57 117.14 1fyh h LYS 94 Ca 0.25 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.97 1fyh h LYS 94 Cb 0.01 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.12 1fyh h LYS 94 CO -0.10 0.56 0.58 -0.07 -0.57 0.00 0.00 179.45 179.86 1fyh h LEU 95 N 0.74 1.01 -0.96 2.94 3.38 -0.79 -2.34 115.31 119.30 1fyh h LEU 95 Ca 0.20 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1fyh h LEU 95 Cb 0.01 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.50 1fyh h LEU 95 CO -0.04 0.73 0.00 0.71 0.09 0.00 0.00 178.44 179.94 1fyh h THR 96 N 1.20 0.00 -0.00 0.22 1.35 -1.10 -3.17 112.91 111.40 1fyh h THR 96 Ca 0.32 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 1fyh h THR 96 Cb -0.14 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 1fyh h THR 96 CO -0.07 0.00 -0.68 0.59 -0.25 0.00 0.00 175.52 175.11 1fyh n ASN 97 N -2.87 0.82 -4.76 5.36 3.02 -0.89 -4.96 115.26 110.98 1fyh n ASN 97 Ca 0.02 -0.66 -0.41 0.00 -0.03 0.00 0.00 54.58 53.49 1fyh n ASN 97 Cb 0.34 0.55 -0.01 0.00 -0.61 0.00 0.00 39.78 40.06 1fyh n ASN 97 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1fyh n TYR 98 N -1.36 2.89 -3.29 3.10 4.01 -1.13 -4.97 117.16 116.42 1fyh n TYR 98 Ca 0.06 0.37 -0.39 0.00 -0.16 0.00 0.00 57.90 57.77 1fyh n TYR 98 Cb 0.34 -2.55 -0.07 0.00 -0.31 0.00 0.00 39.34 36.75 1fyh n TYR 98 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1fyh s SER 99 N 0.14 6.49 0.58 7.72 0.15 -1.26 -4.97 113.70 122.55 1fyh s SER 99 Ca 0.58 0.59 0.36 0.00 0.70 0.00 0.00 55.95 58.18 1fyh s SER 99 Cb -0.49 -2.27 1.64 0.00 -1.71 0.00 0.00 66.02 63.19 1fyh s SER 99 CO 0.57 -0.17 2.08 -0.37 1.20 0.00 0.00 173.24 176.55 1fyh h VAL 100 N 5.16 0.01 0.00 4.45 -1.51 -1.95 -2.93 116.25 119.47 1fyh h VAL 100 Ca -0.33 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 1fyh h VAL 100 Cb 1.15 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 31.70 1fyh h VAL 100 CO 0.72 0.00 -0.70 0.35 -1.23 0.00 0.00 177.57 176.72 1fyh n THR 101 N -3.09 0.30 -2.09 7.19 -2.24 -1.26 -4.78 114.28 108.30 1fyh n THR 101 Ca -0.00 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.10 1fyh n THR 101 Cb 0.25 -0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.40 1fyh n THR 101 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1fyh s ASP 102 N -4.10 6.67 0.39 3.42 -1.08 -1.11 -4.91 116.67 115.94 1fyh s ASP 102 Ca 0.06 2.05 0.06 0.00 -0.52 0.00 0.00 52.55 54.19 1fyh s ASP 102 Cb 0.14 -2.53 0.78 0.00 -1.46 0.00 0.00 42.92 39.85 1fyh s ASP 102 CO 0.73 -0.95 2.03 0.25 0.52 0.00 0.00 175.17 177.75 1fyh h LEU 103 N 10.38 0.52 -0.25 -1.34 5.85 -1.89 -1.86 115.31 126.72 1fyh h LEU 103 Ca -0.36 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.25 1fyh h LEU 103 Cb 1.16 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1fyh h LEU 103 CO 0.96 0.40 -0.41 0.78 -0.34 0.00 0.00 178.44 179.84 1fyh h ASN 104 N 0.61 0.00 -0.26 1.25 2.35 -1.97 -2.75 115.58 114.81 1fyh h ASN 104 Ca 0.16 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.80 1fyh h ASN 104 Cb -0.02 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 1fyh h ASN 104 CO -0.03 0.41 -0.26 0.58 -1.65 0.00 0.00 177.43 176.48 1fyh h VAL 105 N 0.00 1.31 -0.62 2.81 2.07 -1.75 -2.16 116.25 117.91 1fyh h VAL 105 Ca -0.00 -1.43 0.08 0.00 0.82 0.00 0.00 66.70 66.17 1fyh h VAL 105 Cb 1.22 1.63 -0.06 0.00 -1.52 0.00 0.00 31.29 32.56 1fyh h VAL 105 CO 0.05 0.45 0.29 1.56 0.02 0.00 0.00 177.57 179.95 1fyh h GLN 106 N 0.36 0.51 -0.26 1.57 4.20 -1.30 0.86 115.11 121.05 1fyh h GLN 106 Ca 0.04 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1fyh h GLN 106 Cb 0.82 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.48 1fyh h GLN 106 CO 0.06 0.34 0.06 0.00 -0.67 0.00 0.00 178.83 178.63 1fyh h ARG 107 N 0.53 0.41 -0.58 1.46 3.08 -1.42 -1.21 114.38 116.65 1fyh h ARG 107 Ca 0.30 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 1fyh h ARG 107 Cb 0.29 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 1fyh h ARG 107 CO -0.24 0.51 0.14 0.87 -1.07 0.00 0.00 179.97 180.18 1fyh h LYS 108 N 0.24 0.91 -0.59 0.04 1.57 -1.02 -0.83 116.57 116.89 1fyh h LYS 108 Ca 0.08 -0.19 -0.06 0.00 -1.87 0.00 0.00 60.65 58.60 1fyh h LYS 108 Cb 0.29 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1fyh h LYS 108 CO 0.00 0.81 0.12 0.00 -0.57 0.00 0.00 179.45 179.81 1fyh h ALA 109 N 1.28 0.78 -0.22 3.86 0.00 -0.59 -2.34 119.26 122.02 1fyh h ALA 109 Ca 0.19 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1fyh h ALA 109 Cb 0.31 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1fyh h ALA 109 CO -0.00 0.51 -0.49 0.82 0.00 0.00 0.00 179.25 180.09 1fyh h ILE 110 N 0.86 1.31 -0.16 0.00 1.08 -1.02 -2.83 117.51 116.75 1fyh h ILE 110 Ca 0.18 -1.70 -0.06 0.00 -0.39 0.00 0.00 64.86 62.89 1fyh h ILE 110 Cb 0.39 1.66 -0.01 0.00 -3.07 0.00 0.00 36.82 35.79 1fyh h ILE 110 CO 0.01 0.53 -0.18 -0.78 -0.69 0.00 0.00 178.15 177.04 1fyh h ASP 111 N 0.48 0.25 0.19 1.72 3.58 -0.93 -2.86 116.42 118.84 1fyh h ASP 111 Ca 0.02 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.41 1fyh h ASP 111 Cb 1.02 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.01 1fyh h ASP 111 CO 0.10 0.45 -0.17 -0.62 -2.88 0.00 0.00 179.24 176.12 1fyh n GLU 112 N -4.22 1.02 -0.07 0.28 1.02 -0.90 -4.56 120.64 113.21 1fyh n GLU 112 Ca -0.01 -0.57 -0.07 0.00 -0.02 0.00 0.00 57.16 56.49 1fyh n GLU 112 Cb 0.31 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.23 1fyh n GLU 112 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1fyh h LEU 113 N 1.38 -0.73 -0.49 -4.62 5.85 -1.26 0.07 115.31 115.51 1fyh h LEU 113 Ca 0.00 0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1fyh h LEU 113 Cb 0.48 0.36 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 1fyh h LEU 113 CO 0.00 -0.26 0.32 0.40 -0.34 0.00 0.00 178.44 178.56 1fyh h ILE 114 N -0.20 1.10 -0.25 4.05 2.04 -1.82 -1.71 117.51 120.72 1fyh h ILE 114 Ca 0.15 -0.22 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 1fyh h ILE 114 Cb 0.44 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1fyh h ILE 114 CO -0.41 0.12 -0.17 1.56 0.00 0.00 0.00 178.15 179.25 1fyh h GLN 115 N 0.64 0.43 -0.67 2.37 4.20 -1.75 -2.45 115.11 117.88 1fyh h GLN 115 Ca 0.19 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 1fyh h GLN 115 Cb -0.05 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 1fyh h GLN 115 CO -0.06 0.59 0.10 0.28 -0.67 0.00 0.00 178.83 179.08 1fyh h VAL 116 N 0.40 1.27 -0.65 -0.54 2.07 -0.49 -1.67 116.25 116.64 1fyh h VAL 116 Ca 0.07 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1fyh h VAL 116 Cb 0.53 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 1fyh h VAL 116 CO 0.03 0.40 0.40 0.24 0.02 0.00 0.00 177.57 178.66 1fyh h MET 117 N 1.05 0.86 -0.56 1.57 2.86 -0.87 0.79 114.93 120.63 1fyh h MET 117 Ca 0.20 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.68 1fyh h MET 117 Cb 0.45 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 1fyh h MET 117 CO 0.01 0.59 -0.05 0.00 1.06 0.00 0.00 176.91 178.53 1fyh h ALA 118 N 1.56 0.76 0.00 6.32 0.00 -1.13 -0.33 119.26 126.44 1fyh h ALA 118 Ca 0.23 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1fyh h ALA 118 Cb -0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1fyh h ALA 118 CO -0.05 0.63 -0.20 0.93 0.00 0.00 0.00 179.25 180.57 1fyh h GLU 119 N 0.90 0.00 0.00 0.00 4.39 -0.20 -1.23 114.58 118.45 1fyh h GLU 119 Ca 0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.85 1fyh h GLU 119 Cb 0.61 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1fyh h GLU 119 CO 0.04 0.20 0.00 1.28 -1.16 0.00 0.00 179.01 179.37 1fyh n LEU 120 N -3.44 0.03 0.00 1.33 4.77 0.12 -4.90 117.00 114.90 1fyh n LEU 120 Ca -0.00 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 1fyh n LEU 120 Cb 0.38 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1fyh n LEU 120 CO 0.32 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1fyh n GLY 121 N 1.20 0.74 3.81 -0.72 0.00 -0.46 -4.95 105.19 104.80 1fyh n GLY 121 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1fyh n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fyh s ALA 122 N -2.07 3.20 -0.70 4.61 0.00 -0.17 -5.00 121.76 121.63 1fyh s ALA 122 Ca 0.00 0.36 -0.07 0.00 0.00 0.00 0.00 51.96 52.25 1fyh s ALA 122 Cb 0.00 -3.06 0.18 0.00 0.00 0.00 0.00 23.12 20.24 1fyh s ALA 122 CO 0.00 0.20 0.55 -0.80 0.00 0.00 0.00 175.76 175.72 1fyh s ASN 123 N -1.91 5.75 0.60 0.00 0.02 -1.26 -4.30 114.94 113.84 1fyh s ASN 123 Ca 0.54 -2.81 -0.18 0.00 -1.02 0.00 0.00 52.86 49.39 1fyh s ASN 123 Cb -0.14 -1.97 -0.03 0.00 0.02 0.00 0.00 41.25 39.13 1fyh s ASN 123 CO 0.19 -0.44 1.18 0.68 0.02 0.00 0.00 177.10 178.73 1fyh s VAL 124 N 0.00 2.77 0.68 1.60 -7.23 -1.26 -5.04 120.40 111.91 1fyh s VAL 124 Ca 0.17 0.45 -0.08 0.00 -1.81 0.00 0.00 61.98 60.71 1fyh s VAL 124 Cb -0.17 -3.14 0.03 0.00 0.56 0.00 0.00 36.38 33.67 1fyh s VAL 124 CO -0.05 -0.12 1.02 -0.94 -0.31 0.00 0.00 175.10 174.69 1fyh s SER 201 N -1.77 5.20 0.49 4.85 1.04 -1.26 -4.94 113.70 117.31 1fyh s SER 201 Ca 0.75 0.75 0.22 0.00 0.48 0.00 0.00 55.95 58.15 1fyh s SER 201 Cb -0.28 -1.54 1.27 0.00 0.10 0.00 0.00 66.02 65.58 1fyh s SER 201 CO 0.34 -1.39 2.04 1.23 0.98 0.00 0.00 173.24 176.44 1fyh h GLY 202 N -0.53 0.00 1.17 7.32 0.00 -2.00 -2.22 103.07 106.82 1fyh h GLY 202 Ca -0.45 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.72 1fyh h GLY 202 CO 0.62 0.00 -0.41 -2.09 0.00 0.00 0.00 176.54 174.66 1fyh h GLU 203 N 0.00 0.90 -0.57 4.80 4.81 -2.00 -2.73 114.58 119.78 1fyh h GLU 203 Ca -0.00 -0.48 -0.01 0.00 -0.13 0.00 0.00 59.36 58.73 1fyh h GLU 203 Cb 0.33 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 1fyh h GLU 203 CO 0.02 1.13 0.30 0.35 -0.73 0.00 0.00 179.01 180.08 1fyh h PHE 204 N 0.73 0.80 -0.95 0.92 3.04 -1.79 -1.65 116.94 118.04 1fyh h PHE 204 Ca 0.05 -0.03 -0.00 0.00 3.98 0.00 0.00 57.97 61.97 1fyh h PHE 204 Cb 0.99 -0.25 -0.05 0.00 2.56 0.00 0.00 35.95 39.20 1fyh h PHE 204 CO 0.06 0.60 0.58 0.28 -2.02 0.00 0.00 178.31 177.81 1fyh h VAL 205 N 0.78 1.26 -0.37 1.41 2.07 -1.33 -0.87 116.25 119.19 1fyh h VAL 205 Ca 0.20 -0.56 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 1fyh h VAL 205 Cb 0.07 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 29.74 1fyh h VAL 205 CO -0.03 0.27 -0.13 0.11 0.02 0.00 0.00 177.57 177.81 1fyh h LYS 206 N 1.31 0.75 -0.53 1.57 1.57 -1.27 -1.29 116.57 118.68 1fyh h LYS 206 Ca 0.34 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.74 1fyh h LYS 206 Cb -0.06 