#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 3.27 0.19 2.12 0.52 -0.75 -2.89 118.95 121.40 2fyh s ARG 2 Ca 0.00 -1.70 -0.05 0.00 -0.52 0.00 0.00 55.73 53.45 2fyh s ARG 2 Cb 0.00 -4.42 -0.06 0.00 0.52 0.00 0.00 34.95 30.99 2fyh s ARG 2 CO 0.00 -1.51 0.44 0.00 0.02 0.00 0.00 175.30 174.25 2fyh s ALA 3 N 2.00 3.73 -0.20 2.13 0.00 -0.95 0.97 121.76 129.43 2fyh s ALA 3 Ca 0.16 -0.54 -0.22 0.00 0.00 0.00 0.00 51.96 51.36 2fyh s ALA 3 Cb -0.18 -2.20 0.06 0.00 0.00 0.00 0.00 23.12 20.81 2fyh s ALA 3 CO -0.00 0.55 0.61 -0.59 0.00 0.00 0.00 175.76 176.32 2fyh s PHE 4 N -1.78 -0.65 -0.33 0.00 -0.12 -0.47 -2.51 117.98 112.12 2fyh s PHE 4 Ca 0.42 1.53 -0.17 0.00 -0.05 0.00 0.00 56.93 58.67 2fyh s PHE 4 Cb -0.12 0.25 -0.01 0.00 -0.63 0.00 0.00 43.02 42.51 2fyh s PHE 4 CO 0.25 -0.36 0.46 0.96 -0.05 0.00 0.00 175.22 176.48 2fyh s ILE 5 N 0.08 5.08 0.30 -4.49 -4.36 -1.06 -2.00 121.20 114.76 2fyh s ILE 5 Ca -0.02 0.35 0.09 0.00 -0.26 0.00 0.00 60.65 60.81 2fyh s ILE 5 Cb -0.04 -3.88 -0.04 0.00 1.25 0.00 0.00 42.46 39.75 2fyh s ILE 5 CO 0.02 -0.11 0.07 0.00 0.24 0.00 0.00 174.94 175.17 2fyh s ALA 6 N 2.25 3.34 -0.21 2.27 0.00 0.17 -0.37 121.76 129.22 2fyh s ALA 6 Ca 0.17 -1.74 -0.07 0.00 0.00 0.00 0.00 51.96 50.32 2fyh s ALA 6 Cb -0.16 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.18 2fyh s ALA 6 CO 0.12 0.14 0.04 0.42 0.00 0.00 0.00 175.76 176.49 2fyh s ILE 7 N -2.37 4.36 0.03 0.00 1.01 0.10 -1.38 121.20 122.95 2fyh s ILE 7 Ca 0.35 -0.17 -0.35 0.00 0.00 0.00 0.00 60.65 60.47 2fyh s ILE 7 Cb -0.04 -2.99 -0.14 0.00 0.01 0.00 0.00 42.46 39.30 2fyh s ILE 7 CO 0.21 0.41 1.62 -0.90 0.00 0.00 0.00 174.94 176.29 2fyh n ASP 8 N 4.18 2.78 -4.21 3.58 5.75 -1.26 -3.29 116.55 124.08 2fyh n ASP 8 Ca -0.17 1.06 -0.41 0.00 -0.01 0.00 0.00 54.79 55.26 2fyh n ASP 8 Cb 0.52 -1.33 -0.05 0.00 -1.03 0.00 0.00 41.12 39.24 2fyh n ASP 8 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 2fyh s VAL 9 N 1.96 4.87 0.45 2.12 -7.23 -1.26 -4.98 120.40 116.33 2fyh s VAL 9 Ca 0.86 -3.12 -0.14 0.00 -1.81 0.00 0.00 61.98 57.77 2fyh s VAL 9 Cb -0.79 -4.03 -0.12 0.00 0.56 0.00 0.00 36.38 32.00 2fyh s VAL 9 CO 0.47 -1.03 -0.16 -0.24 -0.31 0.00 0.00 175.10 173.82 2fyh n SER 10 N 3.21 -3.16 -0.33 4.85 2.88 -1.26 -3.98 113.62 115.83 2fyh n SER 10 Ca 0.16 0.48 0.21 0.00 -1.33 0.00 0.00 58.87 58.39 2fyh n SER 10 Cb 0.41 -0.67 0.40 0.00 -0.75 0.00 0.00 64.21 63.60 2fyh n SER 10 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2fyh h GLU 11 N -0.10 0.05 -0.98 -1.46 5.08 -1.97 0.27 114.58 115.47 2fyh h GLU 11 Ca -0.33 -0.00 0.27 0.00 -1.00 0.00 0.00 59.36 58.29 2fyh h GLU 11 Cb 1.15 -0.01 -0.18 0.00 0.50 0.00 0.00 28.75 30.20 2fyh h GLU 11 CO 0.32 0.03 0.00 -1.13 -1.00 0.00 0.00 179.01 177.23 2fyh n SER 12 N -5.35 -0.13 -0.02 1.42 3.41 -1.26 -0.34 113.62 111.35 2fyh n SER 12 Ca 0.29 1.67 -0.09 0.00 -0.26 0.00 0.00 58.87 60.48 2fyh n SER 12 Cb 0.95 -0.60 -0.07 0.00 -0.26 0.00 0.00 64.21 64.22 2fyh n SER 12 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2fyh h VAL 13 N 0.00 0.93 -0.88 -3.33 2.07 -0.71 -3.14 116.25 111.19 2fyh h VAL 13 Ca 0.59 -1.54 0.14 0.00 0.82 0.00 0.00 66.70 66.71 2fyh h VAL 13 Cb 1.19 1.70 -0.15 0.00 -1.52 0.00 0.00 31.29 32.51 2fyh h VAL 13 CO -0.93 0.29 -0.36 0.03 0.02 0.00 0.00 177.57 176.63 2fyh h ARG 14 N -0.96 -0.04 -0.88 1.57 3.08 -0.86 0.75 114.38 117.03 2fyh h ARG 14 Ca -0.01 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.10 2fyh h ARG 14 Cb 0.53 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.54 2fyh h ARG 14 CO 0.01 -0.03 0.58 -0.44 -1.07 0.00 0.00 179.97 179.02 2fyh h ASP 15 N -0.05 0.90 0.24 7.04 5.19 -0.82 -1.28 116.42 127.65 2fyh h ASP 15 Ca 0.33 -0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.72 2fyh h ASP 15 Cb 0.59 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.91 2fyh h ASP 15 CO -0.90 0.60 -0.13 0.00 -3.12 0.00 0.00 179.24 175.69 2fyh h ALA 16 N 1.51 -1.06 -0.89 3.45 0.00 0.52 -0.22 119.26 122.56 2fyh h ALA 16 Ca 0.37 -0.07 0.19 0.00 0.00 0.00 0.00 54.91 55.40 2fyh h ALA 16 Cb 0.13 0.17 -0.11 0.00 0.00 0.00 0.00 17.79 17.98 2fyh h ALA 16 CO -0.13 -1.04 0.43 -0.07 0.00 0.00 0.00 179.25 178.44 2fyh h LEU 17 N -0.34 0.44 -1.25 0.00 3.38 -1.20 0.23 115.31 116.56 2fyh h LEU 17 Ca -0.03 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2fyh h LEU 17 Cb 0.27 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 2fyh h LEU 17 CO 0.05 0.09 0.40 0.58 0.09 0.00 0.00 178.44 179.66 2fyh h VAL 18 N 0.50 1.19 -0.97 1.22 2.07 -1.13 -2.26 116.25 116.88 2fyh h VAL 18 Ca 0.53 -0.42 0.11 0.00 0.82 0.00 0.00 66.70 67.73 2fyh h VAL 18 Cb 0.92 0.24 -0.08 0.00 -1.52 0.00 0.00 31.29 30.85 2fyh h VAL 18 CO -0.46 0.20 0.60 -0.09 0.02 0.00 0.00 177.57 177.84 2fyh h ARG 19 N 0.93 0.96 -0.13 1.57 2.43 0.13 -2.05 114.38 118.23 2fyh h ARG 19 Ca 0.24 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 2fyh h ARG 19 Cb -0.03 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.30 2fyh h ARG 19 CO -0.05 0.63 -0.03 0.00 -1.51 0.00 0.00 179.97 179.02 2fyh h ALA 20 N 1.51 0.17 -0.01 2.80 0.00 -1.31 -3.24 119.26 119.19 2fyh h ALA 20 Ca 0.47 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.19 2fyh h ALA 20 Cb 0.41 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 2fyh h ALA 20 CO -0.25 -0.09 -0.46 1.96 0.00 0.00 0.00 179.25 180.41 2fyh h GLN 21 N -0.06 -0.58 -1.52 0.00 4.20 -1.18 0.18 115.11 116.14 2fyh h GLN 21 Ca 0.03 0.04 0.45 0.00 0.06 0.00 0.00 58.65 59.24 2fyh h GLN 21 Cb 0.43 0.13 -0.09 0.00 0.30 0.00 0.00 27.48 28.26 2fyh h GLN 21 CO 0.01 -0.39 1.06 0.22 -0.67 0.00 0.00 178.83 179.06 2fyh h ASP 22 N -0.60 0.10 0.25 1.46 3.58 -1.45 0.72 116.42 120.48 2fyh h ASP 22 Ca 0.04 0.05 -0.34 0.00 0.42 0.00 0.00 57.03 57.19 2fyh h ASP 22 Cb 0.68 0.04 0.01 0.00 1.72 0.00 0.00 39.33 41.78 2fyh h ASP 22 CO -0.34 -0.05 -1.68 0.22 -2.88 0.00 0.00 179.24 174.52 2fyh h TYR 23 N 0.05 0.72 -0.28 0.28 3.20 -0.93 -3.36 116.97 116.66 2fyh h TYR 23 Ca 0.78 -0.52 0.06 0.00 3.14 0.00 0.00 58.73 62.19 2fyh h TYR 23 Cb 2.88 -0.03 -0.06 0.00 1.54 0.00 0.00 36.73 41.06 2fyh h TYR 23 CO -0.00 1.61 -0.12 0.82 -1.64 0.00 0.00 178.16 178.83 2fyh h ILE 24 N 0.11 0.61 -3.31 1.81 2.04 0.32 -3.48 117.51 115.60 2fyh h ILE 24 Ca -0.31 0.00 0.24 0.00 1.00 0.00 0.00 64.86 65.78 2fyh h ILE 24 Cb 2.10 0.61 -0.13 0.00 -0.74 0.00 0.00 36.82 38.65 2fyh h ILE 24 CO 0.19 0.00 -1.11 0.61 0.00 0.00 0.00 178.15 177.84 2fyh n GLY 25 N -1.29 -3.52 2.32 5.37 0.00 -0.71 -4.81 105.19 102.55 2fyh n GLY 25 Ca -0.00 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.82 2fyh n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fyh n SER 26 N -3.74 3.84 -0.02 1.61 3.41 -1.26 -4.79 113.62 112.67 2fyh n SER 26 Ca -0.07 -3.23 -0.01 0.00 -0.26 0.00 0.00 58.87 55.30 2fyh n SER 26 Cb 0.59 -0.40 -0.00 0.00 -0.26 0.00 0.00 64.21 64.13 2fyh n SER 26 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2fyh h LYS 27 N 2.37 -0.06 0.06 4.33 1.57 -2.01 -3.40 116.57 119.43 2fyh h LYS 27 Ca 0.20 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.83 2fyh h LYS 27 Cb 1.39 0.01 0.02 0.00 0.08 0.00 0.00 32.23 33.73 2fyh h LYS 27 CO 0.60 -0.04 -0.66 1.05 -0.57 0.00 0.00 179.45 179.83 2fyh h GLU 28 N -0.87 0.34 -6.26 3.15 -0.00 -1.95 -3.46 114.58 105.54 2fyh h GLU 28 Ca -0.01 -0.45 -0.45 0.00 -0.00 0.00 0.00 59.36 58.46 2fyh h GLU 28 Cb 0.05 0.15 -0.00 0.00 -0.00 0.00 0.00 28.75 28.94 2fyh h GLU 28 CO 0.01 1.15 -0.39 0.00 -0.00 0.00 0.00 179.01 179.78 2fyh s ALA 29 N -2.87 4.08 -0.48 1.06 0.00 -1.26 -3.68 121.76 118.60 2fyh s ALA 29 Ca -0.14 -1.36 0.04 0.00 0.00 0.00 0.00 51.96 50.50 2fyh s ALA 29 Cb 0.02 -1.68 0.12 0.00 0.00 0.00 0.00 23.12 21.59 2fyh s ALA 29 CO 0.82 0.10 0.22 0.21 0.00 0.00 0.00 175.76 177.10 2fyh s LYS 30 N -4.07 1.88 -0.14 0.00 2.47 -0.02 -4.47 119.74 115.39 2fyh s LYS 30 Ca 0.40 -2.46 -0.00 0.00 -1.56 0.00 0.00 55.97 52.34 2fyh s LYS 30 Cb -0.09 -3.30 -0.01 0.00 -1.46 0.00 0.00 37.83 32.96 2fyh s LYS 30 CO 0.30 -1.07 -0.13 0.42 0.16 0.00 0.00 175.35 175.03 2fyh s ILE 31 N -0.03 3.03 -1.07 5.43 1.01 -1.26 -1.28 121.20 127.02 2fyh s ILE 31 Ca 0.16 -0.66 -0.15 0.00 0.00 0.00 0.00 60.65 59.99 2fyh s ILE 31 Cb -0.24 -2.28 0.17 0.00 0.01 0.00 0.00 42.46 40.11 2fyh s ILE 31 CO -0.02 0.52 1.26 -0.75 0.00 0.00 0.00 174.94 175.95 2fyh s LYS 32 N 0.48 3.88 1.30 2.79 2.36 -0.75 -4.92 119.74 124.88 2fyh s LYS 32 Ca -0.09 -2.30 -0.20 0.00 -2.55 0.00 0.00 55.97 50.83 2fyh s LYS 32 Cb -0.16 -4.94 0.31 0.00 -1.05 0.00 0.00 37.83 31.99 2fyh s LYS 32 CO 0.04 -1.71 0.70 1.19 1.55 0.00 0.00 175.35 177.12 2fyh n PHE 33 N 5.71 -3.19 -4.41 4.03 3.72 -1.26 -3.68 117.46 118.37 2fyh n PHE 33 Ca 0.30 -0.50 -0.29 0.00 -0.05 0.00 0.00 57.45 56.90 2fyh n PHE 33 Cb 0.45 -1.37 -0.13 0.00 -0.94 0.00 0.00 39.48 37.49 2fyh n PHE 33 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2fyh s VAL 34 N -2.11 2.25 1.01 -4.37 1.01 -0.87 -4.89 120.40 112.42 2fyh s VAL 34 Ca 0.56 -1.74 -0.19 0.00 0.00 0.00 0.00 61.98 60.61 2fyh s VAL 34 Cb -0.11 -1.98 -0.08 0.00 0.00 0.00 0.00 36.38 34.21 2fyh s VAL 34 CO 0.48 0.10 -0.58 -0.62 0.00 0.00 0.00 175.10 174.49 2fyh n GLU 35 N 0.96 -0.30 -0.06 2.72 -0.58 -1.26 -4.86 120.64 117.26 2fyh n GLU 35 Ca -0.18 -0.08 -0.14 0.00 -0.42 0.00 0.00 57.16 56.34 2fyh n GLU 35 Cb 0.53 -1.30 -0.07 0.00 -0.57 0.00 0.00 31.44 30.03 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 -1.29 0.53 -0.95 3.49 -0.00 -1.99 -3.00 114.38 111.17 2fyh h ARG 36 Ca -0.44 -0.35 -0.04 0.00 -0.50 0.00 0.00 59.98 58.65 2fyh h ARG 36 Cb 1.33 0.04 -0.02 0.00 0.00 0.00 0.00 29.97 31.32 2fyh h ARG 36 CO 0.27 0.96 0.05 0.39 0.00 0.00 0.00 179.97 181.64 2fyh n GLU 37 N -4.32 1.52 -0.08 0.04 1.02 -1.26 -3.16 120.64 114.40 2fyh n GLU 37 Ca -0.06 -0.56 0.02 0.00 -0.02 0.00 0.00 57.16 56.53 2fyh n GLU 37 Cb 0.50 -1.47 0.03 0.00 -0.02 0.00 0.00 31.44 30.47 2fyh n GLU 37 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2fyh n ASN 38 N 0.15 1.26 -0.95 1.62 3.02 -1.13 -4.68 115.26 114.55 2fyh n ASN 38 Ca 0.07 -1.92 0.11 0.00 -0.03 0.00 0.00 54.58 52.81 2fyh n ASN 38 Cb 0.54 -0.10 0.27 0.00 -0.61 0.00 0.00 39.78 39.87 2fyh n ASN 38 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2fyh n PHE 39 N -0.47 0.42 -1.65 3.10 3.72 -1.19 -4.86 117.46 116.52 2fyh n PHE 39 Ca 0.03 -0.21 -0.50 0.00 -0.05 0.00 0.00 57.45 56.72 2fyh n PHE 39 Cb 0.45 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.93 2fyh n PHE 39 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 176.76 174.32 2fyh n HIS 40 N 1.08 1.99 -1.68 1.38 1.44 -1.26 -4.83 115.22 113.34 2fyh n HIS 40 Ca 0.18 0.39 -0.45 0.00 -2.01 0.00 0.00 57.72 55.83 2fyh n HIS 40 Cb 0.50 -2.48 -0.04 0.00 0.12 0.00 0.00 29.99 28.10 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 3.61 0.47 -2.39 0.61 5.41 -1.21 -4.67 119.36 121.19 2fyh n ILE 41 Ca 0.20 -0.08 -0.36 0.00 1.00 0.00 0.00 62.75 63.50 2fyh n ILE 41 Cb 0.23 -1.97 -0.04 0.00 -0.71 0.00 0.00 39.64 37.15 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 3.28 3.78 0.15 1.39 2.01 -1.26 0.02 115.64 125.01 2fyh s THR 42 Ca 0.87 -0.74 -0.29 0.00 0.31 0.00 0.00 61.69 61.84 2fyh s THR 42 Cb -0.58 -4.74 -0.03 0.00 0.01 0.00 0.00 72.50 67.16 2fyh s THR 42 CO 0.44 -1.61 1.56 0.25 -0.69 0.00 0.00 174.62 174.56 2fyh h LEU 43 N 14.48 -1.62 -7.39 4.42 6.46 -1.02 -3.44 115.31 127.21 2fyh h LEU 43 Ca 0.19 0.24 -0.11 0.00 -0.12 0.00 0.00 57.88 58.08 2fyh h LEU 43 Cb 0.99 0.70 -0.21 0.00 -0.73 0.00 0.00 40.66 41.41 2fyh h LEU 43 CO 1.36 -0.37 -0.19 -0.75 -0.62 0.00 0.00 178.44 177.87 2fyh s LYS 44 N -5.77 0.69 -0.17 1.25 2.20 -1.07 -4.90 119.74 111.97 2fyh s LYS 44 Ca -0.14 0.05 -0.10 0.00 -0.36 0.00 0.00 55.97 55.42 2fyh s LYS 44 Cb 0.11 0.31 -0.05 0.00 -1.51 0.00 0.00 37.83 36.70 2fyh s LYS 44 CO 0.64 -0.18 0.16 0.12 -0.36 0.00 0.00 175.35 175.74 2fyh s PHE 45 N -0.95 3.48 -0.16 4.03 5.36 -1.26 -2.55 117.98 125.94 2fyh s PHE 45 Ca -0.10 0.44 -0.14 0.00 -0.96 0.00 0.00 56.93 56.18 2fyh s PHE 45 Cb -0.04 -2.13 -0.06 0.00 -0.34 0.00 0.00 43.02 40.45 2fyh s PHE 45 CO 0.04 0.42 -0.28 1.28 -1.46 0.00 0.00 175.22 175.22 2fyh n LEU 46 N 3.04 1.72 0.00 6.12 4.77 -1.13 -5.03 117.00 126.49 2fyh n LEU 46 Ca -0.16 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2fyh n LEU 46 Cb 0.53 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2fyh n LEU 46 CO 0.36 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2fyh n GLY 47 N 1.78 0.98 3.72 -0.72 0.00 -1.04 -4.93 105.19 104.97 2fyh n GLY 47 Ca -0.21 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 2fyh n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fyh s GLU 48 N 0.00 4.29 -0.02 1.61 0.41 -1.25 -2.23 118.70 121.51 2fyh s GLU 48 Ca 0.00 2.15 -0.08 0.00 -0.41 0.00 0.00 54.97 56.64 2fyh s GLU 48 Cb 0.00 -3.22 0.01 0.00 -1.78 0.00 0.00 34.13 29.14 2fyh s GLU 48 CO 0.00 -0.48 0.17 0.42 -0.49 0.00 0.00 175.26 174.88 2fyh s ILE 49 N 1.09 0.05 -0.01 -1.63 1.01 -1.14 -4.99 121.20 115.58 2fyh s ILE 