#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fiy h HIS 20 N 0.00 0.00 -4.12 0.54 2.76 -1.98 -3.45 115.15 108.90 2fiy h HIS 20 Ca 0.00 0.00 -0.45 0.00 -2.20 0.00 0.00 60.37 57.72 2fiy h HIS 20 Cb 0.00 0.00 -0.28 0.00 1.55 0.00 0.00 27.41 28.68 2fiy h HIS 20 CO 0.00 0.23 -0.80 -1.17 -1.30 0.00 0.00 177.93 174.89 2fiy s LEU 21 N -7.11 2.05 -0.17 0.26 2.96 -1.26 -0.02 118.68 115.40 2fiy s LEU 21 Ca -0.01 -0.26 -0.00 0.00 -0.22 0.00 0.00 54.13 53.64 2fiy s LEU 21 Cb 0.12 -0.61 0.04 0.00 0.50 0.00 0.00 46.19 46.23 2fiy s LEU 21 CO 0.64 0.13 -0.06 -1.00 -1.32 0.00 0.00 176.35 174.73 2fiy s HIS 22 N -0.39 1.81 0.47 5.38 3.76 0.07 -5.01 115.29 121.37 2fiy s HIS 22 Ca 0.04 -1.14 -0.23 0.00 -0.15 0.00 0.00 55.06 53.58 2fiy s HIS 22 Cb -0.05 -1.37 -0.07 0.00 1.11 0.00 0.00 32.58 32.20 2fiy s HIS 22 CO -0.00 -0.63 1.17 -0.65 -0.85 0.00 0.00 174.74 173.78 2fiy s GLN 23 N 1.60 3.72 0.80 1.40 -0.21 -1.26 -1.69 119.66 124.02 2fiy s GLN 23 Ca 0.01 1.78 -0.11 0.00 0.02 0.00 0.00 55.36 57.06 2fiy s GLN 23 Cb -0.15 -2.38 0.08 0.00 1.00 0.00 0.00 33.01 31.56 2fiy s GLN 23 CO -0.08 -0.59 1.09 -1.25 -2.12 0.00 0.00 175.29 172.34 2fiy s PRO 24 N -2.74 2.00 0.62 2.91 0.04 -1.26 -4.93 135.00 131.64 2fiy s PRO 24 Ca 0.64 1.03 -0.19 0.00 0.04 0.00 0.00 61.00 62.52 2fiy s PRO 24 Cb -0.29 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 2fiy s PRO 24 CO 0.35 -1.78 1.32 0.45 0.04 0.00 0.00 177.00 177.37 2fiy s SER 25 N -3.45 4.80 0.03 6.66 0.15 -1.26 -4.88 113.70 115.75 2fiy s SER 25 Ca 0.62 2.68 0.14 0.00 0.70 0.00 0.00 55.95 60.09 2fiy s SER 25 Cb -0.17 -2.62 0.61 0.00 -1.71 0.00 0.00 66.02 62.12 2fiy s SER 25 CO 0.56 -1.88 1.45 0.54 1.20 0.00 0.00 173.24 175.12 2fiy n ARG 26 N -1.63 0.02 -0.77 5.44 1.74 -1.26 -1.84 116.66 118.36 2fiy n ARG 26 Ca 0.14 0.29 0.03 0.00 -0.77 0.00 0.00 57.85 57.55 2fiy n ARG 26 Cb 0.47 -1.54 0.31 0.00 -1.02 0.00 0.00 32.46 30.68 2fiy n ARG 26 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2fiy n ASP 27 N -1.58 4.60 -0.25 0.55 8.00 -1.26 -4.76 116.55 121.84 2fiy n ASP 27 Ca 0.03 -3.11 0.05 0.00 0.71 0.00 0.00 54.79 52.47 2fiy n ASP 27 Cb 0.16 -0.65 0.28 0.00 -0.02 0.00 0.00 41.12 40.89 2fiy n ASP 27 CO 0.00 0.00 0.00 0.17 -0.39 0.00 0.00 177.20 176.98 2fiy h LEU 28 N 2.63 0.81 -0.13 0.64 8.10 -1.72 -1.79 115.31 123.85 2fiy h LEU 28 Ca 0.09 0.00 -0.24 0.00 0.11 0.00 0.00 57.88 57.85 2fiy h LEU 28 Cb 1.87 -0.17 0.01 0.00 -0.44 0.00 0.00 40.66 41.93 2fiy h LEU 28 CO 0.46 0.52 -0.92 -0.26 -4.11 0.00 0.00 178.44 174.13 2fiy h PHE 29 N 0.92 0.88 -0.44 0.17 0.04 -1.86 -1.26 116.94 115.40 2fiy h PHE 29 Ca 0.36 -0.45 -0.00 0.00 2.80 0.00 0.00 57.97 60.68 2fiy h PHE 29 Cb 0.22 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 2fiy h PHE 29 CO -0.00 1.27 0.27 0.00 -0.60 0.00 0.00 178.31 179.25 2fiy h ALA 30 N 0.59 0.55 -0.71 2.45 0.00 -1.67 -1.44 119.26 119.03 2fiy h ALA 30 Ca -0.09 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2fiy h ALA 30 Cb 1.56 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 2fiy h ALA 30 CO 0.18 0.03 0.26 0.00 0.00 0.00 0.00 179.25 179.72 2fiy h ARG 31 N 0.58 1.08 -0.03 0.00 3.08 -1.29 -1.03 114.38 116.77 2fiy h ARG 31 Ca 0.16 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2fiy h ARG 31 Cb -0.02 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 29.86 2fiy h ARG 31 CO -0.03 0.91 0.02 -0.09 -1.07 0.00 0.00 179.97 179.71 2fiy h ARG 32 N 1.03 0.04 -0.55 0.04 2.43 -1.10 -0.41 114.38 115.87 2fiy h ARG 32 Ca 0.23 -0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.45 2fiy h ARG 32 Cb 0.25 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.75 2fiy h ARG 32 CO -0.01 0.02 0.27 0.78 -1.51 0.00 0.00 179.97 179.52 2fiy h GLY 33 N 0.04 0.77 1.02 2.80 0.00 -1.02 -0.82 103.07 105.86 2fiy h GLY 33 Ca 0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 2fiy h GLY 33 CO -0.00 0.10 0.36 0.83 0.00 0.00 0.00 176.54 177.83 2fiy h GLU 34 N 0.52 1.10 -0.52 4.80 5.08 -1.00 -1.13 114.58 123.43 2fiy h GLU 34 Ca 0.25 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 2fiy h GLU 34 Cb 0.17 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2fiy h GLU 34 CO -0.18 0.86 0.06 -0.09 -1.00 0.00 0.00 179.01 178.66 2fiy h ARG 35 N 1.08 0.89 -0.56 2.33 9.65 -0.68 -0.89 114.38 126.19 2fiy h ARG 35 Ca 0.26 -0.25 0.04 0.00 -1.10 0.00 0.00 59.98 58.93 2fiy h ARG 35 Cb 0.12 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.56 2fiy h ARG 35 CO -0.03 0.88 0.31 -0.07 2.80 0.00 0.00 179.97 183.86 2fiy h LEU 36 N 0.77 0.47 -0.81 3.80 3.38 -0.88 0.11 115.31 122.15 2fiy h LEU 36 Ca 0.16 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 2fiy h LEU 36 Cb 0.44 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 2fiy h LEU 36 CO 0.02 0.32 0.43 -0.07 0.09 0.00 0.00 178.44 179.22 2fiy h LEU 37 N 0.60 1.02 -0.39 1.67 3.38 -0.91 0.14 115.31 120.82 2fiy h LEU 37 Ca 0.24 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 2fiy h LEU 37 Cb 0.11 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2fiy h LEU 37 CO -0.14 0.84 0.09 -0.61 0.09 0.00 0.00 178.44 178.71 2fiy h GLN 38 N 1.13 0.63 0.00 1.13 4.15 -0.75 -2.98 115.11 118.42 2fiy h GLN 38 Ca 0.28 -0.15 -0.11 0.00 0.77 0.00 0.00 58.65 59.44 2fiy h GLN 38 Cb 0.06 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 2fiy h GLN 38 CO -0.04 0.66 -0.52 -0.07 -1.93 0.00 0.00 178.83 176.93 2fiy h LEU 39 N 0.49 0.00 -1.87 -2.39 3.38 -0.80 -3.23 115.31 110.90 2fiy h LEU 39 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2fiy h LEU 39 Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 2fiy h LEU 39 CO 0.00 0.52 -0.06 0.00 0.09 0.00 0.00 178.44 178.99 2fiy h ALA 40 N 1.48 1.07 -2.27 1.53 0.00 -0.80 -3.40 119.26 116.86 2fiy h ALA 40 Ca -0.01 -0.05 -0.55 0.00 0.00 0.00 0.00 54.91 54.31 2fiy h ALA 40 Cb 0.98 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2fiy h ALA 40 CO 0.07 0.07 1.03 -2.00 0.00 0.00 0.00 179.25 178.42 2fiy s GLU 41 N -3.90 4.20 -1.43 0.00 2.56 -1.22 -1.67 118.70 117.24 2fiy s GLU 41 Ca -0.01 2.11 0.00 0.00 0.00 0.00 0.00 54.97 57.07 2fiy s GLU 41 Cb 0.11 -3.89 0.00 0.00 2.00 0.00 0.00 34.13 32.35 2fiy s GLU 41 CO 0.53 -0.79 0.00 0.41 -0.56 0.00 0.00 175.26 174.85 2fiy n GLY 42 N 4.01 1.17 3.83 -1.50 0.00 -1.26 -5.01 105.19 106.44 2fiy n GLY 42 Ca 0.16 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 2fiy n GLY 42 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2fiy s HIS 43 N -2.55 3.53 0.38 1.61 5.04 -0.67 -5.01 115.29 117.62 2fiy s HIS 43 Ca 0.00 0.46 0.11 0.00 -1.54 0.00 0.00 55.06 54.09 2fiy s HIS 43 Cb 0.00 -1.98 0.89 0.00 0.04 0.00 0.00 32.58 31.53 2fiy s HIS 43 CO 0.00 0.62 1.89 -1.35 -2.34 0.00 0.00 174.74 173.56 2fiy h PRO 44 N 5.37 0.59 -0.71 2.88 0.11 -1.95 -1.78 132.00 136.51 2fiy h PRO 44 Ca -0.52 -0.04 -0.35 0.00 0.11 0.00 0.00 66.00 65.21 2fiy h PRO 44 Cb 1.21 -0.13 -0.21 0.00 0.11 0.00 0.00 31.00 31.98 2fiy h PRO 44 CO 0.62 0.39 0.33 -1.33 -0.21 0.00 0.00 178.00 177.79 2fiy n MET 45 N -4.53 2.30 -0.17 1.05 2.81 -1.26 -4.78 117.12 112.54 2fiy n MET 45 Ca 0.16 -3.08 0.01 0.00 -1.81 0.00 0.00 57.70 52.99 2fiy n MET 45 Cb 0.48 -2.04 0.28 0.00 -0.71 0.00 0.00 33.22 31.23 2fiy n MET 45 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 2fiy h GLY 46 N 1.22 0.96 0.94 3.03 0.00 -1.52 -1.65 103.07 106.05 2fiy h GLY 46 Ca 0.43 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 2fiy h GLY 46 CO 0.78 0.35 0.13 -0.55 0.00 0.00 0.00 176.54 177.25 2fiy h ASP 47 N 0.92 0.33 -0.14 0.19 3.32 -1.86 0.62 116.42 119.79 2fiy h ASP 47 Ca 0.25 -0.11 0.03 0.00 0.02 0.00 0.00 57.03 57.22 2fiy h ASP 47 Cb -0.10 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 2fiy h ASP 47 CO -0.05 0.34 -0.06 0.22 -1.72 0.00 0.00 179.24 177.97 2fiy h TYR 48 N 0.29 -0.14 -0.85 4.55 3.20 -1.82 -2.16 116.97 120.04 2fiy h TYR 48 Ca 0.09 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.02 2fiy h TYR 48 Cb 0.09 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.40 2fiy h TYR 48 CO -0.03 -0.10 0.56 -0.07 -1.64 0.00 0.00 178.16 176.88 2fiy h LEU 49 N -0.04 0.89 -0.92 2.82 3.38 -1.09 -1.21 115.31 119.13 2fiy h LEU 49 Ca 0.08 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 2fiy h LEU 49 Cb 0.