#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yfi n ARG 2 N 0.00 3.41 -0.54 2.12 1.74 -1.26 -4.84 116.66 117.28 1yfi n ARG 2 Ca 0.00 -3.98 -0.29 0.00 -0.77 0.00 0.00 57.85 52.81 1yfi n ARG 2 Cb 0.00 -2.93 0.26 0.00 -1.02 0.00 0.00 32.46 28.77 1yfi n ARG 2 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1yfi s THR 3 N 0.93 1.71 0.19 0.55 -4.23 -1.26 -4.45 115.64 109.07 1yfi s THR 3 Ca 0.40 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.78 1yfi s THR 3 Cb -0.04 -2.11 0.13 0.00 1.34 0.00 0.00 72.50 71.82 1yfi s THR 3 CO -0.02 0.00 1.68 -0.08 -0.54 0.00 0.00 174.62 175.67 1yfi h GLU 4 N -2.89 0.10 -0.11 3.99 4.81 -1.99 0.15 114.58 118.63 1yfi h GLU 4 Ca -0.55 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 58.65 1yfi h GLU 4 Cb 1.34 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.69 1yfi h GLU 4 CO 0.43 0.07 -0.00 1.25 -0.73 0.00 0.00 179.01 180.02 1yfi h LEU 5 N 0.11 0.20 -1.15 1.64 5.85 -2.00 -2.38 115.31 117.58 1yfi h LEU 5 Ca 0.25 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1yfi h LEU 5 Cb 0.38 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1yfi h LEU 5 CO -0.42 0.47 0.30 -0.07 -0.34 0.00 0.00 178.44 178.37 1yfi h LEU 6 N -0.08 0.81 -0.12 2.25 3.38 -1.80 -1.54 115.31 118.20 1yfi h LEU 6 Ca 0.03 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1yfi h LEU 6 Cb 0.37 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1yfi h LEU 6 CO 0.01 0.69 0.05 -1.28 0.09 0.00 0.00 178.44 178.00 1yfi h SER 7 N 0.89 0.15 -0.96 -0.43 0.87 -0.68 0.90 113.55 114.30 1yfi h SER 7 Ca 0.22 -0.13 0.10 0.00 -1.23 0.00 0.00 61.79 60.75 1yfi h SER 7 Cb 0.10 -0.04 -0.07 0.00 -0.44 0.00 0.00 62.40 61.95 1yfi h SER 7 CO -0.03 0.24 0.61 0.50 -0.53 0.00 0.00 176.83 177.63 1yfi h LYS 8 N 0.05 0.95 -0.10 2.24 3.64 -1.00 -1.42 116.57 120.93 1yfi h LYS 8 Ca 0.04 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 1yfi h LYS 8 Cb 0.13 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1yfi h LYS 8 CO -0.00 0.63 -0.34 -0.07 -2.27 0.00 0.00 179.45 177.39 1yfi h LEU 9 N 0.98 0.48 -1.89 5.20 3.38 -0.75 0.15 115.31 122.87 1yfi h LEU 9 Ca 0.45 -0.61 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1yfi h LEU 9 Cb 0.40 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1yfi h LEU 9 CO -0.21 1.01 0.06 1.88 0.09 0.00 0.00 178.44 181.27 1yfi h TYR 10 N -0.02 0.13 0.01 1.13 -1.99 -0.49 0.25 116.97 115.99 1yfi h TYR 10 Ca -0.01 0.00 -0.23 0.00 2.00 0.00 0.00 58.73 60.49 1yfi h TYR 10 Cb 0.97 -0.04 0.02 0.00 2.00 0.00 0.00 36.73 39.67 1yfi h TYR 10 CO 0.11 0.09 -0.90 0.22 -0.00 0.00 0.00 178.16 177.69 1yfi h ASP 11 N 0.14 0.77 -0.86 3.88 3.58 -1.20 -0.96 116.42 121.77 1yfi h ASP 11 Ca 0.04 -0.76 -0.02 0.00 0.42 0.00 0.00 57.03 56.70 1yfi h ASP 11 Cb -0.01 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 40.77 1yfi h ASP 11 CO -0.01 1.43 0.44 0.44 -2.88 0.00 0.00 179.24 178.66 1yfi h ASP 12 N 0.19 1.10 -0.21 2.28 3.32 0.29 -1.84 116.42 121.54 1yfi h ASP 12 Ca -0.12 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1yfi h ASP 12 Cb 1.58 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1yfi h ASP 12 CO 0.18 0.90 0.00 0.49 -1.72 0.00 0.00 179.24 179.09 1yfi n PHE 13 N -4.34 0.28 -3.13 4.55 3.01 0.74 -4.92 117.46 113.65 1yfi n PHE 13 Ca 0.09 -0.14 -0.19 0.00 1.01 0.00 0.00 57.45 58.22 1yfi n PHE 13 Cb 0.12 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.58 1yfi n PHE 13 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1yfi n GLY 14 N 1.06 -0.48 0.40 1.37 0.00 -0.69 -4.81 105.19 102.04 1yfi n GLY 14 Ca 0.14 0.05 0.19 0.00 0.00 0.00 0.00 46.02 46.41 1yfi n GLY 14 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1yfi h ILE 15 N -0.60 0.69 0.00 -0.61 1.08 -1.48 -1.01 117.51 115.58 1yfi h ILE 15 Ca -0.34 -0.12 -0.10 0.00 -0.39 0.00 0.00 64.86 63.91 1yfi h ILE 15 Cb 1.23 0.29 -0.01 0.00 -3.07 0.00 0.00 36.82 35.26 1yfi h ILE 15 CO 0.43 0.07 -0.46 0.44 -0.69 0.00 0.00 178.15 177.94 1yfi h ASP 16 N 0.36 0.00 0.04 1.72 3.32 -1.88 -2.89 116.42 117.09 1yfi h ASP 16 Ca 0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.49 1yfi h ASP 16 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1yfi h ASP 16 CO -0.15 0.46 0.00 0.00 -1.72 0.00 0.00 179.24 177.83 1yfi n GLN 17 N -3.32 0.73 -3.34 3.56 3.00 -0.39 -4.71 117.38 112.92 1yfi n GLN 17 Ca 0.01 0.01 -0.39 0.00 -0.01 0.00 0.00 57.00 56.62 1yfi n GLN 17 Cb 0.66 -1.50 -0.07 0.00 0.00 0.00 0.00 30.24 29.32 1yfi n GLN 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1yfi s LEU 18 N -2.05 4.13 0.30 1.08 1.43 -1.09 -5.05 118.68 117.43 1yfi s LEU 18 Ca 0.36 0.54 -0.30 0.00 -1.03 0.00 0.00 54.13 53.70 1yfi s LEU 18 Cb 0.17 -2.57 -0.12 0.00 0.03 0.00 0.00 46.19 43.70 1yfi s LEU 18 CO 0.29 -0.13 1.49 -2.65 0.23 0.00 0.00 176.35 175.58 1yfi n PRO 19 N 4.72 2.45 -0.88 1.29 -0.02 -1.26 -4.85 135.00 136.46 1yfi n PRO 19 Ca -0.07 0.87 -0.16 0.00 -2.02 0.00 0.00 63.50 62.12 1yfi n PRO 19 Cb 0.51 -2.58 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 1yfi n PRO 19 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1yfi n HIS 20 N 1.56 0.61 -1.27 6.00 8.25 -1.26 -0.89 115.22 128.22 1yfi n HIS 20 Ca 0.08 -1.63 0.00 0.00 -0.26 0.00 0.00 57.72 55.91 1yfi n HIS 20 Cb 0.36 -1.60 0.00 0.00 1.12 0.00 0.00 29.99 29.87 1yfi n HIS 20 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1yfi n THR 21 N 3.00 0.00 -2.79 1.59 -2.24 -1.26 -4.93 114.28 107.65 1yfi n THR 21 Ca 0.43 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.79 1yfi n THR 21 Cb 0.56 0.13 0.01 0.00 -2.10 0.00 0.00 70.33 68.94 1yfi n THR 21 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1yfi n GLN 22 N 0.00 4.93 -0.06 -0.78 7.27 -0.07 -4.77 117.38 123.90 1yfi n GLN 22 Ca 0.00 -4.56 0.03 0.00 0.07 0.00 0.00 57.00 52.54 1yfi n GLN 22 Cb 0.09 -2.50 0.38 0.00 2.41 0.00 0.00 30.24 30.61 1yfi n GLN 22 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 1yfi h HIS 23 N 4.84 0.63 0.77 3.69 3.86 -1.92 -2.14 115.15 124.89 1yfi h HIS 23 Ca 0.38 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.56 1yfi h HIS 23 Cb 0.47 -0.21 0.01 0.00 1.06 0.00 0.00 27.41 28.73 1yfi h HIS 23 CO 1.19 0.40 -0.39 0.78 0.86 0.00 0.00 177.93 180.77 1yfi h GLY 24 N 0.68 -1.13 1.89 2.45 0.00 -1.98 -1.28 103.07 103.71 1yfi h GLY 24 Ca 0.19 0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.87 1yfi h GLY 24 CO -0.04 -0.41 -0.29 -2.08 0.00 0.00 0.00 176.54 173.72 1yfi h VAL 25 N -1.06 1.24 -0.46 4.60 2.07 -1.98 -2.50 116.25 118.16 1yfi h VAL 25 Ca -0.11 -1.13 -0.06 0.00 0.82 0.00 0.00 66.70 66.23 1yfi h VAL 25 Cb 0.82 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 1yfi h VAL 25 CO 0.16 0.33 0.05 0.74 0.02 0.00 0.00 177.57 178.88 1yfi h THR 26 N 0.11 1.22 -0.14 2.57 2.02 -1.33 -0.79 112.91 116.58 1yfi h THR 26 Ca 0.02 -0.86 -0.18 0.00 0.77 0.00 0.00 66.41 66.16 1yfi h THR 26 Cb 0.58 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1yfi h THR 26 CO 0.04 0.31 -0.65 -1.28 0.37 0.00 0.00 175.52 174.31 1yfi h SER 27 N 0.69 0.59 0.08 4.18 0.87 -0.80 -1.39 113.55 117.77 1yfi h SER 27 Ca 0.15 -0.36 -0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1yfi h SER 27 Cb 0.35 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1yfi h SER 27 CO 0.01 1.09 -0.04 0.44 -0.53 0.00 0.00 176.83 177.80 1yfi h ASP 28 N 0.37 -0.09 -0.17 6.23 3.32 -1.17 -1.62 116.42 123.29 1yfi h ASP 28 Ca -0.02 -0.26 0.04 0.00 0.02 0.00 0.00 57.03 56.82 1yfi h ASP 28 Cb 1.22 0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.74 1yfi h ASP 28 CO 0.12 0.22 -0.12 0.03 -1.72 0.00 0.00 179.24 177.77 1yfi h ARG 29 N -0.41 -0.11 -0.33 3.56 -0.00 -1.14 0.09 114.38 116.03 1yfi h ARG 29 Ca -0.01 0.01 0.04 0.00 -0.50 0.00 0.00 59.98 59.52 1yfi h ARG 29 Cb 0.35 0.03 -0.04 0.00 0.00 0.00 0.00 29.97 30.31 1yfi h ARG 29 CO 0.02 -0.07 0.08 -0.07 0.00 0.00 0.00 179.97 179.93 1yfi h LEU 30 N -0.12 0.05 -0.71 3.04 3.38 -1.27 0.96 115.31 120.65 1yfi h LEU 30 Ca 0.10 0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.20 1yfi h LEU 30 Cb 0.27 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.01 1yfi h LEU 30 CO -0.25 0.07 0.37 1.23 0.09 0.00 0.00 178.44 179.95 1yfi h GLY 31 N 0.21 1.06 1.69 0.83 0.00 -0.64 0.35 103.07 106.57 1yfi h GLY 31 Ca 0.15 -0.24 -0.18 0.00 0.00 0.00 0.00 47.33 47.05 1yfi h GLY 31 CO -0.18 0.10 -0.78 0.50 0.00 0.00 0.00 176.54 176.18 1yfi h LYS 32 N 0.65 0.30 -0.34 4.80 1.79 -0.23 -3.06 116.57 120.47 1yfi h LYS 32 Ca 0.34 -0.27 -0.05 0.00 -2.18 0.00 0.00 60.65 58.49 1yfi h LYS 32 Cb 0.31 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.01 1yfi h LYS 32 CO -0.24 0.94 0.00 1.25 -1.08 0.00 0.00 179.45 180.32 1yfi h LEU 33 N 0.19 0.58 -0.38 2.94 6.46 0.22 -2.76 115.31 122.57 1yfi h LEU 33 Ca -0.04 -0.31 0.00 0.00 -0.12 0.00 0.00 57.88 57.42 1yfi h LEU 33 Cb 1.36 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.13 1yfi h LEU 33 CO 0.13 0.75 0.00 -1.22 -0.62 0.00 0.00 178.44 177.47 1yfi n TYR 34 N -4.52 0.52 0.06 1.25 4.02 0.11 -1.64 117.16 116.96 1yfi n TYR 34 Ca -0.02 0.20 -0.12 0.00 -0.01 0.00 0.00 57.90 57.95 1yfi n TYR 