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1fyh h LYS 206 CO -0.06 0.91 0.03 0.93 -0.57 0.00 0.00 179.45 180.69 1fyh h GLU 207 N 0.55 0.87 -0.31 3.15 4.39 -1.07 -1.71 114.58 120.45 1fyh h GLU 207 Ca 0.09 -0.23 -0.17 0.00 0.34 0.00 0.00 59.36 59.39 1fyh h GLU 207 Cb 0.66 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.21 1fyh h GLU 207 CO 0.05 0.85 -0.46 0.00 -1.16 0.00 0.00 179.01 178.28 1fyh h ALA 208 N 1.22 0.59 0.00 3.43 0.00 -1.09 -1.60 119.26 121.81 1fyh h ALA 208 Ca 0.16 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 1fyh h ALA 208 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1fyh h ALA 208 CO 0.02 0.68 -0.24 0.93 0.00 0.00 0.00 179.25 180.63 1fyh h GLU 209 N 0.66 0.00 -0.21 0.00 5.08 -1.02 -2.10 114.58 116.99 1fyh h GLU 209 Ca 0.04 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.23 1fyh h GLU 209 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1fyh h GLU 209 CO 0.10 0.24 -0.51 -0.97 -1.00 0.00 0.00 179.01 176.87 1fyh h ASN 210 N 0.00 0.81 -0.05 1.42 -1.24 -0.98 -2.49 115.58 113.05 1fyh h ASN 210 Ca -0.00 -0.57 -0.04 0.00 0.71 0.00 0.00 56.30 56.40 1fyh h ASN 210 Cb 0.52 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 39.33 1fyh h ASN 210 CO 0.03 1.23 -0.06 -0.07 -1.29 0.00 0.00 177.43 177.27 1fyh h LEU 211 N 0.43 0.25 -0.89 0.34 3.38 -1.04 -2.34 115.31 115.43 1fyh h LEU 211 Ca -0.01 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 1fyh h LEU 211 Cb 1.13 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1fyh h LEU 211 CO 0.11 0.35 -0.52 0.50 0.09 0.00 0.00 178.44 178.97 1fyh h LYS 212 N 0.26 0.08 -0.04 1.13 3.64 -1.24 -1.61 116.57 118.81 1fyh h LYS 212 Ca 0.06 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1fyh h LYS 212 Cb 0.28 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1fyh h LYS 212 CO 0.01 0.58 -0.05 0.87 -2.27 0.00 0.00 179.45 178.59 1fyh h LYS 213 N 0.06 0.10 -0.02 1.90 1.79 -0.99 -2.88 116.57 116.54 1fyh h LYS 213 Ca -0.00 -0.06 0.03 0.00 -2.18 0.00 0.00 60.65 58.44 1fyh h LYS 213 Cb 0.94 0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 31.54 1fyh h LYS 213 CO 0.07 0.60 -0.45 -0.92 -1.08 0.00 0.00 179.45 177.68 1fyh h TYR 214 N -0.39 -1.29 0.00 -1.35 3.20 -1.35 -2.83 116.97 112.96 1fyh h TYR 214 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1fyh h TYR 214 Cb 0.59 0.57 0.00 0.00 1.54 0.00 0.00 36.73 39.43 1fyh h TYR 214 CO 0.11 -0.52 0.00 1.19 -1.64 0.00 0.00 178.16 177.30 1fyh n PHE 215 N -5.45 0.00 -4.55 -3.82 3.72 -0.61 -5.12 117.46 101.63 1fyh n PHE 215 Ca -0.06 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.07 1fyh n PHE 215 Cb 0.38 -0.20 -0.10 0.00 -0.94 0.00 0.00 39.48 38.61 1fyh n PHE 215 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1fyh s ASN 216 N -2.40 3.94 0.00 4.37 0.01 -1.07 -4.78 114.94 115.00 1fyh s ASN 216 Ca 0.24 -1.31 0.00 0.00 -0.71 0.00 0.00 52.86 51.08 1fyh s ASN 216 Cb 0.15 -0.41 0.00 0.00 0.41 0.00 0.00 41.25 41.40 1fyh s ASN 216 CO 0.31 -0.43 0.00 0.61 -1.51 0.00 0.00 177.10 176.08 1fyh n GLY 226 N -0.98 -3.19 3.73 0.66 0.00 -1.26 -5.03 105.19 99.12 1fyh n GLY 226 Ca -0.05 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 1fyh n GLY 226 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fyh s THR 227 N 0.00 2.88 -0.20 2.61 -4.23 -1.26 -5.01 115.64 110.43 1fyh s THR 227 Ca 0.00 0.28 -0.20 0.00 -1.18 0.00 0.00 61.69 60.60 1fyh s THR 227 Cb 0.00 -2.76 -0.20 0.00 1.34 0.00 0.00 72.50 70.89 1fyh s THR 227 CO 0.00 -0.37 0.22 -0.11 -0.54 0.00 0.00 174.62 173.82 1fyh n LEU 228 N -3.77 1.95 -0.02 4.79 7.94 -1.26 -4.80 117.00 121.82 1fyh n LEU 228 Ca 0.08 0.40 -0.03 0.00 -1.11 0.00 0.00 56.01 55.35 1fyh n LEU 228 Cb 0.54 -0.98 -0.03 0.00 0.53 0.00 0.00 43.42 43.48 1fyh n LEU 228 CO 0.55 0.35 -0.64 0.49 -1.11 0.00 0.00 177.39 177.02 1fyh n PHE 229 N -4.32 0.00 -0.16 1.96 3.72 -1.26 -4.75 117.46 112.64 1fyh n PHE 229 Ca -0.33 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.04 1fyh n PHE 229 Cb 0.73 -0.19 0.16 0.00 -0.94 0.00 0.00 39.48 39.24 1fyh n PHE 229 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1fyh h LEU 230 N 0.00 0.85 0.09 4.37 3.38 -1.95 -1.67 115.31 120.38 1fyh h LEU 230 Ca -0.11 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1fyh h LEU 230 Cb 1.20 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1fyh h LEU 230 CO -0.01 0.81 -0.04 1.23 0.09 0.00 0.00 178.44 180.52 1fyh h GLY 231 N 1.01 -0.13 0.95 0.83 0.00 -1.87 -2.42 103.07 101.43 1fyh h GLY 231 Ca 0.19 0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.59 1fyh h GLY 231 CO -0.00 -0.05 0.52 -2.22 0.00 0.00 0.00 176.54 174.79 1fyh h ILE 232 N -0.22 1.17 -0.14 2.60 2.04 -1.82 -2.14 117.51 119.00 1fyh h ILE 232 Ca -0.01 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 1fyh h ILE 232 Cb 0.18 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.29 1fyh h ILE 232 CO 0.02 0.19 -0.03 -0.07 0.00 0.00 0.00 178.15 178.26 1fyh h LEU 233 N 1.03 0.18 -0.54 1.44 3.38 -1.18 -2.01 115.31 117.61 1fyh h LEU 233 Ca 0.30 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1fyh h LEU 233 Cb -0.06 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1fyh h LEU 233 CO -0.09 0.25 0.00 0.11 0.09 0.00 0.00 178.44 178.80 1fyh h LYS 234 N 0.19 