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2fiy h LEU 49 CO -0.17 0.60 -0.26 0.03 0.09 0.00 0.00 178.44 178.72 2fiy h ARG 50 N 1.02 0.48 -0.32 1.13 3.08 -0.72 -1.34 114.38 117.72 2fiy h ARG 50 Ca 0.35 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 2fiy h ARG 50 Cb 0.09 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2fiy h ARG 50 CO -0.11 0.71 0.15 -0.07 -1.07 0.00 0.00 179.97 179.58 2fiy h LEU 51 N 0.43 0.42 -1.00 3.04 4.07 -0.69 -2.52 115.31 119.05 2fiy h LEU 51 Ca 0.06 -0.13 -0.03 0.00 0.08 0.00 0.00 57.88 57.86 2fiy h LEU 51 Cb 0.69 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 42.29 2fiy h LEU 51 CO 0.05 0.43 0.31 0.58 -1.08 0.00 0.00 178.44 178.73 2fiy h VAL 52 N 0.38 1.23 -0.70 1.22 2.07 -1.18 -2.67 116.25 116.60 2fiy h VAL 52 Ca 0.11 -0.70 0.09 0.00 0.82 0.00 0.00 66.70 67.02 2fiy h VAL 52 Cb 0.13 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.18 2fiy h VAL 52 CO -0.01 0.29 0.34 0.00 0.02 0.00 0.00 177.57 178.21 2fiy h ALA 53 N 1.32 0.96 -0.72 1.67 0.00 -1.03 -0.33 119.26 121.14 2fiy h ALA 53 Ca 0.24 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.28 2fiy h ALA 53 Cb 0.15 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 2fiy h ALA 53 CO -0.03 -0.06 0.39 0.78 0.00 0.00 0.00 179.25 180.33 2fiy h GLY 54 N 0.58 1.07 0.99 0.00 0.00 -1.13 0.13 103.07 104.71 2fiy h GLY 54 Ca 0.35 -0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 2fiy h GLY 54 CO -0.27 0.13 0.18 -2.00 0.00 0.00 0.00 176.54 174.57 2fiy h LEU 55 N 0.69 0.82 -0.93 3.11 5.85 -1.09 -1.92 115.31 121.84 2fiy h LEU 55 Ca 0.33 -0.21 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 2fiy h LEU 55 Cb 0.27 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2fiy h LEU 55 CO -0.22 0.81 0.06 0.00 -0.34 0.00 0.00 178.44 178.75 2fiy h ARG 57 N 0.80 1.20 -0.30 0.00 3.08 -0.73 -1.71 114.38 116.72 2fiy h ARG 57 Ca 0.16 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 2fiy h ARG 57 Cb 0.39 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2fiy h ARG 57 CO 0.01 0.79 0.13 1.25 -1.07 0.00 0.00 179.97 181.09 2fiy h LEU 58 N 1.23 0.40 -0.84 3.04 6.46 -0.63 -2.40 115.31 122.57 2fiy h LEU 58 Ca 0.35 -0.14 0.15 0.00 -0.12 0.00 0.00 57.88 58.12 2fiy h LEU 58 Cb -0.09 -0.10 -0.10 0.00 -0.73 0.00 0.00 40.66 39.64 2fiy h LEU 58 CO -0.09 0.43 0.41 1.56 -0.62 0.00 0.00 178.44 180.13 2fiy h GLN 59 N 0.34 0.56 -0.36 1.25 4.20 -0.73 -1.26 115.11 119.11 2fiy h GLN 59 Ca 0.10 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 2fiy h GLN 59 Cb 0.15 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 2fiy h GLN 59 CO -0.01 0.37 0.13 0.37 -0.67 0.00 0.00 178.83 179.02 2fiy h GLN 60 N 0.58 0.55 -0.89 1.46 5.75 -0.93 -1.00 115.11 120.63 2fiy h GLN 60 Ca 0.46 -0.11 0.01 0.00 -0.15 0.00 0.00 58.65 58.86 2fiy h GLN 60 Cb 0.68 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.10 2fiy h GLN 60 CO -0.38 0.55 0.59 0.00 -2.65 0.00 0.00 178.83 176.94 2fiy h ALA 61 N 0.97 1.13 0.10 3.38 0.00 -1.05 -0.25 119.26 123.54 2fiy h ALA 61 Ca 0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2fiy h ALA 61 Cb 0.22 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2fiy h ALA 61 CO -0.01 0.53 -0.05 -0.07 0.00 0.00 0.00 179.25 179.66 2fiy h LEU 62 N 1.21 -0.11 -1.42 0.00 3.38 -1.09 -2.28 115.31 114.99 2fiy h LEU 62 Ca 0.33 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.18 2fiy h LEU 62 Cb -0.14 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 2fiy h LEU 62 CO -0.07 0.10 0.43 0.25 0.09 0.00 0.00 178.44 179.24 2fiy h LEU 63 N -0.32 0.64 -0.04 1.67 5.85 -0.87 -0.19 115.31 122.05 2fiy h LEU 63 Ca -0.01 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2fiy h LEU 63 Cb 0.27 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2fiy h LEU 63 CO 0.02 0.43 0.00 0.47 -0.34 0.00 0.00 178.44 179.03 2fiy n ASP 64 N -4.47 0.15 -3.12 1.25 8.00 -0.13 -4.29 116.55 113.94 2fiy n ASP 64 Ca 0.09 0.52 -0.21 0.00 0.71 0.00 0.00 54.79 55.89 2fiy n ASP 64 Cb 0.16 -0.56 -0.05 0.00 -0.02 0.00 0.00 41.12 40.66 2fiy n ASP 64 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2fiy n ASN 65 N -1.64 -0.31 -4.75 -2.24 2.85 -0.10 -5.07 115.26 104.00 2fiy n ASN 65 Ca 0.06 -2.79 -0.37 0.00 -0.11 0.00 0.00 54.58 51.37 2fiy n ASN 65 Cb 0.31 -0.25 0.03 0.00 1.24 0.00 0.00 39.78 41.11 2fiy n ASN 65 CO 0.00 0.00 0.00 -2.84 -2.11 0.00 0.00 177.26 172.31 2fiy s PRO 66 N -0.90 3.10 0.95 1.20 0.02 -1.07 -4.78 135.00 133.52 2fiy s PRO 66 Ca 0.35 1.96 -0.13 0.00 0.02 0.00 0.00 61.00 63.20 2fiy s PRO 66 Cb 0.18 -2.09 0.16 0.00 0.02 0.00 0.00 34.50 32.77 2fiy s PRO 66 CO -0.13 -1.14 1.13 -1.25 -0.33 0.00 0.00 177.00 175.28 2fiy s PRO 67 N -3.11 0.82 0.08 5.54 0.04 -1.26 -4.96 135.00 132.14 2fiy s PRO 67 Ca 0.74 0.28 -0.31 0.00 0.04 0.00 0.00 61.00 61.75 2fiy s PRO 67 Cb -0.34 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 2fiy s PRO 67 CO 0.38 -2.41 1.89 0.00 0.04 0.00 0.00 177.00 176.90 2fiy n ALA 68 N -3.91 1.86 -2.53 8.56 0.00 -1.26 -4.99 120.51 118.23 2fiy n ALA 68 Ca 0.07 0.28 -0.24 0.00 0.00 0.00 0.00 53.44 53.55 2fiy n ALA 68 Cb 0.59 -2.62 -0.14 0.00 0.00 0.00 0.00 19.45 17.29 2fiy n ALA 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fiy s LEU 69 N 3.43 2.17 0.15 0.00 1.43 -1.26 -4.90 118.68 119.71 2fiy s LEU 69 Ca 0.85 -0.51 -0.31 0.00 -1.03 0.00 0.00 54.13 53.13 2fiy s LEU 69 Cb -0.48 -0.86 -0.09 0.00 0.03 0.00 0.00 46.19 44.79 2fiy s LEU 69 CO 0.40 0.12 1.41 0.00 0.23 0.00 0.00 176.35 178.51 2fiy s ALA 70 N -0.83 3.61 0.74 4.21 0.00 -1.26 -4.99 121.76 123.24 2fiy s ALA 70 Ca 0.06 1.18 -0.11 0.00 0.00 0.00 0.00 51.96 53.09 2fiy s ALA 70 Cb -0.09 -3.54 0.03 0.00 0.00 0.00 0.00 23.12 19.53 2fiy s ALA 70 CO 0.02 -0.64 1.07 -1.25 0.00 0.00 0.00 175.76 174.96 2fiy s PRO 71 N 0.73 2.58 0.01 0.00 0.04 -1.26 -4.96 135.00 132.15 2fiy s PRO 71 Ca 0.63 0.90 -0.30 0.00 0.04 0.00 0.00 61.00 62.27 2fiy s PRO 71 Cb -0.38 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.13 2fiy s PRO 71 CO 0.33 -1.34 1.62 -0.51 0.04 0.00 0.00 177.00 177.14 2fiy s LEU 72 N -5.68 4.34 -0.31 -3.56 1.43 -1.26 -4.93 118.68 108.72 2fiy s LEU 72 Ca 0.59 2.34 -0.35 0.00 -1.03 0.00 0.00 54.13 55.68 2fiy s LEU 72 Cb -0.15 -3.55 -0.11 0.00 0.03 0.00 0.00 46.19 42.41 2fiy s LEU 72 CO 0.55 -0.87 2.14 -0.67 0.23 0.00 0.00 176.35 177.73 2fiy n ASP 73 N 6.14 2.38 0.25 2.29 -0.08 -1.26 -4.86 116.55 121.41 2fiy n ASP 73 Ca 0.16 0.48 0.11 0.00 -1.51 0.00 0.00 54.79 54.03 2fiy n ASP 73 Cb 0.42 -1.30 0.64 0.00 2.34 0.00 0.00 41.12 43.22 2fiy n ASP 73 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2fiy h PRO 74 N 12.11 0.00 -0.15 -0.67 0.13 -1.99 -1.55 132.00 139.87 2fiy h PRO 74 Ca -0.32 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.65 2fiy h PRO 74 Cb 1.31 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.44 2fiy h PRO 74 CO 1.00 0.16 -0.56 1.49 -0.23 0.00 0.00 178.00 179.87 2fiy h GLU 75 N 0.00 0.64 -0.74 0.86 4.57 -1.99 -2.19 114.58 115.73 2fiy h GLU 75 Ca -0.00 -0.49 -0.06 0.00 -1.18 0.00 0.00 59.36 57.63 2fiy h GLU 75 Cb 0.46 0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 2fiy h GLU 75 CO 0.02 1.11 0.24 -0.09 -1.18 0.00 0.00 179.01 179.11 2fiy h ARG 76 N 0.31 1.15 -0.42 1.92 1.12 -1.85 0.20 114.38 116.81 2fiy h ARG 76 Ca -0.03 -0.24 0.02 0.00 -1.11 0.00 0.00 59.98 58.62 2fiy h ARG 76 Cb 1.18 -0.17 -0.03 0.00 -0.01 0.00 0.00 29.97 30.95 2fiy h ARG 76 CO 0.12 0.97 0.24 -0.07 -3.11 0.00 0.00 179.97 178.11 2fiy h LEU 77 N 1.10 0.37 -0.60 3.80 4.07 -1.33 -0.74 115.31 121.98 2fiy h LEU 77 Ca 0.24 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.20 2fiy h LEU 77 Cb 0.30 -0.07 -0.03 0.00 1.08 0.00 0.00 40.66 41.94 2fiy h LEU 77 CO -0.01 0.27 0.34 -0.09 -1.08 0.00 0.00 178.44 177.87 2fiy h ARG 78 N 0.48 0.83 -0.26 1.13 2.43 -0.76 -1.43 114.38 116.79 2fiy h ARG 78 Ca 0.17 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 2fiy h ARG 78 Cb 0.03 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 2fiy h ARG 78 CO -0.09 0.62 -0.08 0.87 -1.51 0.00 0.00 179.97 179.79 2fiy h LYS 79 N 0.81 0.51 -0.55 0.20 1.57 -0.78 0.39 116.57 118.71 2fiy h LYS 79 Ca 0.21 -0.20 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 2fiy h LYS 79 Cb 0.02 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 2fiy h LYS 79 CO -0.04 0.73 0.13 0.66 -0.57 0.00 0.00 179.45 180.36 2fiy h SER 80 N 0.25 0.80 -0.31 0.86 4.64 -0.98 -0.12 113.55 118.70 2fiy h SER 80 Ca 0.06 -0.15 -0.08 0.00 -0.47 0.00 0.00 61.79 61.15 2fiy h SER 80 Cb 0.55 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 2fiy h SER 80 CO 0.03 0.79 -0.14 -0.09 -0.87 0.00 0.00 176.83 176.55 2fiy h ARG 81 N 0.82 0.63 -0.08 4.77 2.43 -1.14 0.11 114.38 121.92 2fiy h ARG 81 Ca 0.18 -0.27 0.02 0.00 -0.81 0.00 0.00 59.98 59.10 2fiy h ARG 81 Cb 0.31 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.84 2fiy h ARG 81 CO -0.00 0.85 0.06 1.49 -1.51 0.00 0.00 179.97 180.86 2fiy h GLU 82 N 0.39 0.00 -0.50 0.20 4.81 -0.38 -2.21 114.58 116.89 2fiy h GLU 82 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2fiy h GLU 82 Cb 0.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.04 2fiy h GLU 82 CO 0.04 0.00 0.00 0.72 -0.73 0.00 0.00 179.01 179.04 2fiy n HIS 83 N -4.47 0.66 -2.36 0.92 8.25 -0.10 -4.95 115.22 113.17 2fiy n HIS 83 Ca -0.01 -0.33 -0.17 0.00 -0.26 0.00 0.00 57.72 56.95 2fiy n HIS 83 Cb 0.17 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.28 2fiy n HIS 83 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2fiy n GLY 84 N 1.44 -0.32 3.81 -1.41 0.00 -0.83 -5.01 105.19 102.87 2fiy n GLY 84 Ca 0.20 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 2fiy n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2fiy s MET 85 N -4.88 2.96 0.27 1.61 -1.94 0.35 -5.03 119.30 112.65 2fiy s MET 85 Ca 0.02 -0.77 -0.30 0.00 -1.71 0.00 0.00 55.69 52.93 2fiy s MET 85 Cb -0.01 -2.72 -0.12 0.00 2.01 0.00 0.00 34.83 33.99 2fiy s MET 85 CO 0.02 0.52 1.55 -2.30 -0.01 0.00 0.00 175.02 174.80 2fiy n PRO 86 N -0.07 2.51 0.26 2.03 -0.02 -1.26 -4.16 135.00 134.30 2fiy n PRO 86 Ca -0.08 0.89 0.09 0.00 -2.02 0.00 0.00 63.50 62.38 2fiy n PRO 86 Cb 0.53 -2.64 0.67 0.00 -0.02 0.00 0.00 33.50 32.04 2fiy n PRO 86 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2fiy h PRO 87 N 4.70 0.00 -0.44 0.52 0.13 -1.73 -2.45 132.00 132.72 2fiy h PRO 87 Ca -0.46 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.41 2fiy h PRO 87 Cb 1.24 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.21 2fiy h PRO 87 CO 0.79 0.06 -0.11 1.28 -0.23 0.00 0.00 178.00 179.79 2fiy n LEU 88 N -4.24 4.47 -3.97 1.56 4.77 0.61 -4.91 117.00 115.28 2fiy n LEU 88 Ca -0.03 -3.95 -0.56 0.00 -0.03 0.00 0.00 56.01 51.44 2fiy n LEU 88 Cb 0.15 -0.63 -0.10 0.00 -2.33 0.00 0.00 43.42 40.51 2fiy n LEU 88 CO 0.33 1.40 1.33 0.00 -1.33 0.00 0.00 177.39 179.12 2fiy n ALA 89 N -1.07 -0.38 -0.32 -1.18 0.00 -0.93 -4.53 120.51 112.11 2fiy n ALA 89 Ca 0.37 0.28 -0.03 0.00 0.00 0.00 0.00 53.44 54.06 