49 Ca 0.66 -0.45 -0.16 0.00 0.00 0.00 0.00 60.65 60.70 2fyh s ILE 49 Cb -0.39 -0.39 -0.06 0.00 0.01 0.00 0.00 42.46 41.63 2fyh s ILE 49 CO 0.31 -0.25 0.43 0.42 0.00 0.00 0.00 174.94 175.85 2fyh s THR 50 N -0.90 5.03 0.43 2.92 -4.23 -1.26 -4.73 115.64 112.91 2fyh s THR 50 Ca -0.10 0.88 0.31 0.00 -1.18 0.00 0.00 61.69 61.59 2fyh s THR 50 Cb -0.05 -3.74 0.48 0.00 1.34 0.00 0.00 72.50 70.52 2fyh s THR 50 CO 0.01 0.54 1.57 1.21 -0.54 0.00 0.00 174.62 177.41 2fyh n GLU 51 N 2.11 -0.04 0.02 3.99 2.13 -1.26 0.44 120.64 128.03 2fyh n GLU 51 Ca -0.13 1.28 -0.12 0.00 0.66 0.00 0.00 57.16 58.85 2fyh n GLU 51 Cb 0.52 -2.48 -0.09 0.00 0.27 0.00 0.00 31.44 29.66 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 -0.10 -0.70 5.31 4.39 -2.04 -3.23 114.58 118.21 2fyh h GLU 52 Ca 0.88 0.01 0.04 0.00 0.34 0.00 0.00 59.36 60.62 2fyh h GLU 52 Cb 2.74 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 31.38 2fyh h GLU 52 CO -0.52 0.38 0.46 1.96 -1.16 0.00 0.00 179.01 180.14 2fyh h GLN 53 N -0.65 0.82 -0.87 2.33 1.08 -0.40 -2.96 115.11 114.46 2fyh h GLN 53 Ca -0.01 -0.05 0.11 0.00 -1.45 0.00 0.00 58.65 57.25 2fyh h GLN 53 Cb 0.53 -0.18 -0.12 0.00 -0.05 0.00 0.00 27.48 27.66 2fyh h GLN 53 CO 0.02 0.54 -0.43 0.00 -0.95 0.00 0.00 178.83 178.01 2fyh n ALA 54 N -2.44 -0.34 -0.17 3.87 0.00 0.57 0.49 120.51 122.50 2fyh n ALA 54 Ca 0.09 0.80 -0.02 0.00 0.00 0.00 0.00 53.44 54.31 2fyh n ALA 54 Cb 0.13 -0.25 0.05 0.00 0.00 0.00 0.00 19.45 19.38 2fyh n ALA 54 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2fyh h GLU 55 N 0.00 0.03 -0.46 0.00 4.11 -1.66 -2.53 114.58 114.08 2fyh h GLU 55 Ca 0.22 -0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.69 2fyh h GLU 55 Cb 0.44 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.62 2fyh h GLU 55 CO -0.84 0.02 -0.35 1.49 0.07 0.00 0.00 179.01 179.40 2fyh h GLU 56 N 0.04 -0.09 -0.65 1.06 4.57 -0.09 -1.31 114.58 118.11 2fyh h GLU 56 Ca 0.26 0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.52 2fyh h GLU 56 Cb 0.39 0.02 -0.11 0.00 -0.16 0.00 0.00 28.75 28.90 2fyh h GLU 56 CO -0.50 -0.06 -0.51 0.82 -1.18 0.00 0.00 179.01 177.57 2fyh h ILE 57 N -0.10 0.03 -0.37 2.32 5.03 -1.23 -2.02 117.51 121.17 2fyh h ILE 57 Ca 0.08 0.00 0.04 0.00 -0.12 0.00 0.00 64.86 64.85 2fyh h ILE 57 Cb 0.29 0.03 -0.05 0.00 -3.03 0.00 0.00 36.82 34.06 2fyh h ILE 57 CO -0.49 0.00 -0.28 0.11 -0.68 0.00 0.00 178.15 176.81 2fyh h LYS 58 N -0.22 -0.08 -0.76 2.37 1.57 -1.09 -1.71 116.57 116.66 2fyh h LYS 58 Ca 0.15 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.01 2fyh h LYS 58 Cb 0.54 0.02 -0.10 0.00 0.08 0.00 0.00 32.23 32.77 2fyh h LYS 58 CO -0.74 -0.05 -0.50 0.87 -0.57 0.00 0.00 179.45 178.46 2fyh h LYS 59 N -0.08 -0.06 -0.93 3.15 1.79 -0.67 0.19 116.57 119.96 2fyh h LYS 59 Ca 0.06 0.00 0.21 0.00 -2.18 0.00 0.00 60.65 58.74 2fyh h LYS 59 Cb 0.24 0.01 -0.18 0.00 -1.58 0.00 0.00 32.23 30.73 2fyh h LYS 59 CO -0.39 -0.04 -0.16 -0.89 -1.08 0.00 0.00 179.45 176.89 2fyh n ILE 60 N -4.93 -0.39 0.20 1.86 5.41 -0.69 0.09 119.36 120.90 2fyh n ILE 60 Ca 0.01 2.11 -0.15 0.00 1.00 0.00 0.00 62.75 65.72 2fyh n ILE 60 Cb 0.23 -2.96 -0.08 0.00 -0.71 0.00 0.00 39.64 36.12 2fyh n ILE 60 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2fyh h LEU 61 N 0.00 -0.37 -1.24 1.39 3.38 -0.12 -1.35 115.31 117.00 2fyh h LEU 61 Ca 0.48 0.01 0.45 0.00 0.09 0.00 0.00 57.88 58.92 2fyh h LEU 61 Cb 0.81 0.10 -0.15 0.00 0.09 0.00 0.00 40.66 41.51 2fyh h LEU 61 CO -0.94 -0.26 0.76 1.21 0.09 0.00 0.00 178.44 179.30 2fyh n GLU 62 N -5.28 -0.04 -0.06 1.13 4.07 0.11 0.37 120.64 120.94 2fyh n GLU 62 Ca -0.10 1.29 -0.06 0.00 -0.06 0.00 0.00 57.16 58.23 2fyh n GLU 62 Cb 0.19 -2.46 -0.05 0.00 -0.06 0.00 0.00 31.44 29.07 2fyh n GLU 62 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2fyh h LYS 63 N 0.00 0.00 0.26 5.31 1.57 -1.12 -3.25 116.57 119.34 2fyh h LYS 63 Ca 0.86 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.64 2fyh h LYS 63 Cb 2.61 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.91 2fyh h LYS 63 CO -0.57 0.36 -0.27 0.82 -0.57 0.00 0.00 179.45 179.22 2fyh h ILE 64 N -1.00 0.00 -0.08 1.86 2.04 0.21 0.48 117.51 121.01 2fyh h ILE 64 Ca -0.01 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.87 2fyh h ILE 64 Cb 0.40 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.48 2fyh h ILE 64 CO -0.01 0.00 0.71 0.00 0.00 0.00 0.00 178.15 178.85 2fyh h ALA 65 N -1.30 1.79 0.00 1.87 0.00 -0.30 1.43 119.26 122.75 2fyh h ALA 65 Ca -0.03 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.57 2fyh h ALA 65 Cb 0.46 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 2fyh h ALA 65 CO -0.04 -0.76 -1.99 1.17 0.00 0.00 0.00 179.25 177.64 2fyh n LYS 66 N -2.77 0.66 0.16 0.00 4.81 -0.38 -4.07 118.16 116.57 2fyh n LYS 66 Ca 0.01 0.14 0.13 0.00 -0.87 0.00 0.00 58.31 57.72 2fyh n LYS 66 Cb 0.76 -1.66 0.45 0.00 0.02 0.00 0.00 35.03 34.59 2fyh n LYS 66 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 2fyh h LYS 67 N 0.00 0.00 -6.20 1.64 2.10 0.67 -3.44 116.57 111.34 2fyh h LYS 67 Ca -0.38 0.00 -0.50 0.00 -2.00 0.00 0.00 60.65 57.77 2fyh h LYS 67 Cb 2.04 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 33.32 2fyh h LYS 67 CO 0.05 0.00 -0.51 0.71 -2.00 0.00 0.00 179.45 177.70 2fyh s TYR 68 N -3.28 3.08 0.29 0.07 2.02 -0.53 -5.07 117.35 113.93 2fyh s TYR 68 Ca 0.06 -0.14 0.04 0.00 -0.37 0.00 0.00 57.07 56.67 2fyh s TYR 68 Cb 0.10 -1.46 0.04 0.00 -0.40 0.00 0.00 41.96 40.24 2fyh s TYR 68 CO 0.53 0.47 0.36 1.63 -1.57 0.00 0.00 175.55 176.96 2fyh n LYS 69 N -1.21 0.88 -2.90 -0.62 4.76 -1.26 -4.93 118.16 112.87 2fyh n LYS 69 Ca -0.07 -1.66 -0.43 0.00 -2.87 0.00 0.00 58.31 53.29 2fyh n LYS 69 Cb 0.58 -0.03 -0.05 0.00 -1.84 0.00 0.00 35.03 33.69 2fyh n LYS 69 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2fyh s LYS 70 N -3.30 3.50 -0.07 1.97 -0.14 -1.26 -4.98 119.74 115.46 2fyh s LYS 70 Ca 0.27 0.05 -0.07 0.00 -1.36 0.00 0.00 55.97 54.87 2fyh s LYS 70 Cb -0.02 -3.92 -0.04 0.00 -1.68 0.00 0.00 37.83 32.17 2fyh s LYS 70 CO 0.17 -1.13 0.19 -1.58 -0.76 0.00 0.00 175.35 172.24 2fyh s HIS 71 N 3.47 3.60 -0.44 3.18 2.46 -1.26 -4.99 115.29 121.31 2fyh s HIS 71 Ca 0.33 0.54 -0.09 0.00 0.47 0.00 0.00 55.06 56.32 2fyh s HIS 71 Cb -0.11 -1.95 0.10 0.00 -0.13 0.00 0.00 32.58 30.48 2fyh s HIS 71 CO 0.24 0.69 0.29 -2.00 -2.47 0.00 0.00 174.74 171.49 2fyh s GLU 72 N -1.32 2.50 0.53 2.88 2.12 -1.26 -3.14 118.70 121.01 2fyh s GLU 72 Ca 0.20 -1.62 0.07 0.00 0.36 0.00 0.00 54.97 