#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fyh n ARG 2 N 0.00 3.42 -2.25 3.17 0.63 -0.65 -2.95 116.66 118.03 2fyh n ARG 2 Ca 0.00 -3.35 -0.40 0.00 -0.92 0.00 0.00 57.85 53.18 2fyh n ARG 2 Cb 0.00 -3.03 -0.03 0.00 0.45 0.00 0.00 32.46 29.85 2fyh n ARG 2 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2fyh s ALA 3 N 1.23 3.42 -0.22 5.13 0.00 -0.57 -1.86 121.76 128.90 2fyh s ALA 3 Ca 0.42 1.11 -0.20 0.00 0.00 0.00 0.00 51.96 53.29 2fyh s ALA 3 Cb 0.09 -3.42 0.06 0.00 0.00 0.00 0.00 23.12 19.85 2fyh s ALA 3 CO -0.01 -0.47 0.58 -0.59 0.00 0.00 0.00 175.76 175.26 2fyh s PHE 4 N -1.18 -0.65 0.07 0.00 -0.12 -0.63 -2.13 117.98 113.34 2fyh s PHE 4 Ca 0.49 1.57 -0.12 0.00 -0.05 0.00 0.00 56.93 58.82 2fyh s PHE 4 Cb -0.36 0.23 -0.06 0.00 -0.63 0.00 0.00 43.02 42.20 2fyh s PHE 4 CO 0.47 -0.31 0.43 0.96 -0.05 0.00 0.00 175.22 176.71 2fyh s ILE 5 N 0.38 5.04 0.08 -4.49 -4.36 -1.16 -2.22 121.20 114.47 2fyh s ILE 5 Ca -0.01 0.59 -0.02 0.00 -0.26 0.00 0.00 60.65 60.95 2fyh s ILE 5 Cb -0.04 -3.67 -0.03 0.00 1.25 0.00 0.00 42.46 39.96 2fyh s ILE 5 CO -0.00 0.34 0.03 0.00 0.24 0.00 0.00 174.94 175.55 2fyh s ALA 6 N -1.35 0.47 -0.11 2.27 0.00 -0.11 -2.08 121.76 120.86 2fyh s ALA 6 Ca 0.32 -1.17 -0.04 0.00 0.00 0.00 0.00 51.96 51.07 2fyh s ALA 6 Cb -0.15 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 2fyh s ALA 6 CO 0.17 -0.43 0.05 0.42 0.00 0.00 0.00 175.76 175.97 2fyh s ILE 7 N -3.94 4.69 0.42 0.00 1.01 -0.12 -1.88 121.20 121.37 2fyh s ILE 7 Ca 0.11 -0.10 -0.26 0.00 0.00 0.00 0.00 60.65 60.39 2fyh s ILE 7 Cb 0.07 -3.01 -0.10 0.00 0.01 0.00 0.00 42.46 39.44 2fyh s ILE 7 CO -0.07 0.59 1.43 -0.67 0.00 0.00 0.00 174.94 176.22 2fyh n ASP 8 N 2.28 3.37 -3.87 3.58 2.03 -1.26 -3.16 116.55 119.52 2fyh n ASP 8 Ca -0.19 1.16 -0.30 0.00 0.52 0.00 0.00 54.79 55.99 2fyh n ASP 8 Cb 0.54 -1.59 -0.14 0.00 -0.72 0.00 0.00 41.12 39.21 2fyh n ASP 8 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2fyh s VAL 9 N -1.16 2.19 1.00 5.18 -7.23 -1.26 -4.92 120.40 114.20 2fyh s VAL 9 Ca 0.58 -3.10 -0.19 0.00 -1.81 0.00 0.00 61.98 57.46 2fyh s VAL 9 Cb -0.47 -2.52 -0.14 0.00 0.56 0.00 0.00 36.38 33.81 2fyh s VAL 9 CO 0.60 -0.84 -0.88 -0.24 -0.31 0.00 0.00 175.10 173.43 2fyh n SER 10 N 3.21 -4.89 -0.29 4.85 2.88 -1.26 -3.92 113.62 114.20 2fyh n SER 10 Ca 0.07 0.14 0.12 0.00 -1.33 0.00 0.00 58.87 57.87 2fyh n SER 10 Cb 0.33 -0.74 0.28 0.00 -0.75 0.00 0.00 64.21 63.33 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 -1.08 0.25 -1.66 -1.46 5.08 -1.98 0.21 114.58 113.94 2fyh h GLU 11 Ca -0.43 -0.01 0.52 0.00 -1.00 0.00 0.00 59.36 58.44 2fyh h GLU 11 Cb 1.32 -0.06 -0.11 0.00 0.50 0.00 0.00 28.75 30.41 2fyh h GLU 11 CO 0.24 0.16 1.13 -1.13 -1.00 0.00 0.00 179.01 178.42 2fyh n SER 12 N -5.18 0.11 -0.10 1.42 3.41 -1.26 -1.05 113.62 110.97 2fyh n SER 12 Ca 0.20 1.20 -0.17 0.00 -0.26 0.00 0.00 58.87 59.85 2fyh n SER 12 Cb 0.65 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 2fyh n SER 12 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2fyh n VAL 13 N -4.34 1.50 -0.19 -3.33 0.31 0.71 -3.73 118.33 109.26 2fyh n VAL 13 Ca 0.42 -0.02 -0.08 0.00 -0.01 0.00 0.00 64.34 64.65 2fyh n VAL 13 Cb 1.78 -2.16 -0.06 0.00 -0.91 0.00 0.00 33.84 32.48 2fyh n VAL 13 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2fyh h ARG 14 N -1.00 -0.10 -0.72 5.55 3.08 -0.67 0.37 114.38 120.89 2fyh h ARG 14 Ca -0.27 0.01 0.08 0.00 0.07 0.00 0.00 59.98 59.86 2fyh h ARG 14 Cb 1.12 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 31.15 2fyh h ARG 14 CO -0.16 -0.07 0.47 0.22 -1.07 0.00 0.00 179.97 179.36 2fyh h ASP 15 N -0.10 0.60 0.18 7.04 1.82 -1.34 -1.25 116.42 123.37 2fyh h ASP 15 Ca 0.08 0.01 -0.00 0.00 -0.39 0.00 0.00 57.03 56.72 2fyh h ASP 15 Cb 0.30 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.19 2fyh h ASP 15 CO -0.49 0.37 -0.14 0.00 -1.61 0.00 0.00 179.24 177.37 2fyh h ALA 16 N 1.63 -0.30 -0.11 -0.78 0.00 -0.51 0.21 119.26 119.39 2fyh h ALA 16 Ca 0.32 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2fyh h ALA 16 Cb 0.37 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2fyh h ALA 16 CO -0.11 -0.69 0.04 -0.07 0.00 0.00 0.00 179.25 178.43 2fyh h LEU 17 N -0.33 0.16 -0.94 0.00 3.38 -0.23 -2.91 115.31 114.45 2fyh h LEU 17 Ca -0.01 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 57.85 2fyh h LEU 17 Cb 0.29 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 2fyh h LEU 17 CO -0.01 0.29 0.60 0.58 0.09 0.00 0.00 178.44 179.99 2fyh h VAL 18 N 0.02 1.07 -0.77 1.22 2.07 -1.14 -2.17 116.25 116.55 2fyh h VAL 18 Ca 0.04 -0.37 0.17 0.00 0.82 0.00 0.00 66.70 67.36 2fyh h VAL 18 Cb 0.18 -0.11 -0.11 0.00 -1.52 0.00 0.00 31.29 29.73 2fyh h VAL 18 CO -0.00 0.20 0.20 -0.09 0.02 0.00 0.00 177.57 177.90 2fyh h ARG 19 N 1.08 0.27 -0.07 1.57 2.43 -0.37 -1.05 114.38 118.24 2fyh h ARG 19 Ca 0.41 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.55 2fyh h ARG 19 Cb 0.17 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2fyh h ARG 19 CO -0.17 0.18 0.01 0.00 -1.51 0.00 0.00 179.97 178.47 2fyh h ALA 20 N 1.64 0.09 -0.50 2.80 0.00 -1.39 -3.24 119.26 118.67 2fyh h ALA 20 Ca 0.44 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.27 2fyh h ALA 20 Cb 0.78 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.45 2fyh h ALA 20 CO -0.53 -0.26 -0.50 1.96 0.00 0.00 0.00 179.25 179.91 2fyh h GLN 21 N -0.14 -0.30 -0.99 0.00 4.20 -0.98 0.21 115.11 117.11 2fyh h GLN 21 Ca 0.02 0.02 0.34 0.00 0.06 0.00 0.00 58.65 59.09 2fyh h GLN 21 Cb 0.29 0.07 -0.17 0.00 0.30 0.00 0.00 27.48 27.96 2fyh h GLN 21 CO 0.00 -0.20 0.35 0.22 -0.67 0.00 0.00 178.83 178.53 2fyh h ASP 22 N -0.31 0.05 -0.07 1.46 3.58 -1.42 0.55 116.42 120.25 2fyh h ASP 22 Ca 0.12 0.25 -0.16 0.00 0.42 0.00 0.00 57.03 57.66 2fyh h ASP 22 Cb 0.58 0.33 0.01 0.00 1.72 0.00 0.00 39.33 41.96 2fyh h ASP 22 CO -0.64 -0.35 -0.58 0.22 -2.88 0.00 0.00 179.24 175.01 2fyh h TYR 23 N 0.06 0.73 -0.29 0.28 3.20 -0.76 -3.29 116.97 116.89 2fyh h TYR 23 Ca 0.73 -0.34 0.06 0.00 3.14 0.00 0.00 58.73 62.32 2fyh h TYR 23 Cb 1.74 -0.10 -0.06 0.00 1.54 0.00 0.00 36.73 39.84 2fyh h TYR 23 CO -0.20 1.14 -0.12 0.82 -1.64 0.00 0.00 178.16 178.16 2fyh h ILE 24 N 0.11 0.60 -3.63 1.81 2.04 0.24 -3.48 117.51 115.20 2fyh h ILE 24 Ca -0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.87 2fyh h ILE 24 Cb 1.24 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.88 2fyh h ILE 24 CO 0.12 0.00 -1.01 0.61 0.00 0.00 0.00 178.15 177.87 2fyh n GLY 25 N -1.30 -3.94 2.16 5.37 