2fiy n ALA 89 Cb 1.01 -1.80 0.09 0.00 0.00 0.00 0.00 19.45 18.74 2fiy n ALA 89 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2fiy h TYR 90 N 6.58 1.11 -0.30 0.00 -0.00 -1.54 -2.60 116.97 120.21 2fiy h TYR 90 Ca -0.21 0.02 -0.06 0.00 0.00 0.00 0.00 58.73 58.49 2fiy h TYR 90 Cb 1.25 -0.37 -0.01 0.00 0.00 0.00 0.00 36.73 37.59 2fiy h TYR 90 CO 0.75 0.70 -0.03 0.22 -0.00 0.00 0.00 178.16 179.80 2fiy h ASP 91 N 1.19 0.55 0.27 0.10 3.58 -1.86 0.25 116.42 120.50 2fiy h ASP 91 Ca 0.32 -0.33 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 2fiy h ASP 91 Cb -0.13 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 40.75 2fiy h ASP 91 CO -0.07 0.75 -0.24 0.25 -2.88 0.00 0.00 179.24 177.05 2fiy h LEU 92 N 0.33 -0.64 -0.64 2.28 6.46 -1.91 -2.77 115.31 118.42 2fiy h LEU 92 Ca 0.08 0.06 -0.13 0.00 -0.12 0.00 0.00 57.88 57.76 2fiy h LEU 92 Cb 0.49 0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.62 2fiy h LEU 92 CO 0.02 -0.36 -0.38 -0.07 -0.62 0.00 0.00 178.44 177.04 2fiy h LEU 93 N -0.53 0.68 -0.93 2.25 3.38 -1.27 -2.33 115.31 116.56 2fiy h LEU 93 Ca -0.01 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.61 2fiy h LEU 93 Cb 0.48 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2fiy h LEU 93 CO -0.04 0.98 0.19 1.62 0.09 0.00 0.00 178.44 181.28 2fiy h VAL 94 N 0.53 1.24 -0.08 1.22 3.04 -0.52 -2.53 116.25 119.15 2fiy h VAL 94 Ca 0.05 -0.84 -0.09 0.00 -1.01 0.00 0.00 66.70 64.81 2fiy h VAL 94 Cb 0.89 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.71 2fiy h VAL 94 CO 0.08 0.32 -0.36 0.03 -1.01 0.00 0.00 177.57 176.63 2fiy h ARG 95 N 0.94 0.17 0.00 4.17 3.08 -1.25 -3.12 114.38 118.37 2fiy h ARG 95 Ca 0.21 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.11 2fiy h ARG 95 Cb 0.28 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 2fiy h ARG 95 CO -0.01 0.51 -0.36 0.93 -1.07 0.00 0.00 179.97 179.97 2fiy h GLU 96 N 0.15 0.00 0.00 0.04 5.08 -0.99 -3.48 114.58 115.38 2fiy h GLU 96 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2fiy h GLU 96 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2fiy h GLU 96 CO 0.05 0.36 0.00 0.41 -1.00 0.00 0.00 179.01 178.83 2fiy n GLY 97 N -0.07 0.69 0.08 -3.84 0.00 -1.13 -4.92 105.19 96.00 2fiy n GLY 97 Ca -0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.10 2fiy n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fiy n ALA 98 N 0.55 1.57 0.88 4.61 0.00 -1.26 -1.78 120.51 125.08 2fiy n ALA 98 Ca 0.00 0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.62 2fiy n ALA 98 Cb 0.00 -1.30 0.55 0.00 0.00 0.00 0.00 19.45 18.70 2fiy n ALA 98 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 2fiy n TRP 99 N -1.93 0.29 -0.23 0.00 4.27 -1.26 -4.37 117.44 114.20 2fiy n TRP 99 Ca 0.02 0.08 0.00 0.00 -3.89 0.00 0.00 57.50 53.72 2fiy n TRP 99 Cb 0.18 -0.64 0.23 0.00 -1.36 0.00 0.00 31.31 29.72 2fiy n TRP 99 CO 0.00 0.00 0.00 -0.07 -2.29 0.00 0.00 177.69 175.33 2fiy h LEU 100 N 0.00 0.89 -2.63 5.67 4.07 -1.77 -1.72 115.31 119.83 2fiy h LEU 100 Ca 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2fiy h LEU 100 Cb 0.57 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 42.09 2fiy h LEU 100 CO 0.00 0.66 0.02 -0.65 -1.08 0.00 0.00 178.44 177.39 2fiy h PRO 101 N 1.05 0.00 -0.51 1.13 0.11 -1.83 -1.21 132.00 130.73 2fiy h PRO 101 Ca 0.28 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.31 2fiy h PRO 101 Cb -0.10 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 2fiy h PRO 101 CO -0.06 0.00 0.00 -1.49 -0.21 0.00 0.00 178.00 176.24 2fiy h TRP 102 N 0.00 0.98 -0.32 0.65 4.06 -1.63 -0.74 115.95 118.96 2fiy h TRP 102 Ca 0.01 -0.17 -0.02 0.00 2.06 0.00 0.00 58.89 60.77 2fiy h TRP 102 Cb 0.05 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 27.94 2fiy h TRP 102 CO 0.00 0.91 0.14 1.25 -3.56 0.00 0.00 178.44 177.18 2fiy h LEU 103 N 0.77 0.43 -0.36 -4.49 5.85 -1.31 -0.34 115.31 115.85 2fiy h LEU 103 Ca 0.15 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.75 2fiy h LEU 103 Cb 0.52 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 2fiy h LEU 103 CO 0.03 0.46 0.16 0.44 -0.34 0.00 0.00 178.44 179.18 2fiy h ASP 104 N 0.37 0.20 -0.82 1.25 3.32 -1.32 -1.64 116.42 117.79 2fiy h ASP 104 Ca 0.11 0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 2fiy h ASP 104 Cb 0.15 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 2fiy h ASP 104 CO -0.01 0.16 0.37 0.00 -1.72 0.00 0.00 179.24 178.04 2fiy h ALA 105 N 1.21 1.11 -0.45 3.45 0.00 -1.00 -1.45 119.26 122.13 2fiy h ALA 105 Ca 0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2fiy h ALA 105 Cb 0.10 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2fiy h ALA 105 CO -0.14 0.66 0.10 1.25 0.00 0.00 0.00 179.25 181.12 2fiy h LEU 106 N 1.17 0.69 -0.36 0.00 6.46 -0.74 0.09 115.31 122.61 2fiy h LEU 106 Ca 0.28 -0.24 -0.04 0.00 -0.12 0.00 0.00 57.88 57.76 2fiy h LEU 106 Cb 0.15 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.88 2fiy h LEU 106 CO -0.03 0.75 0.06 -0.07 -0.62 0.00 0.00 178.44 178.52 2fiy h LEU 107 N 0.59 0.58 -1.44 2.25 3.38 -1.11 -2.09 115.31 117.48 2fiy h LEU 107 Ca 0.14 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 2fiy h LEU 107 Cb 0.33 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2fiy h LEU 107 CO 0.00 0.69 -0.21 0.00 0.09 0.00 0.00 178.44 179.01 2fiy h ALA 108 N 0.91 1.54 -0.10 1.53 0.00 -1.18 -2.44 119.26 119.51 2fiy h ALA 108 Ca 0.11 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2fiy h ALA 108 Cb 0.36 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2fiy h ALA 108 CO 0.01 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.01 2fiy n GLY 109 N -0.81 -0.42 2.75 0.00 0.00 0.01 -4.29 105.19 102.43 2fiy n GLY 109 Ca -0.02 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 2fiy n GLY 109 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2fiy n TYR 110 N -0.23 3.70 1.78 1.61 9.36 -0.84 -4.93 117.16 127.61 2fiy n TYR 110 Ca 0.11 -4.03 0.15 0.00 3.32 0.00 0.00 57.90 57.45 2fiy n TYR 110 Cb 0.15 -0.50 0.88 0.00 -0.63 0.00 0.00 39.34 39.23 2fiy n TYR 110 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2fiy n PRO 111 N 0.10 0.79 -3.18 2.98 -0.04 -1.26 -4.37 135.00 130.02 2fiy n PRO 111 Ca 0.30 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.56 2fiy n PRO 111 Cb 0.41 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.33 2fiy n PRO 111 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fiy n ALA 112 N -1.10 2.31 -0.76 0.55 0.00 -1.26 -5.12 120.51 115.13 2fiy n ALA 112 Ca 0.20 -3.50 -0.31 0.00 0.00 0.00 0.00 53.44 49.83 2fiy n ALA 112 Cb 0.15 -0.89 0.16 0.00 0.00 0.00 0.00 19.45 18.88 2fiy n ALA 112 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2fiy s PRO 113 N -2.14 1.15 0.22 0.00 0.04 -1.26 -4.95 135.00 128.05 2fiy s PRO 113 Ca 0.39 1.52 0.05 0.00 0.04 0.00 0.00 61.00 63.00 2fiy s PRO 113 Cb 0.29 -1.74 0.19 0.00 0.04 0.00 0.00 34.50 33.27 2fiy s PRO 113 CO -0.09 -2.53 1.51 0.00 0.04 0.00 0.00 177.00 175.93 2fiy h ALA 114 N -1.78 0.77 -2.99 8.56 0.00 -1.99 -3.48 119.26 118.35 2fiy h ALA 114 Ca -0.43 -0.60 -0.08 0.00 0.00 0.00 0.00 54.91 53.79 2fiy h ALA 114 Cb 1.27 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2fiy h ALA 114 CO 0.42 0.80 0.17 0.54 0.00 0.00 0.00 179.25 181.19 2fiy s ASN 115 N -6.89 0.24 0.36 0.00 2.20 -1.26 -5.06 114.94 104.53 2fiy s ASN 115 Ca -0.03 -1.25 0.10 0.00 -0.94 0.00 0.00 52.86 50.74 2fiy s ASN 115 Cb 0.12 0.82 0.69 0.00 -2.00 0.00 0.00 41.25 40.88 2fiy s ASN 115 CO 0.80 -1.62 1.84 0.00 -2.94 0.00 0.00 177.10 175.18 2fiy h ALA 116 N 2.02 1.38 -0.03 3.54 0.00 -1.98 -1.43 119.26 122.77 2fiy h ALA 116 Ca -0.32 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.20 2fiy h ALA 116 Cb 1.25 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.97 2fiy h ALA 116 CO 0.41 0.43 -0.37 0.00 0.00 0.00 0.00 179.25 179.72 2fiy h ALA 117 N 1.58 0.08 -0.57 0.00 0.00 -1.98 0.23 119.26 118.60 2fiy h ALA 117 Ca 0.02 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 2fiy h ALA 117 Cb 0.56 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 2fiy h ALA 117 CO 0.04 0.19 0.20 -0.24 0.00 0.00 0.00 179.25 179.45 2fiy h VAL 118 N -0.27 1.21 -0.37 0.00 3.04 -1.94 -0.15 116.25 117.77 2fiy h VAL 118 Ca -0.04 -0.70 0.04 0.00 -1.01 0.00 0.00 66.70 64.99 2fiy h VAL 118 Cb 1.08 0.56 -0.04 0.00 -2.01 0.00 0.00 31.29 30.88 2fiy h VAL 118 CO 0.07 0.27 0.15 1.23 -1.01 0.00 0.00 177.57 178.29 2fiy h GLY 119 N 0.96 0.49 1.36 3.17 0.00 -1.06 -1.04 103.07 106.94 2fiy h GLY 119 Ca 0.19 -0.09 -0.04 0.00 0.00 0.00 0.00 47.33 47.39 2fiy h GLY 119 CO -0.01 0.05 0.19 0.00 0.00 0.00 0.00 176.54 176.76 2fiy h ALA 120 N 1.23 1.29 -0.39 3.60 0.00 -0.01 -1.69 119.26 123.28 2fiy h ALA 120 Ca 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2fiy h ALA 120 Cb 0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2fiy h ALA 120 CO -0.15 0.52 0.12 0.00 0.00 0.00 0.00 179.25 179.73 2fiy h ALA 121 N 1.40 0.51 -0.61 0.00 0.00 -0.64 -1.86 119.26 118.08 2fiy h ALA 121 Ca 0.19 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2fiy h ALA 121 Cb 0.21 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2fiy h ALA 121 CO -0.01 0.16 0.08 -0.07 0.00 0.00 0.00 179.25 179.42 2fiy h LEU 122 N 0.49 0.98 -0.70 0.00 3.38 -1.01 -2.16 115.31 116.28 2fiy h LEU 122 Ca 0.13 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2fiy h LEU 122 Cb 0.27 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2fiy h LEU 122 CO -0.00 1.00 0.42 -0.08 0.09 0.00 0.00 178.44 179.87 2fiy h GLU 123 N 0.92 0.95 -0.87 1.13 4.57 -1.18 0.16 114.58 120.25 2fiy h GLU 123 Ca 