34 Cb 0.27 -0.82 -0.13 0.00 -0.02 0.00 0.00 39.34 38.64 1yfi n TYR 34 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 1yfi h GLU 35 N 0.00 0.13 -0.33 -0.72 4.81 -1.41 -3.18 114.58 113.88 1yfi h GLU 35 Ca 0.00 -0.21 -0.14 0.00 -0.13 0.00 0.00 59.36 58.88 1yfi h GLU 35 Cb 0.36 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1yfi h GLU 35 CO 0.00 1.00 -0.35 -0.22 -0.73 0.00 0.00 179.01 178.71 1yfi h LYS 36 N 0.03 0.75 0.14 1.92 3.11 -1.06 -1.52 116.57 119.94 1yfi h LYS 36 Ca -0.14 -0.36 0.02 0.00 -2.81 0.00 0.00 60.65 57.35 1yfi h LYS 36 Cb 1.92 -0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 33.11 1yfi h LYS 36 CO 0.15 0.98 -0.28 -0.92 -2.81 0.00 0.00 179.45 176.57 1yfi h TYR 37 N 0.63 -0.75 -0.01 1.91 3.20 -1.35 0.51 116.97 121.11 1yfi h TYR 37 Ca 0.06 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.96 1yfi h TYR 37 Cb 0.88 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 39.45 1yfi h TYR 37 CO 0.05 -0.39 -0.05 0.82 -1.64 0.00 0.00 178.16 176.94 1yfi h ILE 38 N -0.51 0.86 -0.77 1.81 1.08 -1.51 -1.65 117.51 116.81 1yfi h ILE 38 Ca 0.03 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.60 1yfi h ILE 38 Cb 0.53 0.86 -0.08 0.00 -3.07 0.00 0.00 36.82 35.06 1yfi h ILE 38 CO -0.15 0.00 0.40 -0.07 -0.69 0.00 0.00 178.15 177.64 1yfi h LEU 39 N -0.09 0.52 -0.31 1.44 3.38 -0.75 -1.93 115.31 117.57 1yfi h LEU 39 Ca 0.02 0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1yfi h LEU 39 Cb 0.12 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1yfi h LEU 39 CO -0.06 0.28 -0.20 0.44 0.09 0.00 0.00 178.44 178.98 1yfi h ASP 40 N 0.65 0.71 -0.93 -0.43 3.32 0.27 -0.67 116.42 119.34 1yfi h ASP 40 Ca 0.39 -0.43 0.09 0.00 0.02 0.00 0.00 57.03 57.10 1yfi h ASP 40 Cb 0.44 -0.20 -0.07 0.00 0.22 0.00 0.00 39.33 39.73 1yfi h ASP 40 CO -0.29 0.99 0.60 0.40 -1.72 0.00 0.00 179.24 179.22 1yfi h ILE 41 N 0.44 0.98 -0.77 0.35 2.04 -0.86 -1.49 117.51 118.21 1yfi h ILE 41 Ca 0.06 -0.33 -0.50 0.00 1.00 0.00 0.00 64.86 65.09 1yfi h ILE 41 Cb 0.75 -0.06 -0.29 0.00 -0.74 0.00 0.00 36.82 36.48 1yfi h ILE 41 CO 0.06 0.17 0.13 0.49 0.00 0.00 0.00 178.15 179.00 1yfi n PHE 42 N -4.54 2.55 -0.18 1.37 3.01 -0.77 -3.31 117.46 115.60 1yfi n PHE 42 Ca 0.16 -2.33 -0.07 0.00 1.01 0.00 0.00 57.45 56.22 1yfi n PHE 42 Cb 0.29 -0.84 0.08 0.00 -0.01 0.00 0.00 39.48 39.00 1yfi n PHE 42 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1yfi h LYS 43 N 1.70 0.98 -2.59 -1.08 3.64 -0.01 -3.20 116.57 116.01 1yfi h LYS 43 Ca 0.45 -0.28 0.13 0.00 -1.27 0.00 0.00 60.65 59.68 1yfi h LYS 43 Cb 1.45 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 33.13 1yfi h LYS 43 CO 1.01 0.95 0.50 0.16 -2.27 0.00 0.00 179.45 179.79 1yfi s ASP 44 N -6.58 -0.04 0.38 4.20 3.84 -1.24 -4.13 116.67 113.10 1yfi s ASP 44 Ca -0.11 -0.71 0.08 0.00 -0.00 0.00 0.00 52.55 51.81 1yfi s ASP 44 Cb 0.14 0.57 0.77 0.00 -1.38 0.00 0.00 42.92 43.02 1yfi s ASP 44 CO 0.84 -1.12 1.95 -0.29 -0.00 0.00 0.00 175.17 176.55 1yfi h ILE 45 N 2.00 1.16 -0.42 2.11 6.09 -1.90 -1.65 117.51 124.89 1yfi h ILE 45 Ca -0.28 -0.60 -0.04 0.00 -1.37 0.00 0.00 64.86 62.58 1yfi h ILE 45 Cb 1.23 0.95 -0.02 0.00 0.47 0.00 0.00 36.82 39.45 1yfi h ILE 45 CO 0.34 0.20 0.11 -0.08 -3.07 0.00 0.00 178.15 175.66 1yfi h GLU 46 N 0.38 0.68 -0.21 2.19 4.81 -1.96 -1.84 114.58 118.62 1yfi h GLU 46 Ca 0.09 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1yfi h GLU 46 Cb 0.24 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1yfi h GLU 46 CO 0.00 0.68 0.06 0.77 -0.73 0.00 0.00 179.01 179.79 1yfi h SER 47 N 0.55 0.32 -0.09 1.04 0.02 -1.77 -2.02 113.55 111.60 1yfi h SER 47 Ca 0.13 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.87 1yfi h SER 47 Cb 0.31 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 1yfi h SER 47 CO 0.00 0.46 0.02 0.25 -1.14 0.00 0.00 176.83 176.42 1yfi h LEU 48 N 0.17 0.01 -0.79 5.07 5.85 -1.20 0.17 115.31 124.60 1yfi h LEU 48 Ca 0.07 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 1yfi h LEU 48 Cb 0.26 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1yfi h LEU 48 CO -0.00 0.02 0.30 0.11 -0.34 0.00 0.00 178.44 178.54 1yfi h LYS 49 N 0.06 1.18 -0.04 1.25 1.57 -1.37 -2.29 116.57 116.93 1yfi h LYS 49 Ca 0.04 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 1yfi h LYS 49 Cb 0.03 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.15 1yfi h LYS 49 CO -0.05 0.97 0.01 -0.22 -0.57 0.00 0.00 179.45 179.59 1yfi h LYS 50 N 1.15 0.07 0.00 3.15 3.64 -1.01 -2.92 116.57 120.64 1yfi h LYS 50 Ca 0.26 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1yfi h LYS 50 Cb 0.23 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1yfi h LYS 50 CO -0.02 0.27 0.00 0.66 -2.27 0.00 0.00 179.45 178.09 1yfi n TYR 51 N -4.94 0.00 0.77 1.91 0.53 0.58 -2.74 117.16 113.28 1yfi n TYR 51 Ca -0.07 0.00 0.10 0.00 -1.02 0.00 0.00 57.90 56.92 1yfi n TYR 51 Cb 0.14 0.00 -0.09 0.00 -1.03 0.00 0.00 39.34 38.35 1yfi n TYR 51 CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 1yfi n ASN 52 N -0.92 0.75 -4.84 7.72 5.15 -0.87 -1.23 115.26 121.03 1yfi n ASN 52 Ca 0.16 -0.70 -0.32 0.00 -0.60 0.00 0.00 54.58 53.12 1yfi n ASN 52 Cb 0.07 1.12 -0.05 0.00 -0.53 0.00 0.00 39.78 40.39 1yfi n ASN 52 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1yfi s THR 53 N -3.11 4.55 -1.82 -0.44 -4.23 -1.11 -4.83 115.64 104.64 1yfi s THR 53 Ca 0.05 1.16 0.00 0.00 -1.18 0.00 0.00 61.69 61.72 1yfi s THR 53 Cb 0.16 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 70.33 1yfi s THR 53 CO 0.86 -0.45 0.26 0.59 -0.54 0.00 0.00 174.62 175.34 1yfi n ASN 54 N -1.01 0.00 0.12 3.99 3.02 -1.26 -1.21 115.26 118.91 1yfi n ASN 54 Ca 0.05 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.65 1yfi n ASN 54 Cb 0.54 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.73 1yfi n ASN 54 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yfi h ALA 55 N 1.43 0.70 -2.24 5.41 0.00 -1.91 -3.37 119.26 119.28 1yfi h ALA 55 Ca 0.00 -0.43 -0.60 0.00 0.00 0.00 0.00 54.91 53.88 1yfi h ALA 55 Cb 0.00 0.02 -0.41 0.00 0.00 0.00 0.00 17.79 17.40 1yfi h ALA 55 CO 0.00 0.54 -0.67 1.19 0.00 0.00 0.00 179.25 180.31 1yfi n PHE 56 N -3.07 2.97 -0.36 0.00 3.01 -0.35 -4.97 117.46 114.69 1yfi n PHE 56 Ca -0.01 -4.07 0.02 0.00 1.01 0.00 0.00 57.45 54.40 1yfi n PHE 56 Cb 0.71 -0.52 0.09 0.00 -0.01 0.00 0.00 39.48 39.74 1yfi n PHE 56 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1yfi h PRO 57 N 4.27 -0.01 0.41 -1.08 0.11 -1.76 0.10 132.00 134.05 1yfi h PRO 57 Ca 0.18 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.27 1yfi h PRO 57 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1yfi h PRO 57 CO 0.77 -0.00 -0.20 0.37 -0.21 0.00 0.00 178.00 178.72 1yfi h GLN 58 N -0.01 -0.53 -0.49 1.05 4.15 -1.94 -0.75 115.11 116.59 1yfi h GLN 58 Ca 0.40 0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.89 1yfi h GLN 58 Cb 0.65 0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.44 1yfi h GLN 58 CO -0.98 -0.23 0.33 0.93 -1.93 0.00 0.00 178.83 176.94 1yfi h GLU 59 N -0.86 0.55 -0.62 1.69 3.07 -1.74 -0.82 114.58 115.86 1yfi h GLU 59 Ca -0.06 -0.03 -0.09 0.00 -0.50 0.00 0.00 59.36 58.68 1yfi h GLU 59 Cb 0.55 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 1yfi h GLU 59 CO 0.09 0.37 0.04 -0.22 -1.40 0.00 0.00 179.01 177.89 1yfi h LYS 60 N 0.57 1.05 -0.30 2.33 3.64 0.65 -0.68 116.57 123.83 1yfi h LYS 60 Ca 0.20 -0.30 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 1yfi h LYS 60 Cb 0.08 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1yfi h LYS 60 CO -0.05 1.00 0.15 0.22 -2.27 0.00 0.00 179.45 178.50 1yfi h ASP 61 N 0.97 0.38 0.19 4.20 3.58 0.26 -0.72 116.42 125.28 1yfi h ASP 61 Ca 0.18 -0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.52 1yfi h ASP 61 Cb 0.50 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.45 1yfi h ASP 61 CO 0.02 0.38 -0.09 0.40 -2.88 0.00 0.00 179.24 177.07 1yfi h ILE 62 N 0.36 0.83 -0.89 2.25 2.04 -1.10 -1.16 117.51 119.84 1yfi h ILE 62 Ca 0.10 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 1yfi h ILE 62 Cb 0.09 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 1yfi h ILE 62 CO -0.01 0.02 0.47 0.77 0.00 0.00 0.00 178.15 179.40 1yfi h SER 63 N -0.30 1.12 -0.63 1.72 4.64 -1.08 -1.53 113.55 117.49 1yfi h SER 63 Ca -0.03 -0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.17 1yfi h SER 63 Cb 0.23 -0.29 -0.03 0.00 -0.31 0.00 0.00 62.40 62.00 1yfi h SER 63 CO 0.04 0.91 0.35 0.28 -0.87 0.00 0.00 176.83 177.55 1yfi h SER 64 N 1.25 0.79 -0.67 4.97 0.02 -0.93 -0.15 113.55 118.83 1yfi h SER 64 Ca 0.31 -0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 61.15 1yfi h SER 64 Cb 0.05 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 1yfi h SER 64 CO -0.05 0.65 0.32 0.11 -1.14 0.00 0.00 176.83 176.72 1yfi h LYS 65 N 0.86 0.97 0.59 3.45 1.57 -0.76 0.54 116.57 123.78 1yfi h LYS 65 Ca 0.22 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1yfi h LYS 65 Cb 0.03 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.18 1yfi h LYS 65 CO -0.04 0.77 -0.28 1.25 -0.57 0.00 0.00 179.45 180.58 1yfi