0.00 -0.16 -4.76 105.19 102.56 2fyh n GLY 25 Ca -0.00 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.86 2fyh n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fyh n SER 26 N -2.90 5.52 -0.06 1.61 3.41 -1.26 -4.72 113.62 115.22 2fyh n SER 26 Ca -0.02 -3.76 -0.02 0.00 -0.26 0.00 0.00 58.87 54.82 2fyh n SER 26 Cb 0.51 -0.50 -0.01 0.00 -0.26 0.00 0.00 64.21 63.95 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 2.22 0.00 0.01 4.33 1.79 -2.00 -3.41 116.57 119.50 2fyh h LYS 27 Ca 0.41 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.84 2fyh h LYS 27 Cb 1.28 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.93 2fyh h LYS 27 CO 0.95 0.02 -0.18 0.93 -1.08 0.00 0.00 179.45 180.10 2fyh h GLU 28 N -1.00 0.11 -6.01 3.15 3.07 -1.93 -3.46 114.58 108.51 2fyh h GLU 28 Ca -0.00 -0.13 -0.59 0.00 -0.50 0.00 0.00 59.36 58.14 2fyh h GLU 28 Cb 0.19 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.11 2fyh h GLU 28 CO -0.00 0.91 -0.44 0.00 -1.40 0.00 0.00 179.01 178.08 2fyh s ALA 29 N -2.94 3.95 -0.88 3.43 0.00 -1.26 -3.58 121.76 120.47 2fyh s ALA 29 Ca -0.17 -0.82 -0.07 0.00 0.00 0.00 0.00 51.96 50.90 2fyh s ALA 29 Cb -0.00 -1.89 0.22 0.00 0.00 0.00 0.00 23.12 21.45 2fyh s ALA 29 CO 0.72 0.71 0.80 0.21 0.00 0.00 0.00 175.76 178.21 2fyh s LYS 30 N -2.74 3.48 -0.12 0.00 2.47 0.81 -4.45 119.74 119.19 2fyh s LYS 30 Ca 0.36 -2.91 -0.02 0.00 -1.56 0.00 0.00 55.97 51.84 2fyh s LYS 30 Cb -0.12 -4.20 -0.03 0.00 -1.46 0.00 0.00 37.83 32.02 2fyh s LYS 30 CO 0.28 -1.25 -0.03 0.42 0.16 0.00 0.00 175.35 174.92 2fyh s ILE 31 N -0.69 3.96 -0.83 5.43 1.01 -1.26 -0.98 121.20 127.84 2fyh s ILE 31 Ca 0.24 -0.35 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 2fyh s ILE 31 Cb -0.11 -2.69 0.19 0.00 0.01 0.00 0.00 42.46 39.85 2fyh s ILE 31 CO -0.09 0.54 0.84 -0.75 0.00 0.00 0.00 174.94 175.49 2fyh s LYS 32 N -0.17 3.55 1.34 2.79 2.20 -0.73 -4.88 119.74 123.84 2fyh s LYS 32 Ca 0.03 -2.20 -0.19 0.00 -0.36 0.00 0.00 55.97 53.26 2fyh s LYS 32 Cb -0.13 -4.54 0.34 0.00 -1.51 0.00 0.00 37.83 32.00 2fyh s LYS 32 CO 0.02 -1.42 0.96 -0.06 -0.36 0.00 0.00 175.35 174.49 2fyh s PHE 33 N 0.97 0.15 0.09 4.03 0.08 -1.26 -3.26 117.98 118.78 2fyh s PHE 33 Ca 0.21 0.83 0.09 0.00 0.12 0.00 0.00 56.93 58.18 2fyh s PHE 33 Cb -0.10 -2.95 -0.03 0.00 -0.57 0.00 0.00 43.02 39.37 2fyh s PHE 33 CO -0.08 -4.63 -0.23 0.08 -0.10 0.00 0.00 175.22 170.26 2fyh s VAL 34 N -2.30 1.87 0.96 -0.44 1.01 -1.03 -4.89 120.40 115.57 2fyh s VAL 34 Ca 0.69 -1.52 -0.17 0.00 0.00 0.00 0.00 61.98 60.98 2fyh s VAL 34 Cb -0.19 -1.66 -0.14 0.00 0.00 0.00 0.00 36.38 34.39 2fyh s VAL 34 CO 0.61 0.06 -0.66 -0.62 0.00 0.00 0.00 175.10 174.49 2fyh n GLU 35 N 1.23 -0.02 -0.07 2.72 1.02 -1.26 -4.84 120.64 119.42 2fyh n GLU 35 Ca -0.19 -0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.82 2fyh n GLU 35 Cb 0.53 -1.07 -0.06 0.00 -0.02 0.00 0.00 31.44 30.82 2fyh n GLU 35 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2fyh h ARG 36 N -0.96 0.48 -0.95 3.49 -0.00 -1.99 -2.93 114.38 111.52 2fyh h ARG 36 Ca -0.44 -0.26 -0.02 0.00 -0.50 0.00 0.00 59.98 58.77 2fyh h ARG 36 Cb 1.31 0.01 -0.01 0.00 0.00 0.00 0.00 29.97 31.28 2fyh h ARG 36 CO 0.25 0.83 0.03 0.39 0.00 0.00 0.00 179.97 181.47 2fyh n GLU 37 N -4.45 1.51 0.00 0.04 4.71 -1.26 -3.09 120.64 118.10 2fyh n GLU 37 Ca -0.05 -0.49 0.00 0.00 -0.01 0.00 0.00 57.16 56.61 2fyh n GLU 37 Cb 0.41 -1.51 0.00 0.00 -1.01 0.00 0.00 31.44 29.32 2fyh n GLU 37 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2fyh n ASN 38 N 0.13 1.42 -0.76 1.62 5.03 -1.10 -4.65 115.26 116.95 2fyh n ASN 38 Ca 0.06 -1.68 0.11 0.00 0.87 0.00 0.00 54.58 53.94 2fyh n ASN 38 Cb 0.47 0.00 0.31 0.00 -1.02 0.00 0.00 39.78 39.54 2fyh n ASN 38 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2fyh n PHE 39 N -0.34 0.30 -1.68 3.10 3.72 -1.18 -4.88 117.46 116.51 2fyh n PHE 39 Ca 0.00 -0.15 -0.57 0.00 -0.05 0.00 0.00 57.45 56.67 2fyh n PHE 39 Cb 0.29 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.76 2fyh n PHE 39 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 176.76 174.32 2fyh n HIS 40 N 0.74 1.82 -1.58 1.38 1.44 -1.26 -4.75 115.22 113.01 2fyh n HIS 40 Ca 0.17 0.65 -0.52 0.00 -2.01 0.00 0.00 57.72 56.01 2fyh n HIS 40 Cb 0.43 -2.39 -0.07 0.00 0.12 0.00 0.00 29.99 28.08 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 3.87 0.31 -2.08 0.61 5.41 -1.19 -4.60 119.36 121.70 2fyh n ILE 41 Ca 0.25 -0.16 -0.28 0.00 1.00 0.00 0.00 62.75 63.55 2fyh n ILE 41 Cb 0.12 -1.57 -0.06 0.00 -0.71 0.00 0.00 39.64 37.42 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 5.50 3.54 0.19 1.39 2.01 -1.26 -0.95 115.64 126.07 2fyh s THR 42 Ca 1.03 -0.86 -0.24 0.00 0.31 0.00 0.00 61.69 61.93 2fyh s THR 42 Cb -0.89 -4.50 0.08 0.00 0.01 0.00 0.00 72.50 67.20 2fyh s THR 42 CO 0.55 -1.01 1.51 -0.11 -0.69 0.00 0.00 174.62 174.86 2fyh n LEU 43 N 14.17 -0.84 -3.73 4.42 0.00 -0.88 -4.60 117.00 125.53 2fyh n LEU 43 Ca 0.44 1.72 -0.13 0.00 0.00 0.00 0.00 56.01 58.04 2fyh n LEU 43 Cb 0.47 -0.30 -0.10 0.00 0.00 0.00 0.00 43.42 43.49 2fyh n LEU 43 CO 0.67 -1.47 0.10 -0.75 0.00 0.00 0.00 177.39 175.94 2fyh s LYS 44 N -5.69 0.53 -0.01 1.96 2.20 -1.23 -4.92 119.74 112.58 2fyh s LYS 44 Ca -0.13 0.49 -0.15 0.00 -0.36 0.00 0.00 55.97 55.83 2fyh s LYS 44 Cb 0.15 0.25 -0.06 0.00 -1.51 0.00 0.00 37.83 36.67 2fyh s LYS 44 CO 0.65 -0.08 0.40 0.12 -0.36 0.00 0.00 175.35 176.08 2fyh s PHE 45 N 0.02 3.72 -0.02 4.03 5.36 -1.26 -2.98 117.98 126.84 2fyh s PHE 45 Ca -0.02 0.98 -0.06 0.00 -0.96 0.00 0.00 56.93 56.87 2fyh s PHE 45 Cb -0.03 -2.29 -0.02 0.00 -0.34 0.00 0.00 43.02 40.34 2fyh s PHE 45 CO 0.01 0.63 -0.11 1.28 -1.46 0.00 0.00 175.22 175.57 2fyh n LEU 46 N 1.89 1.01 0.00 6.12 4.77 -1.17 -5.03 117.00 124.59 2fyh n LEU 46 Ca -0.14 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2fyh n LEU 46 Cb 0.52 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2fyh n LEU 46 CO 0.37 -0.52 0.00 0.61 -1.33 0.00 0.00 177.39 176.53 2fyh n GLY 47 N 2.52 0.72 3.73 -0.72 0.00 -0.91 -4.97 105.19 105.55 2fyh n GLY 47 Ca -0.04 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.12 2fyh n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fyh s GLU 48 N 0.00 4.41 -0.07 1.61 2.12 -1.24 -1.51 118.70 124.03 2fyh s GLU 48 Ca 0.00 1.94 -0.13 0.00 0.36 0.00 0.00 54.97 57.14 2fyh s GLU 48 Cb 0.00 -3.26 0.03 0.00 0.26 0.00 0.00 34.13 31.16 2fyh s GLU 48 CO 0.00 -0.25 0.31 0.42 -0.54 0.00 0.00 175.26 175.20 2fyh s ILE 49 N 0.52 0.03 0.03 -3.70 1.01 -1.15 -4.95 121.20 112.98 2fyh s ILE 49 Ca 0.58 -0.25 -0.21 0.00 0.00 0.00 0.00 60.65 60.77 2fyh s ILE 49 Cb -0.34 -0.53 -0.06 0.00 0.01 0.00 0.00 42.46 41.54 2fyh s ILE 49 CO 0.34 -0.14 0.63 0.42 0.00 0.00 0.00 174.94 176.19 2fyh s THR 50 N -0.58 4.82 0.57 2.92 -4.23 -1.26 -4.16 115.64 113.72 2fyh s THR 50 Ca -0.07 1.32 0.38 0.00 -1.18 0.00 0.00 61.69 62.15 2fyh s THR 50 Cb -0.04 -3.97 0.56 0.00 1.34 0.00 0.00 72.50 70.40 2fyh s THR 50 CO 0.02 0.44 1.40 1.21 -0.54 0.00 0.00 174.62 177.15 2fyh n GLU 51 N 2.51 0.01 0.05 3.99 2.13 -1.26 -0.33 120.64 127.75 2fyh n GLU 51 Ca -0.07 1.03 -0.03 0.00 0.66 0.00 0.00 57.16 58.75 2fyh n GLU 51 Cb 0.51 -2.47 -0.02 0.00 0.27 0.00 0.00 31.44 29.73 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 -0.20 -0.77 5.31 5.08 -2.04 -3.32 114.58 118.65 2fyh h GLU 52 Ca 0.71 0.01 0.18 0.00 -1.00 0.00 0.00 59.36 59.26 2fyh h GLU 52 Cb 3.32 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 32.57 2fyh h GLU 52 CO -0.01 -0.14 0.52 1.96 -1.00 0.00 0.00 179.01 180.35 2fyh h GLN 53 N -0.84 0.28 -1.03 2.33 7.50 -1.06 -1.75 115.11 120.53 2fyh h GLN 53 Ca -0.02 -0.02 0.42 0.00 0.50 0.00 0.00 58.65 59.53 2fyh h GLN 53 Cb 0.16 -0.06 -0.18 0.00 0.05 0.00 0.00 27.48 27.45 2fyh h GLN 53 CO 0.04 0.18 0.57 0.00 -1.50 0.00 0.00 178.83 178.12 2fyh h ALA 54 N 1.64 2.22 -0.21 3.87 0.00 -1.00 0.95 119.26 126.74 2fyh h ALA 54 Ca 0.38 0.26 -0.12 0.00 0.00 0.00 0.00 54.91 55.42 2fyh h ALA 54 Cb 1.07 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 2fyh h ALA 54 CO -0.10 -1.00 -0.35 1.05 0.00 0.00 0.00 179.25 178.85 2fyh h GLU 55 N 0.01 0.60 -1.03 0.00 4.11 -1.49 -3.14 114.58 113.64 2fyh h GLU 55 Ca 0.85 -0.37 0.27 0.00 0.07 0.00 0.00 59.36 60.17 2fyh h GLU 55 Cb 2.29 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 31.46 2fyh h GLU 55 CO -0.74 0.99 0.64 0.93 0.07 0.00 0.00 179.01 180.90 2fyh h GLU 56 N 0.29 0.45 -0.84 1.06 3.07 0.82 0.29 114.58 119.71 2fyh h GLU 56 Ca 0.01 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.83 2fyh h GLU 56 Cb 0.95 -0.10 -0.04 0.00 -0.84 0.00 0.00 28.75 28.72 2fyh h GLU 56 CO 0.08 0.30 0.44 0.82 -1.40 0.00 0.00 179.01 179.25 2fyh h ILE 57 N 0.46 1.25 0.32 3.13 5.03 -1.41 -2.99 117.51 123.30 2fyh h ILE 57 Ca 0.63 -0.65 -0.02 0.00 -0.12 0.00 0.00 64.86 64.71 2fyh h ILE 57 Cb 1.43 0.14 0.00 0.00 -3.03 0.00 0.00 36.82 35.36 2fyh h ILE 57 CO -0.39 0.29 -0.15 0.11 -0.68 0.00 0.00 178.15 177.32 2fyh h LYS 58 N 1.18 -0.41 -0.74 2.37 6.56 -0.51 -2.68 116.57 122.33 2fyh h LYS 58 Ca 0.29 0.03 0.14 0.00 -1.06 0.00 0.00 60.65 60.05 2fyh h LYS 58 Cb 0.06 0.09 -0.13 0.00 -0.57 0.00 0.00 32.23 31.68 2fyh h LYS 58 CO -0.04 -0.28 -0.22 1.63 -2.06 0.00 0.00 179.45 178.48 2fyh n LYS 59 N -3.22 -0.10 -0.02 3.15 4.76 -1.01 0.11 118.16 121.83 2fyh n LYS 59 Ca -0.05 1.15 -0.09 0.00 -2.87 0.00 0.00 58.31 56.45 2fyh n LYS 59 Cb 0.17 -1.72 -0.02 0.00 -1.84 0.00 0.00 35.03 31.61 2fyh n LYS 59 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2fyh h ILE 60 N 0.00 0.56 -0.50 -0.18 2.04 -1.48 -1.55 117.51 116.39 2fyh h ILE 60 Ca 0.32 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.16 2fyh h ILE 60 Cb 0.51 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 2fyh h ILE 60 CO -0.76 0.00 0.19 -0.07 0.00 0.00 0.00 178.15 177.51 2fyh h LEU 61 N -0.19 0.66 -1.89 1.44 3.38 0.11 -1.78 115.31 117.04 2fyh h LEU 61 Ca 0.11 -0.08 0.29 0.00 0.09 0.00 0.00 57.88 58.29 2fyh h LEU 61 Cb 0.35 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 2fyh h LEU 61 CO -0.28 0.61 0.73 -0.08 0.09 0.00 0.00 178.44 179.51 2fyh h GLU 62 N 0.72 0.07 0.02 1.13 4.57 0.47 0.77 114.58 122.33 2fyh h GLU 62 Ca 0.17 -0.00 -0.35 0.00 -1.18 0.00 0.00 59.36 58.00 2fyh h GLU 62 Cb 0.16 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.69 2fyh h GLU 62 CO -0.01 0.05 -1.95 1.63 -1.18 0.00 0.00 179.01 177.54 2fyh n LYS 63 N -4.29 0.62 -0.17 1.92 4.01 -0.84 -4.24 118.16 115.18 2fyh n LYS 63 Ca 0.22 0.37 -0.02 0.00 -0.51 0.00 0.00 58.31 58.37 2fyh n LYS 63 Cb 1.05 -1.63 0.06 0.00 -0.51 0.00 0.00 35.03 34.00 2fyh n LYS 63 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 2fyh h ILE 64 N -0.68 0.55 0.00 -0.18 2.04 -0.58 0.70 117.51 119.36 2fyh h ILE 64 Ca -0.50 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.33 2fyh h ILE 64 Cb 1.61 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2fyh h ILE 64 CO -0.21 0.01 0.00 0.00 0.00 0.00 0.00 178.15 177.96 2fyh n ALA 65 N -2.75 1.05 -0.12 1.87 0.00 0.19 -1.49 120.51 119.26 2fyh n ALA 65 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.27 2fyh n ALA 65 Cb 0.28 -1.03 -0.08 0.00 0.00 0.00 0.00 19.45 18.63 2fyh n ALA 65 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2fyh n LYS 66 N -1.53 0.54 0.00 0.00 4.76 0.21 -4.38 118.16 117.77 2fyh n LYS 66 Ca 0.00 0.23 0.03 0.00 -2.87 0.00 0.00 58.31 55.70 2fyh n LYS 66 Cb 0.01 -1.41 0.12 0.00 -1.84 0.00 0.00 35.03 31.91 2fyh n LYS 66 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2fyh n LYS 67 N -4.23 0.01 -4.36 1.97 2.85 0.50 -4.64 118.16 110.27 2fyh n LYS 67 Ca -0.41 0.38 -0.26 0.00 -1.05 0.00 0.00 58.31 56.98 2fyh n LYS 67 Cb 0.77 -1.50 -0.10 0.00 -0.65 0.00 0.00 35.03 33.55 2fyh n LYS 67 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2fyh s TYR 68 N -2.94 2.50 0.43 5.58 2.02 -0.56 -5.07 117.35 119.31 2fyh s TYR 68 Ca 0.03 -0.27 0.05 0.00 -0.37 0.00 0.00 57.07 56.50 2fyh s TYR 68 Cb 0.04 -1.18 0.05 0.00 -0.40 0.00 0.00 41.96 40.47 2fyh s TYR 68 CO 0.10 0.57 0.40 1.63 -1.57 0.00 0.00 175.55 176.68 2fyh n LYS 69 N -0.22 0.82 -3.89 -0.62 5.02 -1.26 -4.84 118.16 113.17 2fyh n LYS 69 Ca -0.09 -2.58 -0.35 0.00 -2.02 0.00 0.00 58.31 53.27 2fyh n LYS 69 Cb 0.57 0.15 -0.13 0.00 -0.02 0.00 0.00 35.03 35.60 2fyh n LYS 69 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2fyh s LYS 70 N -3.82 2.21 0.32 1.97 0.00 -1.26 -4.99 119.74 114.17 2fyh s LYS 70 Ca 0.30 -1.48 -0.02 0.00 0.00 0.00 0.00 55.97 54.77 2fyh s LYS 70 Cb -0.02 -3.28 -0.04 0.00 0.00 0.00 0.00 37.83 34.49 2fyh s LYS 70 CO 0.19 -0.77 0.55 -3.38 0.00 0.00 0.00 175.35 171.94 2fyh s HIS 71 N 1.18 3.50 -0.55 1.78 -3.43 -1.26 -4.80 115.29 111.71 2fyh s HIS 71 Ca -0.00 0.49 -0.19 0.00 -0.80 0.00 0.00 55.06 54.56 2fyh s HIS 71 Cb -0.20 -1.99 0.08 0.00 -1.43 0.00 0.00 32.58 29.03 2fyh s HIS 71 CO -0.03 0.14 0.66 -2.00 -2.00 0.00 0.00 174.74 171.51 2fyh s GLU 72 N -3.98 3.08 0.45 -0.38 2.12 -1.26 -3.37 118.70 115.37 2fyh s GLU 72 Ca 0.42 -1.09 0.08 0.00 0.36 0.00 0.00 54.97 54.73 2fyh s GLU 72 Cb -0.10 -4.18 