0.18 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 2fiy h GLU 123 Cb 0.45 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.80 2fiy h GLU 123 CO 0.01 0.67 0.55 1.96 -1.18 0.00 0.00 179.01 181.02 2fiy h GLN 124 N 0.95 1.17 -0.44 1.92 4.20 -1.12 0.13 115.11 121.92 2fiy h GLN 124 Ca 0.25 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.79 2fiy h GLN 124 Cb -0.03 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.48 2fiy h GLN 124 CO -0.05 0.80 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.79 2fiy h LEU 125 N 1.19 0.80 -0.67 1.46 3.38 -0.78 -0.64 115.31 120.05 2fiy h LEU 125 Ca 0.32 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2fiy h LEU 125 Cb -0.09 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 2fiy h LEU 125 CO -0.06 0.95 0.40 0.03 0.09 0.00 0.00 178.44 179.84 2fiy h ARG 126 N 0.64 0.92 0.00 1.13 3.08 -0.24 -3.10 114.38 116.82 2fiy h ARG 126 Ca 0.12 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 2fiy h ARG 126 Cb 0.56 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2fiy h ARG 126 CO 0.03 0.66 -0.33 0.93 -1.07 0.00 0.00 179.97 180.20 2fiy h GLU 127 N 0.92 0.00 -6.81 0.04 4.39 -0.69 -3.46 114.58 108.97 2fiy h GLU 127 Ca 0.24 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.42 2fiy h GLU 127 Cb -0.01 0.00 0.06 0.00 -0.10 0.00 0.00 28.75 28.70 2fiy h GLU 127 CO -0.04 0.33 0.70 0.00 -1.16 0.00 0.00 179.01 178.84 2fiy s ALA 128 N -3.14 3.56 0.81 3.43 0.00 -0.26 -5.02 121.76 121.15 2fiy s ALA 128 Ca 0.04 1.30 -0.06 0.00 0.00 0.00 0.00 51.96 53.24 2fiy s ALA 128 Cb 0.07 -3.52 0.16 0.00 0.00 0.00 0.00 23.12 19.83 2fiy s ALA 128 CO 0.71 -0.70 1.11 -1.83 0.00 0.00 0.00 175.76 175.05 2fiy s GLU 129 N -1.02 1.28 0.21 0.00 -1.05 -1.26 -4.77 118.70 112.08 2fiy s GLU 129 Ca 0.55 -0.93 -0.10 0.00 -0.15 0.00 0.00 54.97 54.34 2fiy s GLU 129 Cb -0.41 -2.17 0.28 0.00 -0.44 0.00 0.00 34.13 31.39 2fiy s GLU 129 CO 0.48 -1.81 1.71 0.93 0.95 0.00 0.00 175.26 177.52 2fiy h GLU 130 N -0.92 0.26 -0.66 -4.83 5.08 -1.99 -1.41 114.58 110.12 2fiy h GLU 130 Ca -0.38 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 57.91 2fiy h GLU 130 Cb 1.25 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 2fiy h GLU 130 CO 0.38 0.17 0.20 0.78 -1.00 0.00 0.00 179.01 179.55 2fiy h GLY 131 N 0.27 1.08 0.80 -3.84 0.00 -1.99 -0.90 103.07 98.49 2fiy h GLY 131 Ca 0.31 -0.62 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 2fiy h GLY 131 CO -0.39 0.58 -0.02 -1.61 0.00 0.00 0.00 176.54 175.10 2fiy h GLN 132 N 0.97 0.35 -0.84 4.80 5.75 -1.69 -1.26 115.11 123.18 2fiy h GLN 132 Ca 0.21 -0.12 -0.02 0.00 -0.15 0.00 0.00 58.65 58.57 2fiy h GLN 132 Cb 0.28 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.77 2fiy h GLN 132 CO -0.01 0.58 0.44 0.00 -2.65 0.00 0.00 178.83 177.19 2fiy h ARG 133 N 0.08 1.20 -0.54 1.69 3.08 -1.16 -1.61 114.38 117.12 2fiy h ARG 133 Ca 0.05 -0.16 -0.10 0.00 0.07 0.00 0.00 59.98 59.84 2fiy h ARG 133 Cb 0.44 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 2fiy h ARG 133 CO 0.01 0.90 -0.07 0.87 -1.07 0.00 0.00 179.97 180.62 2fiy h LYS 134 N 1.19 0.98 -0.40 0.04 1.57 -1.06 -1.22 116.57 117.68 2fiy h LYS 134 Ca 0.29 -0.33 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2fiy h LYS 134 Cb 0.07 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2fiy h LYS 134 CO -0.04 1.01 0.17 0.00 -0.57 0.00 0.00 179.45 180.01 2fiy h ALA 135 N 1.02 0.52 -0.75 3.86 0.00 -0.85 0.08 119.26 123.14 2fiy h ALA 135 Ca 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2fiy h ALA 135 Cb 0.61 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2fiy h ALA 135 CO 0.04 0.11 0.42 -1.49 0.00 0.00 0.00 179.25 178.33 2fiy h TRP 136 N 0.50 1.03 -0.57 0.00 6.55 -1.21 -1.59 115.95 120.65 2fiy h TRP 136 Ca 0.13 -0.02 -0.10 0.00 0.95 0.00 0.00 58.89 59.85 2fiy h TRP 136 Cb 0.17 -0.33 -0.02 0.00 -0.86 0.00 0.00 29.16 28.12 2fiy h TRP 136 CO -0.00 0.72 -0.02 0.00 -1.05 0.00 0.00 178.44 178.08 2fiy h ALA 137 N 1.22 0.77 -0.79 1.49 0.00 -1.00 -0.76 119.26 120.19 2fiy h ALA 137 Ca 0.27 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2fiy h ALA 137 Cb 0.03 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2fiy h ALA 137 CO -0.04 0.62 0.33 0.82 0.00 0.00 0.00 179.25 180.97 2fiy h ILE 138 N 0.90 1.26 -0.43 0.00 2.04 -0.84 -1.23 117.51 119.22 2fiy h ILE 138 Ca 0.16 -0.79 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 2fiy h ILE 138 Cb 0.58 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 2fiy h ILE 138 CO 0.03 0.33 0.17 0.00 0.00 0.00 0.00 178.15 178.68 2fiy h ALA 139 N 1.17 0.56 -0.12 1.87 0.00 -0.99 -1.94 119.26 119.82 2fiy h ALA 139 Ca 0.26 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2fiy h ALA 139 Cb 0.19 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2fiy h ALA 139 CO -0.02 0.17 -0.00 1.25 0.00 0.00 0.00 179.25 180.64 2fiy h LEU 140 N 0.55 0.21 -0.73 0.00 5.85 -0.87 0.30 115.31 120.62 2fiy h LEU 140 Ca 0.14 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.54 2fiy h LEU 140 Cb 0.20 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.17 2fiy h LEU 140 CO -0.01 0.48 0.00 -0.07 -0.34 0.00 0.00 178.44 178.50 2fiy h LEU 141 N -0.07 0.00 -1.86 2.25 3.38 -1.24 -2.02 115.31 115.75 2fiy h LEU 141 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2fiy h LEU 141 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2fiy h LEU 141 CO 0.01 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.00 2fiy n SER 142 N -2.53 2.85 -0.32 -0.43 3.41 -0.73 -4.98 113.62 110.89 2fiy n SER 142 Ca 0.02 -1.92 -0.04 0.00 -0.26 0.00 0.00 58.87 56.67 2fiy n SER 142 Cb 0.31 -0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.17 2fiy n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fiy n GLY 143 N 1.35 0.70 3.26 5.00 0.00 -0.59 -4.97 105.19 109.95 2fiy n GLY 143 Ca 0.16 -0.80 -0.44 0.00 0.00 0.00 0.00 46.02 44.94 2fiy n GLY 143 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2fiy n GLN 144 N -2.82 3.65 0.28 1.61 6.02 0.96 -4.84 117.38 122.24 2fiy n GLN 144 Ca -0.04 -4.14 0.18 0.00 -0.01 0.00 0.00 57.00 52.99 2fiy n GLN 144 Cb 0.15 -2.76 0.73 0.00 1.02 0.00 0.00 30.24 29.37 2fiy n GLN 144 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2fiy h PHE 145 N 6.48 0.00 0.00 1.08 0.04 -1.93 -1.79 116.94 120.83 2fiy h PHE 145 Ca 0.26 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.03 2fiy h PHE 145 Cb 0.79 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.94 2fiy h PHE 145 CO 0.98 0.00 0.00 -0.25 -0.60 0.00 0.00 178.31 178.44 2fiy n ASP 146 N -3.08 0.18 -1.23 2.17 8.00 -1.26 -3.49 116.55 117.84 2fiy n ASP 146 Ca 0.00 0.53 0.11 0.00 0.71 0.00 0.00 54.79 56.14 2fiy n ASP 146 Cb 0.29 -0.58 0.29 0.00 -0.02 0.00 0.00 41.12 41.10 2fiy n ASP 146 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2fiy n LEU 147 N -1.69 3.77 -4.03 0.64 4.77 -0.67 -4.92 117.00 114.88 2fiy n LEU 147 Ca 0.04 -1.99 -0.08 0.00 -0.03 0.00 0.00 56.01 53.96 2fiy n LEU 147 Cb 0.24 -0.44 -0.09 0.00 -2.33 0.00 0.00 43.42 40.80 2fiy n LEU 147 CO 0.19 0.94 -0.26 -1.48 -1.33 0.00 0.00 177.39 175.45 2fiy s LEU 148 N -1.01 2.04 0.16 2.23 0.05 -1.23 -4.68 118.68 116.25 2fiy s LEU 148 Ca 0.44 -0.92 -0.30 0.00 0.05 0.00 0.00 54.13 53.40 2fiy s LEU 148 Cb 0.23 0.48 -0.07 0.00 -2.05 0.00 0.00 46.19 44.78 2fiy s LEU 148 CO 0.30 -0.66 1.17 -2.84 -0.55 0.00 0.00 176.35 173.76 2fiy s PRO 149 N -3.92 4.51 0.32 1.48 0.02 -1.26 -4.93 135.00 131.22 2fiy s PRO 149 Ca 0.09 1.80 0.02 0.00 0.02 0.00 0.00 61.00 62.94 2fiy s PRO 149 Cb 0.07 -3.27 0.60 0.00 0.02 0.00 0.00 34.50 31.91 2fiy s PRO 149 CO -0.08 -0.06 1.93 0.00 -0.33 0.00 0.00 177.00 178.45 2fiy h ALA 150 N 5.47 1.57 0.00 -1.55 0.00 -1.86 -1.76 119.26 121.13 2fiy h ALA 150 Ca -0.44 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2fiy h ALA 150 Cb 1.21 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2fiy h ALA 150 CO 0.75 0.30 -0.02 0.00 0.00 0.00 0.00 179.25 180.28 2fiy h ALA 151 N 1.54 1.04 0.00 0.00 0.00 -1.91 -2.40 119.26 117.53 2fiy h ALA 151 Ca 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2fiy h ALA 151 Cb 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2fiy h ALA 151 CO -0.13 0.03 -0.46 -0.07 0.00 0.00 0.00 179.25 178.62 2fiy h LEU 152 N 0.00 0.00 -0.24 0.00 4.07 -1.65 -3.40 115.31 114.09 2fiy h LEU 152 Ca -0.00 -0.06 0.06 0.00 0.08 0.00 0.00 57.88 57.96 2fiy h LEU 152 Cb 0.31 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.99 2fiy h LEU 152 CO 0.00 0.03 -0.16 0.58 -1.08 0.00 0.00 178.44 177.81 2fiy h VAL 153 N 0.00 0.54 -0.72 1.22 2.07 -1.43 -1.51 116.25 116.42 2fiy h VAL 153 Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 2fiy h VAL 153 Cb 0.88 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 2fiy h VAL 153 CO 0.00 0.00 0.47 -0.65 0.02 0.00 0.00 177.57 177.41 2fiy h PRO 154 N -0.15 0.78 0.04 1.57 0.11 -1.77 0.21 132.00 132.79 2fiy h PRO 154 Ca 0.14 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.09 2fiy h PRO 154 Cb 0.35 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.30 2fiy h PRO 154 CO -0.33 0.52 -0.44 0.74 -0.21 0.00 0.00 178.00 178.27 2fiy h PHE 155 N 0.80 0.36 -0.17 0.65 0.04 -1.71 -1.29 116.94 115.63 2fiy h PHE 155 Ca 0.30 -0.23 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 2fiy h PHE 155 Cb 0.16 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 2fiy h PHE 155 CO -0.00 1.10 0.05 1.25 -0.60 0.00 0.00 178.31 180.11 2fiy h LEU 156 N -0.47 0.24 -0.57 1.54 5.85 -1.19 -2.25 115.31 118.46 2fiy h LEU 156 Ca -0.07 -0.20 0.09 0.00 0.84 0.00 0.00 57.88 58.54 2fiy h LEU 156 Cb 1.25 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 42.15 2fiy h LEU 156 CO 0.08 0.38 0.20 1.23 -0.34 0.00 0.00 178.44 180.00 2fiy h GLY 157 N 0.09 0.77 1.26 3.75 0.00 -0.66 -1.45 103.07 106.83 2fiy h GLY 157 Ca 0.05 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.23 2fiy h GLY 157 CO -0.00 -0.01 0.18 0.00 0.00 0.00 0.00 176.54 176.71 2fiy h ALA 158 N 1.39 1.16 -0.52 3.60 0.00 -1.12 -0.55 119.26 123.22 2fiy h ALA 158 Ca 0.28 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2fiy h ALA 158 Cb 0.34 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2fiy h ALA 158 CO -0.29 0.58 0.11 0.00 0.00 0.00 0.00 179.25 179.65 2fiy h ALA 159 N 1.29 0.69 -0.42 0.00 0.00 -1.00 -2.41 119.26 117.41 2fiy h ALA 159 Ca 0.20 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2fiy h ALA 159 Cb 0.