53.98 2fyh s GLU 72 Cb -0.13 -3.82 0.04 0.00 0.26 0.00 0.00 34.13 30.48 2fyh s GLU 72 CO 0.09 -1.06 0.47 0.14 -0.54 0.00 0.00 175.26 174.36 2fyh s VAL 73 N 1.37 1.91 0.20 3.70 -7.23 -1.13 -4.97 120.40 114.26 2fyh s VAL 73 Ca 0.04 -1.37 0.11 0.00 -1.81 0.00 0.00 61.98 58.95 2fyh s VAL 73 Cb -0.24 -2.29 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2fyh s VAL 73 CO 0.00 0.00 -0.24 0.21 -0.31 0.00 0.00 175.10 174.77 2fyh s ASN 74 N -4.33 3.43 -0.27 4.85 3.84 -1.26 -2.71 114.94 118.48 2fyh s ASN 74 Ca 0.42 -0.88 0.03 0.00 0.21 0.00 0.00 52.86 52.64 2fyh s ASN 74 Cb -0.03 -0.25 0.06 0.00 -0.55 0.00 0.00 41.25 40.48 2fyh s ASN 74 CO 0.26 0.11 -0.09 0.54 -2.79 0.00 0.00 177.10 175.13 2fyh s VAL 75 N -1.72 2.21 0.12 -5.21 0.11 -0.23 -1.39 120.40 114.29 2fyh s VAL 75 Ca 0.21 -1.72 -0.24 0.00 -2.93 0.00 0.00 61.98 57.30 2fyh s VAL 75 Cb -0.08 -2.35 0.07 0.00 -1.53 0.00 0.00 36.38 32.50 2fyh s VAL 75 CO 0.10 -0.10 0.62 -0.60 -3.33 0.00 0.00 175.10 171.79 2fyh s ARG 76 N 1.08 1.23 0.00 1.54 3.52 -1.22 -3.07 118.95 122.03 2fyh s ARG 76 Ca -0.06 -0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.18 2fyh s ARG 76 Cb -0.20 0.57 0.00 0.00 -1.56 0.00 0.00 34.95 33.76 2fyh s ARG 76 CO -0.05 -0.52 0.00 0.41 -0.81 0.00 0.00 175.30 174.33 2fyh n GLY 77 N -0.18 -0.24 2.99 8.12 0.00 -1.26 -4.29 105.19 110.32 2fyh n GLY 77 Ca -0.17 -1.50 -0.11 0.00 0.00 0.00 0.00 46.02 44.24 2fyh n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fyh s ILE 78 N -2.69 0.05 0.40 -0.61 1.01 -1.26 -0.69 121.20 117.41 2fyh s ILE 78 Ca 0.00 -0.43 0.05 0.00 0.00 0.00 0.00 60.65 60.27 2fyh s ILE 78 Cb 0.00 -0.22 -0.06 0.00 0.01 0.00 0.00 42.46 42.19 2fyh s ILE 78 CO 0.00 -0.24 0.03 -0.83 0.00 0.00 0.00 174.94 173.90 2fyh s GLY 79 N -0.73 2.48 0.12 6.18 0.00 0.67 -4.87 107.32 111.16 2fyh s GLY 79 Ca -0.08 -1.86 -0.01 0.00 0.00 0.00 0.00 44.72 42.77 2fyh s GLY 79 CO 0.00 -2.02 0.04 -1.34 0.00 0.00 0.00 173.10 169.78 2fyh s VAL 80 N -2.94 0.14 0.04 1.40 -7.23 -1.26 -2.73 120.40 107.82 2fyh s VAL 80 Ca 0.30 -1.90 -0.14 0.00 -1.81 0.00 0.00 61.98 58.44 2fyh s VAL 80 Cb 0.08 -1.96 0.02 0.00 0.56 0.00 0.00 36.38 35.08 2fyh s VAL 80 CO 0.15 -0.56 0.30 -0.36 -0.31 0.00 0.00 175.10 174.32 2fyh s PHE 81 N -4.01 -0.11 0.12 2.82 0.08 -1.20 -4.23 117.98 111.45 2fyh s PHE 81 Ca 0.21 -0.00 0.34 0.00 0.12 0.00 0.00 56.93 57.59 2fyh s PHE 81 Cb 0.08 0.09 1.38 0.00 -0.57 0.00 0.00 43.02 44.00 2fyh s PHE 81 CO -0.00 -0.49 1.99 -1.00 -0.10 0.00 0.00 175.22 175.62 2fyh h PRO 82 N 3.30 0.00 -2.66 0.24 0.13 -1.90 0.40 132.00 131.50 2fyh h PRO 82 Ca -0.31 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.86 2fyh h PRO 82 Cb 1.20 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.19 2fyh h PRO 82 CO 0.45 0.01 0.34 0.54 -0.23 0.00 0.00 178.00 179.12 2fyh s ASN 83 N -5.70 -0.47 0.14 1.44 2.20 -1.15 -5.05 114.94 106.35 2fyh s ASN 83 Ca 0.01 -0.02 -0.30 0.00 -0.94 0.00 0.00 52.86 51.61 2fyh s ASN 83 Cb 0.09 0.50 -0.06 0.00 -2.00 0.00 0.00 41.25 39.78 2fyh s ASN 83 CO 0.54 -0.82 1.57 -0.65 -2.94 0.00 0.00 177.10 174.80 2fyh h PRO 84 N 2.00 -0.43 -1.28 3.55 0.11 -1.93 0.23 132.00 134.25 2fyh h PRO 84 Ca -0.28 0.03 0.40 0.00 0.11 0.00 0.00 66.00 66.26 2fyh h PRO 84 Cb 1.28 0.10 -0.11 0.00 0.11 0.00 0.00 31.00 32.37 2fyh h PRO 84 CO 0.34 -0.29 0.84 -0.97 -0.21 0.00 0.00 178.00 177.71 2fyh h ASN 85 N -0.45 0.26 -3.07 -2.05 -0.73 -2.00 -3.26 115.58 104.28 2fyh h ASN 85 Ca 0.09 0.11 -0.56 0.00 1.87 0.00 0.00 56.30 57.81 2fyh h ASN 85 Cb 0.62 0.09 -0.40 0.00 0.27 0.00 0.00 38.32 38.90 2fyh h ASN 85 CO -0.49 -0.11 -0.76 -0.47 -0.37 0.00 0.00 177.43 175.23 2fyh s TYR 86 N -5.30 1.23 -0.10 0.67 5.04 0.06 -5.12 117.35 113.84 2fyh s TYR 86 Ca -0.08 -1.37 -0.18 0.00 -2.44 0.00 0.00 57.07 53.00 2fyh s TYR 86 Cb 0.28 -1.39 -0.04 0.00 0.35 0.00 0.00 41.96 41.16 2fyh s TYR 86 CO 0.82 -0.82 0.47 0.08 -1.34 0.00 0.00 175.55 174.76 2fyh s VAL 87 N 1.78 5.15 0.00 3.14 1.01 -1.17 -2.93 120.40 127.38 2fyh s VAL 87 Ca 0.08 0.95 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2fyh s VAL 87 Cb -0.17 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.40 2fyh s VAL 87 CO -0.26 0.37 0.00 0.54 0.00 0.00 0.00 175.10 175.75 2fyh n ARG 88 N 3.38 1.52 -3.75 2.72 5.12 0.14 -4.84 116.66 120.94 2fyh n ARG 88 Ca -0.08 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.61 2fyh n ARG 88 Cb 0.52 -0.78 -0.18 0.00 -1.16 0.00 0.00 32.46 30.86 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 -1.56 0.32 -0.11 1.55 1.01 -1.12 -1.08 120.40 119.41 2fyh s VAL 89 Ca 0.00 0.12 -0.22 0.00 0.00 0.00 0.00 61.98 61.87 2fyh s VAL 89 Cb 0.00 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.83 2fyh s VAL 89 CO 0.00 0.22 0.66 -0.63 0.00 0.00 0.00 175.10 175.35 2fyh s ILE 90 N 1.99 5.05 -0.04 2.22 1.01 0.13 -3.24 121.20 128.33 2fyh s ILE 90 Ca 0.05 1.33 -0.07 0.00 0.00 0.00 0.00 60.65 61.95 2fyh s ILE 90 Cb -0.13 -3.99 0.01 0.00 0.01 0.00 0.00 42.46 38.36 2fyh s ILE 90 CO -0.05 0.22 0.17 -1.66 0.00 0.00 0.00 174.94 173.62 2fyh s TRP 91 N 1.07 -0.10 0.49 3.97 1.48 -1.10 -0.09 118.94 124.66 2fyh s TRP 91 Ca 0.34 0.21 0.01 0.00 -1.06 0.00 0.00 56.10 55.60 2fyh s TRP 91 Cb -0.17 0.02 0.01 0.00 -1.16 0.00 0.00 33.47 32.18 2fyh s TRP 91 CO 0.15 -0.20 0.70 0.00 -4.06 0.00 0.00 176.95 173.55 2fyh s ALA 92 N -0.63 3.87 0.14 2.67 0.00 0.01 -0.24 121.76 127.59 2fyh s ALA 92 Ca -0.07 -1.22 0.09 0.00 0.00 0.00 0.00 51.96 50.76 2fyh s ALA 92 Cb -0.04 -2.07 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 2fyh s ALA 92 CO 0.01 -0.52 -0.21 0.20 0.00 0.00 0.00 175.76 175.24 2fyh s GLY 93 N -4.31 1.39 -0.02 0.00 0.00 0.13 -1.37 107.32 103.14 2fyh s GLY 93 Ca 0.52 -1.41 -0.01 0.00 0.00 0.00 0.00 44.72 43.82 2fyh s GLY 93 CO 0.38 -1.43 0.09 0.14 0.00 0.00 0.00 173.10 172.28 2fyh s VAL 94 N -1.53 4.86 0.70 1.40 1.01 -0.74 -3.41 120.40 122.69 2fyh s VAL 94 Ca 0.12 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 61.68 2fyh s VAL 94 Cb -0.08 -3.20 0.17 0.00 0.00 0.00 0.00 36.38 33.26 2fyh s VAL 94 CO 0.06 0.39 0.71 -0.62 0.00 0.00 0.00 175.10 175.64 2fyh n GLU 95 N 1.30 -1.81 -0.40 2.72 -0.58 -0.48 -4.71 120.64 116.67 2fyh n GLU 95 Ca -0.14 -1.13 -0.15 0.00 -0.42 0.00 0.00 57.16 55.33 2fyh n GLU 95 Cb 0.53 -0.94 -0.04 0.00 -0.57 0.00 0.00 31.44 30.42 2fyh n GLU 95 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2fyh n ASN 96 N -3.94 0.15 -2.68 1.62 0.23 -1.26 -4.77 115.26 104.62 2fyh n ASN 96 Ca 0.10 0.13 -0.29 0.00 -0.53 0.00 0.00 