0.00 0.00 1.13 1.57 -0.88 -3.16 116.57 115.42 1fyh h LYS 234 Ca 0.05 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.74 1fyh h LYS 234 Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1fyh h LYS 234 CO 0.01 0.00 -0.43 -0.91 -0.57 0.00 0.00 179.45 177.55 1fyh h ASN 235 N 0.00 0.00 -3.56 0.86 2.35 -1.12 -3.43 115.58 110.68 1fyh h ASN 235 Ca 0.00 0.00 -0.67 0.00 -0.55 0.00 0.00 56.30 55.08 1fyh h ASN 235 Cb 0.70 0.00 -0.31 0.00 0.05 0.00 0.00 38.32 38.76 1fyh h ASN 235 CO 0.00 0.43 -0.72 0.26 -1.65 0.00 0.00 177.43 175.75 1fyh s TRP 236 N -3.34 3.11 -0.14 1.19 0.52 -1.20 -4.99 118.94 114.09 1fyh s TRP 236 Ca 0.02 -1.53 0.07 0.00 0.02 0.00 0.00 56.10 54.68 1fyh s TRP 236 Cb 0.10 -2.09 -0.23 0.00 -1.15 0.00 0.00 33.47 30.09 1fyh s TRP 236 CO 0.71 -0.72 0.26 1.63 0.02 0.00 0.00 176.95 178.85 1fyh n LYS 237 N 4.69 0.68 -2.34 4.98 4.76 -1.26 -4.68 118.16 124.99 1fyh n LYS 237 Ca -0.16 0.18 -0.39 0.00 -2.87 0.00 0.00 58.31 55.08 1fyh n LYS 237 Cb 0.47 -1.65 -0.03 0.00 -1.84 0.00 0.00 35.03 31.98 1fyh n LYS 237 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1fyh s GLU 238 N -2.55 4.18 0.24 1.97 0.41 -1.26 -4.88 118.70 116.81 1fyh s GLU 238 Ca -0.16 1.83 -0.05 0.00 -0.41 0.00 0.00 54.97 56.17 1fyh s GLU 238 Cb 0.07 -2.77 0.37 0.00 -1.78 0.00 0.00 34.13 30.02 1fyh s GLU 238 CO 0.77 -0.21 1.80 1.49 -0.49 0.00 0.00 175.26 178.62 1fyh h GLU 239 N 2.86 0.71 -0.38 1.61 4.57 -2.00 -1.94 114.58 120.02 1fyh h GLU 239 Ca -0.48 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 57.56 1fyh h GLU 239 Cb 1.23 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 29.64 1fyh h GLU 239 CO 0.63 0.47 -0.16 0.77 -1.18 0.00 0.00 179.01 179.55 1fyh h SER 240 N 0.74 0.69 -0.33 1.04 0.02 -1.96 -1.80 113.55 111.94 1fyh h SER 240 Ca 0.38 -0.22 -0.12 0.00 -0.84 0.00 0.00 61.79 60.99 1fyh h SER 240 Cb 0.35 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1fyh h SER 240 CO -0.25 0.86 -0.23 0.44 -1.14 0.00 0.00 176.83 176.51 1fyh h ASP 241 N 0.62 0.84 -0.55 3.07 3.32 -1.83 -2.66 116.42 119.23 1fyh h ASP 241 Ca 0.10 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.85 1fyh h ASP 241 Cb 0.62 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 1fyh h ASP 241 CO 0.04 1.04 0.35 0.03 -1.72 0.00 0.00 179.24 178.99 1fyh h ARG 242 N 0.72 0.69 -0.76 3.56 3.08 -1.05 -2.77 114.38 117.85 1fyh h ARG 242 Ca 0.10 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 1fyh h ARG 242 Cb 0.76 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.62 1fyh h ARG 242 CO 0.06 0.46 0.31 0.87 -1.07 0.00 0.00 179.97 180.60 1fyh h LYS 243 N 0.71 1.12 -0.44 0.04 1.79 -1.13 0.96 116.57 119.62 1fyh h LYS 243 Ca 0.21 -0.19 0.03 0.00 -2.18 0.00 0.00 60.65 58.52 1fyh h LYS 243 Cb -0.04 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 30.39 1fyh h LYS 243 CO -0.07 0.90 0.23 0.82 -1.08 0.00 0.00 179.45 180.25 1fyh h ILE 244 N 1.09 1.00 0.03 1.86 2.04 -1.23 -0.61 117.51 121.69 1fyh h ILE 244 Ca 0.25 -0.16 -0.27 0.00 1.00 0.00 0.00 64.86 65.68 1fyh h ILE 244 Cb 0.19 0.49 0.02 0.00 -0.74 0.00 0.00 36.82 36.78 1fyh h ILE 244 CO -0.02 0.09 -1.09 0.24 0.00 0.00 0.00 178.15 177.37 1fyh h MET 245 N 0.47 0.69 -0.32 2.37 2.86 -1.22 -3.25 114.93 116.54 1fyh h MET 245 Ca 0.18 -0.78 -0.04 0.00 -2.06 0.00 0.00 59.70 57.01 1fyh h MET 245 Cb 0.06 0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1fyh h MET 245 CO -0.11 1.34 0.03 1.96 1.06 0.00 0.00 176.91 181.19 1fyh h GLN 246 N 0.37 0.47 -0.89 1.72 4.20 -0.61 -1.77 115.11 118.61 1fyh h GLN 246 Ca -0.14 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.48 1fyh h GLN 246 Cb 1.75 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 29.40 1fyh h GLN 246 CO 0.21 0.48 0.56 1.03 -0.67 0.00 0.00 178.83 180.44 1fyh h SER 247 N 0.46 1.04 0.49 1.46 0.87 -1.14 -0.71 113.55 116.02 1fyh h SER 247 Ca 0.11 -0.04 -0.20 0.00 -1.23 0.00 0.00 61.79 60.42 1fyh h SER 247 Cb 0.25 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 1fyh h SER 247 CO 0.00 0.78 -0.85 1.56 -0.53 0.00 0.00 176.83 177.79 1fyh h GLN 248 N 1.22 0.26 -0.13 2.24 1.08 -1.45 -2.47 115.11 115.85 1fyh h GLN 248 Ca 0.32 -0.26 -0.06 0.00 -1.45 0.00 0.00 58.65 57.20 1fyh h GLN 248 Cb -0.10 0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.40 1fyh h GLN 248 CO -0.07 0.97 -0.14 0.82 -0.95 0.00 0.00 178.83 179.46 1fyh h ILE 249 N 0.15 1.35 -0.68 2.54 2.04 -0.91 -2.66 117.51 119.34 1fyh h ILE 249 Ca -0.05 -1.31 -0.04 0.00 1.00 0.00 0.00 64.86 64.46 1fyh h ILE 249 Cb 1.47 1.91 -0.03 0.00 -0.74 0.00 0.00 36.82 39.42 1fyh h ILE 249 CO 0.13 0.38 0.25 0.58 0.00 0.00 0.00 178.15 179.49 1fyh h VAL 250 N -0.05 1.24 0.00 1.67 2.07 -1.20 -1.73 116.25 118.25 1fyh h VAL 250 Ca 0.02 -0.79 -0.08 0.00 0.82 0.00 0.00 66.70 66.67 1fyh h VAL 250 Cb 0.67 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1fyh h VAL 250 CO 0.03 0.31 -0.37 0.77 0.02 0.00 0.00 177.57 178.34 1fyh h SER 251 N 1.00 0.00 -0.23 0.57 4.64 -1.44 -0.91 113.55 117.18 1fyh h SER 251 Ca 0.23 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.50 1fyh h SER 251 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1fyh h SER 251 CO -0.02 0.37 -0.06 0.15 -0.87 0.00 0.00 176.83 176.40 1fyh h PHE 252 N 0.00 0.51 -0.36 4.77 3.04 -1.02 -2.45 116.94 121.42 1fyh h PHE 252 Ca -0.00 -0.11 -0.09 0.00 3.98 0.00 0.00 57.97 61.75 1fyh h PHE 252 Cb 0.73 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 39.10 1fyh h PHE 252 CO 0.00 0.68 -0.15 1.88 -2.02 0.00 0.00 178.31 178.70 1fyh h TYR 253 N 0.18 0.72 -0.22 0.41 0.05 -1.01 -1.56 116.97 115.55 1fyh h TYR 253 Ca 0.06 -0.13 -0.04 0.00 0.05 0.00 0.00 58.73 58.66 1fyh h TYR 253 Cb 0.52 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 1fyh h TYR 253 CO 0.05 0.77 -0.06 0.74 -1.05 0.00 0.00 178.16 178.61 1fyh h PHE 254 N 0.59 0.35 -0.10 4.88 0.04 -1.07 -0.99 116.94 120.64 1fyh h PHE 254 Ca 0.10 -0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.68 1fyh h PHE 254 Cb 0.60 -0.10 0.01 0.00 2.20 0.00 0.00 35.95 38.65 1fyh h PHE 254 CO 0.03 0.41 -0.53 -0.22 -0.60 0.00 0.00 178.31 177.39 1fyh h LYS 255 N 0.32 0.54 -0.40 1.51 3.64 -1.19 -1.67 116.57 119.33 1fyh h LYS 255 Ca 0.07 -0.45 -0.01 0.00 -1.27 0.00 0.00 60.65 58.99 1fyh h LYS 255 Cb 0.32 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 1fyh h LYS 255 CO 0.01 1.07 0.22 1.25 -2.27 0.00 0.00 179.45 179.74 1fyh h LEU 256 N 0.15 0.50 -0.83 5.20 5.85 -1.06 -2.73 115.31 122.39 1fyh h LEU 256 Ca -0.04 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 1fyh h LEU 256 Cb 1.18 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.06 1fyh h LEU 256 CO 0.11 0.45 -0.14 -0.26 -0.34 0.00 0.00 178.44 178.25 1fyh h PHE 257 N 0.52 0.79 -0.75 1.25 0.04 -1.19 -2.87 116.94 114.73 1fyh h PHE 257 Ca 0.14 -0.15 0.01 0.00 2.80 0.00 0.00 57.97 60.77 1fyh h PHE 257 Cb 0.05 -0.20 -0.04 0.00 2.20 0.00 0.00 35.95 37.97 1fyh h PHE 257 CO -0.02 0.82 0.49 -0.22 -0.60 0.00 0.00 178.31 178.77 1fyh h LYS 258 N 0.65 0.99 0.00 1.51 3.64 -1.18 -1.86 116.57 120.32 1fyh h LYS 258 Ca 0.11 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1fyh h LYS 258 Cb 0.61 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1fyh h LYS 258 CO 0.04 0.66 0.00 -0.91 -2.27 0.00 0.00 179.45 176.98 1fyh h ASN 259 N 1.02 0.00 0.00 4.20 -0.26 -1.27 -3.19 115.58 116.07 1fyh h ASN 259 Ca 0.27 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.01 1fyh h ASN 259 Cb -0.10 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.16 1fyh h ASN 259 CO -0.06 0.00 -0.09 0.49 -1.06 0.00 0.00 177.43 176.71 1fyh n PHE 260 N -2.47 0.00 0.76 1.19 3.72 -1.03 -4.76 117.46 114.87 1fyh n PHE 260 Ca 0.02 -0.63 0.10 0.00 -0.05 0.00 0.00 57.45 56.88 1fyh n PHE 260 Cb 0.24 -0.10 0.46 0.00 -0.94 0.00 0.00 39.48 39.14 1fyh n PHE 260 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1fyh n LYS 261 N -0.87 0.04 -0.02 -1.08 2.85 -0.73 -2.90 118.16 115.46 1fyh n LYS 261 Ca 0.08 0.13 0.04 0.00 -1.05 0.00 0.00 58.31 57.52 1fyh n LYS 261 Cb 0.56 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 33.30 1fyh n LYS 261 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1fyh n ASP 262 N -1.47 0.16 -4.60 -5.58 8.00 -1.26 -4.76 116.55 107.04 1fyh n ASP 262 Ca 0.06 0.07 -0.53 0.00 0.71 0.00 0.00 54.79 55.10 1fyh n ASP 262 Cb 0.23 1.41 -0.07 0.00 -0.02 0.00 0.00 41.12 42.68 1fyh n ASP 262 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1fyh n ASP 263 N -2.49 2.56 -0.15 -2.24 -0.08 -1.14 -4.86 116.55 108.15 1fyh n ASP 263 Ca -0.12 0.80 -0.07 0.00 -1.51 0.00 0.00 54.79 53.89 1fyh n ASP 263 Cb 0.75 -1.24 0.02 0.00 2.34 0.00 0.00 41.12 42.99 1fyh n ASP 263 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 1fyh h GLN 264 N 9.65 0.54 0.00 -0.67 4.20 -1.92 -0.73 115.11 126.19 1fyh h GLN 264 Ca -0.40 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.28 1fyh h GLN 264 Cb 1.31 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.96 1fyh h GLN 264 CO 0.98 0.36 -0.02 0.77 -0.67 0.00 0.00 178.83 180.26 1fyh h SER 265 N 0.56 0.00 0.00 1.46 0.02 -1.98 -3.26 113.55 110.35 1fyh h SER 265 Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1fyh h SER 265 Cb -0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.52 1fyh h SER 265 CO -0.07 0.02 -0.00 2.30 -1.14 0.00 0.00 176.83 177.94 1fyh n ILE 266 N -4.12 0.51 -0.19 3.27 -5.35 -1.11 -4.87 119.36 107.50 1fyh n ILE 266 Ca -0.03 -0.51 0.00 0.00 -0.27 0.00 0.00 62.75 61.94 1fyh n ILE 266 Cb 0.10 0.74 0.09 0.00 -1.74 0.00 0.00 39.64 38.84 1fyh n ILE 266 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1fyh h GLN 267 N 0.00 0.15 -0.12 6.28 4.15 -1.18 0.42 115.11 124.82 1fyh h GLN 267 Ca 0.00 -0.01 -0.19 0.00 0.77 0.00 0.00 58.65 59.22 1fyh h GLN 267 Cb 0.75 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.40 1fyh h GLN 267 CO 0.00 0.10 -0.70 -0.22 -1.93 0.00 0.00 178.83 176.08 1fyh h LYS 268 N 0.16 0.51 0.01 1.69 1.63 -1.87 -2.26 116.57 116.44 1fyh h LYS 268 Ca 0.30 -0.40 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 1fyh h LYS 268 Cb 0.47 0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 32.17 1fyh h LYS 268 CO -0.46 1.02 -0.02 0.77 -3.45 0.00 0.00 179.45 177.31 1fyh h SER 269 N 0.36 -0.05 -0.79 4.20 0.02 -1.79 -2.15 113.55 113.36 1fyh h SER 269 Ca -0.03 0.01 0.03 0.00 -0.84 0.00 0.00 61.79 60.96 1fyh h SER 269 Cb 1.27 0.02 -0.05 0.00 0.14 0.00 0.00 62.40 63.79 1fyh h SER 269 CO 0.13 -0.03 0.50 0.58 -1.14 0.00 0.00 176.83 176.87 1fyh h VAL 270 N -0.04 1.13 -0.33 2.27 2.07 -0.92 -2.03 116.25 118.40 1fyh h VAL 270 Ca 0.00 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.12 1fyh h VAL 270 Cb 0.04 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 1fyh h VAL 270 CO -0.01 0.18 -0.05 -0.08 0.02 0.00 0.00 177.57 177.63 1fyh h GLU 271 N 0.99 0.54 -0.07 1.57 4.57 -1.11 -2.13 114.58 118.94 1fyh h GLU 271 Ca 0.31 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.33 1fyh h GLU 271 Cb -0.01 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.51 1fyh h GLU 271 CO -0.10 0.60 -0.05 1.15 -1.18 0.00 0.00 179.01 179.43 1fyh h THR 272 N 0.51 1.34 -0.24 0.32 2.02 -1.02 -2.41 112.91 113.43 1fyh h THR 272 Ca 0.10 -1.