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2fiy h ALA 159 CO -0.01 0.40 -0.10 -0.07 0.00 0.00 0.00 179.25 179.47 2fiy h LEU 160 N 0.73 0.82 -0.38 0.00 3.38 -0.98 -2.08 115.31 116.80 2fiy h LEU 160 Ca 0.16 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.81 2fiy h LEU 160 Cb 0.36 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2fiy h LEU 160 CO 0.01 0.99 0.13 1.56 0.09 0.00 0.00 178.44 181.22 2fiy h GLN 161 N 0.64 0.27 -0.51 1.13 4.20 -1.05 -0.83 115.11 118.96 2fiy h GLN 161 Ca 0.11 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 2fiy h GLN 161 Cb 0.63 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 2fiy h GLN 161 CO 0.04 0.18 0.30 0.28 -0.67 0.00 0.00 178.83 178.96 2fiy h VAL 162 N 0.28 1.16 -0.13 -0.54 2.07 -1.39 -0.31 116.25 117.40 2fiy h VAL 162 Ca 0.17 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2fiy h VAL 162 Cb 0.16 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2fiy h VAL 162 CO -0.18 0.17 0.07 0.00 0.02 0.00 0.00 177.57 177.65 2fiy h ALA 163 N 1.14 0.16 -0.26 1.67 0.00 -1.08 -0.14 119.26 120.75 2fiy h ALA 163 Ca 0.18 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 2fiy h ALA 163 Cb 0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2fiy h ALA 163 CO -0.03 -0.37 -0.44 -1.49 0.00 0.00 0.00 179.25 176.93 2fiy h TRP 164 N 0.16 0.79 -0.49 0.00 6.55 -1.03 -1.84 115.95 120.08 2fiy h TRP 164 Ca 0.05 -0.24 -0.13 0.00 0.95 0.00 0.00 58.89 59.52 2fiy h TRP 164 Cb -0.01 -0.16 -0.01 0.00 -0.86 0.00 0.00 29.16 28.12 2fiy h TRP 164 CO -0.08 0.97 -0.20 0.77 -1.05 0.00 0.00 178.44 178.85 2fiy h SER 165 N 0.53 1.03 -0.31 -3.49 0.02 -0.94 0.23 113.55 110.62 2fiy h SER 165 Ca 0.04 -0.38 0.04 0.00 -0.84 0.00 0.00 61.79 60.65 2fiy h SER 165 Cb 0.97 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 63.19 2fiy h SER 165 CO 0.09 1.19 0.06 -0.74 -1.14 0.00 0.00 176.83 176.28 2fiy h HIS 166 N 0.87 0.10 -0.57 3.45 -0.00 -0.92 0.20 115.15 118.28 2fiy h HIS 166 Ca 0.12 0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.48 2fiy h HIS 166 Cb 0.78 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.17 2fiy h HIS 166 CO 0.05 0.02 0.26 -1.49 -0.00 0.00 0.00 177.93 176.77 2fiy h TRP 167 N 0.17 0.84 -0.17 5.26 6.55 -1.12 -2.56 115.95 124.91 2fiy h TRP 167 Ca 0.14 -0.05 0.02 0.00 0.95 0.00 0.00 58.89 59.95 2fiy h TRP 167 Cb 0.16 -0.26 -0.02 0.00 -0.86 0.00 0.00 29.16 28.18 2fiy h TRP 167 CO -0.18 0.66 0.07 1.25 -1.05 0.00 0.00 178.44 179.19 2fiy h LEU 168 N 0.78 0.08 -2.12 -4.49 5.85 -0.59 -2.32 115.31 112.50 2fiy h LEU 168 Ca 0.19 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 2fiy h LEU 168 Cb 0.15 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 2fiy h LEU 168 CO -0.02 0.07 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.08 2fiy h LEU 169 N 0.15 0.00 -0.53 2.25 3.38 -0.80 -2.23 115.31 117.54 2fiy h LEU 169 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2fiy h LEU 169 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2fiy h LEU 169 CO -0.07 0.00 -0.30 0.61 0.09 0.00 0.00 178.44 178.77 2fiy n GLY 170 N -0.45 -0.56 3.73 0.83 0.00 -0.90 -4.87 105.19 102.98 2fiy n GLY 170 Ca -0.01 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 2fiy n GLY 170 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fiy s LEU 171 N -2.52 4.40 -0.56 0.99 1.43 -0.84 -4.95 118.68 116.63 2fiy s LEU 171 Ca 0.23 2.28 -0.01 0.00 -1.03 0.00 0.00 54.13 55.61 2fiy s LEU 171 Cb 0.19 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.80 2fiy s LEU 171 CO 0.54 -0.51 0.47 1.21 0.23 0.00 0.00 176.35 178.29 2fiy n GLU 172 N 3.13 -2.64 -2.21 1.70 4.07 -1.26 -4.99 120.64 118.44 2fiy n GLU 172 Ca 0.07 0.41 -0.41 0.00 -0.06 0.00 0.00 57.16 57.18 2fiy n GLU 172 Cb 0.44 -3.98 -0.03 0.00 -0.06 0.00 0.00 31.44 27.80 2fiy n GLU 172 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2fiy s GLU 173 N -4.40 4.41 0.00 5.31 2.02 -1.26 -1.29 118.70 123.49 2fiy s GLU 173 Ca 0.06 2.09 0.00 0.00 0.02 0.00 0.00 54.97 57.14 2fiy s GLU 173 Cb -0.01 -3.14 0.00 0.00 0.10 0.00 0.00 34.13 31.08 2fiy s GLU 173 CO 0.35 -0.16 0.00 0.41 0.02 0.00 0.00 175.26 175.88 2fiy n GLY 174 N 1.54 1.95 0.20 -1.39 0.00 -1.26 -4.96 105.19 101.28 2fiy n GLY 174 Ca 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 2fiy n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fiy h ALA 175 N 0.00 0.90 -2.37 4.61 0.00 -1.60 -3.42 119.26 117.38 2fiy h ALA 175 Ca 0.00 -0.46 -0.55 0.00 0.00 0.00 0.00 54.91 53.90 2fiy h ALA 175 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2fiy h ALA 175 CO 0.00 0.65 0.56 0.08 0.00 0.00 0.00 179.25 180.54 2fiy s VAL 176 N -4.08 4.43 0.40 0.00 1.01 -1.26 -4.52 120.40 116.37 2fiy s VAL 176 Ca -0.06 1.74 -0.27 0.00 0.00 0.00 0.00 61.98 63.39 2fiy s VAL 176 Cb 0.12 -4.12 -0.10 0.00 0.00 0.00 0.00 36.38 32.28 2fiy s VAL 176 CO 0.81 0.07 1.47 0.52 0.00 0.00 0.00 175.10 177.97 2fiy n VAL 177 N 4.25 2.26 -2.81 2.92 0.31 -1.22 -4.97 118.33 119.07 2fiy n VAL 177 Ca 0.09 -0.50 -0.24 0.00 -0.01 0.00 0.00 64.34 63.68 2fiy n VAL 177 Cb 0.48 -1.94 -0.02 0.00 -0.91 0.00 0.00 33.84 31.45 2fiy n VAL 177 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2fiy n GLU 178 N 0.23 2.79 -2.77 5.55 0.28 -1.26 -4.74 120.64 120.72 2fiy n GLU 178 Ca 0.02 -4.41 -0.34 0.00 -0.16 0.00 0.00 57.16 52.28 2fiy n GLU 178 Cb 0.40 -2.08 -0.06 0.00 1.43 0.00 0.00 31.44 31.12 2fiy n GLU 178 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2fiy s THR 179 N -4.39 4.26 -0.65 3.84 2.01 -1.26 -5.02 115.64 114.43 2fiy s THR 179 Ca 0.45 1.51 0.24 0.00 0.31 0.00 0.00 61.69 64.20 2fiy s THR 179 Cb 0.34 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 2fiy s THR 179 CO -0.13 -0.20 1.18 -0.62 -0.69 0.00 0.00 174.62 174.15 2fiy n GLU 180 N -0.40 0.27 -3.11 4.92 4.71 -1.26 -4.18 120.64 121.58 2fiy n GLU 180 Ca 0.06 0.03 -0.17 0.00 -0.01 0.00 0.00 57.16 57.08 2fiy n GLU 180 Cb 0.53 -1.63 -0.01 0.00 -1.01 0.00 0.00 31.44 29.32 2fiy n GLU 180 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 2fiy n SER 181 N -1.99 0.53 -4.72 1.62 3.41 -1.26 -4.26 113.62 106.95 2fiy n SER 181 Ca 0.03 -3.06 -0.41 0.00 -0.26 0.00 0.00 58.87 55.16 2fiy n SER 181 Cb 0.43 -0.35 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 2fiy n SER 181 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2fiy s ARG 182 N -2.18 4.62 0.24 4.33 0.52 -1.26 -4.95 118.95 120.26 2fiy s ARG 182 Ca 0.37 1.49 0.25 0.00 -0.52 0.00 0.00 55.73 57.32 2fiy s ARG 182 Cb 0.35 -3.40 0.57 0.00 0.52 0.00 0.00 34.95 32.99 2fiy s ARG 182 CO -0.07 0.06 1.60 1.79 0.02 0.00 0.00 175.30 178.70 2fiy h THR 183 N 4.34 0.00 -3.02 0.02 1.35 -1.94 -3.47 112.91 110.19 2fiy h THR 183 Ca -0.42 -0.62 -0.63 0.00 -0.55 0.00 0.00 66.41 64.19 2fiy h THR 183 Cb 1.21 1.50 -0.18 0.00 -1.73 0.00 0.00 68.15 68.96 2fiy h THR 183 CO 0.74 0.00 -0.80 -0.76 -0.25 0.00 0.00 175.52 174.44 2fiy s LEU 184 N -4.86 2.46 0.20 3.87 1.43 -1.26 -4.44 118.68 116.08 2fiy s LEU 184 Ca 0.08 -0.90 -0.32 0.00 -1.03 0.00 0.00 54.13 51.96 2fiy s LEU 184 Cb 0.11 -1.10 -0.12 0.00 0.03 0.00 0.00 46.19 45.10 2fiy s LEU 184 CO 0.65 0.08 1.71 0.00 0.23 0.00 0.00 176.35 179.02 2fiy n PRO 186 N 3.94 0.18 0.00 0.00 -0.04 -1.26 -0.67 135.00 137.15 2fiy n PRO 186 Ca 0.16 0.28 -0.21 0.00 -0.04 0.00 0.00 63.50 63.68 2fiy n PRO 186 Cb 0.34 -1.77 -0.14 0.00 -0.04 0.00 0.00 33.50 31.90 2fiy n PRO 186 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fiy h ALA 187 N 2.47 0.21 0.00 0.55 0.00 -1.90 -3.24 119.26 117.35 2fiy h ALA 187 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.78 2fiy h ALA 187 Cb 0.51 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2fiy h ALA 187 CO 0.00 0.88 -0.08 0.00 0.00 0.00 0.00 179.25 180.05 2fiy n GLY 189 N 0.74 0.72 3.89 0.00 0.00 0.15 -1.27 105.19 109.42 2fiy n GLY 189 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2fiy n GLY 189 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fiy s SER 190 N -2.42 6.20 0.63 1.61 0.01 -1.26 -4.47 113.70 114.01 2fiy s SER 190 Ca 0.00 1.14 -0.13 0.00 1.31 0.00 0.00 55.95 58.27 2fiy s SER 190 Cb 0.00 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.89 2fiy s SER 190 CO 0.00 -0.74 1.04 -2.16 0.41 0.00 0.00 173.24 171.79 2fiy s PRO 191 N -4.96 3.29 0.68 12.44 0.05 -1.26 -0.90 135.00 144.34 2fiy s PRO 191 Ca 0.51 1.00 -0.15 0.00 0.05 0.00 0.00 61.00 62.42 2fiy s PRO 191 Cb -0.11 -2.04 0.01 0.00 0.05 0.00 0.00 34.50 32.42 2fiy s PRO 191 CO 0.49 -0.82 1.13 -1.25 0.05 0.00 0.00 177.00 176.60 2fiy s PRO 192 N -4.63 2.61 0.08 0.56 0.04 -1.26 -1.67 135.00 130.74 2fiy s PRO 192 Ca 0.59 1.47 0.21 0.00 0.04 0.00 0.00 61.00 63.32 2fiy s PRO 192 Cb -0.14 -1.92 -0.15 0.00 0.04 0.00 0.00 34.50 32.33 2fiy s PRO 192 CO 0.46 -1.41 0.76 -0.12 0.04 0.00 0.00 177.00 176.73 2fiy n MET 193 N -2.53 