h LEU 66 N 0.93 -0.67 -0.90 2.94 6.46 -0.80 -1.26 115.31 122.03 1yfi h LEU 66 Ca 0.23 -0.02 0.08 0.00 -0.12 0.00 0.00 57.88 58.04 1yfi h LEU 66 Cb 0.13 0.17 -0.07 0.00 -0.73 0.00 0.00 40.66 40.16 1yfi h LEU 66 CO -0.03 -0.39 0.55 -0.07 -0.62 0.00 0.00 178.44 177.89 1yfi h LEU 67 N -0.92 0.85 -1.07 2.25 3.38 -0.98 -1.67 115.31 117.16 1yfi h LEU 67 Ca -0.08 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1yfi h LEU 67 Cb 0.65 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1yfi h LEU 67 CO 0.13 0.52 0.21 0.50 0.09 0.00 0.00 178.44 179.89 1yfi h LYS 68 N 0.97 0.87 0.00 1.13 3.64 -0.78 0.12 116.57 122.52 1yfi h LYS 68 Ca 0.41 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1yfi h LYS 68 Cb 0.25 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1yfi h LYS 68 CO -0.20 0.74 -0.10 0.00 -2.27 0.00 0.00 179.45 177.62 1yfi h ALA 69 N 1.37 1.14 -0.02 5.00 0.00 -0.28 -2.04 119.26 124.44 1yfi h ALA 69 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1yfi h ALA 69 Cb 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1yfi h ALA 69 CO -0.01 0.13 -0.31 1.28 0.00 0.00 0.00 179.25 180.33 1yfi n LEU 70 N -3.41 2.06 -3.67 0.00 4.77 -0.67 -4.55 117.00 111.53 1yfi n LEU 70 Ca -0.01 -0.82 -0.23 0.00 -0.03 0.00 0.00 56.01 54.92 1yfi n LEU 70 Cb 0.27 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.41 1yfi n LEU 70 CO 0.29 0.38 0.06 0.59 -1.33 0.00 0.00 177.39 177.38 1yfi n ASN 71 N 0.24 -3.03 -4.57 -1.43 3.02 0.31 -5.00 115.26 104.81 1yfi n ASN 71 Ca 0.09 -0.72 -0.30 0.00 -0.03 0.00 0.00 54.58 53.62 1yfi n ASN 71 Cb 0.44 -4.43 -0.10 0.00 -0.61 0.00 0.00 39.78 35.07 1yfi n ASN 71 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1yfi s LEU 72 N -6.84 3.01 -0.12 3.41 1.43 -0.62 -5.03 118.68 113.92 1yfi s LEU 72 Ca 0.24 -0.35 -0.03 0.00 -1.03 0.00 0.00 54.13 52.97 1yfi s LEU 72 Cb -0.12 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 1yfi s LEU 72 CO 0.78 0.21 -0.02 -1.81 0.23 0.00 0.00 176.35 175.74 1yfi s ASP 73 N -1.96 4.98 0.54 2.29 1.11 -1.26 -4.50 116.67 117.87 1yfi s ASP 73 Ca 0.20 -0.01 0.23 0.00 0.18 0.00 0.00 52.55 53.15 1yfi s ASP 73 Cb -0.11 -1.60 1.41 0.00 1.07 0.00 0.00 42.92 43.69 1yfi s ASP 73 CO 0.11 0.27 2.08 0.25 1.18 0.00 0.00 175.17 179.07 1yfi h LEU 74 N 5.96 0.00 -2.10 1.23 5.85 -1.98 -1.52 115.31 122.76 1yfi h LEU 74 Ca -0.41 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 1yfi h LEU 74 Cb 1.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 1yfi h LEU 74 CO 0.59 0.00 -0.03 -2.24 -0.34 0.00 0.00 178.44 176.42 1yfi h ASP 75 N 0.00 0.00 0.63 1.25 2.03 -2.05 -2.60 116.42 115.69 1yfi h ASP 75 Ca 0.12 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.42 1yfi h ASP 75 Cb 0.50 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.00 1yfi h ASP 75 CO -0.00 0.03 -0.89 -3.20 -1.03 0.00 0.00 179.24 174.15 1yfi n ASN 76 N -3.23 0.65 -4.62 4.15 5.15 -0.57 -4.88 115.26 111.90 1yfi n ASN 76 Ca -0.01 -0.04 -0.42 0.00 -0.60 0.00 0.00 54.58 53.50 1yfi n ASN 76 Cb 0.21 0.55 -0.03 0.00 -0.53 0.00 0.00 39.78 39.98 1yfi n ASN 76 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1yfi s ILE 77 N -3.21 4.64 -0.12 -1.44 1.01 -0.98 -1.27 121.20 119.83 1yfi s ILE 77 Ca 0.04 1.46 -0.09 0.00 0.00 0.00 0.00 60.65 62.06 1yfi s ILE 77 Cb 0.14 -4.30 -0.26 0.00 0.01 0.00 0.00 42.46 38.05 1yfi s ILE 77 CO 0.77 -0.39 0.40 0.40 0.00 0.00 0.00 174.94 176.12 1yfi h ILE 78 N 5.68 0.70 -3.92 2.92 1.08 -0.11 -3.48 117.51 120.39 1yfi h ILE 78 Ca -0.22 -2.35 -0.11 0.00 -0.39 0.00 0.00 64.86 61.78 1yfi h ILE 78 Cb 1.08 2.53 -0.16 0.00 -3.07 0.00 0.00 36.82 37.19 1yfi h ILE 78 CO 0.97 0.84 -0.52 -0.62 -0.69 0.00 0.00 178.15 178.12 1yfi s ASP 79 N -7.06 0.25 -0.04 1.72 2.15 -0.77 -4.89 116.67 108.02 1yfi s ASP 79 Ca -0.22 -0.69 -0.13 0.00 0.43 0.00 0.00 52.55 51.94 1yfi s ASP 79 Cb 0.06 0.25 0.02 0.00 -0.30 0.00 0.00 42.92 42.96 1yfi s ASP 79 CO 0.77 -0.59 0.30 0.54 -0.17 0.00 0.00 175.17 176.02 1yfi s VAL 80 N -3.29 0.04 0.07 1.11 0.11 -1.26 -0.55 120.40 116.63 1yfi s VAL 80 Ca 0.01 -0.35 -0.09 0.00 -2.93 0.00 0.00 61.98 58.62 1yfi s VAL 80 Cb 0.03 -0.56 -0.00 0.00 -1.53 0.00 0.00 36.38 34.32 1yfi s VAL 80 CO -0.08 -0.19 0.19 -0.94 -3.33 0.00 0.00 175.10 170.75 1yfi s SER 81 N -0.90 0.09 0.07 3.54 1.04 -0.95 -3.54 113.70 113.04 1yfi s SER 81 Ca -0.10 -0.55 -0.13 0.00 0.48 0.00 0.00 55.95 55.65 1yfi s SER 81 Cb -0.05 0.32 0.02 0.00 0.10 0.00 0.00 66.02 66.41 1yfi s SER 81 CO 0.03 -0.66 0.29 -0.94 0.98 0.00 0.00 173.24 172.94 1yfi s SER 82 N -2.57 -0.08 0.02 7.02 1.04 -1.21 -1.15 113.70 116.76 1yfi s SER 82 Ca 0.01 -0.34 -0.28 0.00 0.48 0.00 0.00 55.95 55.83 1yfi s SER 82 Cb 0.03 0.37 0.10 0.00 0.10 0.00 0.00 66.02 66.62 1yfi s SER 82 CO -0.08 -0.69 0.88 -0.94 0.98 0.00 0.00 173.24 173.39 1yfi s SER 83 N -2.40 -0.36 0.14 7.02 1.04 -0.88 -4.96 113.70 113.30 1yfi s SER 83 Ca -0.01 -0.03 -0.30 0.00 0.48 0.00 0.00 55.95 56.08 1yfi s SER 83 Cb 0.01 0.40 -0.07 0.00 0.10 0.00 0.00 66.02 66.46 1yfi s SER 83 CO -0.07 -0.66 1.13 -0.62 0.98 0.00 0.00 173.24 174.00 1yfi s ASP 84 N -2.53 7.20 0.06 7.02 3.68 -1.26 -1.58 116.67 129.26 1yfi s ASP 84 Ca 0.05 2.07 -0.19 0.00 2.13 0.00 0.00 52.55 56.62 1yfi s ASP 84 Cb -0.01 -2.60 -0.06 0.00 -1.45 0.00 0.00 42.92 38.80 1yfi s ASP 84 CO -0.08 -0.30 0.54 -0.89 0.13 0.00 0.00 175.17 174.57 1yfi s THR 85 N 0.13 4.79 -0.40 1.71 2.01 -0.68 -4.86 115.64 118.35 1yfi s THR 85 Ca 0.52 1.15 0.02 0.00 0.31 0.00 0.00 61.69 63.69 1yfi s THR 85 Cb -0.29 -3.87 0.19 0.00 0.01 0.00 0.00 72.50 68.54 1yfi s THR 85 CO 0.34 0.56 0.80 -0.62 -0.69 0.00 0.00 174.62 175.00 1yfi s ASP 86 N -1.08 -1.09 0.00 3.53 2.15 -1.26 -4.70 116.67 114.22 1yfi s ASP 86 Ca 0.28 -0.77 0.26 0.00 0.43 0.00 0.00 52.55 52.75 1yfi s ASP 86 Cb -0.19 1.41 0.70 0.00 -0.30 0.00 0.00 42.92 44.54 1yfi s ASP 86 CO 0.18 -0.10 1.55 0.18 -0.17 0.00 0.00 175.17 176.81 1yfi n LEU 87 N 3.76 0.41 -3.86 -1.34 4.77 -1.26 -4.98 117.00 114.50 1yfi n LEU 87 Ca 0.11 0.10 -0.29 0.00 -0.03 0.00 0.00 56.01 55.90 1yfi n LEU 87 Cb 0.59 -0.30 0.01 0.00 -2.33 0.00 0.00 43.42 41.39 1yfi n LEU 87 CO -0.04 0.10 -0.17 0.61 -1.33 0.00 0.00 177.39 176.56 1yfi n GLY 88 N 1.49 -0.53 3.62 -0.72 0.00 -1.26 -4.96 105.19 102.82 1yfi n GLY 88 Ca 0.06 0.27 -0.12 0.00 0.00 0.00 0.00 46.02 46.23 1yfi n GLY 88 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1yfi s ARG 89 N -6.39 0.66 0.21 1.61 1.70 -1.26 -5.17 118.95 110.31 1yfi s ARG 89 Ca 0.20 0.64 0.05 0.00 -0.47 0.00 0.00 55.73 56.14 1yfi s ARG 89 Cb -0.08 0.32 -0.03 0.00 -0.57 0.00 0.00 34.95 34.59 1yfi s ARG 89 CO 0.88 -0.11 0.29 0.95 -1.08 0.00 0.00 175.30 176.23 1yfi s THR 90 N -0.00 5.03 0.00 4.99 -4.23 -1.26 -4.36 115.64 115.81 1yfi s THR 90 Ca 0.00 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.50 1yfi s THR 90 Cb -0.04 -3.68 0.00 0.00 1.34 0.00 0.00 72.50 70.12 1yfi s THR 90 CO -0.02 -0.26 0.00 2.30 -0.54 0.00 0.00 174.62 176.11 1yfi n ILE 91 N -1.05 0.00 -1.61 2.99 -5.35 0.16 -4.95 119.36 109.54 1yfi n ILE 91 Ca -0.08 0.00 -0.40 0.00 -0.27 0.00 0.00 62.75 62.00 1yfi n ILE 91 Cb 0.56 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 38.43 1yfi n ILE 91 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1yfi s ALA 92 N -2.00 2.22 0.00 -1.28 0.00 -1.26 -0.62 121.76 118.82 1yfi s ALA 92 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.34 1yfi s ALA 92 Cb 0.00 -4.20 0.00 0.00 0.00 0.00 0.00 23.12 18.92 1yfi s ALA 92 CO 0.00 -3.57 0.00 0.41 0.00 0.00 0.00 175.76 172.60 1yfi n GLY 93 N 5.86 1.14 0.00 0.00 0.00 -1.26 -4.94 105.19 105.99 1yfi n GLY 93 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1yfi n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yfi n GLY 94 N -0.47 -0.03 3.77 -0.02 0.00 0.21 -5.03 105.19 103.61 1yfi n GLY 94 Ca 0.00 -2.14 -0.40 0.00 0.00 0.00 0.00 46.02 43.48 1yfi n GLY 94 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yfi s SER 95 N -4.00 6.48 0.47 1.61 0.01 -1.26 -0.67 113.70 116.34 1yfi s SER 95 Ca 0.00 2.60 -0.25 0.00 1.31 0.00 0.00 55.95 59.61 1yfi s SER 95 Cb 0.00 -2.64 -0.08 0.00 0.21 0.00 0.00 66.02 63.52 1yfi s SER 95 CO 0.00 -0.73 1.43 -2.84 0.41 0.00 0.00 173.24 171.51 1yfi s PRO 96 N -2.12 3.60 0.00 12.44 0.02 -1.26 -4.88 135.00 142.80 1yfi s PRO 96 Ca 0.55 2.42 0.19 0.00 0.02 0.00 0.00 61.00 64.17 1yfi s PRO 96 Cb -0.37 -2.60 1.15 0.00 0.02 0.00 0.00 34.50 32.69 1yfi s PRO 96 CO 0.48 -0.89 1.66 1.63 -0.33 0.00 0.00 177.00 179.55 1yfi n LYS 97 N -0.31 0.88 -2.34 5.54 4.76 -1.26 -4.80 118.16 120.62 1yfi n LYS 97 Ca 0.06 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.07 1yfi n LYS 97 Cb 0.42 -1.34 -0.02 0.00 -1.84 0.00 0.00 35.03 32.24 1yfi n LYS 97 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1yfi s THR 98 N -2.00 4.06 -0.12 -0.18 2.01 -1.26 -4.59 115.64 113.56 1yfi s THR 98 Ca 0.29 1.23 0.17 0.00 0.31 0.00 0.00 61.69 63.69 1yfi s THR 98 Cb 0.13 -3.98 -0.17 0.00 0.01 0.00 0.00 72.50 68.50 1yfi s THR 98 CO 0.22 -0.31 0.70 0.47 -0.69 0.00 0.00 174.62 175.02 1yfi n ASP 99 N 7.44 0.69 -3.66 3.53 8.00 0.56 -4.72 116.55 128.39 1yfi n