0.01 0.00 0.26 0.00 0.00 34.13 30.12 2fyh s GLU 72 CO 0.34 -1.38 0.47 0.14 -0.54 0.00 0.00 175.26 174.29 2fyh s VAL 73 N 2.67 2.54 0.28 3.70 -7.23 -0.94 -4.94 120.40 116.47 2fyh s VAL 73 Ca 0.13 -1.25 0.11 0.00 -1.81 0.00 0.00 61.98 59.16 2fyh s VAL 73 Cb -0.22 -2.79 -0.05 0.00 0.56 0.00 0.00 36.38 33.88 2fyh s VAL 73 CO 0.09 0.00 -0.17 0.21 -0.31 0.00 0.00 175.10 174.92 2fyh s ASN 74 N -4.26 3.43 -0.24 4.85 2.47 -1.26 -2.03 114.94 117.90 2fyh s ASN 74 Ca 0.49 -1.05 0.01 0.00 0.42 0.00 0.00 52.86 52.73 2fyh s ASN 74 Cb -0.05 -0.28 0.06 0.00 -1.45 0.00 0.00 41.25 39.54 2fyh s ASN 74 CO 0.29 -0.03 -0.06 0.54 -3.72 0.00 0.00 177.10 174.12 2fyh s VAL 75 N -2.61 1.71 -0.17 -5.21 0.11 -0.38 -0.45 120.40 113.40 2fyh s VAL 75 Ca 0.29 -1.36 -0.24 0.00 -2.93 0.00 0.00 61.98 57.74 2fyh s VAL 75 Cb -0.03 -1.95 0.06 0.00 -1.53 0.00 0.00 36.38 32.93 2fyh s VAL 75 CO 0.14 -0.10 0.63 -0.60 -3.33 0.00 0.00 175.10 171.84 2fyh s ARG 76 N 1.31 0.83 0.00 1.54 3.52 -1.20 -2.64 118.95 122.30 2fyh s ARG 76 Ca -0.06 0.63 0.00 0.00 -0.13 0.00 0.00 55.73 56.17 2fyh s ARG 76 Cb -0.19 0.40 0.00 0.00 -1.56 0.00 0.00 34.95 33.60 2fyh s ARG 76 CO -0.06 -0.16 0.00 0.41 -0.81 0.00 0.00 175.30 174.68 2fyh n GLY 77 N 2.11 2.41 2.89 8.12 0.00 -1.25 -4.43 105.19 115.04 2fyh n GLY 77 Ca -0.16 -1.67 -0.14 0.00 0.00 0.00 0.00 46.02 44.06 2fyh n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fyh s ILE 78 N -1.58 -0.04 0.36 -0.61 1.01 -1.26 -0.13 121.20 118.95 2fyh s ILE 78 Ca 0.00 0.13 0.08 0.00 0.00 0.00 0.00 60.65 60.87 2fyh s ILE 78 Cb 0.00 -0.16 -0.05 0.00 0.01 0.00 0.00 42.46 42.26 2fyh s ILE 78 CO 0.00 0.05 0.10 -0.83 0.00 0.00 0.00 174.94 174.27 2fyh s GLY 79 N 0.79 2.10 0.21 6.18 0.00 0.18 -4.92 107.32 111.87 2fyh s GLY 79 Ca -0.06 -1.96 0.02 0.00 0.00 0.00 0.00 44.72 42.71 2fyh s GLY 79 CO -0.03 -1.86 0.04 -1.34 0.00 0.00 0.00 173.10 169.91 2fyh s VAL 80 N -2.51 0.64 0.02 1.40 -7.23 -1.26 -2.51 120.40 108.94 2fyh s VAL 80 Ca 0.37 -1.99 -0.15 0.00 -1.81 0.00 0.00 61.98 58.40 2fyh s VAL 80 Cb 0.00 -2.35 0.03 0.00 0.56 0.00 0.00 36.38 34.62 2fyh s VAL 80 CO 0.21 -0.27 0.34 -0.36 -0.31 0.00 0.00 175.10 174.71 2fyh s PHE 81 N -3.69 -0.18 0.14 2.82 0.08 -1.19 -4.23 117.98 111.73 2fyh s PHE 81 Ca 0.30 0.17 0.34 0.00 0.12 0.00 0.00 56.93 57.86 2fyh s PHE 81 Cb 0.07 0.12 1.40 0.00 -0.57 0.00 0.00 43.02 44.04 2fyh s PHE 81 CO 0.08 -0.47 2.00 -1.00 -0.10 0.00 0.00 175.22 175.73 2fyh h PRO 82 N 3.45 0.00 -2.36 0.24 0.13 -1.91 0.33 132.00 131.88 2fyh h PRO 82 Ca -0.31 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.93 2fyh h PRO 82 Cb 1.19 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 2fyh h PRO 82 CO 0.43 0.02 0.47 0.54 -0.23 0.00 0.00 178.00 179.22 2fyh s ASN 83 N -5.71 -0.35 0.09 1.44 2.20 -1.19 -5.05 114.94 106.36 2fyh s ASN 83 Ca 0.01 -0.07 -0.25 0.00 -0.94 0.00 0.00 52.86 51.61 2fyh s ASN 83 Cb 0.09 0.42 -0.09 0.00 -2.00 0.00 0.00 41.25 39.67 2fyh s ASN 83 CO 0.54 -0.70 1.40 -0.65 -2.94 0.00 0.00 177.10 174.75 2fyh h PRO 84 N 2.00 -0.39 -1.00 3.55 0.11 -1.93 -0.82 132.00 133.53 2fyh h PRO 84 Ca -0.23 0.03 0.40 0.00 0.11 0.00 0.00 66.00 66.30 2fyh h PRO 84 Cb 1.25 0.09 -0.16 0.00 0.11 0.00 0.00 31.00 32.29 2fyh h PRO 84 CO 0.31 -0.26 0.56 0.09 -0.21 0.00 0.00 178.00 178.49 2fyh n ASN 85 N -4.65 0.30 -3.66 -2.05 3.02 -1.26 -3.01 115.26 103.94 2fyh n ASN 85 Ca -0.04 1.49 -0.29 0.00 -0.03 0.00 0.00 54.58 55.70 2fyh n ASN 85 Cb 0.27 -0.73 -0.13 0.00 -0.61 0.00 0.00 39.78 38.58 2fyh n ASN 85 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2fyh s TYR 86 N -5.35 1.60 -0.05 3.10 5.04 -0.33 -5.11 117.35 116.24 2fyh s TYR 86 Ca -0.08 -2.03 -0.23 0.00 -2.44 0.00 0.00 57.07 52.29 2fyh s TYR 86 Cb 0.31 -1.62 -0.04 0.00 0.35 0.00 0.00 41.96 40.97 2fyh s TYR 86 CO 0.73 -0.82 0.70 0.08 -1.34 0.00 0.00 175.55 174.90 2fyh s VAL 87 N 0.90 5.02 0.00 3.14 1.01 -1.08 -3.20 120.40 126.19 2fyh s VAL 87 Ca 0.15 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.58 2fyh s VAL 87 Cb -0.22 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.12 2fyh s VAL 87 CO -0.08 0.27 0.00 0.54 0.00 0.00 0.00 175.10 175.83 2fyh n ARG 88 N 3.65 1.12 -3.94 2.72 5.12 0.11 -4.91 116.66 120.54 2fyh n ARG 88 Ca -0.02 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.67 2fyh n ARG 88 Cb 0.51 -0.90 -0.17 0.00 -1.16 0.00 0.00 32.46 30.74 2fyh n ARG 88 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2fyh s VAL 89 N -1.79 0.59 -0.11 1.55 1.01 -1.09 -1.89 120.40 118.66 2fyh s VAL 89 Ca 0.00 -0.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.73 2fyh s VAL 89 Cb 0.00 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 2fyh s VAL 89 CO 0.00 0.28 0.50 -0.63 0.00 0.00 0.00 175.10 175.25 2fyh s ILE 90 N 1.57 5.17 -0.04 2.22 1.01 -1.11 -3.17 121.20 126.86 2fyh s ILE 90 Ca -0.00 1.01 -0.07 0.00 0.00 0.00 0.00 60.65 61.59 2fyh s ILE 90 Cb -0.13 -3.84 0.01 0.00 0.01 0.00 0.00 42.46 38.51 2fyh s ILE 90 CO -0.04 0.32 0.17 -1.66 0.00 0.00 0.00 174.94 173.72 2fyh s TRP 91 N 0.65 -0.11 0.48 3.97 1.48 -1.05 -0.93 118.94 123.44 2fyh s TRP 91 Ca 0.27 0.25 0.02 0.00 -1.06 0.00 0.00 56.10 55.58 2fyh s TRP 91 Cb -0.15 0.03 0.01 0.00 -1.16 0.00 0.00 33.47 32.19 2fyh s TRP 91 CO 0.11 -0.17 0.69 0.00 -4.06 0.00 0.00 176.95 173.52 2fyh s ALA 92 N -0.49 3.92 0.18 2.67 0.00 0.32 -0.64 121.76 127.71 2fyh s ALA 92 Ca -0.06 -1.26 0.09 0.00 0.00 0.00 0.00 51.96 50.73 2fyh s ALA 92 Cb -0.04 -2.03 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 2fyh s ALA 92 CO 0.01 -0.51 -0.19 0.20 0.00 0.00 0.00 175.76 175.27 2fyh s GLY 93 N -4.32 1.45 0.02 0.00 0.00 0.82 -1.49 107.32 103.79 2fyh s GLY 93 Ca 0.53 -1.54 0.04 0.00 0.00 0.00 0.00 44.72 43.75 2fyh s GLY 93 CO 0.37 -1.59 -0.07 0.14 0.00 0.00 0.00 173.10 171.95 2fyh s VAL 94 N -2.11 3.64 0.81 1.40 1.01 -1.11 -3.25 120.40 120.79 2fyh s VAL 94 Ca 0.17 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.19 2fyh s VAL 94 Cb -0.05 -2.60 0.20 0.00 0.00 0.00 0.00 36.38 33.92 2fyh s VAL 94 CO 0.07 0.35 0.75 -0.62 0.00 0.00 0.00 175.10 175.66 2fyh n GLU 95 N 1.43 -2.27 -0.54 2.72 1.02 0.41 -4.67 120.64 118.74 2fyh n GLU 95 Ca -0.15 -1.20 -0.16 0.00 -0.02 0.00 0.00 57.16 55.64 2fyh n GLU 95 Cb 0.52 -1.08 -0.05 0.00 -0.02 0.00 0.00 31.44 30.81 2fyh n GLU 95 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2fyh n ASN 96 N -4.18 0.12 -2.62 1.62 0.23 -1.26 -4.72 115.26 104.46 2fyh n ASN 96 Ca 0.10 0.08 -0.28 0.00 -0.53 0.00 0.00 54.58 53.96 2fyh n ASN 96 Cb 0.39 -0.33 -0.00 0.00 -2.08 