0.63 -3.62 4.56 0.00 1.00 -3.46 117.12 113.70 2fiy n MET 193 Ca 0.11 0.03 -0.00 0.00 -0.00 0.00 0.00 57.70 57.84 2fiy n MET 193 Cb 0.52 -1.70 -0.01 0.00 0.00 0.00 0.00 33.22 32.02 2fiy n MET 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2fiy s ALA 194 N -3.28 -2.17 0.19 -5.12 0.00 -1.24 -4.75 121.76 105.39 2fiy s ALA 194 Ca -0.04 0.87 0.06 0.00 0.00 0.00 0.00 51.96 52.86 2fiy s ALA 194 Cb 0.11 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.45 2fiy s ALA 194 CO 0.84 -0.95 0.12 0.20 0.00 0.00 0.00 175.76 175.97 2fiy s GLY 195 N -2.79 1.64 -0.06 0.00 0.00 -0.63 -1.06 107.32 104.41 2fiy s GLY 195 Ca 0.13 -1.32 -0.01 0.00 0.00 0.00 0.00 44.72 43.52 2fiy s GLY 195 CO -0.04 -1.34 0.02 1.06 0.00 0.00 0.00 173.10 172.80 2fiy s MET 196 N -3.29 0.36 -0.31 2.90 -1.94 0.96 -1.48 119.30 116.50 2fiy s MET 196 Ca 0.31 0.18 -0.09 0.00 -1.71 0.00 0.00 55.69 54.38 2fiy s MET 196 Cb -0.09 -0.76 -0.00 0.00 2.01 0.00 0.00 34.83 35.99 2fiy s MET 196 CO 0.23 -0.28 0.13 0.42 -0.01 0.00 0.00 175.02 175.51 2fiy s ILE 197 N 1.87 4.42 -0.38 2.53 1.09 -0.19 -0.14 121.20 130.40 2fiy s ILE 197 Ca 0.02 -0.52 -0.08 0.00 -1.10 0.00 0.00 60.65 58.98 2fiy s ILE 197 Cb -0.12 -3.27 0.06 0.00 -1.06 0.00 0.00 42.46 38.07 2fiy s ILE 197 CO -0.04 0.06 0.19 -0.13 -0.10 0.00 0.00 174.94 174.92 2fiy s ARG 198 N 1.58 2.57 -0.15 2.79 0.52 0.22 -2.00 118.95 124.48 2fiy s ARG 198 Ca 0.04 -1.36 -0.06 0.00 -0.52 0.00 0.00 55.73 53.83 2fiy s ARG 198 Cb -0.17 -3.63 0.01 0.00 0.52 0.00 0.00 34.95 31.67 2fiy s ARG 198 CO 0.05 -0.84 0.16 1.04 0.02 0.00 0.00 175.30 175.73 2fiy n GLN 199 N 4.85 -0.44 0.00 3.54 3.00 -1.26 -2.76 117.38 124.31 2fiy n GLN 199 Ca -0.10 0.28 0.00 0.00 -0.01 0.00 0.00 57.00 57.17 2fiy n GLN 199 Cb 0.44 -0.51 0.00 0.00 0.00 0.00 0.00 30.24 30.16 2fiy n GLN 199 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 2fiy n THR 204 N -0.45 0.00 0.00 5.09 5.66 -1.26 -4.68 114.28 118.64 2fiy n THR 204 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 2fiy n THR 204 Cb 0.17 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.95 2fiy n THR 204 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2fiy n GLY 205 N 0.21 3.34 3.77 1.09 0.00 -1.26 -5.16 105.19 107.19 2fiy n GLY 205 Ca 0.00 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 2fiy n GLY 205 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fiy s LEU 206 N 0.00 4.54 -0.15 0.99 1.43 -1.11 -4.78 118.68 119.60 2fiy s LEU 206 Ca 0.00 1.52 -0.07 0.00 -1.03 0.00 0.00 54.13 54.55 2fiy s LEU 206 Cb 0.00 -3.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.97 2fiy s LEU 206 CO 0.00 0.17 0.10 -0.60 0.23 0.00 0.00 176.35 176.24 2fiy s ARG 207 N -0.83 3.68 0.02 1.70 3.52 -1.26 -0.61 118.95 125.18 2fiy s ARG 207 Ca 0.35 -0.25 0.07 0.00 -0.13 0.00 0.00 55.73 55.78 2fiy s ARG 207 Cb -0.22 -3.19 -0.02 0.00 -1.56 0.00 0.00 34.95 29.96 2fiy s ARG 207 CO 0.24 0.53 -0.21 0.71 -0.81 0.00 0.00 175.30 175.76 2fiy s TYR 208 N -0.34 1.83 0.15 5.12 1.51 0.80 -2.29 117.35 124.14 2fiy s TYR 208 Ca 0.10 -0.37 -0.15 0.00 -1.01 0.00 0.00 57.07 55.64 2fiy s TYR 208 Cb -0.12 -1.12 -0.07 0.00 -0.11 0.00 0.00 41.96 40.54 2fiy s TYR 208 CO 0.01 0.05 0.57 -0.51 -1.11 0.00 0.00 175.55 174.56 2fiy s LEU 209 N -0.95 4.35 -0.19 -1.29 1.43 0.04 -0.02 118.68 122.05 2fiy s LEU 209 Ca 0.08 1.13 -0.00 0.00 -1.03 0.00 0.00 54.13 54.30 2fiy s LEU 209 Cb -0.09 -3.27 0.01 0.00 0.03 0.00 0.00 46.19 42.88 2fiy s LEU 209 CO 0.01 0.11 -0.16 -0.55 0.23 0.00 0.00 176.35 175.99 2fiy s SER 210 N -1.66 3.42 0.23 2.29 0.15 -0.22 -1.23 113.70 116.67 2fiy s SER 210 Ca 0.38 -0.59 -0.30 0.00 0.70 0.00 0.00 55.95 56.14 2fiy s SER 210 Cb -0.15 -1.54 -0.09 0.00 -1.71 0.00 0.00 66.02 62.52 2fiy s SER 210 CO 0.19 -0.00 1.35 0.00 1.20 0.00 0.00 173.24 175.98 2fiy h SER 212 N 4.97 0.00 0.00 0.00 4.64 -1.56 -3.18 113.55 118.43 2fiy h SER 212 Ca -0.46 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.85 2fiy h SER 212 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2fiy h SER 212 CO 0.76 0.09 -0.94 -0.11 -0.87 0.00 0.00 176.83 175.77 2fiy n LEU 213 N -3.36 1.83 -0.17 5.97 0.00 -1.26 -4.58 117.00 115.43 2fiy n LEU 213 Ca -0.01 0.31 0.10 0.00 0.00 0.00 0.00 56.01 56.41 2fiy n LEU 213 Cb 0.28 -0.69 -0.06 0.00 0.00 0.00 0.00 43.42 42.95 2fiy n LEU 213 CO 0.29 -0.30 0.10 0.00 0.00 0.00 0.00 177.39 177.48 2fiy n ALA 215 N -0.99 -0.27 -1.80 0.00 0.00 -1.20 -4.17 120.51 112.08 2fiy n ALA 215 Ca 0.06 0.24 -0.41 0.00 0.00 0.00 0.00 53.44 53.33 2fiy n ALA 215 Cb 0.38 -1.69 -0.02 0.00 0.00 0.00 0.00 19.45 18.12 2fiy n ALA 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fiy s GLU 217 N -1.44 3.56 0.01 0.00 2.02 -0.68 -0.57 118.70 121.59 2fiy s GLU 217 Ca 0.52 -0.58 0.04 0.00 0.02 0.00 0.00 54.97 54.96 2fiy s GLU 217 Cb -0.41 -2.82 -0.01 0.00 0.10 0.00 0.00 34.13 30.99 2fiy s GLU 217 CO 0.51 0.21 -0.12 1.67 0.02 0.00 0.00 175.26 177.55 2fiy s TRP 218 N 0.41 1.10 0.24 1.61 -2.14 -0.37 -0.75 118.94 119.04 2fiy s TRP 218 Ca -0.06 -0.26 -0.30 0.00 2.66 0.00 0.00 56.10 58.14 2fiy s TRP 218 Cb -0.15 -0.69 -0.10 0.00 -3.10 0.00 0.00 33.47 29.43 2fiy s TRP 218 CO 0.04 -0.00 1.46 -1.58 -2.66 0.00 0.00 176.95 174.20 2fiy s HIS 219 N -0.49 3.01 -0.03 1.66 5.65 0.97 -0.78 115.29 125.29 2fiy s HIS 219 Ca 0.03 0.97 -0.00 0.00 0.25 0.00 0.00 55.06 56.31 2fiy s HIS 219 Cb -0.06 -3.84 0.03 0.00 -1.18 0.00 0.00 32.58 27.53 2fiy s HIS 219 CO 0.00 -2.78 0.01 -0.47 -0.65 0.00 0.00 174.74 170.85 2fiy s TYR 220 N 0.13 0.24 0.09 3.88 5.04 -0.97 -4.76 117.35 121.02 2fiy s TYR 220 Ca 0.61 0.05 -0.36 0.00 -2.44 0.00 0.00 57.07 54.92 2fiy s TYR 220 Cb -0.42 -0.40 -0.17 0.00 0.35 0.00 0.00 41.96 41.31 2fiy s TYR 220 CO 0.42 -0.14 1.17 1.55 -1.34 0.00 0.00 175.55 177.21 2fiy n VAL 221 N 4.33 0.38 0.25 3.14 3.14 -1.26 -4.58 118.33 123.72 2fiy n VAL 221 Ca -0.23 -0.09 0.12 0.00 -2.96 0.00 0.00 64.34 61.18 2fiy n VAL 221 Cb 0.50 -0.56 0.60 0.00 -1.06 0.00 0.00 33.84 33.32 2fiy n VAL 221 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 2fiy h ARG 222 N 3.60 0.00 -1.59 1.45 2.43 -1.96 -3.24 114.38 115.06 2fiy h ARG 222 Ca -0.46 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.04 2fiy h ARG 222 Cb 1.37 0.00 -0.34 0.00 -0.42 0.00 0.00 29.97 30.58 2fiy h ARG 222 CO 0.71 0.16 0.23 0.44 -1.51 0.00 0.00 179.97 180.00 2fiy n ILE 223 N -3.42 3.07 -3.78 1.20 -0.00 -1.26 -4.97 119.36 110.20 2fiy n ILE 223 Ca -0.01 -4.35 -0.13 0.00 -0.00 0.00 0.00 62.75 58.27 2fiy n ILE 223 Cb 0.34 -1.23 -0.11 0.00 -0.00 0.00 0.00 39.64 38.64 2fiy n ILE 223 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 2fiy s LYS 224 N -3.81 0.32 0.41 6.28 2.20 -1.23 -4.29 119.74 119.62 2fiy s LYS 224 Ca 0.52 0.38 -0.26 0.00 -0.36 0.00 0.00 55.97 56.25 2fiy s LYS 224 Cb 0.43 0.16 -0.09 0.00 -1.51 0.00 0.00 37.83 36.82 2fiy s LYS 224 CO -0.24 -0.04 1.35 0.00 -0.36 0.00 0.00 175.35 176.05 2fiy n SER 226 N 0.08 0.13 0.00 0.00 3.41 -1.26 -4.26 113.62 111.72 2fiy n SER 226 Ca 0.04 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 2fiy n SER 226 Cb 0.43 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2fiy n SER 226 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2fiy n HIS 227 N -1.48 0.00 -1.72 7.33 -0.00 -1.26 -4.73 115.22 113.35 2fiy n HIS 227 Ca 0.07 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.47 2fiy n HIS 227 Cb 0.34 0.00 0.04 0.00 -0.00 0.00 0.00 29.99 30.37 2fiy n HIS 227 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2fiy n GLU 229 N -2.64 2.40 -2.41 0.00 1.02 -1.26 -4.09 120.64 113.66 2fiy n GLU 229 Ca 0.09 -3.06 -0.41 0.00 -0.02 0.00 0.00 57.16 53.76 2fiy n GLU 229 Cb 0.53 -2.10 -0.04 0.00 -0.02 0.00 0.00 31.44 29.81 2fiy n GLU 229 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2fiy s GLU 230 N -3.23 4.54 0.00 3.49 2.56 -1.26 -4.62 118.70 120.18 2fiy s GLU 230 Ca 0.54 1.84 0.16 0.00 0.00 0.00 0.00 54.97 57.51 2fiy s GLU 230 Cb 0.45 -3.23 -0.08 0.00 2.00 0.00 0.00 34.13 33.28 2fiy s GLU 230 CO 0.09 0.01 0.77 0.43 -0.56 0.00 0.00 175.26 175.99 2fiy n SER 231 N 2.12 1.22 -4.40 -1.70 7.64 -1.26 -0.73 113.62 116.51 2fiy n SER 231 Ca 0.03 -1.11 -0.40 0.00 1.01 0.00 0.00 58.87 58.39 2fiy n SER 231 Cb 0.45 0.71 0.01 0.00 -1.01 0.00 0.00 64.21 64.37 2fiy n SER 231 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2fiy n LYS 232 N -0.68 0.37 -1.50 1.43 4.81 -1.26 -4.42 118.16 116.90 2fiy n LYS 232 Ca 0.05 0.14 -0.36 0.00 -0.87 0.00 0.00 58.31 57.27 2fiy n LYS 232 Cb 0.30 -1.39 -0.16 0.00 0.02 0.00 0.00 35.03 33.80 2fiy n LYS 232 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 2fiy n HIS 233 N -1.19 0.52 -1.68 5.64 1.44 -1.26 -4.90 115.22 113.78 2fiy n HIS 233 Ca 0.11 0.28 -0.30 0.00 -2.01 0.00 0.00 57.72 55.80 2fiy n HIS 233 Cb 0.43 -2.02 0.07 0.00 0.12 0.00 0.00 29.99 28.58 2fiy n HIS 233 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2fiy s LEU 234 N 7.53 2.80 0.14 2.39 1.43 -1.26 -4.91 118.68 126.80 2fiy s LEU 234 Ca 1.32 1.30 0.11 0.00 -1.03 0.00 0.00 54.13 55.82 2fiy s LEU 234 Cb -1.08 -4.03 -0.04 0.00 0.03 0.00 0.00 46.19 41.07 2fiy s LEU 234 CO 0.48 -1.63 -0.25 0.00 0.23 0.00 0.00 176.35 175.18 2fiy s ALA 235 N -3.21 2.46 -0.13 4.21 0.00 -0.99 -4.97 121.76 119.13 2fiy s ALA 235 Ca 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 51.06 2fiy s ALA 235 Cb -0.13 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.60 2fiy s ALA 235 CO 0.53 0.52 -0.11 0.71 0.00 0.00 0.00 175.76 177.41 2fiy s TYR 236 N -1.22 1.86 -0.09 0.00 1.51 -1.26 0.31 117.35 118.46 2fiy s TYR 236 Ca 0.16 -1.00 0.02 0.00 -1.01 0.00 0.00 57.07 55.24 2fiy s TYR 236 