ASP 99 Ca 0.15 0.30 -0.04 0.00 0.71 0.00 0.00 54.79 55.92 1yfi n ASP 99 Cb 0.46 0.40 -0.01 0.00 -0.02 0.00 0.00 41.12 41.94 1yfi n ASP 99 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yfi s ALA 100 N -2.92 -1.83 0.20 2.24 0.00 -1.13 -1.68 121.76 116.64 1yfi s ALA 100 Ca -0.04 0.54 0.03 0.00 0.00 0.00 0.00 51.96 52.49 1yfi s ALA 100 Cb 0.09 0.48 -0.05 0.00 0.00 0.00 0.00 23.12 23.64 1yfi s ALA 100 CO 0.82 -0.93 -0.01 0.95 0.00 0.00 0.00 175.76 176.59 1yfi s THR 101 N -3.03 0.92 -0.03 0.00 -4.23 -0.61 0.14 115.64 108.79 1yfi s THR 101 Ca 0.11 -2.02 -0.01 0.00 -1.18 0.00 0.00 61.69 58.59 1yfi s THR 101 Cb -0.00 -2.22 0.03 0.00 1.34 0.00 0.00 72.50 71.65 1yfi s THR 101 CO -0.02 -0.41 0.06 -0.63 -0.54 0.00 0.00 174.62 173.07 1yfi s ILE 102 N -3.50 -0.09 -0.21 2.99 1.01 -0.67 -2.07 121.20 118.66 1yfi s ILE 102 Ca 0.26 0.31 -0.05 0.00 0.00 0.00 0.00 60.65 61.17 1yfi s ILE 102 Cb 0.05 -0.13 -0.02 0.00 0.01 0.00 0.00 42.46 42.37 1yfi s ILE 102 CO 0.06 0.13 -0.00 -0.60 0.00 0.00 0.00 174.94 174.53 1yfi s ARG 103 N 1.59 3.56 -0.09 2.79 3.52 -0.30 -0.90 118.95 129.11 1yfi s ARG 103 Ca -0.03 -0.54 -0.04 0.00 -0.13 0.00 0.00 55.73 54.98 1yfi s ARG 103 Cb -0.12 -3.09 -0.04 0.00 -1.56 0.00 0.00 34.95 30.14 1yfi s ARG 103 CO -0.03 -0.06 0.09 -0.06 -0.81 0.00 0.00 175.30 174.42 1yfi s PHE 104 N 1.19 3.42 -0.16 5.12 0.40 -0.65 -2.25 117.98 125.05 1yfi s PHE 104 Ca 0.03 0.38 0.01 0.00 -0.60 0.00 0.00 56.93 56.75 1yfi s PHE 104 Cb -0.15 -1.87 0.01 0.00 0.51 0.00 0.00 43.02 41.53 1yfi s PHE 104 CO 0.01 0.63 -0.20 0.99 0.70 0.00 0.00 175.22 177.34 1yfi s THR 105 N -1.01 2.13 0.69 0.64 2.01 0.28 -1.06 115.64 119.34 1yfi s THR 105 Ca 0.16 -0.93 -0.01 0.00 0.31 0.00 0.00 61.69 61.21 1yfi s THR 105 Cb -0.12 -1.88 0.11 0.00 0.01 0.00 0.00 72.50 70.62 1yfi s THR 105 CO 0.05 0.54 0.96 -0.36 -0.69 0.00 0.00 174.62 175.12 1yfi s PHE 106 N 1.08 1.87 0.16 4.92 0.40 -0.24 0.57 117.98 126.75 1yfi s PHE 106 Ca -0.00 -0.19 -0.21 0.00 -0.60 0.00 0.00 56.93 55.93 1yfi s PHE 106 Cb -0.14 -2.98 0.06 0.00 0.51 0.00 0.00 43.02 40.47 1yfi s PHE 106 CO -0.08 -1.57 1.63 1.25 0.70 0.00 0.00 175.22 177.16 1yfi h HIS 107 N -0.45 -0.61 0.00 0.36 2.76 -1.50 0.86 115.15 116.57 1yfi h HIS 107 Ca -0.38 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 57.83 1yfi h HIS 107 Cb 1.27 0.32 0.00 0.00 1.55 0.00 0.00 27.41 30.55 1yfi h HIS 107 CO -0.09 -0.31 0.00 0.27 -1.30 0.00 0.00 177.93 176.51 1yfi n ASN 108 N -5.38 0.00 0.00 3.26 0.23 -1.26 -4.80 115.26 107.31 1yfi n ASN 108 Ca 0.01 -0.53 0.00 0.00 -0.53 0.00 0.00 54.58 53.53 1yfi n ASN 108 Cb 0.29 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.99 1yfi n ASN 108 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1yfi n GLN 109 N -0.68 0.00 -1.17 -3.83 1.13 0.30 -5.02 117.38 108.11 1yfi n GLN 109 Ca 0.03 0.00 -0.29 0.00 -1.94 0.00 0.00 57.00 54.80 1yfi n GLN 109 Cb 0.01 -2.17 0.18 0.00 0.11 0.00 0.00 30.24 28.37 1yfi n GLN 109 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1yfi s SER 110 N -3.43 2.56 0.23 1.08 1.04 -1.26 -4.67 113.70 109.24 1yfi s SER 110 Ca 0.00 1.17 0.00 0.00 0.48 0.00 0.00 55.95 57.60 1yfi s SER 110 Cb 0.00 -1.83 -0.04 0.00 0.10 0.00 0.00 66.02 64.25 1yfi s SER 110 CO 0.00 -3.17 0.14 -0.94 0.98 0.00 0.00 173.24 170.25 1yfi s SER 111 N -3.46 0.53 -0.04 7.02 1.04 -1.26 -1.08 113.70 116.45 1yfi s SER 111 Ca 0.65 -1.44 -0.01 0.00 0.48 0.00 0.00 55.95 55.64 1yfi s SER 111 Cb -0.19 0.37 0.03 0.00 0.10 0.00 0.00 66.02 66.33 1yfi s SER 111 CO 0.58 -0.85 0.03 -0.60 0.98 0.00 0.00 173.24 173.38 1yfi s ARG 112 N -4.05 0.09 -0.15 4.02 3.00 -0.22 -4.97 118.95 116.66 1yfi s ARG 112 Ca 0.39 0.24 -0.20 0.00 -1.00 0.00 0.00 55.73 55.16 1yfi s ARG 112 Cb 0.07 -0.50 -0.03 0.00 0.00 0.00 0.00 34.95 34.48 1yfi s ARG 112 CO 0.14 -0.25 0.59 -1.17 0.00 0.00 0.00 175.30 174.61 1yfi s LEU 113 N 1.68 4.21 -0.40 -0.88 2.96 -1.26 -1.63 118.68 123.36 1yfi s LEU 113 Ca -0.01 0.88 0.04 0.00 -0.22 0.00 0.00 54.13 54.82 1yfi s LEU 113 Cb -0.13 -2.86 0.11 0.00 0.50 0.00 0.00 46.19 43.82 1yfi s LEU 113 CO -0.03 -0.16 0.13 -0.69 -1.32 0.00 0.00 176.35 174.28 1yfi s VAL 114 N 1.33 2.23 0.30 1.68 1.01 -0.08 -3.63 120.40 123.23 1yfi s VAL 114 Ca 0.29 -2.61 -0.29 0.00 0.00 0.00 0.00 61.98 59.38 1yfi s VAL 114 Cb -0.16 -2.62 -0.09 0.00 0.00 0.00 0.00 36.38 33.51 1yfi s VAL 114 CO 0.12 -0.68 1.11 -2.16 0.00 0.00 0.00 175.10 173.48 1yfi s PRO 115 N 0.54 4.56 0.27 2.72 0.04 -1.26 -1.67 135.00 140.19 1yfi s PRO 115 Ca 0.13 1.80 0.11 0.00 0.04 0.00 0.00 61.00 63.09 1yfi s PRO 115 Cb -0.21 -3.10 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 1yfi s PRO 115 CO -0.06 0.14 -0.19 -0.51 0.04 0.00 0.00 177.00 176.42 1yfi s LEU 116 N -1.62 2.59 -0.10 -3.56 1.43 0.38 -0.85 118.68 116.94 1yfi s LEU 116 Ca 0.46 -1.03 -0.00 0.00 -1.03 0.00 0.00 54.13 52.53 1yfi s LEU 116 Cb -0.31 -1.03 0.02 0.00 0.03 0.00 0.00 46.19 44.90 1yfi s LEU 116 CO 0.40 -0.00 -0.08 0.21 0.23 0.00 0.00 176.35 177.11 1yfi s ASN 117 N -3.48 2.08 -0.04 2.29 3.84 -0.88 -0.32 114.94 118.42 1yfi s ASN 117 Ca 0.29 -0.29 0.06 0.00 0.21 0.00 0.00 52.86 53.12 1yfi s ASN 117 Cb -0.04 -0.82 -0.01 0.00 -0.55 0.00 0.00 41.25 39.83 1yfi s ASN 117 CO 0.14 -0.10 -0.22 -0.63 -2.79 0.00 0.00 177.10 173.50 1yfi s ILE 118 N 1.54 1.81 0.12 -5.21 1.01 -1.26 0.15 121.20 119.36 1yfi s ILE 118 Ca 0.02 -0.94 -0.04 0.00 0.00 0.00 0.00 60.65 59.68 1yfi s ILE 118 Cb -0.13 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.79 1yfi s ILE 118 CO -0.06 0.51 0.12 -0.54 0.00 0.00 0.00 174.94 174.97 1yfi s LYS 119 N -0.21 0.91 0.06 2.79 1.02 -0.57 -4.99 119.74 118.75 1yfi s LYS 119 Ca -0.00 -1.25 0.05 0.00 0.02 0.00 0.00 55.97 54.78 1yfi s LYS 119 Cb -0.12 0.29 -0.03 0.00 -0.52 0.00 0.00 37.83 37.45 1yfi s LYS 119 CO 0.02 -0.27 -0.13 -3.38 -0.92 0.00 0.00 175.35 170.66 1yfi s HIS 120 N -3.97 1.16 -0.19 3.18 -3.43 -1.26 -1.17 115.29 109.61 1yfi s HIS 120 Ca 0.16 -0.44 -0.30 0.00 -0.80 0.00 0.00 55.06 53.68 1yfi s HIS 120 Cb 0.06 -0.66 0.14 0.00 -1.43 0.00 0.00 32.58 30.69 1yfi s HIS 120 CO -0.03 0.04 1.09 0.45 -2.00 0.00 0.00 174.74 174.29 1yfi s SER 121 N -1.62 -0.28 0.00 7.38 0.15 -0.50 -4.93 113.70 113.89 1yfi s SER 121 Ca -0.02 0.31 0.28 0.00 0.70 0.00 0.00 55.95 57.22 1yfi s SER 121 Cb -0.10 0.23 1.03 0.00 -1.71 0.00 0.00 66.02 65.48 1yfi s SER 121 CO 0.02 -0.26 1.73 -1.54 1.20 0.00 0.00 173.24 174.39 1yfi n SER 122 N 0.67 1.38 -4.48 5.45 3.41 -1.17 -1.04 113.62 117.84 1yfi n SER 122 Ca -0.08 -1.38 -0.24 0.00 -0.26 0.00 0.00 58.87 56.91 1yfi n SER 122 Cb 0.58 0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 64.45 1yfi n SER 122 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1yfi s LYS 123 N -2.08 1.71 0.47 4.33 1.02 -1.26 -4.89 119.74 119.03 1yfi s LYS 123 Ca 0.36 -1.80 0.27 0.00 0.02 0.00 0.00 55.97 54.82 1yfi s LYS 123 Cb 0.21 -1.75 0.78 0.00 -0.52 0.00 0.00 37.83 36.55 1yfi s LYS 123 CO 0.36 0.29 1.77 0.87 -0.92 0.00 0.00 175.35 177.72 1yfi h LYS 124 N 2.22 0.00 -5.48 1.68 1.57 -1.95 -3.43 116.57 111.17 1yfi h LYS 124 Ca -0.40 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.86 1yfi h LYS 124 Cb 1.26 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.28 1yfi h LYS 124 CO 0.62 0.00 -0.82 0.15 -0.57 0.00 0.00 179.45 178.83 1yfi s LYS 125 N -3.39 1.29 0.18 3.15 1.02 -1.26 -4.96 119.74 115.77 1yfi s LYS 125 Ca 0.05 -0.57 -0.05 0.00 0.02 0.00 0.00 55.97 55.42 1yfi s LYS 125 Cb 0.07 -1.24 -0.02 0.00 -0.52 0.00 0.00 37.83 36.11 1yfi s LYS 125 CO 0.61 0.34 0.22 0.54 -0.92 0.00 0.00 175.35 176.14 1yfi s VAL 126 N -0.37 0.04 0.24 3.17 0.11 -0.45 -4.86 120.40 118.28 1yfi s VAL 126 Ca 0.06 -1.70 -0.31 0.00 -2.93 0.00 0.00 61.98 57.10 1yfi s VAL 126 Cb -0.06 -2.15 -0.11 0.00 -1.53 0.00 0.00 36.38 32.52 1yfi s VAL 126 CO -0.01 -0.20 1.62 -0.44 -3.33 0.00 0.00 175.10 172.75 1yfi s SER 127 N -3.05 6.42 -0.05 3.54 0.01 -1.26 -0.60 113.70 118.72 1yfi s SER 127 Ca 0.26 2.86 0.06 0.00 1.31 0.00 0.00 55.95 60.44 1yfi s SER 127 Cb 0.05 -2.62 -0.08 0.00 0.21 0.00 0.00 66.02 63.58 1yfi s SER 127 CO 0.06 -0.91 0.05 2.30 0.41 0.00 0.00 173.24 175.15 1yfi n ILE 128 N 3.07 0.30 -3.61 1.44 -5.35 0.11 -4.84 119.36 110.48 1yfi n ILE 128 Ca 0.12 -0.23 -0.01 0.00 -0.27 0.00 0.00 62.75 62.36 1yfi n ILE 128 Cb 0.37 -0.53 -0.01 0.00 -1.74 0.00 0.00 39.64 37.73 1yfi n ILE 128 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1yfi s ALA 129 N -2.22 -2.15 -0.02 -1.28 0.00 -1.14 -4.89 121.76 110.05 1yfi s ALA 129 Ca -0.03 1.01 -0.01 0.00 0.00 0.00 0.00 51.96 52.94 1yfi s ALA 129 Cb 0.02 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.36 1yfi s ALA 129 CO 0.25 -0.88 0.04 -1.83 0.00 0.00 0.00 175.76 173.35 1yfi s GLU 130 N -2.47 0.01 0.11 0.00 -1.05 -1.26 0.20 118.70 114.24 1yfi s GLU 130 Ca 0.12 0.15 -0.09 0.00 -0.15 0.00 0.00 54.97 55.01 1yfi s GLU 130 Cb 0.02 -0.14 -0.00 0.00 -0.44 0.00 0.00 34.13 33.57 1yfi s GLU 130 CO -0.04 -0.10 0.22 0.71 0.95 0.00 0.00 175.26 176.99 1yfi s TYR 131 N 0.68 0.24 0.19 4.83 1.51 0.02 -4.98 117.35 119.84 1yfi s TYR 131 Ca -0.06 -0.65 -0.15 0.00 -1.01 0.00 