54.58 53.99 2fyh n ASN 96 Cb 0.36 -0.26 -0.01 0.00 -2.08 0.00 0.00 39.78 37.79 2fyh n ASN 96 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2fyh n ASP 97 N 2.58 5.03 0.20 0.53 5.68 -1.26 -4.63 116.55 124.69 2fyh n ASP 97 Ca 0.17 -3.72 -0.15 0.00 -0.50 0.00 0.00 54.79 50.59 2fyh n ASP 97 Cb -0.00 -0.57 -0.07 0.00 -1.14 0.00 0.00 41.12 39.34 2fyh n ASP 97 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2fyh h GLU 98 N 2.78 -0.58 0.44 0.11 4.81 -2.00 -1.90 114.58 118.25 2fyh h GLU 98 Ca 0.29 0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.54 2fyh h GLU 98 Cb 0.71 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.22 2fyh h GLU 98 CO 0.91 -0.38 -0.21 0.82 -0.73 0.00 0.00 179.01 179.41 2fyh h ILE 99 N -0.60 0.00 -1.46 2.32 1.08 -2.00 -2.68 117.51 114.17 2fyh h ILE 99 Ca -0.02 -0.13 0.47 0.00 -0.39 0.00 0.00 64.86 64.79 2fyh h ILE 99 Cb 0.53 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.17 2fyh h ILE 99 CO -0.02 0.00 0.99 -0.38 -0.69 0.00 0.00 178.15 178.05 2fyh n ILE 100 N -3.95 -0.14 0.11 -0.67 5.41 -1.24 0.67 119.36 119.55 2fyh n ILE 100 Ca -0.07 1.54 -0.12 0.00 1.00 0.00 0.00 62.75 65.09 2fyh n ILE 100 Cb 0.23 -2.53 -0.08 0.00 -0.71 0.00 0.00 39.64 36.55 2fyh n ILE 100 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2fyh h LYS 101 N 0.00 -0.33 -0.66 0.38 3.64 -1.19 -2.29 116.57 116.12 2fyh h LYS 101 Ca 0.82 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 60.36 2fyh h LYS 101 Cb 2.91 0.07 -0.13 0.00 -0.41 0.00 0.00 32.23 34.68 2fyh h LYS 101 CO -0.27 0.04 -0.21 0.87 -2.27 0.00 0.00 179.45 177.61 2fyh h LYS 102 N -0.83 -0.03 -0.46 1.90 1.57 0.58 0.23 116.57 119.53 2fyh h LYS 102 Ca -0.03 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2fyh h LYS 102 Cb 0.51 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 2fyh h LYS 102 CO 0.06 -0.02 0.28 0.82 -0.57 0.00 0.00 179.45 180.01 2fyh h ILE 103 N -0.04 1.14 -0.59 1.86 2.04 -1.50 0.11 117.51 120.53 2fyh h ILE 103 Ca 0.31 -0.31 0.01 0.00 1.00 0.00 0.00 64.86 65.87 2fyh h ILE 103 Cb 0.51 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 2fyh h ILE 103 CO -0.70 0.14 0.39 0.00 0.00 0.00 0.00 178.15 177.98 2fyh h ALA 104 N 1.13 1.59 -0.00 1.87 0.00 -0.33 0.82 119.26 124.34 2fyh h ALA 104 Ca 0.16 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.81 2fyh h ALA 104 Cb -0.02 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 17.56 2fyh h ALA 104 CO -0.03 0.38 -0.86 -0.22 0.00 0.00 0.00 179.25 178.52 2fyh h LYS 105 N 0.79 0.59 -0.33 0.00 3.64 -0.12 -3.11 116.57 118.03 2fyh h LYS 105 Ca 0.22 -0.63 -0.03 0.00 -1.27 0.00 0.00 60.65 58.94 2fyh h LYS 105 Cb -0.09 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 2fyh h LYS 105 CO -0.05 1.24 0.10 1.49 -2.27 0.00 0.00 179.45 179.96 2fyh h GLU 106 N 0.19 0.51 -0.55 1.90 4.57 -0.40 0.83 114.58 121.64 2fyh h GLU 106 Ca -0.11 -0.11 0.09 0.00 -1.18 0.00 0.00 59.36 58.04 2fyh h GLU 106 Cb 1.54 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 30.02 2fyh h GLU 106 CO 0.17 0.56 0.37 0.82 -1.18 0.00 0.00 179.01 179.75 2fyh h ILE 107 N 0.37 0.92 0.00 2.32 2.04 -0.93 -2.68 117.51 119.55 2fyh h ILE 107 Ca 0.11 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2fyh h ILE 107 Cb 0.26 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2fyh h ILE 107 CO -0.00 0.07 -0.07 -0.78 0.00 0.00 0.00 178.15 177.37 2fyh h ASP 108 N 0.39 0.00 -0.82 1.72 1.82 -1.40 -3.08 116.42 115.05 2fyh h ASP 108 Ca 0.25 -0.26 0.26 0.00 -0.39 0.00 0.00 57.03 56.89 2fyh h ASP 108 Cb 0.47 0.00 -0.15 0.00 0.68 0.00 0.00 39.33 40.33 2fyh h ASP 108 CO -0.06 0.67 0.15 0.47 -1.61 0.00 0.00 179.24 178.85 2fyh n ASP 109 N -4.72 0.02 0.14 2.28 9.92 0.25 0.10 116.55 124.55 2fyh n ASP 109 Ca -0.04 1.38 -0.12 0.00 -0.53 0.00 0.00 54.79 55.48 2fyh n ASP 109 Cb 0.16 -0.55 -0.07 0.00 -0.64 0.00 0.00 41.12 40.01 2fyh n ASP 109 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2fyh h GLU 110 N 0.00 -0.39 -1.05 -1.24 4.39 -1.61 -3.17 114.58 111.50 2fyh h GLU 110 Ca 0.56 0.03 0.27 0.00 0.34 0.00 0.00 59.36 60.56 2fyh h GLU 110 Cb 1.27 0.09 -0.10 0.00 -0.10 0.00 0.00 28.75 29.91 2fyh h GLU 110 CO -0.73 -0.05 0.66 -0.07 -1.16 0.00 0.00 179.01 177.66 2fyh h LEU 111 N -0.87 0.49 -1.65 1.33 3.38 -0.24 0.24 115.31 117.99 2fyh h LEU 111 Ca -0.04 0.10 0.35 0.00 0.09 0.00 0.00 57.88 58.38 2fyh h LEU 111 Cb 0.52 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.21 2fyh h LEU 111 CO 0.07 0.07 0.82 0.00 0.09 0.00 0.00 178.44 179.48 2fyh h ALA 112 N 1.65 2.76 0.00 1.53 0.00 -0.74 1.06 119.26 125.52 2fyh h ALA 112 Ca 0.63 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 55.39 2fyh h ALA 112 Cb 1.52 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 2fyh h ALA 112 CO -0.35 -1.20 -0.82 -0.22 0.00 0.00 0.00 179.25 176.66 2fyh h LYS 113 N 0.16 0.01 0.00 0.00 1.63 -0.65 -3.15 116.57 114.57 2fyh h LYS 113 Ca 0.65 -0.01 -0.12 0.00 -0.85 0.00 0.00 60.65 60.32 2fyh h LYS 113 Cb 2.14 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 33.75 2fyh h LYS 113 CO -0.19 0.82 -0.56 -0.07 -3.45 0.00 0.00 179.45 176.00 2fyh h LEU 114 N 0.01 0.00 0.00 5.20 3.38 0.11 -3.46 115.31 120.54 2fyh h LEU 114 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2fyh h LEU 114 Cb 1.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.20 2fyh h LEU 114 CO 0.11 0.56 0.00 0.61 0.09 0.00 0.00 178.44 179.81 2fyh n GLY 115 N 0.64 0.67 3.58 0.83 0.00 -0.30 -5.12 105.19 105.50 2fyh n GLY 115 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.77 2.43 0.53 1.61 0.40 -1.11 -4.99 117.98 116.09 2fyh s PHE 116 Ca 0.00 -0.63 -0.14 0.00 -0.60 0.00 0.00 56.93 55.55 2fyh s PHE 116 Cb 0.00 -1.60 -0.07 0.00 0.51 0.00 0.00 43.02 41.86 2fyh s PHE 116 CO 0.00 0.46 0.98 0.21 0.70 0.00 0.00 175.22 177.57 2fyh s LYS 117 N -3.69 3.83 -0.23 0.44 2.20 -1.26 -4.40 119.74 116.63 2fyh s LYS 117 Ca 0.34 0.84 -0.10 0.00 -0.36 0.00 0.00 55.97 56.69 2fyh s LYS 117 Cb 0.07 -2.15 -0.05 0.00 -1.51 0.00 0.00 37.83 34.20 2fyh s LYS 117 CO 0.17 -0.33 0.15 0.21 -0.36 0.00 0.00 175.35 175.19 2fyh s LYS 118 N -4.37 4.05 -0.72 4.03 2.36 -1.26 -4.74 119.74 119.09 2fyh s LYS 118 Ca 0.57 -0.28 -0.15 0.00 -2.55 0.00 0.00 55.97 53.55 2fyh s LYS 118 Cb -0.10 -3.50 0.18 0.00 -1.05 0.00 0.00 37.83 33.36 2fyh s LYS 118 CO 0.38 0.08 0.68 -1.21 1.55 0.00 0.00 175.35 176.83 2fyh s GLU 119 N 1.00 3.37 0.08 4.03 2.02 -1.26 -4.95 118.70 122.99 2fyh s GLU 119 Ca 0.07 -2.13 -0.26 0.00 0.02 0.00 0.00 54.97 52.67 2fyh s GLU 119 Cb -0.13 -4.39 -0.11 0.00 0.10 0.00 0.00 34.13 29.59 2fyh s GLU 119 CO 0.04 -1.33 1.42 0.78 0.02 0.00 0.00 175.26 176.19 2fyh h GLY 120 N 8.36 -1.18 -5.92 -1.39 0.00 -2.02 -3.41 103.07 97.51 2fyh h GLY 120 Ca -0.05 0.62 -0.63 0.00 0.00 0.00 0.00 47.33 47.27 2fyh h GLY 120 CO 0.88 -0.31 -0.47 0.21 0.00 0.00 0.00 176.54 176.84 2fyh s ASN 121 N -4.13 6.32 0.26 0.19 2.47 -1.26 -5.10 114.94 113.70 2fyh s ASN 121 Ca -0.12 0.37 -0.06 0.00 0.42 0.00 0.00 52.86 53.47 2fyh s ASN 121 Cb 0.05 -2.09 -0.06 0.00 -1.45 0.00 0.00 41.25 37.70 2fyh s ASN 121 CO 0.46 0.29 0.54 0.12 -3.72 0.00 0.00 177.10 174.80 2fyh s PHE 122 N -0.35 3.46 -0.02 0.43 5.36 -1.26 -5.10 117.98 120.50 2fyh s PHE 122 Ca 0.12 0.70 0.00 0.00 -0.96 0.00 0.00 56.93 56.80 2fyh s PHE 122 Cb -0.12 -2.14 0.03 0.00 -0.34 0.00 0.00 43.02 40.45 2fyh s PHE 122 CO 0.01 0.21 0.02 0.08 -1.46 0.00 0.00 175.22 174.09 2fyh s VAL 123 N -1.99 0.01 -0.47 3.12 1.01 -1.26 -5.11 120.40 115.71 2fyh s VAL 123 Ca 0.45 0.18 -0.00 0.00 0.00 0.00 0.00 61.98 62.61 2fyh s VAL 123 Cb -0.11 -0.14 0.13 0.00 0.00 0.00 0.00 36.38 36.26 2fyh s VAL 123 CO 0.27 0.11 0.25 0.00 0.00 0.00 0.00 175.10 175.73 2fyh s ALA 124 N 1.07 3.25 0.18 5.51 0.00 -1.26 -4.98 121.76 125.53 2fyh s ALA 124 Ca -0.09 -2.87 -0.00 0.00 0.00 0.00 0.00 51.96 49.00 2fyh s ALA 124 Cb -0.13 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 2fyh s ALA 124 CO -0.03 -1.90 0.08 -3.38 0.00 0.00 0.00 175.76 170.54 2fyh s HIS 125 N 0.51 1.11 -0.26 0.00 -3.43 -1.26 -1.79 115.29 110.17 2fyh s HIS 125 Ca 0.13 -1.25 -0.02 0.00 -0.80 0.00 0.00 55.06 53.11 2fyh s HIS 125 Cb -0.22 -0.60 0.08 0.00 -1.43 0.00 0.00 32.58 30.42 2fyh s HIS 125 CO -0.04 -0.50 0.08 0.42 -2.00 0.00 0.00 174.74 172.71 2fyh s ILE 126 N -4.00 0.49 -0.22 -5.38 1.09 -0.47 -4.15 121.20 108.56 2fyh s ILE 126 Ca 0.32 -0.91 -0.28 0.00 -1.10 0.00 0.00 60.65 58.67 2fyh s ILE 126 Cb 0.07 -1.24 -0.05 0.00 -1.06 0.00 0.00 42.46 40.18 2fyh s ILE 126 CO 0.08 -0.52 2.19 -0.89 -0.10 0.00 0.00 174.94 175.70 2fyh s THR 127 N 1.84 3.03 0.03 2.92 2.01 -1.26 -0.81 115.64 123.40 2fyh s THR 127 Ca 0.06 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 61.92 2fyh s THR 127 Cb -0.17 -3.04 -0.27 0.00 0.01 0.00 0.00 72.50 69.03 2fyh s THR 127 CO -0.22 -0.03 1.08 -0.07 -0.69 0.00 0.00 174.62 174.70 2fyh h LEU 128 N 14.88 0.71 0.00 4.42 3.38 -0.84 -3.47 115.31 134.39 2fyh h LEU 128 Ca -0.41 -0.81 0.00 0.00 0.09 0.00 0.00 57.88 56.75 2fyh h LEU 128 Cb 1.24 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2fyh h LEU 128 CO 0.96 1.44 0.00 0.61 0.09 0.00 0.00 178.44 181.54 2fyh n GLY 129 N 1.27 -1.19 3.31 0.83 0.00 -1.07 -2.06 105.19 106.28 2fyh n GLY 129 Ca -0.12 -0.91 -0.23 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.97 1.19 -0.26 1.61 3.00 -1.24 -0.69 118.95 121.59 2fyh s ARG 130 Ca 0.00 -1.26 -0.13 0.00 0.00 0.00 0.00 55.73 54.34 2fyh s ARG 130 Cb 0.00 -1.37 -0.04 0.00 0.00 0.00 0.00 34.95 33.54 2fyh s ARG 130 CO 0.00 0.30 0.27 0.08 0.00 0.00 0.00 175.30 175.95 2fyh s VAL 131 N -1.52 5.27 -0.15 3.52 1.01 -0.24 -1.80 120.40 126.48 2fyh s VAL 131 Ca 0.10 0.37 -0.12 0.00 0.00 0.00 0.00 61.98 62.34 2fyh s VAL 131 Cb -0.08 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 2fyh s VAL 131 CO 0.05 0.24 -0.18 1.17 0.00 0.00 0.00 175.10 176.39 2fyh n LYS 132 N 4.88 0.47 -3.73 2.72 3.00 -0.40 -4.89 118.16 120.21 2fyh n LYS 132 Ca -0.12 0.48 -0.12 0.00 -0.00 0.00 0.00 58.31 58.55 2fyh n LYS 132 Cb 0.51 -1.65 -0.11 0.00 0.00 0.00 0.00 35.03 33.78 2fyh n LYS 132 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.40 176.81 2fyh s PHE 133 N -2.36 -0.47 0.03 5.64 -0.12 -1.24 -5.03 117.98 114.42 2fyh s PHE 133 Ca -0.18 1.08 0.01 0.00 -0.05 0.00 0.00 56.93 57.78 2fyh s PHE 133 Cb 0.03 0.18 -0.02 0.00 -0.63 0.00 0.00 43.02 42.57 2fyh s PHE 133 CO 0.28 -0.25 -0.05 0.54 -0.05 0.00 0.00 175.22 175.69 2fyh s VAL 134 N 0.73 0.27 -0.14 -2.49 0.11 -1.26 -0.84 120.40 116.79 2fyh s VAL 134 Ca -0.04 -1.04 -0.06 0.00 -2.93 0.00 0.00 61.98 57.91 2fyh s VAL 134 Cb -0.05 -0.47 -0.06 0.00 -1.53 0.00 0.00 36.38 34.26 2fyh s VAL 134 CO -0.05 -0.50 -0.17 1.17 -3.33 0.00 0.00 175.10 172.22 2fyh n LYS 135 N 1.44 0.30 -2.67 1.54 3.00 -1.24 -4.89 118.16 115.63 2fyh n LYS 135 Ca -0.23 0.12 -0.42 0.00 -0.00 0.00 0.00 58.31 57.79 2fyh n LYS 135 Cb 0.55 -1.03 -0.03 0.00 0.00 0.00 0.00 35.03 34.52 2fyh n LYS 135 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2fyh s ASP 136 N -6.12 6.20 0.01 3.14 -1.08 -1.26 -4.90 116.67 112.66 2fyh s ASP 136 Ca -0.19 -0.75 -0.22 0.00 -0.52 0.00 0.00 52.55 50.87 2fyh s ASP 136 Cb 0.07 -2.51 -0.12 0.00 -1.46 0.00 0.00 42.92 38.90 2fyh s ASP 136 CO 0.25 -1.66 1.01 0.11 0.52 0.00 0.00 175.17 175.40 2fyh h LYS 137 N 9.82 -0.78 -0.77 4.34 1.79 -2.00 -3.24 116.57 125.74 2fyh h LYS 137 Ca -0.24 0.05 0.15 0.00 -2.18 0.00 0.00 60.65 58.44 2fyh h LYS 137 Cb 1.05 0.18 -0.14 0.00 -1.58 0.00 0.00 32.23 31.74 2fyh h LYS 137 CO 1.25 -0.52 -0.21 1.28 -1.08 0.00 0.00 179.45 180.17 2fyh n LEU 138 N -4.97 -0.32 -0.25 2.94 4.77 -1.26 0.80 117.00 118.71 2fyh n LEU 138 Ca -0.10 1.34 0.01 0.00 -0.03 0.00 0.00 56.01 57.23 2fyh n LEU 138 Cb 0.32 -0.39 0.09 0.00 -2.33 0.00 0.00 43.42 41.11 2fyh n LEU 138 CO 0.24 -1.27 0.72 1.23 -1.33 0.00 0.00 177.39 176.98 2fyh h GLY 139 N 0.00 0.53 -0.60 -0.72 0.00 -1.97 0.15 103.07 100.46 2fyh h GLY 139 Ca 0.35 0.24 0.08 0.00 0.00 0.00 0.00 47.33 48.00 2fyh h GLY 139 CO -0.79 -0.28 -0.52 1.41 0.00 0.00 0.00 176.54 176.36 2fyh h LEU 140 N 0.00 -1.80 0.60 3.11 3.38 0.32 0.82 115.31 121.75 2fyh h LEU 140 Ca 0.35 0.27 -0.03 0.00 0.09 0.00 0.00 57.88 58.56 2fyh h LEU 140 Cb 0.54 0.78 0.01 0.00 0.09 0.00 0.00 40.66 42.08 2fyh h LEU 140 CO -0.75 -0.34 -0.29 0.00 0.09 0.00 0.00 178.44 177.16 2fyh h ALA 141 N 0.36 -0.87 -1.76 1.53 0.00 -1.32 -2.45 119.26 114.76 2fyh h ALA 141 Ca 0.14 -0.18 0.52 0.00 0.00 0.00 0.00 54.91 55.39 2fyh h ALA 141 Cb 0.54 0.31 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 2fyh h ALA 141 CO -0.72 -0.81 1.26 -1.33 0.00 0.00 0.00 179.25 177.65 2fyh n MET 142 N -5.07 -0.00 -0.04 0.00 2.81 0.42 0.43 117.12 115.66 2fyh n MET 142 Ca -0.10 1.01 -0.06 0.00 -1.81 0.00 0.00 57.70 56.74 2fyh n MET 142 Cb 0.32 -2.29 -0.06 0.00 -0.71 0.00 0.00 33.22 30.48 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 -0.03 -0.94 0.03 3.64 -0.73 -3.30 116.57 115.25 2fyh h LYS 143 Ca 0.86 0.00 0.17 0.00 -1.27 0.00 0.00 60.65 60.41 2fyh h LYS 143 Cb 3.38 0.01 -0.17 0.00 -0.41 0.00 0.00 