0.00 0.00 39.78 37.76 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 3.72 4.94 0.00 0.53 5.68 -1.26 -4.61 116.55 125.54 2fyh n ASP 97 Ca 0.24 -3.72 0.00 0.00 -0.50 0.00 0.00 54.79 50.80 2fyh n ASP 97 Cb 0.01 -0.54 0.00 0.00 -1.14 0.00 0.00 41.12 39.45 2fyh n ASP 97 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 2fyh n GLU 98 N -0.44 0.00 -0.33 0.11 2.13 -1.26 -1.72 120.64 119.13 2fyh n GLU 98 Ca 0.39 0.69 -0.09 0.00 0.66 0.00 0.00 57.16 58.81 2fyh n GLU 98 Cb 0.57 -1.50 -0.08 0.00 0.27 0.00 0.00 31.44 30.70 2fyh n GLU 98 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2fyh h ILE 99 N 0.00 0.00 -0.99 6.31 1.08 -1.98 0.58 117.51 122.51 2fyh h ILE 99 Ca 0.00 0.00 0.36 0.00 -0.39 0.00 0.00 64.86 64.83 2fyh h ILE 99 Cb 0.00 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 33.59 2fyh h ILE 99 CO 0.00 0.00 0.51 0.40 -0.69 0.00 0.00 178.15 178.37 2fyh h ILE 100 N -0.01 0.16 -0.39 -0.67 2.04 -1.94 0.67 117.51 117.37 2fyh h ILE 100 Ca 0.13 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.90 2fyh h ILE 100 Cb 0.34 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.38 2fyh h ILE 100 CO -0.76 0.03 0.14 0.50 0.00 0.00 0.00 178.15 178.06 2fyh h LYS 101 N 0.16 0.60 0.67 2.37 3.64 0.10 -1.28 116.57 122.83 2fyh h LYS 101 Ca 0.77 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 60.00 2fyh h LYS 101 Cb 1.86 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.59 2fyh h LYS 101 CO -0.70 0.59 -0.37 0.87 -2.27 0.00 0.00 179.45 177.57 2fyh h LYS 102 N 0.49 -0.93 -0.88 1.90 1.57 0.11 -2.07 116.57 116.76 2fyh h LYS 102 Ca 0.13 0.06 0.12 0.00 -1.87 0.00 0.00 60.65 59.09 2fyh h LYS 102 Cb 0.23 0.21 -0.07 0.00 0.08 0.00 0.00 32.23 32.68 2fyh h LYS 102 CO -0.01 -0.62 0.57 0.82 -0.57 0.00 0.00 179.45 179.64 2fyh h ILE 103 N -0.96 0.89 -0.94 1.86 2.04 -1.30 -0.11 117.51 118.99 2fyh h ILE 103 Ca -0.09 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.51 2fyh h ILE 103 Cb 0.76 0.06 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 2fyh h ILE 103 CO 0.11 0.14 0.59 0.00 0.00 0.00 0.00 178.15 179.00 2fyh h ALA 104 N 1.58 1.27 0.00 1.87 0.00 -0.88 0.13 119.26 123.24 2fyh h ALA 104 Ca 0.43 -0.09 -0.21 0.00 0.00 0.00 0.00 54.91 55.04 2fyh h ALA 104 Cb 0.58 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2fyh h ALA 104 CO -0.19 0.65 -0.91 -0.22 0.00 0.00 0.00 179.25 178.57 2fyh h LYS 105 N 1.29 0.30 -0.32 0.00 3.64 -0.42 -3.11 116.57 117.95 2fyh h LYS 105 Ca 0.34 -0.32 -0.14 0.00 -1.27 0.00 0.00 60.65 59.26 2fyh h LYS 105 Cb -0.10 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 2fyh h LYS 105 CO -0.07 1.03 -0.34 1.49 -2.27 0.00 0.00 179.45 179.29 2fyh h GLU 106 N 0.17 0.80 -0.80 1.90 4.57 -0.61 0.11 114.58 120.71 2fyh h GLU 106 Ca -0.06 -0.43 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 2fyh h GLU 106 Cb 1.54 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 30.11 2fyh h GLU 106 CO 0.15 1.06 0.50 0.82 -1.18 0.00 0.00 179.01 180.37 2fyh h ILE 107 N 0.58 1.22 0.01 2.32 2.04 -0.81 -3.09 117.51 119.77 2fyh h ILE 107 Ca 0.05 -0.44 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 2fyh h ILE 107 Cb 0.93 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 2fyh h ILE 107 CO 0.08 0.22 -0.00 -0.78 0.00 0.00 0.00 178.15 177.67 2fyh h ASP 108 N 1.10 -0.01 -0.74 1.72 1.82 -1.47 -3.11 116.42 115.74 2fyh h ASP 108 Ca 0.29 -0.82 0.30 0.00 -0.39 0.00 0.00 57.03 56.41 2fyh h ASP 108 Cb -0.08 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 39.81 2fyh h ASP 108 CO -0.06 0.89 0.41 -0.67 -1.61 0.00 0.00 179.24 178.20 2fyh n ASP 109 N -4.65 0.24 -0.06 2.28 2.03 0.37 0.60 116.55 117.36 2fyh n ASP 109 Ca -0.09 1.16 -0.10 0.00 0.52 0.00 0.00 54.79 56.28 2fyh n ASP 109 Cb 0.40 -0.57 -0.09 0.00 -0.72 0.00 0.00 41.12 40.14 2fyh n ASP 109 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2fyh h GLU 110 N 0.00 -0.01 -0.72 -0.67 4.39 -1.64 -3.35 114.58 112.59 2fyh h GLU 110 Ca 0.60 0.00 0.16 0.00 0.34 0.00 0.00 59.36 60.46 2fyh h GLU 110 Cb 1.64 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 30.18 2fyh h GLU 110 CO -0.52 0.69 0.16 -0.07 -1.16 0.00 0.00 179.01 178.11 2fyh h LEU 111 N -0.99 -0.01 -1.05 1.33 3.38 0.24 -0.43 115.31 117.78 2fyh h LEU 111 Ca -0.00 0.14 0.36 0.00 0.09 0.00 0.00 57.88 58.47 2fyh h LEU 111 Cb 0.70 0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.55 2fyh h LEU 111 CO 0.00 -0.04 0.68 0.00 0.09 0.00 0.00 178.44 179.18 2fyh n ALA 112 N -2.67 1.04 -0.03 1.53 0.00 0.82 0.24 120.51 121.45 2fyh n ALA 112 Ca 0.14 0.63 -0.15 0.00 0.00 0.00 0.00 53.44 54.05 2fyh n ALA 112 Cb 0.44 -0.78 -0.10 0.00 0.00 0.00 0.00 19.45 19.01 2fyh n ALA 112 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2fyh h LYS 113 N 0.00 0.31 0.00 0.00 1.63 -1.27 -3.18 116.57 114.06 2fyh h LYS 113 Ca 0.65 -0.27 -0.02 0.00 -0.85 0.00 0.00 60.65 60.16 2fyh h LYS 113 Cb 2.14 0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 33.83 2fyh h LYS 113 CO -0.31 0.93 -0.10 -0.07 -3.45 0.00 0.00 179.45 176.45 2fyh h LEU 114 N -0.22 0.00 0.00 5.20 3.38 0.31 -3.45 115.31 120.52 2fyh h LEU 114 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2fyh h LEU 114 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2fyh h LEU 114 CO 0.07 0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.30 2fyh n GLY 115 N -0.93 0.37 3.08 0.83 0.00 -0.04 -5.12 105.19 103.37 2fyh n GLY 115 Ca -0.02 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 45.16 2fyh n GLY 115 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fyh s PHE 116 N 0.00 0.69 0.23 1.61 0.40 -1.21 -4.95 117.98 114.74 2fyh s PHE 116 Ca 0.00 -0.59 -0.15 0.00 -0.60 0.00 0.00 56.93 55.59 2fyh s PHE 116 Cb 0.00 -0.41 -0.08 0.00 0.51 0.00 0.00 43.02 43.04 2fyh s PHE 116 CO 0.00 -0.11 0.65 0.21 0.70 0.00 0.00 175.22 176.67 2fyh s LYS 117 N -2.02 4.03 -0.05 0.44 2.47 -1.26 -4.23 119.74 119.12 2fyh s LYS 117 Ca -0.06 0.61 0.04 0.00 -1.56 0.00 0.00 55.97 55.00 2fyh s LYS 117 Cb -0.07 -2.74 -0.02 0.00 -1.46 0.00 0.00 37.83 33.54 2fyh s LYS 117 CO -0.01 0.34 -0.16 0.21 0.16 0.00 0.00 175.35 175.90 2fyh s LYS 118 N -2.37 2.55 -0.25 4.03 2.20 -1.26 -4.96 119.74 119.67 2fyh s LYS 118 Ca 0.45 -0.73 -0.11 0.00 -0.36 0.00 0.00 55.97 55.22 2fyh s LYS 118 Cb -0.14 -2.35 -0.05 0.00 -1.51 0.00 0.00 37.83 33.78 2fyh s LYS 118 CO 0.20 0.57 0.17 -2.00 -0.36 0.00 0.00 175.35 173.93 2fyh s GLU 119 N -0.59 4.03 0.05 4.03 2.12 -1.26 -5.01 118.70 122.07 2fyh s GLU 119 Ca 0.08 -0.28 -0.11 0.00 0.36 0.00 0.00 54.97 55.03 2fyh