0.00 57.07 55.21 1yfi s TYR 131 Cb -0.08 -0.06 -0.07 0.00 -0.11 0.00 0.00 41.96 41.63 1yfi s TYR 131 CO -0.02 -0.60 0.60 0.34 -1.11 0.00 0.00 175.55 174.76 1yfi s ASP 132 N -2.90 6.83 0.39 2.29 2.15 -1.26 -1.30 116.67 122.87 1yfi s ASP 132 Ca 0.09 1.14 0.16 0.00 0.43 0.00 0.00 52.55 54.37 1yfi s ASP 132 Cb 0.04 -2.31 1.05 0.00 -0.30 0.00 0.00 42.92 41.40 1yfi s ASP 132 CO -0.07 0.03 1.78 1.62 -0.17 0.00 0.00 175.17 178.36 1yfi h VAL 133 N 2.58 0.56 -0.20 1.11 3.04 -1.94 -1.68 116.25 119.72 1yfi h VAL 133 Ca -0.48 -0.15 -0.01 0.00 -1.01 0.00 0.00 66.70 65.05 1yfi h VAL 133 Cb 1.19 0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 30.54 1yfi h VAL 133 CO 0.66 0.08 0.10 -0.33 -1.01 0.00 0.00 177.57 177.07 1yfi h GLU 134 N 0.45 0.30 -0.08 4.17 4.39 -1.98 -1.84 114.58 119.98 1yfi h GLU 134 Ca 0.58 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 60.26 1yfi h GLU 134 Cb 1.38 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.95 1yfi h GLU 134 CO -0.30 0.33 -0.09 1.15 -1.16 0.00 0.00 179.01 178.93 1yfi h THR 135 N 0.20 0.74 -0.02 1.13 2.02 -1.71 -0.54 112.91 114.73 1yfi h THR 135 Ca 0.07 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.29 1yfi h THR 135 Cb 0.13 0.74 -0.05 0.00 -1.74 0.00 0.00 68.15 67.23 1yfi h THR 135 CO -0.01 0.00 -0.34 0.40 0.37 0.00 0.00 175.52 175.94 1yfi h ILE 136 N -0.12 0.27 -0.95 3.11 2.04 -1.42 0.73 117.51 121.17 1yfi h ILE 136 Ca 0.06 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.97 1yfi h ILE 136 Cb 0.21 0.27 -0.06 0.00 -0.74 0.00 0.00 36.82 36.51 1yfi h ILE 136 CO -0.16 0.00 0.62 0.00 0.00 0.00 0.00 178.15 178.62 1yfi h THR 138 N 1.17 1.23 -0.17 0.00 2.02 -0.42 0.57 112.91 117.32 1yfi h THR 138 Ca 0.39 -0.82 -0.19 0.00 0.77 0.00 0.00 66.41 66.56 1yfi h THR 138 Cb 0.06 0.97 -0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1yfi h THR 138 CO -0.13 0.28 -0.65 1.23 0.37 0.00 0.00 175.52 176.63 1yfi h GLY 139 N 0.54 0.70 1.80 2.16 0.00 -0.16 -3.20 103.07 104.91 1yfi h GLY 139 Ca 0.13 -0.89 -0.02 0.00 0.00 0.00 0.00 47.33 46.55 1yfi h GLY 139 CO 0.00 0.80 -0.29 -2.08 0.00 0.00 0.00 176.54 174.96 1yfi h VAL 140 N 0.46 0.15 -0.47 4.60 2.07 -0.67 -3.37 116.25 119.02 1yfi h VAL 140 Ca -0.01 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.28 1yfi h VAL 140 Cb 1.23 1.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.98 1yfi h VAL 140 CO 0.13 0.09 0.00 0.61 0.02 0.00 0.00 177.57 178.41 1yfi n GLY 141 N 1.14 0.92 3.41 2.17 0.00 0.07 -4.83 105.19 108.07 1yfi n GLY 141 Ca 0.03 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 1yfi n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yfi s ILE 142 N -2.35 3.36 0.48 -0.61 1.01 0.18 -5.02 121.20 118.25 1yfi s ILE 142 Ca 0.00 -0.55 0.05 0.00 0.00 0.00 0.00 60.65 60.15 1yfi s ILE 142 Cb 0.00 -2.44 0.02 0.00 0.01 0.00 0.00 42.46 40.05 1yfi s ILE 142 CO 0.00 0.51 0.67 -0.94 0.00 0.00 0.00 174.94 175.18 1yfi s SER 143 N 0.42 5.46 0.55 3.58 1.04 -1.26 -4.32 113.70 119.17 1yfi s SER 143 Ca -0.08 -0.25 -0.18 0.00 0.48 0.00 0.00 55.95 55.92 1yfi s SER 143 Cb -0.15 -0.72 -0.09 0.00 0.10 0.00 0.00 66.02 65.15 1yfi s SER 143 CO 0.04 -0.96 0.48 0.47 0.98 0.00 0.00 173.24 174.26 1yfi n ASP 144 N -2.09 -1.20 0.00 7.02 8.00 -1.26 -4.45 116.55 122.57 1yfi n ASP 144 Ca 0.08 0.75 0.00 0.00 0.71 0.00 0.00 54.79 56.33 1yfi n ASP 144 Cb 0.59 -1.15 0.00 0.00 -0.02 0.00 0.00 41.12 40.55 1yfi n ASP 144 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yfi n GLY 145 N 1.83 -0.02 0.32 0.44 0.00 -1.26 -4.89 105.19 101.61 1yfi n GLY 145 Ca 0.11 -1.52 -0.08 0.00 0.00 0.00 0.00 46.02 44.54 1yfi n GLY 145 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1yfi h GLU 146 N 1.95 1.10 0.13 1.61 4.81 -2.00 -2.31 114.58 119.87 1yfi h GLU 146 Ca 0.00 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 1yfi h GLU 146 Cb 0.00 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.25 1yfi h GLU 146 CO 0.00 1.00 -0.06 1.25 -0.73 0.00 0.00 179.01 180.47 1yfi h LEU 147 N 1.03 -0.15 -0.46 1.64 5.85 -1.92 -1.78 115.31 119.52 1yfi h LEU 147 Ca 0.20 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1yfi h LEU 147 Cb 0.44 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 1yfi h LEU 147 CO 0.01 -0.00 0.20 0.50 -0.34 0.00 0.00 178.44 178.81 1yfi h LYS 148 N -0.29 0.39 -0.68 1.25 3.64 -1.76 -1.90 116.57 117.21 1yfi h LYS 148 Ca -0.02 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1yfi h LYS 148 Cb 0.23 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 1yfi h LYS 148 CO 0.03 0.26 0.34 0.93 -2.27 0.00 0.00 179.45 178.74 1yfi h GLU 149 N 0.40 0.96 -0.56 1.90 4.39 -1.31 0.25 114.58 120.61 1yfi h GLU 149 Ca 0.21 -0.12 -0.10 0.00 0.34 0.00 0.00 59.36 59.69 1yfi h GLU 149 Cb 0.16 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1yfi h GLU 149 CO -0.18 0.73 -0.03 -0.07 -1.16 0.00 0.00 179.01 178.31 1yfi h LEU 150 N 0.96 0.98 -0.25 1.33 3.38 -0.93 0.21 115.31 120.98 1yfi h LEU 150 Ca 0.24 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1yfi h LEU 150 Cb 0.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1yfi h LEU 150 CO -0.03 1.05 -0.03 0.40 0.09 0.00 0.00 178.44 179.92 1yfi h ILE 151 N 0.91 1.27 -0.07 1.22 2.04 -0.62 -1.97 117.51 120.29 1yfi h ILE 151 Ca 0.16 -0.99 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1yfi h ILE 151 Cb 0.57 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 1yfi h ILE 151 CO 0.03 0.31 -0.02 -0.09 0.00 0.00 0.00 178.15 178.38 1yfi h ARG 152 N 0.23 0.10 -0.08 2.37 2.43 -0.26 -0.36 114.38 118.81 1yfi h ARG 152 Ca 0.07 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1yfi h ARG 152 Cb 0.47 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1yfi h ARG 152 CO 0.02 0.13 0.03 -0.22 -1.51 0.00 0.00 179.97 178.42 1yfi h LYS 153 N 0.10 0.12 -0.66 0.20 3.64 -0.07 -0.25 116.57 119.64 1yfi h LYS 153 Ca 0.03 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.48 1yfi h LYS 153 Cb 0.11 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 31.83 1yfi h LYS 153 CO 0.00 0.24 0.28 1.25 -2.27 0.00 0.00 179.45 178.95 1yfi h HIS 154 N -0.03 0.49 0.36 1.91 2.76 -0.43 0.10 115.15 120.30 1yfi h HIS 154 Ca 0.03 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 1yfi h HIS 154 Cb 0.17 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 1yfi h HIS 154 CO -0.02 0.14 -0.24 0.37 -1.30 0.00 0.00 177.93 176.89 1yfi h GLN 155 N 0.48 -0.56 -0.41 5.26 4.15 -0.64 0.45 115.11 123.84 1yfi h GLN 155 Ca 0.33 0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.78 1yfi h GLN 155 Cb 0.41 0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.20 1yfi h GLN 155 CO -0.31 -0.37 0.19 -0.91 -1.93 0.00 0.00 178.83 175.50 1yfi h ASN 156 N -0.58 0.54 0.99 -0.69 2.35 -0.49 -2.30 115.58 115.40 1yfi h ASN 156 Ca -0.04 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 1yfi h ASN 156 Cb 0.48 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1yfi h ASN 156 CO 0.03 0.52 0.00 0.44 -1.65 0.00 0.00 177.43 176.77 1yfi h ASP 157 N 0.52 0.00 -0.93 5.81 3.32 -0.96 -3.46 116.42 120.71 1yfi h ASP 157 Ca 0.14 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.96 1yfi h ASP 157 Cb 0.13 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.62 1yfi h ASP 157 CO -0.02 0.00 -0.24 0.00 -1.72 0.00 0.00 179.24 177.26 1yfi n GLN 158 N -2.96 -0.83 -3.34 3.56 6.02 0.11 -4.91 117.38 115.03 1yfi n GLN 158 Ca 0.01 0.77 0.00 0.00 -0.01 0.00 0.00 57.00 57.77 1yfi n GLN 158 Cb 0.30 -4.81 0.00 0.00 1.02 0.00 0.00 30.24 26.75 1yfi n GLN 158 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1yfi n SER 159 N 0.05 0.00 -0.98 1.08 3.41 -0.95 -4.25 113.62 111.97 1yfi n SER 159 Ca -0.12 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.57 1yfi n SER 159 Cb 0.46 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.65 1yfi n SER 159 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yfi n ALA 160 N 0.00 2.58 0.12 7.33 0.00 -1.26 -4.47 120.51 124.81 1yfi n ALA 160 Ca 0.00 -1.51 0.05 0.00 0.00 0.00 0.00 53.44 51.98 1yfi n ALA 160 Cb 0.00 -0.68 0.50 0.00 0.00 0.00 0.00 19.45 19.27 1yfi n ALA 160 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1yfi h LYS 161 N 2.68 0.28 -0.00 0.00 2.10 -1.95 -1.62 116.57 118.06 1yfi h LYS 161 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1yfi h LYS 161 Cb 1.08 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1yfi h LYS 161 CO 0.10 0.23 -0.12 1.28 -2.00 0.00 0.00 179.45 178.94 1yfi n LEU 162 N -4.46 0.56 -4.72 7.07 4.77 -1.26 -4.86 117.00 114.09 1yfi n LEU 162 Ca 0.00 -0.04 -0.29 0.00 -0.03 0.00 0.00 56.01 55.64 1yfi n LEU 162 Cb 0.11 -0.16 0.14 0.00 -2.33 0.00 0.00 43.42 41.18 1yfi n LEU 162 CO 0.35 0.10 0.67 -0.36 -1.33 0.00 0.00 177.39 176.83 1yfi s PHE 163 N -2.44 2.34 0.21 -1.77 0.40 -0.61 -5.06 117.98 111.05 1yfi s PHE 163 Ca 0.29 1.17 0.08 0.00 -0.60 0.00 0.00 56.93 57.87 1yfi s PHE 163 Cb 0.20 -3.19 -0.04 0.00 0.51 0.00 0.00 43.02 40.50 1yfi s PHE 163 CO 0.47 -2.42 0.01 0.95 0.70 0.00 0.00 175.22 174.93 1yfi s THR 164 N -2.98 3.65 0.45 0.64 -4.23 -1.26 -4.98 115.64 106.93 1yfi s THR 164 Ca 0.63 -1.61 0.19 0.00 -1.18 0.00 0.00 61.69 59.73 1yfi s THR 164 Cb -0.17 -2.88 0.38 0.00 1.34 0.00 0.00 72.50 71.16 1yfi s THR 164 CO 0.57 -0.22 1.91 -0.65 -0.54 0.00 0.00 174.62 175.68 1yfi h PRO 165 N 2.33 0.30 -0.40 3.99 0.11 -1.97 0.41 132.00 136.77 1yfi h PRO 165 Ca -0.46 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 1yfi h PRO 165 Cb 1.22 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1yfi h PRO 165 CO 0.59 0.20 -0.05 0.28 -0.21 0.00 0.00 178.00 178.80 1yfi h VAL 166 N 0.31 1.27 -0.41 3.15 2.07 -1.99 -2.10 116.25 118.55 1yfi h VAL 166 Ca 0.38 -1.11 -0.07 0.00 0.82 0.00 0.00 66.70 66.72 1yfi h VAL 166 Cb 1.04 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 1yfi h VAL 166 CO -0.10 0.37 -0.06 1.56 0.02 0.00 0.00 177.57 179.36 1yfi h GLN 167 N 0.55 0.68 0.03 1.57 4.20 -1.37 0.05 115.11 120.83 1yfi h GLN 167 Ca 0.11 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1yfi h GLN 167 Cb 0.56 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1yfi h GLN 167 CO 0.03 0.74 -0.02 0.87 -0.67 0.00 0.00 178.83 179.78 1yfi h LYS 168 N 0.63 -0.04 -0.73 1.46 1.57 -1.06 -0.41 116.57 117.99 1yfi h LYS 168 Ca 0.12 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.97 1yfi h LYS 168 Cb 0.48 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.74 1yfi h LYS 168 CO 0.02 0.27 0.42 1.96 -0.57 0.00 0.00 179.45 181.55 1yfi h GLN 169 N -0.35 0.73 -0.56 3.15 4.20 -1.26 -0.77 115.11 120.25 1yfi h GLN 169 Ca -0.00 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1yfi h GLN 169 Cb 0.33 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.92 1yfi h GLN 169 CO 0.01 0.48 0.31 -0.09 -0.67 0.00 0.00 178.83 178.87 1yfi h ARG 170 N 0.75 0.78 0.11 1.46 9.65 -0.81 -0.68 114.38 125.63 1yfi h ARG 170 Ca 0.33 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 59.12 1yfi h ARG 170 Cb 0.22 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 28.65 1yfi h ARG 170 CO -0.20 0.59 -0.05 1.25 2.80 0.00 0.00 179.97 184.36 1yfi h LEU 171 N 0.75 -0.12 -1.13 3.80 5.85 -0.47 -0.33 115.31 123.66 1yfi h LEU 171 Ca 0.20 -0.14 0.16 0.00 0.84 0.00 0.00 57.88 58.94 1yfi h LEU 171 Cb 0.04 0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.01 1yfi h LEU 171 CO -0.03 0.06 0.61 0.74 -0.34 0.00 0.00 178.44 179.48 1yfi h THR 172 N -0.31 0.79 -0.03 1.05 2.02 -0.96 -0.22 112.91 115.25 1yfi h THR 172 Ca -0.01 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 66.89 1yfi h THR 172 Cb 0.25 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.62 1yfi h THR 172 CO 0.02 0.14 -0.05 -0.08 0.37 0.00 0.00 175.52 175.93 1yfi h GLU 173 N 0.77 0.08 0.00 6.66 4.81 -0.74 -2.30 114.58 123.86 1yfi h GLU 173 Ca 0.52 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.64 1yfi h GLU 173 Cb 0.79 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 1yfi h GLU 173 CO -0.29 0.60 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.29 1yfi h LEU 174 N -0.43 0.00 -0.04 1.64 3.38 -0.52 -2.81 115.31 116.52 1yfi h LEU 174 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1yfi h LEU 174 Cb 0.60 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1yfi h LEU 174 CO 0.01 0.24 -0.66 0.25 0.09 0.00 0.00 178.44 178.37 1yfi h LEU 175 N 0.00 0.00 -0.93 1.67 5.85 -1.05 -3.37 115.31 117.48 1yfi h LEU 175 Ca -0.00 0.00 0.28 0.00 0.84 0.00 0.00 57.88 59.00 1yfi h LEU 175 Cb 0.46 0.00 -0.17 0.00 0.37 0.00 0.00 40.66 41.32 1yfi h LEU 175 CO 0.03 0.66 0.10 1.21 -0.34 0.00 0.00 178.44 180.10 1yfi n GLU 176 N -3.28 -0.07 0.26 1.25 0.00 -0.87 0.80 120.64 118.73 1yfi n GLU 176 Ca 0.01 1.38 0.17 0.00 0.00 0.00 0.00 57.16 58.72 1yfi n GLU 176 Cb 0.79 -2.23 0.65 0.00 0.00 0.00 0.00 31.44 30.65 1yfi n GLU 176 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 1yfi h PRO 177 N 0.00 0.00 -0.02 5.31 0.11 -1.78 -3.14 132.00 132.48 1yfi h PRO 177 Ca 0.60 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.71 1yfi h PRO 177 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1yfi h PRO 177 CO -0.85 0.00 -0.16 0.66 -0.21 0.00 0.00 178.00 177.44 1yfi n TYR 178 N -3.00 0.00 -0.12 0.65 4.02 0.24 -4.78 117.16 114.17 1yfi n TYR 178 Ca 0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.87 1yfi n TYR 178 Cb 0.30 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.60 1yfi n TYR 178 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1yfi n ARG 179 N 0.60 -0.13 -0.03 -0.72 1.74 -0.81 -0.32 116.66 117.00 1yfi n ARG 179 Ca 0.10 1.06 -0.09 0.00 -0.77 0.00 0.00 57.85 58.15 1yfi n ARG 179 Cb 0.44 -1.57 -0.03 0.00 -1.02 0.00 0.00 32.46 30.28 1yfi n ARG 179 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1yfi h GLU 180 N 0.00 -0.03 -0.95 5.56 5.08 -1.86 -0.32 114.58 122.05 1yfi h GLU 180 Ca 0.05 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.48 1yfi h GLU 180 Cb 0.12 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.31 1yfi h GLU 180 CO -0.27 -0.02 0.60 0.00 -1.00 0.00 0.00 179.01 178.32 1yfi h ARG 181 N -0.03 1.05 0.59 2.33 3.08 -1.67 0.06 114.38 119.79 1yfi h ARG 181 Ca 0.09 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 1yfi h ARG 181 Cb 0.17 -0.24 0.01 0.00 0.08 0.00 0.00 29.97 29.99 1yfi h ARG 181 CO -0.20 0.70 -0.28 0.35 -1.07 0.00 0.00 179.97 179.46 1yfi h PHE 182 N 1.08 -0.74 0.49 3.04 3.57 0.09 -0.23 116.94 124.25 1yfi h PHE 182 Ca 0.42 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.89 1yfi h PHE 182 Cb 0.20 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1yfi h PHE 182 CO -0.01 -0.46 -0.35 0.82 -2.23 0.00 0.00 178.31 176.07 1yfi h ILE 183 N -0.79 0.27 -0.95 1.41 2.04 -0.73 -0.03 117.51 118.74 1yfi h ILE 183 Ca -0.08 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.91 1yfi h ILE 183 Cb 0.61 0.27 -0.08 0.00 -0.74 0.00 0.00 36.82 36.89 1yfi h ILE 183 CO 0.13 0.00 0.60 -0.09 0.00 0.00 0.00 178.15 178.79 1yfi h ARG 184 N -0.83 0.82 -0.15 2.37 2.43 -1.02 -2.07 114.38 115.94 1yfi h ARG 184 Ca -0.05 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 58.94 1yfi h ARG 184 Cb 0.70 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1yfi h ARG 184 CO 0.02 0.55 -0.39 2.35 -1.51 0.00 0.00 179.97 180.98 1yfi h TRP 185 N 0.85 0.68 -0.33 2.20 7.01 -0.70 0.35 115.95 126.01 1yfi h TRP 185 Ca 0.47 -0.27 0.07 0.00 2.11 0.00 0.00 58.89 61.27 1yfi h TRP 185 Cb 0.60 -0.12 -0.06 0.00 -2.10 0.00 0.00 29.16 27.48 1yfi h TRP 185 CO -0.00 1.01 -0.07 0.00 -2.79 0.00 0.00 178.44 176.59 1yfi h VAL 187 N 0.01 1.41 0.00 0.00 -1.51 -1.51 -3.40 116.25 111.26 1yfi h VAL 187 Ca 0.16 -3.14 -0.02 0.00 -1.23 0.00 0.00 66.70 62.47 1yfi h VAL 187 Cb 0.24 2.74 -0.00 0.00 -2.13 0.00 0.00 31.29 32.13 1yfi h VAL 187 CO -0.33 0.83 -1.70 0.35 -1.23 0.00 0.00 177.57 175.49 1yfi n THR 188 N -3.30 0.09 -1.59 7.19 -2.24 0.11 -4.84 114.28 109.70 1yfi n THR 188 Ca -0.07 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1yfi n THR 188 Cb 0.99 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 1yfi n THR 188 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1yfi n LEU 189 N -2.06 -0.68 -3.64 3.22 4.77 0.30 -4.61 117.00 114.29 1yfi n LEU 189 Ca -0.05 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.87 1yfi n LEU 189 Cb 0.44 -0.45 -0.07 0.00 -2.33 0.00 0.00 43.42 41.00 1yfi n LEU 189 CO 0.31 0.00 0.32 -0.60 -1.33 0.00 0.00 177.39 176.09 1yfi s ARG 190 N -3.25 0.68 0.26 3.23 3.52 -1.25 -4.96 118.95 117.17 1yfi s ARG 190 Ca 0.00 1.21 0.09 0.00 -0.13 0.00 0.00 55.73 56.90 1yfi s ARG 190 Cb 0.00 0.18 0.32 0.00 -1.56 0.00 0.00 34.95 33.89 1yfi s ARG 190 CO 0.00 -0.15 1.60 0.00 -0.81 0.00 0.00 175.30 175.93 1yfi h ALA 191 N 7.08 0.94 -1.75 6.12 0.00 -1.80 -3.04 119.26 126.81 1yfi h ALA 191 Ca -0.30 -0.56 -0.44 0.00 0.00 0.00 0.00 54.91 53.62 1yfi h ALA 191 Cb 1.22 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.93 1yfi h ALA 191 CO 0.17 0.76 -0.22 -1.21 0.00 0.00 0.00 179.25 178.74 1yfi s GLU 192 N -3.65 2.93 0.51 0.00 8.01 -1.26 -4.51 118.70 120.74 1yfi s GLU 192 Ca -0.02 -0.94 -0.22 0.00 0.01 0.00 0.00 54.97 53.80 1yfi s GLU 192 Cb 0.12 -2.70 -0.06 0.00 -4.31 0.00 0.00 34.13 27.18 1yfi s GLU 192 CO 0.77 -0.22 1.23 0.15 0.01 0.00 0.00 175.26 177.21 1yfi s LYS 193 N -4.39 3.43 0.03 1.61 1.02 -1.26 -5.01 119.74 115.17 1yfi s LYS 193 Ca 0.50 1.92 -0.02 0.00 0.02 0.00 0.00 55.97 58.39 1yfi s LYS 193 Cb -0.10 -2.27 -0.02 0.00 -0.52 0.00 0.00 37.83 34.92 1yfi s LYS 193 CO 0.34 -0.86 0.01 0.45 -0.92 0.00 0.00 175.35 174.37 1yfi s SER 194 N -1.28 0.27 -0.21 2.83 0.15 -1.26 -5.16 113.70 109.04 1yfi s SER 194 Ca 0.68 -0.61 -0.09 0.00 0.70 0.00 0.00 55.95 56.63 1yfi s SER 194 Cb -0.32 0.16 0.08 0.00 -1.71 0.00 0.00 66.02 64.23 1yfi s SER 194 CO 0.38 -0.43 0.48 -0.70 1.20 0.00 0.00 173.24 174.17 1yfi s GLU 195 N -2.32 0.43 0.00 5.44 2.12 -1.26 -4.91 118.70 118.20 1yfi s GLU 195 Ca -0.08 1.00 0.00 0.00 0.36 0.00 0.00 54.97 56.25 1yfi s GLU 195 Cb -0.03 0.21 0.00 0.00 0.26 0.00 0.00 34.13 34.56 1yfi s GLU 195 CO -0.04 -0.19 0.00 0.41 -0.54 0.00 0.00 175.26 174.90 1yfi n GLY 196 N 4.78 0.44 3.56 -1.50 0.00 -1.24 -4.98 105.19 106.25 1yfi n GLY 196 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1yfi n GLY 196 