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.15 1fyh h THR 272 Cb 0.41 1.93 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 1fyh h THR 272 CO 0.02 0.31 0.09 0.40 0.37 0.00 0.00 175.52 176.71 1fyh h ILE 273 N -0.23 1.18 -0.51 3.11 2.04 -1.33 -1.90 117.51 119.87 1fyh h ILE 273 Ca 0.02 -0.56 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 1fyh h ILE 273 Cb 0.52 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 1fyh h ILE 273 CO 0.01 0.18 0.28 0.50 0.00 0.00 0.00 178.15 179.13 1fyh h LYS 274 N 0.23 0.72 -0.51 2.37 3.64 -1.46 -0.30 116.57 121.25 1fyh h LYS 274 Ca 0.08 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 1fyh h LYS 274 Cb 0.20 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1fyh h LYS 274 CO -0.00 0.56 0.15 1.49 -2.27 0.00 0.00 179.45 179.37 1fyh h GLU 275 N 0.69 0.81 -0.66 1.90 4.57 -1.33 -1.26 114.58 119.29 1fyh h GLU 275 Ca 0.18 -0.18 -0.07 0.00 -1.18 0.00 0.00 59.36 58.11 1fyh h GLU 275 Cb 0.05 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 1fyh h GLU 275 CO -0.03 0.76 0.15 -0.44 -1.18 0.00 0.00 179.01 178.27 1fyh h ASP 276 N 0.71 1.01 -0.72 1.04 3.32 -1.07 -1.41 116.42 119.29 1fyh h ASP 276 Ca 0.16 -0.21 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 1fyh h ASP 276 Cb 0.30 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1fyh h ASP 276 CO -0.00 0.98 0.30 -0.03 -1.72 0.00 0.00 179.24 178.77 1fyh h MET 277 N 1.01 1.08 -0.27 3.56 4.05 -0.78 -2.33 114.93 121.25 1fyh h MET 277 Ca 0.21 -0.18 -0.03 0.00 -0.28 0.00 0.00 59.70 59.42 1fyh h MET 277 Cb 0.38 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 30.98 1fyh h MET 277 CO 0.00 0.87 0.06 -0.91 0.23 0.00 0.00 176.91 177.16 1fyh h ASN 278 N 1.06 0.42 -0.38 1.39 2.35 -0.84 -1.64 115.58 117.95 1fyh h ASN 278 Ca 0.25 -0.24 0.04 0.00 -0.55 0.00 0.00 56.30 55.80 1fyh h ASN 278 Cb 0.19 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.41 1fyh h ASN 278 CO -0.02 0.56 0.14 0.58 -1.65 0.00 0.00 177.43 177.03 1fyh h VAL 279 N 0.27 0.89 -0.03 2.81 2.07 -1.06 -2.16 116.25 119.05 1fyh h VAL 279 Ca 0.09 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1fyh h VAL 279 Cb 0.30 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1fyh h VAL 279 CO 0.00 0.05 -0.02 0.50 0.02 0.00 0.00 177.57 178.12 1fyh h LYS 280 N 0.29 0.08 -0.51 1.57 1.63 -1.35 -2.17 116.57 116.11 1fyh h LYS 280 Ca 0.17 -0.04 -0.09 0.00 -0.85 0.00 0.00 60.65 59.84 1fyh h LYS 280 Cb 0.15 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.76 1fyh h LYS 280 CO -0.17 0.50 -0.05 0.35 -3.45 0.00 0.00 179.45 176.63 1fyh h PHE 281 N -0.35 0.97 -0.50 1.91 3.57 -1.30 -3.07 116.94 118.17 1fyh h PHE 281 Ca 0.01 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.34 1fyh h PHE 281 Cb 0.48 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.97 1fyh h PHE 281 CO 0.08 0.91 0.00 1.19 -2.23 0.00 0.00 178.31 178.26 1fyh n PHE 282 N -4.18 0.65 -3.93 0.41 3.72 -0.81 -4.97 117.46 108.35 1fyh n PHE 282 Ca 0.02 -0.32 -0.28 0.00 -0.05 0.00 0.00 57.45 56.82 1fyh n PHE 282 Cb 0.35 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.90 1fyh n PHE 282 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1fyh n ASN 283 N 1.46 -2.53 -1.59 4.37 3.02 -0.94 -1.29 115.26 117.75 1fyh n ASN 283 Ca 0.21 -0.89 -0.20 0.00 -0.03 0.00 0.00 54.58 53.67 1fyh n ASN 283 Cb 0.59 -3.52 -0.09 0.00 -0.61 0.00 0.00 39.78 36.16 1fyh n ASN 283 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1fyh n SER 284 N -2.89 -5.48 -4.42 6.41 7.64 -0.86 -4.96 113.62 109.05 1fyh n SER 284 Ca -0.12 0.49 -0.44 0.00 1.01 0.00 0.00 58.87 59.81 1fyh n SER 284 Cb 0.60 -4.77 -0.08 0.00 -1.01 0.00 0.00 64.21 58.94 1fyh n SER 284 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1fyh s ASN 285 N -2.76 6.15 0.36 6.43 3.84 -0.42 -4.95 114.94 123.59 1fyh s ASN 285 Ca 0.00 -1.11 0.07 0.00 0.21 0.00 0.00 52.86 52.03 1fyh s ASN 285 Cb 0.00 -2.19 0.69 0.00 -0.55 0.00 0.00 41.25 39.20 1fyh s ASN 285 CO 0.00 -0.60 1.89 0.11 -2.79 0.00 0.00 177.10 175.71 1fyh h LYS 286 N 8.74 0.37 -0.27 0.43 1.57 -1.93 -1.61 116.57 123.87 1fyh h LYS 286 Ca -0.28 -0.09 -0.16 0.00 -1.87 0.00 0.00 60.65 58.25 1fyh h LYS 286 Cb 1.11 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 1fyh h LYS 286 CO 0.83 0.47 -0.49 -0.22 -0.57 0.00 0.00 179.45 179.47 1fyh h LYS 287 N 0.36 0.75 -0.30 3.15 3.64 -1.97 -1.09 116.57 121.11 1fyh h LYS 287 Ca 0.07 -0.44 -0.03 0.00 -1.27 0.00 0.00 60.65 58.98 1fyh h LYS 287 Cb 0.37 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1fyh h LYS 287 CO 0.02 1.07 0.07 -0.22 -2.27 0.00 0.00 179.45 