32.23 35.04 2fyh h LYS 143 CO -0.06 0.39 -0.29 -0.07 -2.27 0.00 0.00 179.45 177.15 2fyh h LEU 144 N -0.99 -1.08 -0.98 5.20 3.38 0.47 0.92 115.31 122.22 2fyh h LEU 144 Ca -0.00 0.29 0.17 0.00 0.09 0.00 0.00 57.88 58.43 2fyh h LEU 144 Cb 0.43 0.64 -0.10 0.00 0.09 0.00 0.00 40.66 41.72 2fyh h LEU 144 CO 0.00 -0.30 0.58 0.11 0.09 0.00 0.00 178.44 178.92 2fyh h LYS 145 N -0.01 0.75 -0.16 1.13 1.79 -1.57 1.59 116.57 120.09 2fyh h LYS 145 Ca 0.40 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.79 2fyh h LYS 145 Cb 0.65 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 31.13 2fyh h LYS 145 CO -0.96 0.50 -0.06 0.93 -1.08 0.00 0.00 179.45 178.78 2fyh h GLU 146 N 0.78 0.33 -0.04 3.15 4.39 0.72 -2.86 114.58 121.04 2fyh h GLU 146 Ca 0.55 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 60.12 2fyh h GLU 146 Cb 0.79 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 2fyh h GLU 146 CO -0.36 0.62 0.00 1.28 -1.16 0.00 0.00 179.01 179.38 2fyh n LEU 147 N -4.65 0.79 0.15 1.33 4.32 -0.29 -3.09 117.00 115.56 2fyh n LEU 147 Ca -0.05 -0.30 -0.00 0.00 -0.02 0.00 0.00 56.01 55.63 2fyh n LEU 147 Cb 0.28 -0.03 0.22 0.00 -1.62 0.00 0.00 43.42 42.28 2fyh n LEU 147 CO 0.38 0.15 0.56 0.00 -1.22 0.00 0.00 177.39 177.25 2fyh h ALA 148 N 4.00 1.09 0.00 -1.18 0.00 0.25 -3.32 119.26 120.10 2fyh h ALA 148 Ca 0.00 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.32 2fyh h ALA 148 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2fyh h ALA 148 CO 0.00 0.68 -1.44 0.09 0.00 0.00 0.00 179.25 178.58 2fyh n ASN 149 N -3.89 3.28 -3.71 0.00 3.02 -1.24 -4.33 115.26 108.38 2fyh n ASN 149 Ca -0.01 0.00 -0.47 0.00 -0.03 0.00 0.00 54.58 54.07 2fyh n ASN 149 Cb 0.55 0.87 -0.11 0.00 -0.61 0.00 0.00 39.78 40.48 2fyh n ASN 149 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2fyh n GLU 150 N -2.11 0.00 -1.56 3.52 4.07 -1.18 -4.79 120.64 118.60 2fyh n GLU 150 Ca -0.08 0.00 -0.32 0.00 -0.06 0.00 0.00 57.16 56.70 2fyh n GLU 150 Cb 0.57 -1.29 0.06 0.00 -0.06 0.00 0.00 31.44 30.72 2fyh n GLU 150 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 2fyh s ASP 151 N 5.92 5.08 0.00 4.31 2.15 -1.26 -4.51 116.67 128.35 2fyh s ASP 151 Ca 1.07 1.78 0.00 0.00 0.43 0.00 0.00 52.55 55.83 2fyh s ASP 151 Cb -1.23 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 38.87 2fyh s ASP 151 CO 0.52 -1.65 0.00 0.49 -0.17 0.00 0.00 175.17 174.37 2fyh n PHE 152 N -3.00 0.00 0.00 -5.34 3.72 -1.18 -4.97 117.46 106.69 2fyh n PHE 152 Ca 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.49 2fyh n PHE 152 Cb 0.53 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 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 3.29 0.78 3.26 1.37 0.00 -1.23 -4.68 105.19 107.98 2fyh n GLY 153 Ca 0.00 -2.02 -0.14 0.00 0.00 0.00 0.00 46.02 43.85 2fyh n GLY 153 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fyh s SER 154 N -4.00 1.32 0.15 1.61 1.04 -1.26 -1.07 113.70 111.49 2fyh s SER 154 Ca 0.00 -1.19 -0.25 0.00 0.48 0.00 0.00 55.95 54.99 2fyh s SER 154 Cb 0.00 0.10 0.06 0.00 0.10 0.00 0.00 66.02 66.28 2fyh s SER 154 CO 0.00 -0.57 0.88 0.72 0.98 0.00 0.00 173.24 175.25 2fyh s PHE 155 N -3.62 -0.21 -0.19 5.02 -0.71 -1.10 -4.90 117.98 112.27 2fyh s PHE 155 Ca 0.25 -0.09 -0.03 0.00 -1.04 0.00 0.00 56.93 56.02 2fyh s PHE 155 Cb 0.06 0.63 -0.01 0.00 -1.21 0.00 0.00 43.02 42.49 2fyh s PHE 155 CO 0.05 -0.86 -0.07 0.42 -1.34 0.00 0.00 175.22 173.42 2fyh s ILE 156 N -3.41 3.29 -0.78 -4.49 1.01 -1.26 -2.82 121.20 112.74 2fyh s ILE 156 Ca 0.10 -0.54 -0.24 0.00 0.00 0.00 0.00 60.65 59.97 2fyh s ILE 156 Cb -0.02 -2.46 0.06 0.00 0.01 0.00 0.00 42.46 40.04 2fyh s ILE 156 CO 0.00 0.46 1.19 -0.69 0.00 0.00 0.00 174.94 175.91 2fyh s VAL 157 N 1.10 4.03 -0.02 2.92 1.01 -1.19 -4.83 120.40 123.43 2fyh s VAL 157 Ca 0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 2fyh s VAL 157 Cb -0.15 -4.86 -0.01 0.00 0.00 0.00 0.00 36.38 31.37 2fyh s VAL 157 CO -0.01 -1.72 -0.04 -0.62 0.00 0.00 0.00 175.10 172.71 2fyh n GLU 158 N 8.51 0.06 -2.09 2.72 4.71 -1.26 -4.43 120.64 128.87 2fyh n GLU 158 Ca 0.08 0.05 -0.28 0.00 -0.01 0.00 0.00 57.16 57.00 2fyh n GLU 158 Cb 0.48 -0.63 0.11 0.00 -1.01 0.00 0.00 31.44 30.39 2fyh n GLU 158 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2fyh s ALA 159 N -2.99 2.81 0.10 0.62 0.00 -1.26 -4.92 121.76 116.12 2fyh s ALA 159 Ca -0.03 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 50.95 2fyh s ALA 159 Cb 0.00 -2.68 -0.03 0.00 0.00 0.00 0.00 23.12 20.41 2fyh s ALA 159 CO 0.05 -1.76 -0.14 0.42 0.00 0.00 0.00 175.76 174.32 2fyh s ILE 160 N -3.52 1.26 -0.04 0.00 1.01 -1.11 -4.62 121.20 114.18 2fyh s ILE 160 Ca 0.66 -1.54 0.04 0.00 0.00 0.00 0.00 60.65 59.80 2fyh s ILE 160 Cb -0.08 -1.35 -0.00 0.00 0.01 0.00 0.00 42.46 41.04 2fyh s ILE 160 CO 0.48 -0.32 -0.16 -0.70 0.00 0.00 0.00 174.94 174.25 2fyh s GLU 161 N -2.25 1.69 -0.17 2.79 2.12 -0.48 -3.04 118.70 119.36 2fyh s GLU 161 Ca 0.04 -0.56 0.01 0.00 0.36 0.00 0.00 54.97 54.82 2fyh s GLU 161 Cb -0.07 -1.47 0.03 0.00 0.26 0.00 0.00 34.13 32.88 2fyh s GLU 161 CO 0.03 0.21 -0.14 -1.17 -0.54 0.00 0.00 175.26 173.64 2fyh s LEU 162 N 0.12 2.01 0.31 2.70 2.96 -0.51 0.43 118.68 126.70 2fyh s LEU 162 Ca -0.05 -0.67 0.09 0.00 -0.22 0.00 0.00 54.13 53.29 2fyh s LEU 162 Cb -0.12 -1.27 -0.06 0.00 0.50 0.00 0.00 46.19 45.25 2fyh s LEU 162 CO 0.02 -0.08 -0.11 -0.75 -1.32 0.00 0.00 176.35 174.12 2fyh s LYS 163 N 1.41 1.72 0.48 1.98 2.20 -0.85 -0.69 119.74 125.99 2fyh s LYS 163 Ca 0.03 -1.86 0.06 0.00 -0.36 0.00 0.00 55.97 53.84 2fyh s LYS 163 Cb -0.14 -1.58 0.00 0.00 -1.51 0.00 0.00 37.83 34.60 2fyh s LYS 163 CO -0.10 0.16 0.35 -1.59 -0.36 0.00 0.00 175.35 173.80 2fyh s LYS 164 N -3.62 2.33 -0.16 4.03 -2.85 0.12 -1.36 119.74 118.23 2fyh s LYS 164 Ca 0.31 -1.85 -0.05 0.00 -1.00 0.00 0.00 55.97 53.38 2fyh s LYS 164 Cb 0.01 -2.15 0.08 0.00 -2.06 0.00 0.00 37.83 33.71 2fyh s LYS 164 CO 0.15 -0.39 0.29 0.45 0.10 0.00 0.00 175.35 175.95 2fyh s SER 165 N -4.16 0.40 -0.34 0.03 0.15 0.27 -3.79 113.70 106.27 2fyh s SER 165 Ca 0.39 0.50 0.00 0.00 0.70 0.00 0.00 55.95 57.55 2fyh s SER 165 Cb -0.01 0.79 0.11 0.00 -1.71 0.00 0.00 66.02 65.19 2fyh s SER 165 CO 0.23 -0.26 0.11 -0.89 1.20 0.00 0.00 173.24 173.64 2fyh s THR 166 N 2.45 1.16 0.20 6.45 2.01 -0.65 -1.81 115.64 125.44 2fyh s THR 166 Ca 0.03 -1.72 -0.30 0.00 0.31 0.00 0.00 61.69 60.01 2fyh s THR 166 Cb -0.13 -1.86 -0.09 0.00 0.01 0.00 0.00 72.50 70.43 2fyh s THR 166 CO -0.10 -0.70 1.28 -0.76 -0.69 