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yfi s ASN 197 N -2.21 6.37 0.21 1.61 3.84 -1.26 -4.75 114.94 118.76 1yfi s ASN 197 Ca 0.00 0.04 0.11 0.00 0.21 0.00 0.00 52.86 53.22 1yfi s ASN 197 Cb 0.00 -2.30 0.58 0.00 -0.55 0.00 0.00 41.25 38.98 1yfi s ASN 197 CO 0.00 -0.55 1.24 0.00 -2.79 0.00 0.00 177.10 175.00 1yfi n ILE 198 N 5.52 1.01 0.77 -5.21 3.06 -1.26 -0.96 119.36 122.29 1yfi n ILE 198 Ca -0.03 0.66 0.13 0.00 -2.50 0.00 0.00 62.75 61.00 1yfi n ILE 198 Cb 0.49 -1.66 0.31 0.00 0.54 0.00 0.00 39.64 39.32 1yfi n ILE 198 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 1yfi n LEU 199 N -1.86 0.54 -3.67 9.51 4.77 -1.26 -4.69 117.00 120.34 1yfi n LEU 199 Ca -0.01 0.27 -0.20 0.00 -0.03 0.00 0.00 56.01 56.05 1yfi n LEU 199 Cb 0.19 -0.28 -0.18 0.00 -2.33 0.00 0.00 43.42 40.82 1yfi n LEU 199 CO 0.05 -0.02 -0.33 -1.00 -1.33 0.00 0.00 177.39 174.76 1yfi s HIS 200 N -3.08 0.04 0.29 -1.77 3.76 -0.14 -4.30 115.29 110.10 1yfi s HIS 200 Ca 0.10 0.27 -0.29 0.00 -0.15 0.00 0.00 55.06 54.99 1yfi s HIS 200 Cb 0.15 -0.47 -0.13 0.00 1.11 0.00 0.00 32.58 33.25 1yfi s HIS 200 CO 0.66 -0.21 1.23 -2.30 -0.85 0.00 0.00 174.74 173.27 1yfi n PRO 201 N 5.30 1.83 -0.10 8.40 -0.02 -1.26 -4.57 135.00 144.59 1yfi n PRO 201 Ca -0.03 0.65 -0.13 0.00 -2.02 0.00 0.00 63.50 61.96 1yfi n PRO 201 Cb 0.50 -2.18 -0.14 0.00 -0.02 0.00 0.00 33.50 31.65 1yfi n PRO 201 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1yfi n ASP 202 N 1.28 0.86 -4.33 2.55 8.00 -0.03 -4.85 116.55 120.03 1yfi n ASP 202 Ca 0.08 0.01 -0.27 0.00 0.71 0.00 0.00 54.79 55.32 1yfi n ASP 202 Cb 0.33 0.32 -0.13 0.00 -0.02 0.00 0.00 41.12 41.62 1yfi n ASP 202 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1yfi s LEU 203 N -5.98 2.27 -0.28 0.64 1.43 -1.19 -1.96 118.68 113.61 1yfi s LEU 203 Ca -0.18 -0.67 -0.02 0.00 -1.03 0.00 0.00 54.13 52.22 1yfi s LEU 203 Cb 0.07 -1.09 0.04 0.00 0.03 0.00 0.00 46.19 45.23 1yfi s LEU 203 CO 0.75 0.15 -0.02 -0.76 0.23 0.00 0.00 176.35 176.71 1yfi s LEU 204 N -1.75 3.61 -0.27 1.79 1.43 0.68 -2.08 118.68 122.09 1yfi s LEU 204 Ca 0.10 -1.07 -0.10 0.00 -1.03 0.00 0.00 54.13 52.03 1yfi s LEU 204 Cb -0.10 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.37 1yfi s LEU 204 CO 0.04 -0.20 0.16 -0.63 0.23 0.00 0.00 176.35 175.95 1yfi s ILE 205 N 1.30 5.15 -0.23 -0.59 1.01 0.12 -1.92 121.20 126.05 1yfi s ILE 205 Ca -0.03 0.11 0.02 0.00 0.00 0.00 0.00 60.65 60.76 1yfi s ILE 205 Cb -0.18 -3.44 0.05 0.00 0.01 0.00 0.00 42.46 38.90 1yfi s ILE 205 CO -0.02 0.29 -0.12 -0.13 0.00 0.00 0.00 174.94 174.95 1yfi s ARG 206 N 1.58 2.26 -0.15 2.79 1.81 0.59 -1.51 118.95 126.32 1yfi s ARG 206 Ca 0.07 -1.07 -0.22 0.00 -1.72 0.00 0.00 55.73 52.79 1yfi s ARG 206 Cb -0.15 -2.67 -0.03 0.00 -0.45 0.00 0.00 34.95 31.65 1yfi s ARG 206 CO 0.08 -0.47 0.66 -0.06 -0.68 0.00 0.00 175.30 174.83 1yfi s PHE 207 N 1.25 3.44 -0.36 -0.53 0.40 -0.31 -1.15 117.98 120.72 1yfi s PHE 207 Ca -0.04 1.04 -0.23 0.00 -0.60 0.00 0.00 56.93 57.10 1yfi s PHE 207 Cb -0.18 -2.80 0.01 0.00 0.51 0.00 0.00 43.02 40.56 1yfi s PHE 207 CO -0.07 -0.08 0.79 -1.14 0.70 0.00 0.00 175.22 175.41 1yfi s GLN 208 N 1.53 3.77 -0.15 0.44 0.74 0.20 -1.41 119.66 124.77 1yfi s GLN 208 Ca 0.32 0.33 0.00 0.00 0.05 0.00 0.00 55.36 56.06 1yfi s GLN 208 Cb -0.16 -3.80 0.02 0.00 1.10 0.00 0.00 33.01 30.17 1yfi s GLN 208 CO 0.12 -0.84 -0.15 0.08 -0.55 0.00 0.00 175.29 173.96 1yfi s VAL 209 N 3.09 1.62 -0.05 1.34 1.01 -0.20 -1.57 120.40 125.64 1yfi s VAL 209 Ca 0.31 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.68 1yfi s VAL 209 Cb -0.13 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1yfi s VAL 209 CO 0.17 0.46 -0.23 -0.63 0.00 0.00 0.00 175.10 174.86 1yfi s ILE 210 N 1.46 1.88 -1.49 2.22 1.01 -0.87 -3.03 121.20 122.39 1yfi s ILE 210 Ca 0.05 -0.97 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 1yfi s ILE 210 Cb -0.13 -1.60 0.04 0.00 0.01 0.00 0.00 42.46 40.79 1yfi s ILE 210 CO -0.11 0.53 0.53 0.47 0.00 0.00 0.00 174.94 176.36 1yfi n ASP 211 N 2.97 -1.25 0.00 3.58 8.00 -1.26 -0.64 116.55 127.95 1yfi n ASP 211 Ca -0.17 -1.00 0.00 0.00 0.71 0.00 0.00 54.79 54.33 1yfi n ASP 211 Cb 0.52 -3.00 0.00 0.00 -0.02 0.00 0.00 41.12 38.62 1yfi n ASP 211 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1yfi n ARG 212 N -4.42 -0.37 -4.57 -1.24 1.74 -1.26 -4.98 116.66 101.55 1yfi n ARG 212 Ca -0.20 0.09 -0.32 0.00 -0.77 0.00 0.00 57.85 56.66 1yfi n ARG 212 Cb 0.63 -3.94 -0.11 0.00 -1.02 0.00 0.00 32.46 28.02 1yfi n ARG 212 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1yfi s GLU 213 N -0.83 2.40 0.41 5.56 0.41 0.19 -5.08 118.70 121.75 1yfi s GLU 213 Ca 0.00 -0.80 -0.26 0.00 -0.41 0.00 0.00 54.97 53.50 1yfi s GLU 213 Cb 0.00 -2.39 -0.10 0.00 -1.78 0.00 0.00 34.13 29.86 1yfi s GLU 213 CO 0.00 0.59 1.21 0.98 -0.49 0.00 0.00 175.26 177.54 1yfi n TYR 214 N 1.65 1.92 0.01 1.61 9.36 -1.26 -2.05 117.16 128.40 1yfi n TYR 214 Ca -0.16 0.53 0.00 0.00 3.32 0.00 0.00 57.90 61.59 1yfi n TYR 214 Cb 0.52 -2.35 0.00 0.00 -0.63 0.00 0.00 39.34 36.89 1yfi n TYR 214 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1yfi n VAL 215 N -0.18 0.07 -3.82 2.97 0.31 -0.61 -4.20 118.33 112.87 1yfi n VAL 215 Ca 0.07 0.02 -0.01 0.00 -0.01 0.00 0.00 64.34 64.42 1yfi n VAL 215 Cb 0.39 -1.18 0.01 0.00 -0.91 0.00 0.00 33.84 32.14 1yfi n VAL 215 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1yfi s ASP 216 N -5.06 -0.04 0.01 4.52 -1.08 -1.18 -4.89 116.67 108.95 1yfi s ASP 216 Ca 0.00 -0.41 0.00 0.00 -0.52 0.00 0.00 52.55 51.62 1yfi s ASP 216 Cb 0.00 0.35 -0.01 0.00 -1.46 0.00 0.00 42.92 41.80 1yfi s ASP 216 CO 0.00 -0.68 -0.02 0.54 0.52 0.00 0.00 175.17 175.52 1yfi s VAL 217 N -2.42 0.11 -0.04 1.11 0.11 -1.26 -0.63 120.40 117.38 1yfi s VAL 217 Ca 0.20 -0.54 0.05 0.00 -2.93 0.00 0.00 61.98 58.76 1yfi s VAL 217 Cb -0.00 -0.19 -0.01 0.00 -1.53 0.00 0.00 36.38 34.65 1yfi s VAL 217 CO 0.01 -0.27 -0.19 -0.89 -3.33 0.00 0.00 175.10 170.43 1yfi s THR 218 N -0.83 1.59 -0.13 5.04 2.01 -0.30 -4.99 115.64 118.03 1yfi s THR 218 Ca -0.09 -0.81 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 1yfi s THR 218 Cb -0.06 -1.35 0.05 0.00 0.01 0.00 0.00 72.50 71.14 1yfi s THR 218 CO -0.00 0.45 0.03 -0.63 -0.69 0.00 0.00 174.62 173.78 1yfi s ILE 219 N -0.04 0.35 0.05 1.82 1.01 -1.26 -0.30 121.20 122.84 1yfi s ILE 219 Ca -0.03 -0.17 0.09 0.00 0.00 0.00 0.00 60.65 60.54 1yfi s ILE 219 Cb -0.12 -0.72 -0.03 0.00 0.01 0.00 0.00 42.46 41.60 1yfi s ILE 219 CO 0.02 -0.00 -0.26 -0.54 0.00 0.00 0.00 174.94 174.16 1yfi s LYS 220 N 1.96 1.73 0.46 2.79 -0.14 -0.81 -4.79 119.74 120.94 1yfi s LYS 220 Ca 0.02 -1.13 -0.07 0.00 -1.36 0.00 0.00 55.97 53.44 1yfi s LYS 220 Cb -0.15 -1.94 -0.04 0.00 -1.68 0.00 0.00 37.83 34.02 1yfi s LYS 220 CO -0.07 0.50 0.78 0.54 -0.76 0.00 0.00 175.35 176.34 1yfi s ASN 221 N -1.32 6.33 0.26 2.83 2.20 -1.26 -0.23 114.94 123.75 1yfi s ASN 221 Ca 0.12 0.99 -0.02 0.00 -0.94 0.00 0.00 52.86 53.01 1yfi s ASN 221 Cb -0.10 -2.27 0.50 0.00 -2.00 0.00 0.00 41.25 37.39 1yfi s ASN 221 CO 0.02 -0.53 1.77 0.40 -2.94 0.00 0.00 177.10 175.83 1yfi h ILE 222 N 0.47 0.76 -0.45 0.54 1.08 -1.72 -1.58 117.51 116.62 1yfi h ILE 222 Ca -0.47 -0.22 0.04 0.00 -0.39 0.00 0.00 64.86 63.82 1yfi h ILE 222 Cb 1.20 0.05 -0.04 0.00 -3.07 0.00 0.00 36.82 34.96 1yfi h ILE 222 CO 0.62 0.12 0.21 0.44 -0.69 0.00 0.00 178.15 178.85 1yfi h ASP 223 N 0.65 0.29 -0.29 1.72 3.32 -1.93 -0.10 116.42 120.08 1yfi h ASP 223 Ca 0.45 0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.49 1yfi h ASP 223 Cb 0.59 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 1yfi h ASP 223 CO -0.34 0.21 0.02 0.44 -1.72 0.00 0.00 179.24 177.85 1yfi h ASP 224 N 0.42 0.48 -0.30 6.45 3.32 -1.79 -1.10 116.42 123.90 1yfi h ASP 224 Ca 0.20 -0.28 0.05 0.00 0.02 0.00 0.00 57.03 57.01 1yfi h ASP 224 Cb 0.12 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.50 1yfi h ASP 224 CO -0.15 0.65 0.03 0.22 -1.72 0.00 0.00 179.24 178.27 1yfi h TYR 225 N 0.30 0.05 -0.28 4.55 3.20 -1.00 0.20 116.97 123.99 1yfi h TYR 225 Ca 0.09 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.01 1yfi h TYR 225 Cb 0.38 0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.64 1yfi h TYR 225 CO 0.03 -0.01 0.06 0.28 -1.64 0.00 0.00 178.16 176.88 1yfi h VAL 226 N 0.13 0.88 -0.14 1.81 2.07 -0.88 0.05 116.25 120.18 1yfi h VAL 226 Ca 0.14 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.64 1yfi h VAL 226 Cb 0.17 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 1yfi h VAL 226 CO -0.21 0.03 -0.09 0.28 0.02 0.00 0.00 177.57 177.61 1yfi h SER 227 N 0.17 -0.28 -0.07 0.57 0.02 -0.39 0.45 113.55 114.02 1yfi h SER 227 Ca 0.13 0.06 0.04 0.00 -0.84 0.00 0.00 61.79 61.18 1yfi h SER 227 Cb 0.13 0.15 -0.06 0.00 0.14 0.00 0.00 62.40 62.76 1yfi h SER 227 CO -0.16 -0.12 -0.30 0.44 -1.14 0.00 0.00 176.83 175.55 1yfi h ASP 228 N -0.09 -0.91 -0.39 3.07 3.32 -0.13 0.14 116.42 121.44 1yfi h ASP 228 Ca 0.08 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.24 1yfi h ASP 228 Cb 0.21 0.38 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 