178.11 1fyh h LYS 288 N 0.59 0.48 -0.92 1.90 3.64 -1.82 -1.21 116.57 119.24 1fyh h LYS 288 Ca 0.03 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1fyh h LYS 288 Cb 1.06 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.77 1fyh h LYS 288 CO 0.10 0.56 0.51 -0.09 -2.27 0.00 0.00 179.45 178.27 1fyh h ARG 289 N 0.32 1.27 -0.43 1.90 2.43 -1.23 -1.70 114.38 116.93 1fyh h ARG 289 Ca 0.09 -0.14 -0.11 0.00 -0.81 0.00 0.00 59.98 59.01 1fyh h ARG 289 Cb 0.30 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1fyh h ARG 289 CO 0.00 0.92 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.78 1fyh h ASP 290 N 1.28 0.89 -0.42 -3.80 3.32 -1.02 -1.86 116.42 114.80 1fyh h ASP 290 Ca 0.32 -0.38 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 1fyh h ASP 290 Cb 0.01 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 1fyh h ASP 290 CO -0.05 1.07 0.08 0.44 -1.72 0.00 0.00 179.24 179.06 1fyh h ASP 291 N 0.70 0.65 -0.83 6.45 3.32 -1.05 -2.13 116.42 123.54 1fyh h ASP 291 Ca 0.10 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 1fyh h ASP 291 Cb 0.71 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 40.05 1fyh h ASP 291 CO 0.05 0.73 0.51 0.15 -1.72 0.00 0.00 179.24 178.97 1fyh h PHE 292 N 0.55 1.09 -0.39 4.55 3.04 -1.27 -1.50 116.94 123.01 1fyh h PHE 292 Ca 0.13 0.00 -0.12 0.00 3.98 0.00 0.00 57.97 61.96 1fyh h PHE 292 Cb 0.35 -0.36 -0.01 0.00 2.56 0.00 0.00 35.95 38.48 1fyh h PHE 292 CO 0.02 0.72 -0.25 0.93 -2.02 0.00 0.00 178.31 177.71 1fyh h GLU 293 N 1.15 0.80 0.25 1.11 5.08 -1.14 -2.49 114.58 119.32 1fyh h GLU 293 Ca 0.30 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1fyh h GLU 293 Cb -0.06 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1fyh h GLU 293 CO -0.06 0.96 -0.12 -0.22 -1.00 0.00 0.00 179.01 178.58 1fyh h LYS 294 N 0.69 -0.32 -0.70 2.33 3.64 -1.00 -2.40 116.57 118.81 1fyh h LYS 294 Ca 0.09 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.61 1fyh h LYS 294 Cb 0.78 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.62 1fyh h LYS 294 CO 0.06 -0.15 0.46 -0.07 -2.27 0.00 0.00 179.45 177.49 1fyh h LEU 295 N -0.42 0.43 -1.22 5.20 3.38 -1.27 -2.23 115.31 119.19 1fyh h LEU 295 Ca -0.03 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1fyh h LEU 295 Cb 0.32 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1fyh h LEU 295 CO 0.06 0.24 0.00 0.35 0.09 0.00 0.00 178.44 179.18 1fyh n THR 296 N -4.48 0.07 -1.36 0.22 -2.24 -0.94 -4.28 114.28 101.26 1fyh n THR 296 Ca 0.12 -0.33 0.08 0.00 -2.27 0.00 0.00 64.05 61.64 1fyh n THR 296 Cb 0.43 0.66 0.14 0.00 -2.10 0.00 0.00 70.33 69.46 1fyh n THR 296 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1fyh n ASN 297 N 0.46 1.90 -4.76 3.42 3.02 -0.84 -5.04 115.26 113.42 1fyh n ASN 297 Ca 0.18 -3.17 -0.39 0.00 -0.03 0.00 0.00 54.58 51.17 1fyh n ASN 297 Cb 0.40 -0.43 -0.05 0.00 -0.61 0.00 0.00 39.78 39.09 1fyh n ASN 297 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1fyh s TYR 298 N -2.59 3.69 0.35 3.10 2.02 -1.24 -4.98 117.35 117.71 1fyh s TYR 298 Ca 0.31 1.78 -0.28 0.00 -0.37 0.00 0.00 57.07 58.51 1fyh s TYR 298 Cb 0.28 -3.08 -0.12 0.00 -0.40 0.00 0.00 41.96 38.65 1fyh s TYR 298 CO -0.01 -0.05 1.40 0.45 -1.57 0.00 0.00 175.55 175.77 1fyh n SER 299 N 0.95 3.32 0.05 2.29 2.88 -1.26 -4.88 113.62 116.98 1fyh n SER 299 Ca 0.00 1.21 0.12 0.00 -1.33 0.00 0.00 58.87 58.87 1fyh n SER 299 Cb 0.47 -1.56 0.09 0.00 -0.75 0.00 0.00 64.21 62.47 1fyh n SER 299 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1fyh n VAL 300 N 0.51 0.28 -0.08 2.46 0.31 -1.26 -4.43 118.33 116.12 1fyh n VAL 300 Ca 0.03 -0.28 -0.09 0.00 -0.01 0.00 0.00 64.34 64.00 1fyh n VAL 300 Cb 0.37 0.02 -0.12 0.00 -0.91 0.00 0.00 33.84 33.20 1fyh n VAL 300 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1fyh n THR 301 N -2.08 1.13 -1.66 2.52 -2.24 -1.26 -4.97 114.28 105.73 1fyh n THR 301 Ca 0.02 -0.66 -0.55 0.00 -2.27 0.00 0.00 64.05 60.59 1fyh n THR 301 Cb 0.45 -0.65 -0.07 0.00 -2.10 0.00 0.00 70.33 67.95 1fyh n THR 301 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1fyh n ASP 302 N -2.67 2.54 0.24 3.42 -0.08 -1.26 -4.83 116.55 113.91 1fyh n ASP 302 Ca -0.28 0.95 0.08 0.00 -1.51 0.00 0.00 54.79 54.03 1fyh n ASP 302 Cb 1.02 -1.20 0.59 0.00 2.34 0.00 0.00 41.12 43.87 1fyh n ASP 302 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1fyh h LEU 303 N 8.44 0.00 -0.73 -2.67 3.38 -1.96 -1.51 115.31 120.26 1fyh h LEU 303 Ca -0.43 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.43 1fyh h LEU 303 Cb 1.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 1fyh h LEU 303 CO 0.97 0.15 -0.52 0.78 0.09 0.00 0.00 178.44 179.91 1fyh h ASN 304 N 0.00 0.00 -0.20 -0.43 -0.26 -1.99 -1.76 115.58 110.94 1fyh h ASN 304 Ca -0.00 0.00 -0.21 0.00 -0.56 0.00 0.00 56.30 55.53 1fyh h ASN 304 Cb 0.29 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.55 1fyh h ASN 304 CO 0.02 0.52 -0.68 0.58 -1.06 0.00 0.00 177.43 176.81 1fyh h VAL 305 N 0.00 1.28 -0.72 2.81 2.07 -1.66 -2.32 116.25 117.71 1fyh h VAL 305 Ca -0.01 -1.87 -0.02 0.00 0.82 0.00 0.00 66.70 65.63 1fyh h VAL 305 Cb 1.07 1.