#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fiy s PRO 19 N 0.00 4.19 -0.06 0.54 0.02 -1.26 -5.00 135.00 133.42 2fiy s PRO 19 Ca 0.00 2.45 -0.31 0.00 0.02 0.00 0.00 61.00 63.16 2fiy s PRO 19 Cb 0.00 -3.05 0.07 0.00 0.02 0.00 0.00 34.50 31.54 2fiy s PRO 19 CO 0.00 -0.51 0.68 -3.38 -0.33 0.00 0.00 177.00 173.46 2fiy s HIS 20 N -0.18 -0.66 0.36 6.54 -3.43 -1.26 -4.39 115.29 112.27 2fiy s HIS 20 Ca 0.60 1.17 -0.25 0.00 -0.80 0.00 0.00 55.06 55.78 2fiy s HIS 20 Cb -0.45 0.40 -0.09 0.00 -1.43 0.00 0.00 32.58 31.01 2fiy s HIS 20 CO 0.48 -0.59 1.01 -0.51 -2.00 0.00 0.00 174.74 173.12 2fiy s LEU 21 N -1.10 4.23 -0.53 5.38 1.02 -1.26 -4.77 118.68 121.66 2fiy s LEU 21 Ca -0.10 1.97 -0.05 0.00 0.02 0.00 0.00 54.13 55.97 2fiy s LEU 21 Cb -0.00 -4.10 0.14 0.00 0.02 0.00 0.00 46.19 42.25 2fiy s LEU 21 CO 0.09 -0.31 0.35 -1.00 0.02 0.00 0.00 176.35 175.51 2fiy s HIS 22 N -1.63 3.50 0.53 0.29 3.76 -0.77 -5.03 115.29 115.95 2fiy s HIS 22 Ca 0.54 -2.38 -0.21 0.00 -0.15 0.00 0.00 55.06 52.86 2fiy s HIS 22 Cb -0.21 -3.31 -0.05 0.00 1.11 0.00 0.00 32.58 30.11 2fiy s HIS 22 CO 0.27 -0.93 1.22 -0.65 -0.85 0.00 0.00 174.74 173.80 2fiy s GLN 23 N 0.69 3.31 0.91 1.40 -0.21 -1.26 -1.60 119.66 122.90 2fiy s GLN 23 Ca 0.11 1.89 -0.12 0.00 0.02 0.00 0.00 55.36 57.26 2fiy s GLN 23 Cb -0.22 -2.17 0.14 0.00 1.00 0.00 0.00 33.01 31.76 2fiy s GLN 23 CO -0.03 -0.95 1.12 -1.25 -2.12 0.00 0.00 175.29 172.05 2fiy s PRO 24 N -3.01 1.15 0.59 2.91 0.04 -1.26 -4.91 135.00 130.51 2fiy s PRO 24 Ca 0.71 0.42 -0.19 0.00 0.04 0.00 0.00 61.00 61.98 2fiy s PRO 24 Cb -0.32 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 2fiy s PRO 24 CO 0.36 -2.22 1.27 0.45 0.04 0.00 0.00 177.00 176.90 2fiy s SER 25 N -3.86 5.06 0.20 6.66 0.15 -1.26 -4.92 113.70 115.74 2fiy s SER 25 Ca 0.64 2.55 0.22 0.00 0.70 0.00 0.00 55.95 60.06 2fiy s SER 25 Cb -0.16 -2.61 0.91 0.00 -1.71 0.00 0.00 66.02 62.45 2fiy s SER 25 CO 0.55 -1.69 1.68 0.54 1.20 0.00 0.00 173.24 175.52 2fiy n ARG 26 N -1.51 0.16 -1.03 5.44 1.74 -1.26 -1.93 116.66 118.27 2fiy n ARG 26 Ca 0.13 0.36 -0.14 0.00 -0.77 0.00 0.00 57.85 57.43 2fiy n ARG 26 Cb 0.48 -1.79 0.20 0.00 -1.02 0.00 0.00 32.46 30.33 2fiy n ARG 26 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2fiy n ASP 27 N -2.09 3.32 0.03 0.55 3.85 -1.26 -4.79 116.55 116.16 2fiy n ASP 27 Ca 0.03 -3.64 0.05 0.00 -0.71 0.00 0.00 54.79 50.52 2fiy n ASP 27 Cb 0.24 -0.75 0.46 0.00 -1.35 0.00 0.00 41.12 39.73 2fiy n ASP 27 CO 0.00 0.00 0.00 0.17 -1.01 0.00 0.00 177.20 176.36 2fiy h LEU 28 N 1.14 0.40 0.04 -2.12 -0.00 -1.76 -1.22 115.31 111.78 2fiy h LEU 28 Ca 0.43 -0.01 -0.27 0.00 -0.00 0.00 0.00 57.88 58.03 2fiy h LEU 28 Cb 2.32 -0.10 0.02 0.00 -0.00 0.00 0.00 40.66 42.90 2fiy h LEU 28 CO 0.78 0.28 -1.16 -0.26 -0.00 0.00 0.00 178.44 178.08 2fiy h PHE 29 N 0.47 0.77 -0.40 0.17 0.04 -1.86 -1.81 116.94 114.32 2fiy h PHE 29 Ca 0.14 -0.48 0.06 0.00 2.80 0.00 0.00 57.97 60.49 2fiy h PHE 29 Cb -0.00 -0.06 -0.06 0.00 2.20 0.00 0.00 35.95 38.03 2fiy h PHE 29 CO -0.00 1.34 0.07 0.00 -0.60 0.00 0.00 178.31 179.11 2fiy h ALA 30 N 0.49 0.42 -0.76 2.45 0.00 -1.64 -1.83 119.26 118.40 2fiy h ALA 30 Ca -0.15 