0.00 0.00 174.62 173.65 2fyh s LEU 167 N 1.31 4.42 0.04 4.42 1.43 -1.26 -1.11 118.68 127.93 2fyh s LEU 167 Ca 0.11 2.38 -0.00 0.00 -1.03 0.00 0.00 54.13 55.59 2fyh s LEU 167 Cb -0.19 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.39 2fyh s LEU 167 CO -0.19 -0.49 -0.04 0.42 0.23 0.00 0.00 176.35 176.29 2fyh s THR 168 N 0.01 0.22 0.47 5.49 -4.23 -0.87 -4.93 115.64 111.80 2fyh s THR 168 Ca 0.55 -1.35 0.29 0.00 -1.18 0.00 0.00 61.69 60.01 2fyh s THR 168 Cb -0.36 -0.88 0.48 0.00 1.34 0.00 0.00 72.50 73.09 2fyh s THR 168 CO 0.39 -0.72 1.77 -0.65 -0.54 0.00 0.00 174.62 174.87 2fyh h PRO 169 N 3.93 0.16 0.00 3.99 0.11 -2.03 0.68 132.00 138.84 2fyh h PRO 169 Ca -0.33 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.61 2fyh h PRO 169 Cb 1.18 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2fyh h PRO 169 CO 0.52 0.11 -0.73 -0.22 -0.21 0.00 0.00 178.00 177.47 2fyh h LYS 170 N 0.17 0.00 0.00 1.05 3.64 -2.00 -3.49 116.57 115.94 2fyh h LYS 170 Ca 0.61 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.99 2fyh h LYS 170 Cb 2.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.83 2fyh h LYS 170 CO -0.16 0.73 0.00 0.41 -2.27 0.00 0.00 179.45 178.15 2fyh n GLY 171 N 1.28 2.53 3.72 5.01 0.00 0.24 -5.12 105.19 112.86 2fyh n GLY 171 Ca 0.01 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 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 -2.01 4.36 -0.14 1.61 0.04 -1.26 -2.05 135.00 135.55 2fyh s PRO 172 Ca 0.00 2.04 -0.06 0.00 0.04 0.00 0.00 61.00 63.02 2fyh s PRO 172 Cb 0.00 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 2fyh s PRO 172 CO 0.00 -0.34 0.06 0.42 0.04 0.00 0.00 177.00 177.18 2fyh s ILE 173 N 0.68 4.80 -0.04 0.56 -1.09 -0.27 -4.94 121.20 120.89 2fyh s ILE 173 Ca 0.61 -0.04 0.05 0.00 -2.23 0.00 0.00 60.65 59.03 2fyh s ILE 173 Cb -0.36 -3.11 -0.01 0.00 -1.58 0.00 0.00 42.46 37.41 2fyh s ILE 173 CO 0.33 0.54 -0.18 -0.31 -1.23 0.00 0.00 174.94 174.09 2fyh s TYR 174 N -0.28 1.81 -0.25 3.97 1.51 -1.26 -1.64 117.35 121.21 2fyh s TYR 174 Ca 0.08 -0.51 -0.22 0.00 -1.01 0.00 0.00 57.07 55.41 2fyh s TYR 174 Cb -0.12 -1.21 0.07 0.00 -0.11 0.00 0.00 41.96 40.59 2fyh s TYR 174 CO 0.02 -0.16 0.66 -2.00 -1.11 0.00 0.00 175.55 172.96 2fyh s GLU 175 N -0.04 0.76 0.45 -0.62 2.56 -1.25 -4.99 118.70 115.58 2fyh s GLU 175 Ca -0.03 0.95 -0.23 0.00 0.00 0.00 0.00 54.97 55.66 2fyh s GLU 175 Cb -0.11 0.35 -0.08 0.00 2.00 0.00 0.00 34.13 36.29 2fyh s GLU 175 CO 0.02 -0.10 1.12 0.99 -0.56 0.00 0.00 175.26 176.73 2fyh s THR 176 N 0.49 3.35 -0.03 -1.70 2.01 -1.26 0.15 115.64 118.65 2fyh s THR 176 Ca -0.01 0.98 0.00 0.00 0.31 0.00 0.00 61.69 62.97 2fyh s THR 176 Cb -0.05 -3.48 -0.02 0.00 0.01 0.00 0.00 72.50 68.96 2fyh s THR 176 CO -0.01 -0.05 -0.02 0.18 -0.69 0.00 0.00 174.62 174.03 2fyh n LEU 177 N -0.51 2.84 -3.78 4.42 4.77 0.14 -4.82 117.00 120.06 2fyh n LEU 177 Ca 0.07 -0.02 -0.13 0.00 -0.03 0.00 0.00 56.01 55.91 2fyh n LEU 177 Cb 0.49 -0.10 -0.12 0.00 -2.33 0.00 0.00 43.42 41.36 2fyh n LEU 177 CO 0.45 0.53 -0.11 0.00 -1.33 0.00 0.00 177.39 176.93 2fyh s ALA 178 N -2.06 -0.58 -0.20 -1.18 0.00 -1.06 -5.05 121.76 111.64 2fyh s ALA 178 Ca -0.04 0.75 -0.03 0.00 0.00 0.00 0.00 51.96 52.64 2fyh s ALA 178 Cb 0.01 -0.45 0.06 0.00 0.00 0.00 0.00 23.12 22.75 2fyh s ALA 178 CO 0.07 -0.13 0.06 1.03 0.00 0.00 0.00 175.76 176.79 2fyh s ARG 179 N 0.41 0.48 -0.45 0.00 0.52 -1.26 -1.42 118.95 117.23 2fyh s ARG 179 Ca -0.02 -0.38 -0.06 0.00 -0.52 0.00 0.00 55.73 54.74 2fyh s ARG 179 Cb -0.04 -1.98 0.12 0.00 0.52 0.00 0.00 34.95 33.56 2fyh s ARG 179 CO -0.02 -0.69 0.29 -0.06 0.02 0.00 0.00 175.30 174.84 2fyh s PHE 180 N 1.93 3.50 -0.15 -0.53 0.08 -1.17 -5.07 117.98 116.57 2fyh s PHE 180 Ca 0.01 -2.12 -0.09 0.00 0.12 0.00 0.00 56.93 54.85 2fyh s PHE 180 Cb -0.17 -3.38 -0.05 0.00 -0.57 0.00 0.00 43.02 38.86 2fyh s PHE 180 CO -0.11 -0.98 0.16 -2.00 -0.10 0.00 0.00 175.22 172.18 2fyh s GLU 181 N 1.24 3.82 -0.06 0.44 2.12 -1.26 -2.76 118.70 122.24 2fyh s GLU 181 Ca 0.07 -0.13 -0.01 0.00 0.36 0.00 0.00 54.97 55.26 2fyh s GLU 181 Cb -0.25 -3.30 -0.00 0.00 0.26 0.00 0.00 34.13 30.84 2fyh s GLU 181 CO -0.02 0.54 -0.02 -0.07 -0.54 0.00 0.00 175.26 175.15 2fyh h LEU 182 N 5.77 0.00 0.00 2.70 3.38 -1.97 -3.50 115.31 121.70 2fyh h LEU 182 Ca -0.48 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.05 2fyh h LEU 182 Cb 1.19 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.83 2fyh h LEU 182 CO 0.67 0.30 -0.41 -1.20 0.09 0.00 0.00 178.44 177.89 2fyh n SER 183 N -3.53 0.03 -2.27 -0.43 7.64 -1.26 -5.08 113.62 108.72 2fyh n SER 183 Ca -0.01 -2.91 -0.26 0.00 1.01 0.00 0.00 58.87 56.70 2fyh n SER 183 Cb 0.03 1.26 0.01 0.00 -1.01 0.00 0.00 64.21 64.50 2fyh n SER 183 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2fyh n GLU 184 N -0.65 3.48 -1.67 1.43 1.02 -1.26 -4.80 120.64 118.20 2fyh n GLU 184 Ca 0.03 -4.29 -0.34 0.00 -0.02 0.00 0.00 57.16 52.54 2fyh n GLU 184 Cb 0.53 -2.27 0.05 0.00 -0.02 0.00 0.00 31.44 29.74 2fyh n GLU 184 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 2fyh n HIS 185 N -0.60 3.11 0.00 -0.32 1.44 -1.26 -4.39 115.22 113.19 2fyh n HIS 185 Ca 0.42 -2.74 0.00 0.00 -2.01 0.00 0.00 57.72 53.40 2fyh n HIS 185 Cb 0.80 -1.09 0.00 0.00 0.12 0.00 0.00 29.99 29.81 2fyh n HIS 185 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14 2fyh n HIS 186 N -0.76 0.00 -1.91 -1.40 1.44 -1.26 -5.04 115.22 106.29 2fyh n HIS 186 Ca 0.56 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.84 2fyh n HIS 186 Cb 0.62 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.70 2fyh n HIS 186 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2fyh s HIS 187 N -1.52 1.77 0.52 -1.40 4.02 -1.26 -4.97 115.29 112.45 2fyh s HIS 187 Ca 0.00 0.04 -0.20 0.00 1.02 0.00 0.00 55.06 55.93 2fyh s HIS 187 Cb 0.00 -4.01 -0.07 0.00 -1.02 0.00 0.00 32.58 27.48 2fyh s HIS 187 CO 0.00 -4.28 1.08 -3.38 1.02 0.00 0.00 174.74 169.18 2fyh s HIS 188 N 4.33 2.86 -0.22 1.40 -3.43 -1.26 -5.02 115.29 113.96 2fyh s HIS 188 Ca 0.78 1.56 -0.16 0.00 -0.80 0.00 0.00 55.06 56.44 2fyh s HIS 188 Cb -0.35 -3.15 -0.04 0.00 -1.43 0.00 0.00 32.58 27.61 2fyh s HIS 188 CO 0.33 -1.15 0.39 -3.38 -2.00 0.00 0.00 174.74 168.93 2fyh s HIS 189 N -1.93 3.35 -2.29 0.38 -3.43 -1.26 -5.25 115.29 104.85 2fyh s HIS 189 Ca 0.69 0.57 0.30 0.00 -0.80 0.00 0.00 55.06 55.82 2fyh s HIS 189 Cb -0.19 -2.53 1.41 0.00 -1.43 0.00 0.00 32.58 29.84 2fyh s HIS 189 CO 0.24 -0.05 1.95 -2.39 -2.00 0.00 0.00 174.74 172.49