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.68 1fyh h VAL 305 CO 0.07 0.60 0.39 1.56 0.02 0.00 0.00 177.57 180.20 1fyh h GLN 306 N 0.56 1.01 -0.73 1.57 4.20 -1.26 -1.94 115.11 118.52 1fyh h GLN 306 Ca -0.03 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.52 1fyh h GLN 306 Cb 1.30 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.85 1fyh h GLN 306 CO 0.14 0.76 0.33 -0.09 -0.67 0.00 0.00 178.83 179.30 1fyh h ARG 307 N 1.00 1.07 -0.36 1.46 2.43 -1.32 -1.66 114.38 117.01 1fyh h ARG 307 Ca 0.25 -0.17 -0.09 0.00 -0.81 0.00 0.00 59.98 59.16 1fyh h ARG 307 Cb 0.05 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 1fyh h ARG 307 CO -0.04 0.86 -0.16 0.87 -1.51 0.00 0.00 179.97 179.98 1fyh h LYS 308 N 1.04 0.65 -0.47 0.20 1.57 -1.15 -1.78 116.57 116.62 1fyh h LYS 308 Ca 0.25 -0.22 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1fyh h LYS 308 Cb 0.16 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1fyh h LYS 308 CO -0.03 0.78 0.08 0.00 -0.57 0.00 0.00 179.45 179.71 1fyh h ALA 309 N 1.24 0.62 -0.40 3.86 0.00 -1.00 -1.35 119.26 122.23 1fyh h ALA 309 Ca 0.10 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1fyh h ALA 309 Cb 0.61 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1fyh h ALA 309 CO 0.04 0.35 -0.08 0.82 0.00 0.00 0.00 179.25 180.38 1fyh h ILE 310 N 0.64 1.24 -0.67 0.00 1.08 -1.20 -2.08 117.51 116.53 1fyh h ILE 310 Ca 0.14 -1.07 -0.02 0.00 -0.39 0.00 0.00 64.86 63.53 1fyh h ILE 310 Cb 0.38 1.03 -0.03 0.00 -3.07 0.00 0.00 36.82 35.13 1fyh h ILE 310 CO 0.01 0.36 0.34 -0.74 -0.69 0.00 0.00 178.15 177.43 1fyh h HIS 311 N 0.63 0.94 -0.00 1.37 2.76 -1.05 -2.91 115.15 116.89 1fyh h HIS 311 Ca 0.12 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 1fyh h HIS 311 Cb 0.51 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.18 1fyh h HIS 311 CO 0.02 0.69 -0.05 0.39 -1.30 0.00 0.00 177.93 177.68 1fyh n GLU 312 N -4.49 0.46 -0.14 5.26 1.02 -0.53 -4.40 120.64 117.81 1fyh n GLU 312 Ca 0.05 -0.07 -0.05 0.00 -0.02 0.00 0.00 57.16 57.07 1fyh n GLU 312 Cb 0.11 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.04 1fyh n GLU 312 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1fyh h LEU 313 N 0.16 -0.83 -0.70 -4.62 5.85 -1.18 -1.84 115.31 112.15 1fyh h LEU 313 Ca 0.00 0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1fyh h LEU 313 Cb 0.33 0.43 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 1fyh h LEU 313 CO 0.00 -0.26 0.43 0.40 -0.34 0.00 0.00 178.44 178.67 1fyh h ILE 314 N -0.14 1.08 0.00 4.05 2.04 -1.81 -0.48 117.51 122.24 1fyh h ILE 314 Ca 0.21 -0.29 -0.08 0.00 1.00 0.00 0.00 64.86 65.71 1fyh h ILE 314 Cb 0.48 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1fyh h ILE 314 CO -0.55 0.15 -0.37 1.56 0.00 0.00 0.00 178.15 178.94 1fyh h GLN 315 N 0.84 0.00 -0.10 2.37 4.20 -1.78 -2.20 115.11 118.44 1fyh h GLN 315 Ca 0.29 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.85 1fyh h GLN 315 Cb 0.05 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.83 1fyh h GLN 315 CO -0.12 0.37 -0.52 0.28 -0.67 0.00 0.00 178.83 178.17 1fyh h VAL 316 N 0.00 1.36 -0.85 -0.54 2.07 -0.66 -3.24 116.25 114.39 1fyh h VAL 316 Ca -0.00 -1.84 -0.02 0.00 0.82 0.00 0.00 66.70 65.66 1fyh h VAL 316 Cb 0.86 2.19 -0.04 0.00 -1.52 0.00 0.00 31.29 32.78 1fyh h VAL 316 CO 0.05 0.55 0.45 0.24 0.02 0.00 0.00 177.57 178.88 1fyh h MET 317 N 0.14 1.19 0.00 1.57 2.86 -0.96 -1.81 114.93 117.93 1fyh h MET 317 Ca -0.04 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 1fyh h MET 317 Cb 1.16 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.59 1fyh h MET 317 CO 0.11 0.88 0.02 0.00 1.06 0.00 0.00 176.91 178.98 1fyh h ALA 318 N 1.30 1.02 -0.11 6.32 0.00 -1.43 -2.47 119.26 123.89 1fyh h ALA 318 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1fyh h ALA 318 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1fyh h ALA 318 CO -0.05 -0.02 0.00 0.39 0.00 0.00 0.00 179.25 179.57 1fyh n GLU 319 N -3.02 2.39 0.13 0.00 -0.58 -0.70 -4.74 120.64 114.13 1fyh n GLU 319 Ca -0.03 -2.21 0.00 0.00 -0.42 0.00 0.00 57.16 54.51 1fyh n GLU 319 Cb 0.09 -1.37 0.04 0.00 -0.57 0.00 0.00 31.44 29.63 1fyh n GLU 319 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1fyh h LEU 320 N 0.68 0.00-10.26 -4.62 5.85 -1.23 -3.46 115.31 102.27 1fyh h LEU 320 Ca 0.00 0.00 -0.49 0.00 0.84 0.00 0.00 57.88 58.23 1fyh h LEU 320 Cb 0.88 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.95 1fyh h LEU 320 CO 0.04 0.61 0.31 -0.44 -0.34 0.00 0.00 178.44 178.63 1fyh s SER 321 N -6.53 6.41 0.21 1.25 0.01 -1.26 -4.56 113.70 109.23 1fyh s SER 321 Ca 0.02 1.36 -0.30 0.00 1.31 0.00 0.00 55.95 58.34 1fyh s SER 321 Cb 0.09 -2.43 -0.09 0.00 0.21 0.00 0.00 66.02 63.80 1fyh s SER 321 CO 0.76 -0.66 1.27 -2.16 0.41 0.00 0.00 173.24 172.86 1fyh s PRO 322 N -4.53 4.42 0.56 12.44 0.04 -1.26 -5.01 135.00 141.67 1fyh s PRO 322 Ca 0.55 2.01 -0.11 0.00 0.04 0.00 0.00 61.00 63.50 1fyh s PRO 322 Cb -0.10 -3.20 -0.05 0.00 0.04 0.00 0.00 34.50 31.19 1fyh s PRO 322 CO 0.41 -0.19 0.95 0.00 0.04 0.00 0.00 177.00 178.22 1fyh s ALA 323 N -0.08 3.18 0.00 8.56 0.00 -1.26 -5.21 121.76 126.95 1fyh s ALA 323 Ca 0.55 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.36 1fyh s ALA 323 Cb -0.36 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1fyh s ALA 323 CO 0.39 -0.50 0.00 0.00 0.00 0.00 0.00 175.76 175.65