Cb -0.10 -1.43 0.01 0.00 -0.11 0.00 0.00 41.96 40.33 2fiy s TYR 236 CO 0.08 -0.60 -0.14 -1.17 -1.11 0.00 0.00 175.55 172.60 2fiy s LEU 237 N 1.58 1.68 0.09 -1.29 1.98 -0.12 -4.92 118.68 117.68 2fiy s LEU 237 Ca 0.05 -0.38 0.06 0.00 -2.89 0.00 0.00 54.13 50.97 2fiy s LEU 237 Cb -0.13 -1.00 -0.03 0.00 0.66 0.00 0.00 46.19 45.69 2fiy s LEU 237 CO -0.10 0.02 -0.17 -0.94 -1.89 0.00 0.00 176.35 173.28 2fiy s SER 238 N 0.88 2.06 0.01 3.68 1.04 -1.26 0.10 113.70 120.22 2fiy s SER 238 Ca -0.09 -0.68 0.05 0.00 0.48 0.00 0.00 55.95 55.71 2fiy s SER 238 Cb -0.15 -0.09 -0.02 0.00 0.10 0.00 0.00 66.02 65.86 2fiy s SER 238 CO 0.01 -0.04 -0.16 -1.48 0.98 0.00 0.00 173.24 172.55 2fiy s LEU 239 N -1.93 2.10 0.61 2.42 2.34 -1.26 -5.07 118.68 117.89 2fiy s LEU 239 Ca 0.03 -0.39 -0.18 0.00 0.06 0.00 0.00 54.13 53.66 2fiy s LEU 239 Cb -0.09 -0.79 -0.06 0.00 -0.56 0.00 0.00 46.19 44.69 2fiy s LEU 239 CO 0.03 0.14 0.78 1.21 -1.06 0.00 0.00 176.35 177.45 2fiy n GLU 240 N 2.28 0.68 0.00 1.48 4.07 -1.26 -5.06 120.64 122.83 2fiy n GLU 240 Ca -0.16 0.27 0.00 0.00 -0.06 0.00 0.00 57.16 57.21 2fiy n GLU 240 Cb 0.54 -1.98 0.00 0.00 -0.06 0.00 0.00 31.44 29.94 2fiy n GLU 240 CO 0.00 0.00 0.00 1.58 -0.06 0.00 0.00 177.13 178.65 2fiy n HIS 241 N -1.85 0.00 0.00 4.31 -0.00 -1.26 -5.00 115.22 111.42 2fiy n HIS 241 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.85 2fiy n HIS 241 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.47 2fiy n HIS 241 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2fiy n GLY 243 N 0.33 2.20 3.10 1.57 0.00 -1.26 -4.89 105.19 106.23 2fiy n GLY 243 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2fiy n GLY 243 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2fiy s GLN 244 N 0.00 2.64 0.74 1.61 0.74 -1.26 -5.11 119.66 119.02 2fiy s GLN 244 Ca 0.00 -1.08 -0.11 0.00 0.05 0.00 0.00 55.36 54.23 2fiy s GLN 244 Cb 0.00 -2.74 0.04 0.00 1.10 0.00 0.00 33.01 31.41 2fiy s GLN 244 CO 0.00 -0.38 1.08 -1.25 -0.55 0.00 0.00 175.29 174.18 2fiy s PRO 245 N 1.20 2.52 0.13 1.67 0.04 -1.26 -4.81 135.00 134.50 2fiy s PRO 245 Ca -0.02 1.06 0.20 0.00 0.04 0.00 0.00 61.00 62.29 2fiy s PRO 245 Cb -0.16 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 2fiy s PRO 245 CO -0.09 -1.42 0.90 0.00 0.04 0.00 0.00 177.00 176.42 2fiy n ALA 246 N -3.36 2.33 0.18 8.56 0.00 -1.26 -2.85 120.51 124.11 2fiy n ALA 246 Ca 0.08 -0.38 0.04 0.00 0.00 0.00 0.00 53.44 53.18 2fiy n ALA 246 Cb 0.53 -1.01 0.35 0.00 0.00 0.00 0.00 19.45 19.33 2fiy n ALA 246 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2fiy h GLU 247 N 0.00 0.00 -0.87 0.00 9.09 -2.03 -3.13 114.58 117.64 2fiy h GLU 247 Ca -0.07 0.00 -0.46 0.00 0.05 0.00 0.00 59.36 58.88 2fiy h GLU 247 Cb 1.22 0.00 -0.27 0.00 -1.65 0.00 0.00 28.75 28.05 2fiy h GLU 247 CO 0.02 0.40 0.51 1.63 0.05 0.00 0.00 179.01 181.61 2fiy n LYS 248 N -3.78 2.19 -2.38 1.06 4.76 -1.13 -5.04 118.16 113.83 2fiy n LYS 248 Ca -0.01 -3.07 -0.41 0.00 -2.87 0.00 0.00 58.31 51.96 2fiy n LYS 248 Cb 0.47 -2.11 -0.04 0.00 -1.84 0.00 0.00 35.03 31.51 2fiy n LYS 248 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2fiy s ALA 249 N -3.31 3.43 0.05 7.82 0.00 -1.18 -4.88 121.76 123.69 2fiy s ALA 249 Ca 0.55 0.98 -0.08 0.00 0.00 0.00 0.00 51.96 53.40 2fiy s ALA 249 Cb 0.47 -3.38 -0.31 0.00 0.00 0.00 0.00 23.12 19.90 2fiy s ALA 249 CO 0.08 -0.31 1.05 0.28 0.00 0.00 0.00 175.76 176.86 2fiy h VAL 250 N 3.28 1.37 -3.48 0.00 2.07 -1.90 -3.44 116.25 114.15 2fiy h VAL 250 Ca -0.46 -2.90 -0.63 0.00 0.82 0.00 0.00 66.70 63.53 2fiy h VAL 250 Cb 1.21 2.96 -0.18 0.00 -1.52 0.00 0.00 31.29 33.76 2fiy h VAL 250 CO 0.69 0.86 -0.58 -0.22 0.02 0.00 0.00 177.57 178.34 2fiy s LEU 251 N -7.29 3.72 -0.04 2.57 0.20 -1.26 -0.47 118.68 116.12 2fiy s LEU 251 Ca -0.07 -0.02 0.00 0.00 0.69 0.00 0.00 54.13 54.74 2fiy s LEU 251 Cb 0.06 -1.97 0.02 0.00 -0.43 0.00 0.00 46.19 43.87 2fiy s LEU 251 CO 0.90 0.08 -0.02 -0.13 -0.29 0.00 0.00 176.35 176.90 2fiy s ARG 252 N 0.92 0.55 -0.09 1.98 0.52 -0.74 -4.58 118.95 117.51 2fiy s ARG 252 Ca 0.04 0.00 -0.26 0.00 -0.52 0.00 0.00 55.73 55.00 2fiy s ARG 252 Cb -0.14 -0.68 -0.02 0.00 0.52 0.00 0.00 34.95 34.63 2fiy s ARG 252 CO 0.03 -0.13 0.85 0.00 0.02 0.00 0.00 175.30 176.07 2fiy s ALA 253 N 1.08 3.37 -0.17 2.13 0.00 0.12 -1.80 121.76 126.49 2fiy s ALA 253 Ca -0.09 0.22 -0.26 0.00 0.00 0.00 0.00 51.96 51.83 2fiy s ALA 253 Cb -0.14 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 2fiy s ALA 253 CO -0.01 -0.39 0.87 -2.00 0.00 0.00 0.00 175.76 174.23 2fiy s GLU 254 N 1.49 4.31 0.01 0.00 2.12 -0.17 -0.95 118.70 125.51 2fiy s GLU 254 Ca 0.42 1.10 0.08 0.00 0.36 0.00 0.00 54.97 56.93 2fiy s GLU 254 Cb -0.18 -3.58 -0.02 0.00 0.26 0.00 0.00 34.13 30.61 2fiy s GLU 254 CO 0.18 -0.35 -0.25 0.95 -0.54 0.00 0.00 175.26 175.25 2fiy s THR 255 N 2.22 1.99 -0.13 -1.70 -4.23 0.15 -1.31 115.64 112.63 2fiy s THR 255 Ca 0.40 -1.18 -0.01 0.00 -1.18 0.00 0.00 61.69 59.72 2fiy s THR 255 Cb -0.17 -1.68 0.03 0.00 1.34 0.00 0.00 72.50 72.03 2fiy s THR 255 CO 0.13 0.46 -0.07 0.00 -0.54 0.00 0.00 174.62 174.60 2fiy h PRO 257 N 8.17 0.00 -0.17 0.00 0.13 -1.91 0.25 132.00 138.47 2fiy h PRO 257 Ca -0.28 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.65 2fiy h PRO 257 Cb 1.13 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.26 2fiy h PRO 257 CO 0.40 0.00 -0.69 0.77 -0.23 0.00 0.00 178.00 178.25 2fiy h SER 258 N 0.00 0.89 -0.04 1.44 0.02 -1.97 -3.32 113.55 110.58 2fiy h SER 258 Ca 0.00 -0.61 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 2fiy h SER 258 Cb 0.83 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.11 2fiy h SER 258 CO 0.00 1.36 0.00 0.00 -1.14 0.00 0.00 176.83 177.05 2fiy n GLN 260 N 0.55 -5.11 -4.05 0.00 10.64 0.84 -4.85 117.38 115.39 2fiy n GLN 260 Ca 0.06 0.57 -0.27 0.00 -1.83 0.00 0.00 57.00 55.53 2fiy n GLN 260 Cb 0.26 -5.37 -0.05 0.00 -0.86 0.00 0.00 30.24 24.22 2fiy n GLN 260 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 2fiy s GLY 261 N -3.48 1.80 0.07 2.61 0.00 -1.06 0.62 107.32 107.87 2fiy s GLY 261 Ca 0.57 -1.13 0.05 0.00 0.00 0.00 0.00 44.72 44.21 2fiy s GLY 261 CO 0.84 -1.13 -0.13 -2.52 0.00 0.00 0.00 173.10 170.16 2fiy s TYR 262 N -1.66 1.14 -0.10 1.90 -0.85 -0.38 -1.67 117.35 115.73 2fiy s TYR 262 Ca 0.31 -0.46 -0.00 0.00 -0.52 0.00 0.00 57.07 56.39 2fiy s TYR 262 Cb -0.11 -0.64 0.02 0.00 0.38 0.00 0.00 41.96 41.61 2fiy s TYR 262 CO 0.24 0.04 -0.06 -1.17 -1.52 0.00 0.00 175.55 173.07 2fiy s LEU 263 N -1.71 1.11 0.21 -3.49 2.96 -0.43 -4.41 118.68 112.92 2fiy s LEU 263 Ca -0.03 -0.26 -0.30 0.00 -0.22 0.00 0.00 54.13 53.32 2fiy s LEU 263 Cb -0.10 -0.75 -0.09 0.00 0.50 0.00 0.00 46.19 45.74 2fiy s LEU 263 CO 0.02 -0.12 1.39 -0.54 -1.32 0.00 0.00 176.35 175.78 2fiy s LYS 264 N 1.66 4.32 0.00 1.98 1.02 -1.26 -1.00 119.74 126.46 2fiy s LYS 264 Ca 0.03 2.18 0.02 0.00 0.02 0.00 0.00 55.97 58.23 2fiy s LYS 264 Cb -0.13 -3.16 -0.01 0.00 -0.52 0.00 0.00 37.83 34.02 2fiy s LYS 264 CO -0.07 -0.36 -0.07 -0.65 -0.92 0.00 0.00 175.35 173.28 2fiy s GLN 265 N -0.07 0.55 -0.12 1.68 -0.21 -0.74 -1.61 119.66 119.14 2fiy s GLN 265 Ca 0.59 -0.33 -0.00 0.00 0.02 0.00 0.00 55.36 55.64 2fiy s GLN 265 Cb -0.39 -0.51 -0.02 0.00 1.00 0.00 0.00 33.01 33.09 2fiy s GLN 265 CO 0.39 0.13 -0.12 -0.06 -2.12 0.00 0.00 175.29 173.52 2fiy s PHE 266 N -0.36 2.83 -0.43 0.91 0.08 -0.55 -1.79 117.98 118.67 2fiy s PHE 266 Ca 0.01 -0.50 -0.12 0.00 0.12 0.00 0.00 56.93 56.44 2fiy s PHE 266 Cb -0.04 -1.82 0.06 0.00 -0.57 0.00 0.00 43.02 40.65 2fiy s PHE 266 CO -0.00 -0.10 0.31 0.71 -0.10 0.00 0.00 175.22 176.03 2fiy s TYR 267 N 0.14 3.27 0.02 0.36 2.02 0.38 -1.02 117.35 122.52 2fiy s TYR 267 Ca -0.06 -1.10 0.32 0.00 -0.37 0.00 0.00 57.07 55.86 2fiy s TYR 267 Cb -0.15 -2.90 1.23 0.00 -0.40 0.00 0.00 41.96 39.74 2fiy s TYR 267 CO 0.04 -0.77 1.93 -0.07 -1.57 0.00 0.00 175.55 175.12 2fiy h LEU 268 N 8.57 0.00 -1.64 -1.29 3.38 -1.61 -2.51 115.31 120.20 2fiy h LEU 268 Ca -0.26 0.00 0.17 0.00 0.09 0.00 0.00 57.88 57.89 2fiy h LEU 268 Cb 1.10 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 2fiy h LEU 268 CO 0.78 0.00 0.53 -0.08 0.09 0.00 0.00 178.44 179.76 2fiy h GLU 269 N 0.00 0.32 0.00 1.13 4.81 -1.93 -2.55 114.58 116.36 2fiy h GLU 269 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2fiy h GLU 269 Cb 0.57 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2fiy h GLU 269 CO 0.00 0.21 -1.54 1.19 -0.73 0.00 0.00 179.01 178.15 2fiy n PHE 270 N -4.46 0.07 -3.15 0.92 3.72 -0.95 -4.80 117.46 108.82 2fiy n PHE 270 Ca 0.16 0.02 0.04 0.00 -0.05 0.00 0.00 57.45 57.62 2fiy n PHE 270 Cb 0.62 -0.36 -0.01 0.00 -0.94 0.00 0.00 39.48 38.80 2fiy n PHE 270 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2fiy s ASP 271 N -4.03 -1.42 0.14 4.37 -1.08 -1.00 -4.93 116.67 108.73 2fiy s ASP 271 Ca -0.01 0.51 0.18 0.00 -0.52 0.00 0.00 52.55 52.71 2fiy s ASP 271 Cb 0.14 2.04 0.79 0.00 -1.46 0.00 0.00 42.92 44.43 2fiy s ASP 271 CO 0.88 -0.26 1.57 -2.11 0.52 0.00 0.00 175.17 175.76 2fiy n ARG 272 N 5.42 0.10 -0.12 4.34 1.85 -1.00 -1.85 116.66 125.39 2fiy n ARG 272 Ca 0.02 0.36 0.11 0.00 -1.00 0.00 0.00 57.85 57.34 2fiy n ARG 272 Cb 0.53 -1.70 0.31 0.00 -1.05 0.00 0.00 32.46 30.54 2fiy n ARG 272 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2fiy n HIS 273 N -1.89 0.32 -1.71 2.89 8.25 -1.26 -4.96 115.22 116.87 2fiy n HIS 273 Ca 0.02 -0.16 -0.43 0.00 -0.26 0.00 0.00 57.72 56.89 2fiy n HIS 273 Cb 0.18 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.28 2fiy n HIS 273 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2fiy n ALA 274 N 0.73 1.73 -3.08 -1.41 0.00 -0.77 -4.90 120.51 112.80 2fiy n ALA 274 Ca 0.17 0.38 -0.23 0.00 0.00 0.00 0.00 53.44 53.76 2fiy n ALA 274 Cb 0.42 -2.34 -0.16 0.00 0.00 0.00 0.00 19.45 17.37 2fiy n ALA 274 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2fiy s ASP 275 N 0.20 1.62 0.27 0.00 2.15 -1.26 -5.03 116.67 114.61 2fiy s ASP 275 Ca 0.63 -0.26 -0.03 0.00 0.43 0.00 0.00 52.55 53.32 2fiy s ASP 275 Cb -0.57 -0.51 0.40 0.00 -0.30 0.00 0.00 42.92 41.95 2fiy s ASP 275 CO 0.53 0.09 1.91 0.00 -0.17 0.00 0.00 175.17 177.52 2fiy h ALA 276 N 6.46 1.40 0.02 3.66 0.00 -1.94 -0.84 119.26 128.02 2fiy h ALA 276 Ca -0.33 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 2fiy h ALA 276 Cb 1.17 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2fiy h ALA 276 CO 0.48 0.49 -0.32 1.25 0.00 0.00 0.00 179.25 181.15 2fiy h LEU 277 N 1.19 0.06 -0.24 0.00 6.46 -1.96 -3.19 115.31 117.63 2fiy h LEU 277 Ca 0.40 -0.92 -0.03 0.00 -0.12 0.00 0.00 57.88 57.21 2fiy h LEU 277 Cb 0.07 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 39.97 2fiy h LEU 277 CO -0.14 1.13 0.03 0.00 -0.62 0.00 0.00 178.44 178.85 2fiy h ALA 278 N -0.06 0.32 0.00 1.25 0.00 -1.85 -1.80 119.26 117.12 2fiy h ALA 278 Ca -0.08 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 2fiy h ALA 278 Cb 1.