s GLU 119 Cb -0.11 -3.58 -0.03 0.00 0.26 0.00 0.00 34.13 30.67 2fyh s GLU 119 CO 0.01 -0.02 1.18 0.78 -0.54 0.00 0.00 175.26 176.67 2fyh h GLY 120 N 7.80 -1.85 -5.17 -1.50 0.00 -2.06 -3.40 103.07 96.89 2fyh h GLY 120 Ca -0.37 0.91 -0.64 0.00 0.00 0.00 0.00 47.33 47.24 2fyh h GLY 120 CO 0.62 -0.60 -0.49 0.21 0.00 0.00 0.00 176.54 176.28 2fyh s ASN 121 N -3.65 6.37 0.05 0.19 2.47 -1.26 -5.11 114.94 114.01 2fyh s ASN 121 Ca -0.04 0.35 -0.00 0.00 0.42 0.00 0.00 52.86 53.58 2fyh s ASN 121 Cb 0.03 -2.00 -0.04 0.00 -1.45 0.00 0.00 41.25 37.79 2fyh s ASN 121 CO 0.21 0.26 0.21 0.12 -3.72 0.00 0.00 177.10 174.17 2fyh s PHE 122 N -1.34 3.52 -0.07 0.43 5.36 -1.26 -5.11 117.98 119.52 2fyh s PHE 122 Ca 0.28 0.27 -0.03 0.00 -0.96 0.00 0.00 56.93 56.49 2fyh s PHE 122 Cb -0.13 -1.77 0.04 0.00 -0.34 0.00 0.00 43.02 40.82 2fyh s PHE 122 CO 0.19 0.60 0.14 0.08 -1.46 0.00 0.00 175.22 174.77 2fyh s VAL 123 N -1.49 -0.21 -0.49 3.12 1.01 -1.26 -5.12 120.40 115.97 2fyh s VAL 123 Ca 0.34 0.35 -0.18 0.00 0.00 0.00 0.00 61.98 62.49 2fyh s VAL 123 Cb -0.13 -0.26 0.06 0.00 0.00 0.00 0.00 36.38 36.05 2fyh s VAL 123 CO 0.27 0.15 0.54 0.00 0.00 0.00 0.00 175.10 176.05 2fyh s ALA 124 N 2.15 3.44 0.13 5.51 0.00 -1.26 -5.03 121.76 126.70 2fyh s ALA 124 Ca 0.02 -1.83 -0.02 0.00 0.00 0.00 0.00 51.96 50.13 2fyh s ALA 124 Cb -0.12 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 2fyh s ALA 124 CO -0.05 -1.89 0.08 -3.38 0.00 0.00 0.00 175.76 170.53 2fyh s HIS 125 N 2.29 0.79 -0.20 0.00 -3.43 -1.26 -2.75 115.29 110.72 2fyh s HIS 125 Ca 0.11 -1.16 -0.04 0.00 -0.80 0.00 0.00 55.06 53.17 2fyh s HIS 125 Cb -0.21 -0.42 0.07 0.00 -1.43 0.00 0.00 32.58 30.59 2fyh s HIS 125 CO 0.10 -0.54 0.07 0.42 -2.00 0.00 0.00 174.74 172.79 2fyh s ILE 126 N -4.03 0.27 -0.10 -5.38 1.09 -0.56 -4.24 121.20 108.25 2fyh s ILE 126 Ca 0.22 -0.47 -0.29 0.00 -1.10 0.00 0.00 60.65 59.01 2fyh s ILE 126 Cb 0.07 -0.90 -0.06 0.00 -1.06 0.00 0.00 42.46 40.51 2fyh s ILE 126 CO 0.01 -0.30 1.94 -0.89 -0.10 0.00 0.00 174.94 175.60 2fyh s THR 127 N 1.97 3.21 0.07 2.92 2.01 -1.26 -0.52 115.64 124.03 2fyh s THR 127 Ca 0.01 0.24 -0.08 0.00 0.31 0.00 0.00 61.69 62.18 2fyh s THR 127 Cb -0.17 -3.20 -0.30 0.00 0.01 0.00 0.00 72.50 68.84 2fyh s THR 127 CO -0.11 -0.07 1.11 -0.07 -0.69 0.00 0.00 174.62 174.79 2fyh h LEU 128 N 12.17 0.56 0.00 4.42 3.38 -1.39 -3.46 115.31 130.99 2fyh h LEU 128 Ca -0.43 -0.58 0.18 0.00 0.09 0.00 0.00 57.88 57.14 2fyh h LEU 128 Cb 1.21 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 2fyh h LEU 128 CO 0.96 1.45 0.45 0.61 0.09 0.00 0.00 178.44 182.00 2fyh n GLY 129 N 1.54 0.28 3.25 0.83 0.00 -1.22 -2.48 105.19 107.39 2fyh n GLY 129 Ca -0.11 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 2fyh n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fyh s ARG 130 N -2.00 2.20 -0.43 1.61 1.81 -1.20 -2.74 118.95 118.19 2fyh s ARG 130 Ca 0.15 -0.84 -0.22 0.00 -1.72 0.00 0.00 55.73 53.09 2fyh s ARG 130 Cb -0.00 -1.96 0.02 0.00 -0.45 0.00 0.00 34.95 32.56 2fyh s ARG 130 CO -0.01 0.41 0.74 0.08 -0.68 0.00 0.00 175.30 175.84 2fyh s VAL 131 N -0.29 4.71 -0.14 3.52 1.01 -0.79 -1.77 120.40 126.66 2fyh s VAL 131 Ca 0.01 0.41 -0.12 0.00 0.00 0.00 0.00 61.98 62.29 2fyh s VAL 131 Cb -0.12 -4.27 -0.08 0.00 0.00 0.00 0.00 36.38 31.91 2fyh s VAL 131 CO 0.02 -0.63 0.08 0.50 0.00 0.00 0.00 175.10 175.06 2fyh h LYS 132 N 8.87 0.00 -2.40 2.72 1.63 -1.37 -3.47 116.57 122.55 2fyh h LYS 132 Ca -0.25 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.48 2fyh h LYS 132 Cb 1.09 0.00 -0.23 0.00 -0.60 0.00 0.00 32.23 32.49 2fyh h LYS 132 CO 0.93 0.33 -0.12 -0.59 -3.45 0.00 0.00 179.45 176.55 2fyh s PHE 133 N -2.06 -0.70 0.02 1.91 -0.12 -1.25 -5.01 117.98 110.77 2fyh s PHE 133 Ca -0.14 1.55 0.00 0.00 -0.05 0.00 0.00 56.93 58.29 2fyh s PHE 133 Cb 0.02 0.31 -0.02 0.00 -0.63 0.00 0.00 43.02 42.70 2fyh s PHE 133 CO 0.29 -0.35 -0.03 0.54 -0.05 0.00 0.00 175.22 175.62 2fyh s VAL 134 N 0.89 0.11 -0.17 -2.49 0.11 -1.26 -0.13 120.40 117.46 2fyh s VAL 134 Ca -0.05 -0.73 -0.09 0.00 -2.93 0.00 0.00 61.98 58.18 2fyh s VAL 134 Cb -0.05 -0.23 -0.07 0.00 -1.53 0.00 0.00 36.38 34.49 2fyh s VAL 134 CO -0.07 -0.39 -0.23 0.29 -3.33 0.00 0.00 175.10 171.37 2fyh n LYS 135 N 1.90 0.37 -1.89 1.54 5.02 -1.23 -4.85 118.16 119.01 2fyh n LYS 135 Ca -0.21 0.16 -0.22 0.00 -2.02 0.00 0.00 58.31 56.01 2fyh n LYS 135 Cb 0.56 -1.12 -0.06 0.00 -0.02 0.00 0.00 35.03 34.39 2fyh n LYS 135 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2fyh s ASP 136 N -6.52 4.66 0.05 4.39 2.15 -1.26 -4.81 116.67 115.34 2fyh s ASP 136 Ca -0.24 -0.61 -0.30 0.00 0.43 0.00 0.00 52.55 51.84 2fyh s ASP 136 Cb 0.09 -2.56 -0.16 0.00 -0.30 0.00 0.00 42.92 39.99 2fyh s ASP 136 CO 0.31 -3.24 1.45 0.50 -0.17 0.00 0.00 175.17 174.02 2fyh h LYS 137 N 11.52 -0.98 -0.96 4.34 3.64 -2.00 -2.82 116.57 129.31 2fyh h LYS 137 Ca 0.08 0.07 0.31 0.00 -1.27 0.00 0.00 60.65 59.83 2fyh h LYS 137 Cb 1.00 0.22 -0.17 0.00 -0.41 0.00 0.00 32.23 32.87 2fyh h LYS 137 CO 1.14 -0.65 0.28 -0.07 -2.27 0.00 0.00 179.45 177.87 2fyh h LEU 138 N -1.02 -0.03 -0.77 5.20 3.38 -2.01 0.35 115.31 120.41 2fyh h LEU 138 Ca -0.10 0.24 0.18 0.00 0.09 0.00 0.00 57.88 58.30 2fyh h LEU 138 Cb 0.80 0.33 -0.12 0.00 0.09 0.00 0.00 40.66 41.76 2fyh h LEU 138 CO 0.12 -0.30 0.13 1.23 0.09 0.00 0.00 178.44 179.71 2fyh h GLY 139 N 0.09 1.03 -0.40 0.83 0.00 -1.89 0.25 103.07 102.98 2fyh h GLY 139 Ca 0.67 0.01 0.08 0.00 0.00 0.00 0.00 47.33 48.09 2fyh h GLY 139 CO -0.78 -0.27 -0.42 1.41 0.00 0.00 0.00 176.54 176.49 2fyh h LEU 140 N 0.20 -1.41 0.29 3.11 3.38 -0.29 0.23 115.31 120.81 2fyh h LEU 140 Ca 0.44 0.23 -0.01 0.00 0.09 0.00 0.00 57.88 58.63 2fyh h LEU 140 Cb 0.80 0.64 0.00 0.00 0.09 0.00 0.00 40.66 42.19 2fyh h LEU 140 CO -0.59 -0.34 -0.14 0.00 0.09 0.00 0.00 178.44 177.46 2fyh h ALA 141 N 0.60 -0.43 -0.86 1.53 0.00 -1.37 -2.33 119.26 116.40 2fyh h ALA 141 Ca 0.17 -0.09 0.30 0.00 0.00 0.00 0.00 54.91 55.30 2fyh h ALA 141 Cb 0.57 0.15 -0.16 0.00 0.00 0.00 0.00 17.79 18.35 2fyh h ALA 141 CO -0.64 -0.40 0.25 -1.33 0.00 0.00 0.00 179.25 177.13 2fyh n MET 142 N -4.69 -0.06 0.16 0.00 2.81 0.76 -0.38 117.12 115.73 2fyh n MET 142 Ca -0.05 1.23 -0.10 0.00 -1.81 0.00 0.00 57.70 56.97 2fyh n MET 142 Cb 0.15 -2.08 -0.05 0.00 -0.71 0.00 0.00 33.22 30.53 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 -0.47 -0.88 0.03 3.64 -0.62 -3.25 116.57 115.02 2fyh h LYS 143 Ca 0.63 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 60.12 2fyh h LYS 