1yfi h ASP 228 CO -0.19 -0.35 0.19 0.03 -1.72 0.00 0.00 179.24 177.20 1yfi h ARG 229 N -0.41 0.60 -0.34 3.56 2.47 -0.43 0.95 114.38 120.80 1yfi h ARG 229 Ca 0.08 -0.07 -0.07 0.00 -1.26 0.00 0.00 59.98 58.66 1yfi h ARG 229 Cb 0.53 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.72 1yfi h ARG 229 CO -0.30 0.49 -0.06 0.82 0.56 0.00 0.00 179.97 181.48 1yfi h ILE 230 N 0.61 1.27 0.04 2.04 1.08 0.86 -0.95 117.51 122.46 1yfi h ILE 230 Ca 0.15 -1.09 -0.00 0.00 -0.39 0.00 0.00 64.86 63.53 1yfi h ILE 230 Cb 0.09 1.30 0.00 0.00 -3.07 0.00 0.00 36.82 35.14 1yfi h ILE 230 CO -0.02 0.36 -0.02 0.00 -0.69 0.00 0.00 178.15 177.78 1yfi h ALA 231 N 0.82 -0.06 -0.84 1.87 0.00 -0.24 -1.87 119.26 118.95 1yfi h ALA 231 Ca 0.09 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.07 1yfi h ALA 231 Cb 0.55 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 1yfi h ALA 231 CO 0.03 -0.46 0.55 1.49 0.00 0.00 0.00 179.25 180.86 1yfi h GLU 232 N -0.21 0.52 -0.00 0.00 4.81 -0.78 0.11 114.58 119.03 1yfi h GLU 232 Ca -0.01 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1yfi h GLU 232 Cb 0.19 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1yfi h GLU 232 CO 0.01 0.34 -0.06 0.41 -0.73 0.00 0.00 179.01 178.98 1yfi n GLY 233 N -1.48 -0.94 0.26 1.92 0.00 -0.37 -3.45 105.19 101.12 1yfi n GLY 233 Ca 0.16 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1yfi n GLY 233 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1yfi n SER 234 N -0.93 1.21 -4.52 1.61 7.64 0.37 -4.12 113.62 114.89 1yfi n SER 234 Ca 0.16 -0.98 -0.29 0.00 1.01 0.00 0.00 58.87 58.78 1yfi n SER 234 Cb 0.25 0.32 0.24 0.00 -1.01 0.00 0.00 64.21 64.00 1yfi n SER 234 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1yfi s LYS 235 N -2.61 -0.68 0.36 1.43 -0.14 -1.22 -4.81 119.74 112.08 1yfi s LYS 235 Ca 0.20 0.90 0.08 0.00 -1.36 0.00 0.00 55.97 55.78 1yfi s LYS 235 Cb 0.18 -1.58 0.80 0.00 -1.68 0.00 0.00 37.83 35.56 1yfi s LYS 235 CO 0.59 -3.58 1.92 0.00 -0.76 0.00 0.00 175.35 173.52 1yfi h ALA 236 N -2.52 1.80 -0.24 5.17 0.00 -1.93 -0.94 119.26 120.59 1yfi h ALA 236 Ca -0.59 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.25 1yfi h ALA 236 Cb 1.33 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1yfi h ALA 236 CO 0.50 0.03 -0.12 -0.09 0.00 0.00 0.00 179.25 179.57 1yfi h ARG 237 N 0.70 0.40 -5.50 0.00 2.43 -1.94 -3.48 114.38 107.00 1yfi h ARG 237 Ca 0.37 -0.10 -0.28 0.00 -0.81 0.00 0.00 59.98 59.16 1yfi h ARG 237 Cb 0.50 -0.05 0.18 0.00 -0.42 0.00 0.00 29.97 30.19 1yfi h ARG 237 CO -0.15 0.52 -0.81 1.63 -1.51 0.00 0.00 179.97 179.66 1yfi n LYS 238 N -4.23 -4.15 -1.59 0.20 4.01 -0.36 -4.92 118.16 107.12 1yfi n LYS 238 Ca 0.00 0.85 -0.42 0.00 -0.51 0.00 0.00 58.31 58.23 1yfi n LYS 238 Cb 0.30 -5.80 0.00 0.00 -0.51 0.00 0.00 35.03 29.02 1yfi n LYS 238 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99 1yfi n PRO 239 N -3.60 1.32 -3.34 1.97 -0.02 -1.26 -1.95 135.00 128.12 1yfi n PRO 239 Ca -0.17 0.47 -0.24 0.00 -2.02 0.00 0.00 63.50 61.54 1yfi n PRO 239 Cb 0.64 -1.94 0.01 0.00 -0.02 0.00 0.00 33.50 32.19 1yfi n PRO 239 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yfi n GLY 240 N 1.23 -0.50 2.66 -1.23 0.00 -1.11 -1.36 105.19 104.88 1yfi n GLY 240 Ca 0.09 0.12 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 1yfi n GLY 240 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1yfi n PHE 241 N -4.22 -1.43 0.00 1.61 3.72 -0.82 -1.29 117.46 115.03 1yfi n PHE 241 Ca -0.04 0.17 0.00 0.00 -0.05 0.00 0.00 57.45 57.54 1yfi n PHE 241 Cb 0.56 -3.67 0.00 0.00 -0.94 0.00 0.00 39.48 35.43 1yfi n PHE 241 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1yfi n GLY 242 N -1.10 0.70 0.12 1.37 0.00 -0.46 -4.39 105.19 101.44 1yfi n GLY 242 Ca -0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.98 1yfi n GLY 242 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1yfi h THR 243 N 0.00 0.00 0.00 2.61 1.35 -1.13 -3.41 112.91 112.32 1yfi h THR 243 Ca 0.00 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 1yfi h THR 243 Cb 0.00 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 1yfi h THR 243 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1yfi n GLY 244 N 1.27 0.69 3.94 5.82 0.00 -0.91 -4.39 105.19 111.61 1yfi n GLY 244 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 1yfi n GLY 244 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yfi s LEU 245 N 0.00 4.32 -0.40 0.99 1.43 -1.26 -4.83 118.68 118.93 1yfi s LEU 245 Ca 0.00 0.15 -0.17 0.00 -1.03 0.00 0.00 54.13 53.08 1yfi s LEU 245 Cb 0.00 -2.89 0.01 0.00 0.03 0.00 0.00 46.19 43.34 1yfi s LEU 245 CO 0.00 0.04 0.45 0.20 0.23 0.00 0.00 176.35 177.27 1yfi s ASN 246 N -3.29 6.22 -0.07 2.29 0.02 0.66 -2.76 114.94 118.01 1yfi s ASN 246 Ca 0.34 -0.45 -0.24 0.00 -1.02 0.00 0.00 52.86 51.49 1yfi s ASN 246 Cb -0.11 -2.23 -0.03 0.00 0.02 0.00 0.00 41.25 38.89 1yfi s ASN 246 CO 0.28 -0.53 0.72 0.26 0.02 0.00 0.00 177.10 177.85 1yfi s TRP 247 N 2.21 3.57 0.00 2.20 0.52 -1.26 -0.77 118.94 125.41 1yfi s TRP 247 Ca 0.14 1.27 0.00 0.00 0.02 0.00 0.00 56.10 57.53 1yfi s TRP 247 Cb -0.16 -2.84 0.00 0.00 -1.15 0.00 0.00 33.47 29.32 1yfi s TRP 247 CO 0.14 0.05 0.00 -2.37 0.02 0.00 0.00 176.95 174.79 1yfi n THR 248 N 3.87 0.00 -4.40 2.01 5.66 -0.31 -4.94 114.28 116.18 1yfi n THR 248 Ca -0.00 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.75 1yfi n THR 248 Cb 0.51 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.20 1yfi n THR 248 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1yfi s TYR 249 N -4.37 2.45 -0.37 1.09 1.13 -1.26 -0.20 117.35 115.81 1yfi s TYR 249 Ca 0.00 -0.29 -0.18 0.00 -1.41 0.00 0.00 57.07 55.19 1yfi s TYR 249 Cb 0.00 -1.09 0.00 0.00 -1.10 0.00 0.00 41.96 39.77 1yfi s TYR 249 CO 0.00 0.66 0.52 0.00 -2.51 0.00 0.00 175.55 174.22 1yfi s ALA 250 N -2.33 3.46 -1.77 9.51 0.00 -0.50 -4.55 121.76 125.58 1yfi s ALA 250 Ca 0.29 -1.08 0.23 0.00 0.00 0.00 0.00 51.96 51.41 1yfi s ALA 250 Cb -0.06 -3.06 1.31 0.00 0.00 0.00 0.00 23.12 21.31 1yfi s ALA 250 CO 0.16 -1.32 1.77 -1.13 0.00 0.00 0.00 175.76 175.23 1yfi n SER 251 N 5.80 0.00 -0.23 0.00 3.41 -1.26 -4.18 113.62 117.15 1yfi n SER 251 Ca -0.05 -0.45 0.02 0.00 -0.26 0.00 0.00 58.87 58.13 1yfi n SER 251 Cb 0.49 -0.12 0.11 0.00 -0.26 0.00 0.00 64.21 64.43 1yfi n SER 251 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1yfi h GLY 252 N 3.72 0.67 -0.86 5.00 0.00 -1.95 -3.46 103.07 106.19 1yfi h GLY 252 Ca 0.00 0.14 -0.33 0.00 0.00 0.00 0.00 47.33 47.14 1yfi h GLY 252 CO 0.00 -0.26 -0.30 -1.14 0.00 0.00 0.00 176.54 174.85 1yfi n SER 253 N -5.37 0.50 0.04 0.19 3.41 -1.26 -5.07 113.62 106.06 1yfi n SER 253 Ca 0.11 -2.38 -0.12 0.00 -0.26 0.00 0.00 58.87 56.21 1yfi n SER 253 Cb 0.40 0.81 -0.01 0.00 -0.26 0.00 0.00 64.21 65.16 1yfi n SER 253 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1yfi h LYS 254 N 0.00 0.50 -6.88 4.33 1.57 -1.94 -3.45 116.57 110.71 1yfi h LYS 254 Ca -0.18 -0.43 -0.51 0.00 -1.87 0.00 0.00 60.65 57.65 1yfi h LYS 254 Cb 0.77 0.10 0.05 0.00 0.08 0.00 0.00 32.23 33.22 1yfi h LYS 254 CO 0.28 1.07 0.56 0.00 -0.57 0.00 0.00 179.45 180.79 1yfi s ALA 255 N -3.58 3.39 0.07 3.86 0.00 -1.26 -4.93 121.76 119.31 1yfi s ALA 255 Ca -0.07 1.10 -0.31 0.00 0.00 0.00 0.00 51.96 52.68 1yfi s ALA 255 Cb 0.10 -3.42 -0.08 0.00 0.00 0.00 0.00 23.12 19.72 1yfi s ALA 255 CO 0.86 -0.49 1.60 0.15 0.00 0.00 0.00 175.76 177.88 1yfi s LYS 256 N -1.82 4.22 -0.02 0.00 -0.14 -1.26 -4.98 119.74 115.73 1yfi s LYS 256 Ca 0.50 2.27 -0.02 0.00 -1.36 0.00 0.00 55.97 57.35 1yfi s LYS 256 Cb -0.36 -3.54 0.00 0.00 -1.68 0.00 0.00 37.83 32.26 1yfi s LYS 256 CO 0.46 -0.69 0.06 0.21 -0.76 0.00 0.00 175.35 174.63 1yfi s LYS 257 N 2.41 0.09 0.36 1.68 2.20 -1.26 -4.90 119.74 120.32 1yfi s LYS 257 Ca 0.72 0.04 -0.19 0.00 -0.36 0.00 0.00 55.97 56.17 1yfi s LYS 257 Cb -0.39 0.04 -0.10 0.00 -1.51 0.00 0.00 37.83 35.87 1yfi s LYS 257 CO 0.31 -0.01 0.86 -1.64 -0.36 0.00 0.00 175.35 174.51 1yfi s MET 258 N -0.06 4.19 -0.00 4.03 -1.94 -0.42 -1.41 119.30 123.69 1yfi s MET 258 Ca -0.01 0.97 0.04 0.00 -1.71 0.00 0.00 55.69 54.98 1yfi s MET 258 Cb -0.01 -2.39 -0.01 0.00 2.01 0.00 0.00 34.83 34.43 1yfi s MET 258 CO 0.00 0.10 -0.13 -1.14 -0.01 0.00 0.00 175.02 173.84 1yfi s GLN 259 N -2.89 1.04 -0.09 2.03 0.74 0.71 -0.80 119.66 120.41 1yfi s GLN 259 Ca 0.56 -0.51 0.04 0.00 0.05 0.00 0.00 55.36 55.51 1yfi s GLN 259 Cb -0.11 -1.01 -0.00 0.00 1.10 0.00 0.00 33.01 32.99 1yfi s GLN 259 CO 0.16 0.27 -0.24 -0.06 -0.55 0.00 0.00 175.29 174.88 1yfi s PHE 260 N -0.39 2.48 -0.05 1.67 0.40 0.13 -1.16 117.98 121.07 1yfi s PHE 260 Ca 0.04 -0.96 -0.01 0.00 -0.60 0.00 0.00 56.93 55.41 1yfi s PHE 260 Cb -0.05 -1.66 -0.03 0.00 0.51 0.00 0.00 43.02 41.78 1yfi s PHE 260 CO -0.00 -0.37 0.02 0.15 0.70 0.00 0.00 175.22 175.72 1yfi s LYS 261 N 0.24 2.95 0.00 0.44 1.02 0.05 0.07 119.74 124.51 1yfi s LYS 261 Ca -0.15 -0.47 0.00 0.00 0.02 0.00 0.00 55.97 55.36 1yfi s LYS 261 Cb -0.17 -2.78 0.00 0.00 -0.52 0.00 0.00 37.83 34.36 1yfi s LYS 261 CO 0.08 0.67 0.00 0.41 -0.92 0.00 0.00 175.35 175.59