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2fiy h ALA 278 CO -0.01 0.02 -0.37 -0.44 0.00 0.00 0.00 179.25 178.45 2fiy h ASP 279 N 0.21 0.00 0.44 0.00 3.32 -1.35 -2.25 116.42 116.79 2fiy h ASP 279 Ca 0.07 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 2fiy h ASP 279 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2fiy h ASP 279 CO 0.01 0.37 -0.21 -0.78 -1.72 0.00 0.00 179.24 176.90 2fiy h ASP 280 N 0.00 -0.50 0.19 6.45 3.58 -1.50 -2.93 116.42 121.71 2fiy h ASP 280 Ca -0.00 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.41 2fiy h ASP 280 Cb 0.78 0.13 -0.00 0.00 1.72 0.00 0.00 39.33 41.95 2fiy h ASP 280 CO 0.05 -0.31 -0.11 -0.07 -2.88 0.00 0.00 179.24 175.92 2fiy h LEU 281 N -0.66 0.00 -0.63 2.28 3.38 -1.14 -2.07 115.31 116.48 2fiy h LEU 281 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2fiy h LEU 281 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2fiy h LEU 281 CO 0.10 0.11 -0.02 0.00 0.09 0.00 0.00 178.44 178.72 2fiy n ALA 282 N -2.40 2.65 -2.34 1.53 0.00 -0.86 -4.08 120.51 115.01 2fiy n ALA 282 Ca -0.02 -0.36 -0.08 0.00 0.00 0.00 0.00 53.44 52.97 2fiy n ALA 282 Cb 0.20 -1.27 0.05 0.00 0.00 0.00 0.00 19.45 18.43 2fiy n ALA 282 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2fiy n SER 283 N -0.27 2.82 0.29 0.00 3.41 -0.78 -4.82 113.62 114.26 2fiy n SER 283 Ca 0.20 -2.91 0.17 0.00 -0.26 0.00 0.00 58.87 56.07 2fiy n SER 283 Cb 0.28 -0.41 0.81 0.00 -0.26 0.00 0.00 64.21 64.63 2fiy n SER 283 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2fiy h LEU 284 N 2.07 0.00 -1.05 1.04 3.38 -1.71 -1.98 115.31 117.05 2fiy h LEU 284 Ca 0.06 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.10 2fiy h LEU 284 Cb 1.42 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.10 2fiy h LEU 284 CO 0.37 0.04 0.63 0.00 0.09 0.00 0.00 178.44 179.58 2fiy h ALA 285 N 1.96 1.45 -0.56 1.53 0.00 -1.93 -2.38 119.26 119.33 2fiy h ALA 285 Ca -0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2fiy h ALA 285 Cb 0.37 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2fiy h ALA 285 CO 0.01 0.39 0.03 1.25 0.00 0.00 0.00 179.25 180.93 2fiy h LEU 286 N 1.11 0.90 -0.39 0.00 5.85 -1.76 -2.45 115.31 118.58 2fiy h LEU 286 Ca 0.43 -0.23 0.07 0.00 0.84 0.00 0.00 57.88 58.99 2fiy h LEU 286 Cb 0.21 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 2fiy h LEU 286 CO -0.17 0.95 0.03 0.44 -0.34 0.00 0.00 178.44 179.35 2fiy h ASP 287 N 0.87 -0.09 -0.59 1.25 3.32 -1.49 -1.08 116.42 118.61 2fiy h ASP 287 Ca 0.17 0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 2fiy h ASP 287 Cb 0.47 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.13 2fiy h ASP 287 CO 0.02 -0.01 0.19 0.24 -1.72 0.00 0.00 179.24 177.96 2fiy h MET 288 N 0.15 0.92 -0.91 3.56 2.86 -1.34 0.47 114.93 120.63 2fiy h MET 288 Ca 0.19 -0.20 0.11 0.00 -2.06 0.00 0.00 59.70 57.74 2fiy h MET 288 Cb 0.25 -0.13 -0.08 0.00 0.06 0.00 0.00 31.60 31.70 2fiy h MET 288 CO -0.29 0.82 0.55 -0.09 1.06 0.00 0.00 176.91 178.96 2fiy h ARG 289 N 0.84 0.86 0.05 1.72 9.65 -1.14 -0.45 114.38 125.92 2fiy h ARG 289 Ca 0.19 -0.05 -0.28 0.00 -1.10 0.00 0.00 59.98 58.74 2fiy h ARG 289 Cb 0.28 -0.19 0.02 0.00 -1.39 0.00 0.00 29.97 28.69 2fiy h ARG 289 CO -0.01 0.57 -1.14 -0.07 2.80 0.00 0.00 179.97 182.13 2fiy h LEU 290 N 0.89 0.90 -0.25 3.80 3.38 -0.55 -2.66 115.31 120.81 2fiy h LEU 290 Ca 0.45 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2fiy h LEU 290 Cb 0.43 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2fiy h LEU 290 CO -0.26 1.57 0.00 0.00 0.09 0.00 0.00 178.44 179.84 2fiy n ALA 291 N -2.66 1.80 -0.00 1.53 0.00 0.16 -1.53 120.51 119.80 2fiy n ALA 291 Ca -0.12 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2fiy n ALA 291 Cb 0.93 -1.34 -0.11 0.00 0.00 0.00 0.00 19.45 18.93 2fiy n ALA 291 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2fiy n GLU 292 N -1.84 0.64 0.00 0.00 1.02 -0.21 -4.14 120.64 116.12 2fiy n GLU 292 Ca 0.04 0.09 0.11 0.00 -0.02 0.00 0.00 57.16 57.38 2fiy n GLU 292 Cb 0.24 -1.70 0.67 0.00 -0.02 0.00 0.00 31.44 30.63 2fiy n GLU 292 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2fiy n ASP 293 N -2.74 0.00 -0.12 1.62 8.00 -0.62 -4.88 116.55 117.81 2fiy n ASP 293 Ca -0.13 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.42 2fiy n ASP 293 Cb 0.85 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.95 2fiy n ASP 293 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fiy n GLY 294 N 0.61 0.77 3.53 0.44 0.00 -1.06 -5.06 105.19 104.41 2fiy n GLY 294 Ca 0.17 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 45.21 2fiy n GLY 294 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fiy s TYR 295 N -2.24 2.70 -0.11 1.61 1.51 -0.58 -4.88 117.35 115.36 2fiy s TYR 295 Ca 0.00 -0.17 -0.02 0.00 -1.01 0.00 0.00 57.07 55.87 2fiy s TYR 295 Cb 0.00 -1.50 -0.03 0.00 -0.11 0.00 0.00 41.96 40.32 2fiy s TYR 295 CO 0.00 0.33 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.57 2fiy s LEU 296 N -1.61 3.33 -0.19 -1.29 2.96 0.20 -4.14 118.68 117.94 2fiy s LEU 296 Ca 0.17 -0.02 -0.15 0.00 -0.22 0.00 0.00 54.13 53.90 2fiy s LEU 296 Cb -0.11 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 2fiy s LEU 296 CO 0.08 0.28 0.38 -0.60 -1.32 0.00 0.00 176.35 175.16 2fiy s ARG 297 N -0.28 4.20 -0.14 1.98 3.52 -1.26 -1.24 118.95 125.72 2fiy s ARG 297 Ca 0.05 0.19 0.18 0.00 -0.13 0.00 0.00 55.73 56.02 2fiy s ARG 297 Cb -0.13 -3.51 0.33 0.00 -1.56 0.00 0.00 34.95 30.09 2fiy s ARG 297 CO 0.02 0.03 1.19 0.54 -0.81 0.00 0.00 175.30 176.27 2fiy n ARG 298 N 4.25 1.53 -3.77 5.12 1.74 -1.26 -4.96 116.66 119.31 2fiy n ARG 298 Ca -0.09 -2.65 -0.37 0.00 -0.77 0.00 0.00 57.85 53.97 2fiy n ARG 298 Cb 0.51 -1.56 -0.12 0.00 -1.02 0.00 0.00 32.46 30.28 2fiy n ARG 298 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2fiy s SER 299 N -2.76 5.24 0.51 0.55 1.04 -1.26 -4.82 113.70 112.20 2fiy s SER 299 Ca 0.34 -1.67 -0.21 0.00 0.48 0.00 0.00 55.95 54.89 2fiy s SER 299 Cb 0.29 -1.83 -0.06 0.00 0.10 0.00 0.00 66.02 64.52 2fiy s SER 299 CO 0.03 -0.45 1.14 -2.84 0.98 0.00 0.00 173.24 172.10 2fiy s PRO 300 N 1.24 3.52 -0.28 4.02 0.02 -1.22 -4.79 135.00 137.52 2fiy s PRO 300 Ca 0.03 1.68 -0.02 0.00 0.02 0.00 0.00 61.00 62.71 2fiy s PRO 300 Cb -0.22 -2.17 0.03 0.00 0.02 0.00 0.00 34.50 32.17 2fiy s PRO 300 CO -0.02 -0.72 -0.02 1.21 -0.33 0.00 0.00 177.00 177.12 2fiy s ASN 301 N -1.60 4.65 0.00 2.53 3.04 -1.26 -4.17 114.94 118.13 2fiy s ASN 301 Ca 0.69 -1.03 0.25 0.00 0.04 0.00 0.00 52.86 52.82 2fiy s ASN 301 Cb -0.26 -1.71 1.30 0.00 -1.54 0.00 0.00 41.25 39.04 2fiy s ASN 301 CO 0.30 -0.19 1.85 0.18 -3.04 0.00 0.00 177.10 176.20 2fiy n LEU 302 N 4.67 0.00 -0.59 3.21 4.77 -1.26 -2.56 117.00 125.24 2fiy n LEU 302 Ca -0.15 0.26 0.12 0.00 -0.03 0.00 0.00 56.01 56.21 2fiy n LEU 302 Cb 0.46 -0.26 0.17 0.00 -2.33 0.00 0.00 43.42 41.46 2fiy n LEU 302 CO 0.27 -0.04 0.55 0.18 -1.33 0.00 0.00 177.39 177.02 2fiy n LEU 303 N -1.26 2.06 -3.72 2.23 4.77 -1.26 -4.16 117.00 115.65 2fiy n LEU 303 Ca 0.13 -0.70 -0.23 0.00 -0.03 0.00 0.00 56.01 55.18 2fiy n LEU 303 Cb 0.19 -0.02 -0.17 0.00 -2.33 0.00 0.00 43.42 41.08 2fiy n LEU 303 CO 0.19 0.36 -0.36 -0.22 -1.33 0.00 0.00 177.39 176.03 2fiy s LEU 304 N -2.27 0.50 0.34 2.23 2.96 -1.06 -3.85 118.68 117.53 2fiy s LEU 304 Ca 0.25 -0.19 -0.27 0.00 -0.22 0.00 0.00 54.13 53.70 2fiy s LEU 304 Cb 0.19 -0.35 -0.09 0.00 0.50 0.00 0.00 46.19 46.44 2fiy s LEU 304 CO 0.45 -0.24 1.09 0.00 -1.32 0.00 0.00 176.35 176.32 2fiy s ALA 305 N 2.04 3.26 0.35 5.97 0.00 -1.26 -4.71 121.76 127.41 2fiy s ALA 305 Ca 0.04 0.83 0.16 0.00 0.00 0.00 0.00 51.96 52.99 2fiy s ALA 305 Cb -0.13 -3.31 1.20 0.00 0.00 0.00 0.00 23.12 20.88 2fiy s ALA 305 CO -0.05 -0.22 1.57 -2.30 0.00 0.00 0.00 175.76 174.76 2fiy n PRO 306 N 0.60 -0.06 0.00 0.00 -0.02 -1.26 -4.67 135.00 129.58 2fiy n PRO 306 Ca 0.02 1.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.90 2fiy n PRO 306 Cb 0.47 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2fiy n PRO 306 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fiy n GLY 307 N -1.32 3.75 0.00 -1.23 0.00 -1.26 -5.26 105.19 99.88 2fiy n GLY 307 Ca 0.34 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2fiy n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93