143 Cb 1.52 0.11 -0.11 0.00 -0.41 0.00 0.00 32.23 33.34 2fyh h LYS 143 CO -0.73 -0.22 -0.51 1.28 -2.27 0.00 0.00 179.45 177.00 2fyh n LEU 144 N -5.11 -0.92 -0.30 5.20 4.77 0.49 0.14 117.00 121.28 2fyh n LEU 144 Ca -0.08 1.56 -0.02 0.00 -0.03 0.00 0.00 56.01 57.45 2fyh n LEU 144 Cb 0.24 -0.21 0.04 0.00 -2.33 0.00 0.00 43.42 41.16 2fyh n LEU 144 CO 0.20 -1.28 0.62 0.11 -1.33 0.00 0.00 177.39 175.72 2fyh h LYS 145 N 0.00 -0.06 -0.69 3.23 1.79 -1.44 0.40 116.57 119.80 2fyh h LYS 145 Ca 0.15 0.00 0.07 0.00 -2.18 0.00 0.00 60.65 58.69 2fyh h LYS 145 Cb 0.37 0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 30.97 2fyh h LYS 145 CO -0.83 -0.04 0.37 0.93 -1.08 0.00 0.00 179.45 178.80 2fyh h GLU 146 N -0.07 0.66 -1.08 3.15 4.39 -0.34 -1.08 114.58 120.21 2fyh h GLU 146 Ca 0.31 -0.04 -0.43 0.00 0.34 0.00 0.00 59.36 59.54 2fyh h GLU 146 Cb 0.58 -0.15 -0.23 0.00 -0.10 0.00 0.00 28.75 28.86 2fyh h GLU 146 CO -0.85 0.43 0.55 1.28 -1.16 0.00 0.00 179.01 179.27 2fyh n LEU 147 N -4.80 6.25 -0.10 1.33 4.32 0.11 -3.82 117.00 120.28 2fyh n LEU 147 Ca 0.09 -3.33 -0.14 0.00 -0.02 0.00 0.00 56.01 52.61 2fyh n LEU 147 Cb 0.20 -0.84 -0.14 0.00 -1.62 0.00 0.00 43.42 41.02 2fyh n LEU 147 CO 0.28 1.06 -1.19 0.00 -1.22 0.00 0.00 177.39 176.32 2fyh n ALA 148 N -0.60 1.44 -0.03 -1.18 0.00 0.47 -4.22 120.51 116.39 2fyh n ALA 148 Ca 0.46 -1.16 -0.01 0.00 0.00 0.00 0.00 53.44 52.73 2fyh n ALA 148 Cb 1.14 -0.21 -0.06 0.00 0.00 0.00 0.00 19.45 20.31 2fyh n ALA 148 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2fyh n ASN 149 N -3.04 3.04 -3.46 0.00 4.13 -1.26 -3.92 115.26 110.77 2fyh n ASN 149 Ca -0.38 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.46 2fyh n ASN 149 Cb 1.07 0.95 -0.10 0.00 -1.54 0.00 0.00 39.78 40.16 2fyh n ASN 149 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 2fyh n GLU 150 N -2.11 0.00 -2.12 3.52 0.00 -1.25 -4.71 120.64 113.97 2fyh n GLU 150 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 57.16 56.70 2fyh n GLU 150 Cb 0.56 -1.20 0.01 0.00 0.00 0.00 0.00 31.44 30.81 2fyh n GLU 150 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2fyh s ASP 151 N 5.62 5.83 -0.13 4.31 2.15 -1.26 -4.54 116.67 128.65 2fyh s ASP 151 Ca 1.00 2.42 0.04 0.00 0.43 0.00 0.00 52.55 56.44 2fyh s ASP 151 Cb -1.13 -2.61 -0.11 0.00 -0.30 0.00 0.00 42.92 38.77 2fyh s ASP 151 CO 0.48 -1.16 -0.07 0.49 -0.17 0.00 0.00 175.17 174.74 2fyh n PHE 152 N -0.77 0.00 -0.04 -5.34 3.72 -1.08 -5.04 117.46 108.91 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 0.48 -0.55 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 2fyh n PHE 152 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2fyh n GLY 153 N 2.65 0.97 3.23 1.37 0.00 -1.24 -4.59 105.19 107.59 2fyh n GLY 153 Ca -0.23 -1.90 -0.13 0.00 0.00 0.00 0.00 46.02 43.77 2fyh n GLY 153 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fyh s SER 154 N -4.00 0.65 -0.10 1.61 1.04 -1.26 -1.25 113.70 110.38 2fyh s SER 154 Ca 0.00 -1.31 -0.32 0.00 0.48 0.00 0.00 55.95 54.79 2fyh s SER 154 Cb 0.00 0.26 0.12 0.00 0.10 0.00 0.00 66.02 66.50 2fyh s SER 154 CO 0.00 -0.74 1.08 0.72 0.98 0.00 0.00 173.24 175.28 2fyh s PHE 155 N -3.94 -0.21 -0.19 5.02 -0.71 -0.86 -4.81 117.98 112.29 2fyh s PHE 155 Ca 0.33 0.12 -0.04 0.00 -1.04 0.00 0.00 56.93 56.30 2fyh s PHE 155 Cb 0.07 0.53 -0.02 0.00 -1.21 0.00 0.00 43.02 42.39 2fyh s PHE 155 CO 0.09 -0.35 -0.04 0.42 -1.34 0.00 0.00 175.22 173.99 2fyh s ILE 156 N -2.71 3.60 -0.76 -4.49 1.01 -1.26 -2.22 121.20 114.37 2fyh s ILE 156 Ca 0.08 -0.44 -0.26 0.00 0.00 0.00 0.00 60.65 60.03 2fyh s ILE 156 Cb -0.01 -2.60 0.01 0.00 0.01 0.00 0.00 42.46 39.87 2fyh s ILE 156 CO -0.06 0.45 1.49 -0.69 0.00 0.00 0.00 174.94 176.14 2fyh s VAL 157 N 0.92 3.64 -0.11 2.92 1.01 -1.22 -4.79 120.40 122.77 2fyh s VAL 157 Ca -0.00 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 2fyh s VAL 157 Cb -0.15 -4.63 -0.04 0.00 0.00 0.00 0.00 36.38 31.56 2fyh s VAL 157 CO 0.01 -1.57 -0.22 -0.62 0.00 0.00 0.00 175.10 172.69 2fyh n GLU 158 N 9.23 0.34 -2.93 2.72 1.02 -1.26 -4.26 120.64 125.49 2fyh n GLU 158 Ca 0.14 0.13 -0.22 0.00 -0.02 0.00 0.00 57.16 57.19 2fyh n GLU 158 Cb 0.50 -1.09 0.02 0.00 -0.02 0.00 0.00 31.44 30.85 2fyh n GLU 158 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2fyh s ALA 159 N -2.93 3.84 0.01 0.62 0.00 -1.26 -4.88 121.76 117.15 2fyh s ALA 159 Ca -0.18 -1.16 0.06 0.00 0.00 0.00 0.00 51.96 50.67 2fyh s ALA 159 Cb 0.03 -2.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.04 2fyh s ALA 159 CO 0.27 -0.45 -0.18 0.42 0.00 0.00 0.00 175.76 175.83 2fyh s ILE 160 N -2.58 1.43 0.17 0.00 1.01 -1.16 -4.47 121.20 115.60 2fyh s ILE 160 Ca 0.50 -0.93 0.10 0.00 0.00 0.00 0.00 60.65 60.32 2fyh s ILE 160 Cb -0.10 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 2fyh s ILE 160 CO 0.37 0.27 -0.22 -1.61 0.00 0.00 0.00 174.94 173.76 2fyh s GLU 161 N -0.77 1.38 -0.06 2.79 8.01 -0.79 -2.67 118.70 126.59 2fyh s GLU 161 Ca 0.06 -1.43 -0.03 0.00 0.01 0.00 0.00 54.97 53.58 2fyh s GLU 161 Cb -0.08 -1.62 0.03 0.00 -4.31 0.00 0.00 34.13 28.15 2fyh s GLU 161 CO 0.00 0.35 0.13 -1.17 0.01 0.00 0.00 175.26 174.59 2fyh s LEU 162 N -2.52 1.08 0.04 1.80 2.96 -0.73 -0.94 118.68 120.37 2fyh s LEU 162 Ca 0.17 0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 54.34 2fyh s LEU 162 Cb -0.08 0.38 -0.03 0.00 0.50 0.00 0.00 46.19 46.96 2fyh s LEU 162 CO 0.08 -0.10 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.44 2fyh s LYS 163 N 0.70 0.51 -0.00 1.98 1.02 -0.94 -0.97 119.74 122.03 2fyh s LYS 163 Ca -0.05 -1.00 0.05 0.00 0.02 0.00 0.00 55.97 54.98 2fyh s LYS 163 Cb -0.07 0.18 -0.03 0.00 -0.52 0.00 0.00 37.83 37.39 2fyh s LYS 163 CO -0.03 -0.09 -0.13 -1.59 -0.92 0.00 0.00 175.35 172.59 2fyh s LYS 164 N -3.06 2.39 -0.17 1.68 -2.85 -0.39 -1.60 119.74 115.73 2fyh s LYS 164 Ca -0.01 -0.79 0.01 0.00 -1.00 0.00 0.00 55.97 54.18 2fyh s LYS 164 Cb 0.02 -2.36 0.02 0.00 -2.06 0.00 0.00 37.83 33.44 2fyh s LYS 164 CO -0.07 0.59 -0.19 -1.12 0.10 0.00 0.00 175.35 174.66 2fyh s SER 165 N -1.19 3.06 -0.28 0.03 0.01 -0.77 -3.17 113.70 111.39 2fyh s SER 165 Ca 0.14 -0.62 -0.02 0.00 1.31 0.00 0.00 55.95 56.76 2fyh s SER 165 Cb -0.11 -1.43 0.09 0.00 0.21 0.00 0.00 66.02 64.78 2fyh s SER 165 CO 0.04 -0.01 0.09 -0.89 0.41 0.00 0.00 173.24 172.89 2fyh s THR 166 N 1.31 0.48 0.22 1.44 2.01 -0.85 -1.64 115.64 118.60 2fyh s THR 166 Ca 0.05 -0.98 -0.30 0.00 0.31 0.00 0.00 61.69 60.76 2fyh s THR 166 Cb -0.13 -1.28 -0.09 0.00 0.01 0.00 0.00 72.50 71.00 2fyh s THR 166 CO -0.12 -0.58 1.35 -0.76 -0.69 0.00 0.00 174.62 173.81 2fyh s LEU 167 N 1.84 4.41 0.06 4.42 1.43 -1.26 -1.87 118.68 127.70 2fyh s LEU 167 Ca 0.07 2.48 0.01 0.00 -1.03 0.00 0.00 54.13 55.66 2fyh s LEU 167 Cb -0.17 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.41 2fyh s LEU 167 CO -0.25 -0.58 -0.05 0.42 0.23 0.00 0.00 176.35 176.12 2fyh s THR 168 N 0.05 0.42 0.51 5.49 -4.23 -0.90 -4.94 115.64 112.04 2fyh s THR 168 Ca 0.57 -1.47 0.33 0.00 -1.18 0.00 0.00 61.69 59.94 2fyh s THR 168 Cb -0.38 -1.06 0.52 0.00 1.34 0.00 0.00 72.50 72.91 2fyh s THR 168 CO 0.40 -0.70 1.79 -0.65 -0.54 0.00 0.00 174.62 174.92 2fyh h PRO 169 N 3.76 0.08 0.09 3.99 0.11 -2.04 0.43 132.00 138.43 2fyh h PRO 169 Ca -0.34 -0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.51 2fyh h PRO 169 Cb 1.18 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2fyh h PRO 169 CO 0.54 0.05 -1.17 -0.22 -0.21 0.00 0.00 178.00 176.99 2fyh h LYS 170 N 0.09 0.19 0.00 1.05 3.11 -2.00 -3.49 116.57 115.51 2fyh h LYS 170 Ca 0.58 -0.32 0.00 0.00 -2.81 0.00 0.00 60.65 58.10 2fyh h LYS 170 Cb 2.14 0.12 0.00 0.00 -1.00 0.00 0.00 32.23 33.49 2fyh h LYS 170 CO -0.08 1.15 0.00 0.41 -2.81 0.00 0.00 179.45 178.12 2fyh n GLY 171 N 1.48 1.69 3.71 5.01 0.00 0.15 -5.12 105.19 112.11 2fyh n GLY 171 Ca -0.06 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 2fyh n GLY 171 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fyh s PRO 172 N -1.98 4.31 -0.28 1.61 0.04 -1.26 -2.12 135.00 135.31 2fyh s PRO 172 Ca 0.00 2.04 -0.13 0.00 0.04 0.00 0.00 61.00 62.95 2fyh s PRO 172 Cb 0.00 -3.37 -0.04 0.00 0.04 0.00 0.00 34.50 31.13 2fyh s PRO 172 CO 0.00 -0.49 0.27 0.42 0.04 0.00 0.00 177.00 177.24 2fyh s ILE 173 N 1.58 5.25 -0.19 0.56 -1.09 -0.78 -4.96 121.20 121.58 2fyh s ILE 173 Ca 0.65 0.28 -0.00 0.00 -2.23 0.00 0.00 60.65 59.34 2fyh s ILE 173 Cb -0.35 -3.62 0.05 0.00 -1.58 0.00 0.00 42.46 36.96 2fyh s ILE 173 CO 0.29 0.18 -0.04 -0.31 -1.23 0.00 0.00 174.94 173.83 2fyh s TYR 174 N 1.89 1.81 -0.00 3.97 1.51 -1.26 -2.01 117.35 123.25 2fyh s TYR 174 Ca 0.10 -1.24 -0.07 0.00 -1.01 0.00 0.00 57.07 54.85 2fyh s TYR 174 Cb -0.16 -1.35 0.00 0.00 -0.11 0.00 0.00 41.96 40.34 2fyh s TYR 174 CO 0.11 -0.66 0.14 -1.83 -1.11 0.00 0.00 175.55 172.20 2fyh s GLU 175 N 1.60 0.46 0.36 -0.62 -1.05 -1.19 -5.00 118.70 113.25 2fyh s GLU 175 Ca -0.01 -0.34 -0.25 0.00 -0.15 0.00 0.00 54.97 54.21 2fyh s GLU 175 Cb -0.16 0.19 -0.09 0.00 -0.44 0.00 0.00 34.13 33.62 2fyh s GLU 175 CO -0.07 -0.11 1.02 0.99 0.95 0.00 0.00 175.26 178.04 2fyh s THR 176 N -1.25 3.84 -0.09 1.83 2.01 -1.26 -1.26 115.64 119.46 2fyh s THR 176 Ca -0.13 1.50 0.04 0.00 0.31 0.00 0.00 61.69 63.40 2fyh s THR 176 Cb -0.07 -3.82 -0.08 0.00 0.01 0.00 0.00 72.50 68.54 2fyh s THR 176 CO 0.01 0.09 -0.04 0.18 -0.69 0.00 0.00 174.62 174.18 2fyh n LEU 177 N 0.29 1.65 -3.74 4.42 4.77 -0.14 -4.89 117.00 119.36 2fyh n LEU 177 Ca 0.03 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 2fyh n LEU 177 Cb 0.49 -0.11 -0.12 0.00 -2.33 0.00 0.00 43.42 41.35 2fyh n LEU 177 CO 0.46 0.46 -0.09 0.00 -1.33 0.00 0.00 177.39 176.89 2fyh s ALA 178 N -2.20 -0.64 -0.19 -1.18 0.00 -1.21 -5.04 121.76 111.30 2fyh s ALA 178 Ca -0.09 0.97 -0.03 0.00 0.00 0.00 0.00 51.96 52.81 2fyh s ALA 178 Cb 0.03 -0.60 0.06 0.00 0.00 0.00 0.00 23.12 22.61 2fyh s ALA 178 CO 0.27 -0.18 0.05 0.50 0.00 0.00 0.00 175.76 176.41 2fyh s ARG 179 N 0.91 0.50 -0.47 0.00 3.52 -1.26 -1.78 118.95 120.37 2fyh s ARG 179 Ca -0.06 -0.36 -0.04 0.00 -0.13 0.00 0.00 55.73 55.14 2fyh s ARG 179 Cb -0.07 -2.02 0.12 0.00 -1.56 0.00 0.00 34.95 31.42 2fyh s ARG 179 CO -0.06 -0.67 0.28 -0.06 -0.81 0.00 0.00 175.30 173.98 2fyh s PHE 180 N 1.93 3.53 -0.23 5.12 0.08 -1.09 -5.07 117.98 122.25 2fyh s PHE 180 Ca 0.00 -2.40 -0.10 0.00 0.12 0.00 0.00 56.93 54.55 2fyh s PHE 180 Cb -0.17 -3.27 -0.05 0.00 -0.57 0.00 0.00 43.02 38.97 2fyh s PHE 180 CO -0.09 -0.95 0.15 -2.00 -0.10 0.00 0.00 175.22 172.23 2fyh s GLU 181 N 0.90 4.08 -0.07 0.44 2.12 -1.26 -2.99 118.70 121.92 2fyh s GLU 181 Ca 0.10 -0.27 -0.00 0.00 0.36 0.00 0.00 54.97 55.16 2fyh s GLU 181 Cb -0.23 -3.51 -0.00 0.00 0.26 0.00 0.00 34.13 30.66 2fyh s GLU 181 CO -0.04 0.10 0.00 -0.07 -0.54 0.00 0.00 175.26 174.72 2fyh h LEU 182 N 7.38 -0.00 -8.50 2.70 3.38 -1.98 -3.48 115.31 114.80 2fyh h LEU 182 Ca -0.38 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.23 2fyh h LEU 182 Cb 1.17 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.74 2fyh h LEU 182 CO 0.67 0.34 -0.74 -0.94 0.09 0.00 0.00 178.44 177.86 2fyh s SER 183 N -4.76 1.65 0.06 -0.43 1.04 -1.26 -5.07 113.70 104.93 2fyh s SER 183 Ca -0.00 -0.80 -0.21 0.00 0.48 0.00 0.00 55.95 55.42 2fyh s SER 183 Cb 0.00 -0.02 -0.09 0.00 0.10 0.00 0.00 66.02 66.01 2fyh s SER 183 CO 0.00 -0.21 1.33 -0.33 0.98 0.00 0.00 173.24 175.01 2fyh h GLU 184 N 3.57 -0.43 -2.36 4.02 3.07 -2.05 -3.47 114.58 116.94 2fyh h GLU 184 Ca -0.38 0.03 0.10 0.00 -0.50 0.00 0.00 59.36 58.61 2fyh h GLU 184 Cb 1.19 0.10 -0.14 0.00 -0.84 0.00 0.00 28.75 29.06 2fyh h GLU 184 CO 0.52 -0.28 0.47 -1.58 -1.40 0.00 0.00 179.01 176.73 2fyh s HIS 185 N -4.66 -0.35 0.39 4.33 5.65 -1.26 -5.18 115.29 114.21 2fyh s HIS 185 Ca -0.10 0.19 0.08 0.00 0.25 0.00 0.00 55.06 55.48 2fyh s HIS 185 Cb 0.04 0.55 -0.04 0.00 -1.18 0.00 0.00 32.58 31.95 2fyh s HIS 185 CO 0.37 -0.60 0.22 -1.58 -0.65 0.00 0.00 174.74 172.50 2fyh s HIS 186 N -3.20 2.67 0.38 3.88 2.46 -1.26 -5.15 115.29 115.06 2fyh s HIS 186 Ca 0.05 -0.50 0.08 0.00 0.47 0.00 0.00 55.06 55.16 2fyh s HIS 186 Cb -0.01 -1.93 -0.06 0.00 -0.13 0.00 0.00 32.58 30.45 2fyh s HIS 186 CO -0.08 0.14 0.03 -1.58 -2.47 0.00 0.00 174.74 170.78 2fyh s HIS 187 N -2.52 2.53 -0.23 3.88 2.46 -1.26 -5.15 115.29 115.00 2fyh s HIS 187 Ca 0.42 -0.54 -0.30 0.00 0.47 0.00 0.00 55.06 55.11 2fyh s HIS 187 Cb 0.00 -1.65 0.16 0.00 -0.13 0.00 0.00 32.58 30.96 2fyh s HIS 187 CO 0.24 0.42 1.21 -1.58 -2.47 0.00 0.00 174.74 172.56 2fyh s HIS 188 N -2.60 -0.17 -0.56 3.88 5.04 -1.26 -5.00 115.29 114.61 2fyh s HIS 188 Ca 0.36 0.27 -0.03 0.00 -1.54 0.00 0.00 55.06 54.12 2fyh s HIS 188 Cb 0.04 0.48 0.00 0.00 0.04 0.00 0.00 32.58 33.14 2fyh s HIS 188 CO 0.19 -0.16 0.49 1.58 -2.34 0.00 0.00 174.74 174.50 2fyh n HIS 189 N 0.54 -1.17 0.00 3.88 -0.00 -1.26 -5.37 115.22 111.84 2fyh n HIS 189 Ca -0.04 0.43 0.00 0.00 -0.00 0.00 0.00 57.72 58.11 2fyh n HIS 189 Cb 0.58 -2.85 0.00 0.00 -0.00 0.00 0.00 29.99 27.73 2fyh n HIS 189 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06