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2fiy h ALA 30 Cb 1.84 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.71 2fiy h ALA 30 CO 0.21 -0.34 0.48 0.00 0.00 0.00 0.00 179.25 179.60 2fiy h ARG 31 N 0.19 1.02 -0.21 0.00 3.08 -1.15 -1.01 114.38 116.29 2fiy h ARG 31 Ca 0.19 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.19 2fiy h ARG 31 Cb 0.24 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2fiy h ARG 31 CO -0.27 0.70 0.06 0.00 -1.07 0.00 0.00 179.97 179.40 2fiy h ARG 32 N 1.03 0.15 -0.09 0.04 3.08 -1.11 -0.51 114.38 116.97 2fiy h ARG 32 Ca 0.27 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.32 2fiy h ARG 32 Cb -0.07 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 2fiy h ARG 32 CO -0.05 0.10 0.03 0.78 -1.07 0.00 0.00 179.97 179.76 2fiy h GLY 33 N 0.15 0.11 0.74 0.04 0.00 -1.03 -0.00 103.07 103.08 2fiy h GLY 33 Ca 0.09 -0.02 0.03 0.00 0.00 0.00 0.00 47.33 47.43 2fiy h GLY 33 CO -0.11 0.02 0.05 0.83 0.00 0.00 0.00 176.54 177.33 2fiy h GLU 34 N 0.08 0.14 -0.84 4.80 5.08 -1.13 -0.77 114.58 121.95 2fiy h GLU 34 Ca 0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2fiy h GLU 34 Cb 0.02 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 2fiy h GLU 34 CO -0.04 0.09 0.53 -0.09 -1.00 0.00 0.00 179.01 178.50 2fiy h ARG 35 N 0.15 1.13 -0.42 2.33 9.65 -0.92 -0.48 114.38 125.82 2fiy h ARG 35 Ca 0.11 -0.09 -0.05 0.00 -1.10 0.00 0.00 59.98 58.85 2fiy h ARG 35 Cb 0.10 -0.24 -0.02 0.00 -1.39 0.00 0.00 29.97 28.42 2fiy h ARG 35 CO -0.14 0.77 0.06 -0.07 2.80 0.00 0.00 179.97 183.39 2fiy h LEU 36 N 1.15 0.67 -0.74 3.80 3.38 -0.53 0.05 115.31 123.09 2fiy h LEU 36 Ca 0.30 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2fiy h LEU 36 Cb -0.08 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2fiy h LEU 36 CO -0.06 0.77 0.40 -0.07 0.09 0.00 0.00 178.44 179.56 2fiy h LEU 37 N 0.55 0.94 0.23 1.67 3.38 -0.85 0.15 115.31 121.38 2fiy h LEU 37 Ca 0.13 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2fiy h LEU 37 Cb 0.39 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2fiy h LEU 37 CO 0.01 0.78 -0.18 -0.61 0.09 0.00 0.00 178.44 178.53 2fiy h GLN 38 N 1.03 -0.40 -0.07 1.13 4.15 -0.89 -3.13 115.11 116.92 2fiy h GLN 38 Ca 0.26 0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.64 2fiy h GLN 38 Cb 0.06 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 2fiy h GLN 38 CO -0.04 -0.27 -0.27 -0.07 -1.93 0.00 0.00 178.83 176.26 2fiy h LEU 39 N -0.42 0.12 -1.55 -2.39 3.38 -0.72 -3.05 115.31 110.68 2fiy h LEU 39 Ca -0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2fiy h LEU 39 Cb 0.37 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2fiy h LEU 39 CO -0.01 0.39 0.00 0.00 0.09 0.00 0.00 178.44 178.91 2fiy h ALA 40 N 1.62 1.00 -2.07 1.53 0.00 -0.65 -3.39 119.26 117.30 2fiy h ALA 40 Ca 0.02 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.36 2fiy h ALA 40 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2fiy h ALA 40 CO 0.04 0.00 1.24 -1.21 0.00 0.00 0.00 179.25 179.32 2fiy s GLU 41 N -3.67 3.67 0.00 0.00 2.02 -1.16 -2.02 118.70 117.56 2fiy s GLU 41 Ca 0.01 1.90 0.00 0.00 0.02 0.00 0.00 54.97 56.89 2fiy s GLU 41 Cb 0.10 -4.15 0.00 0.00 0.10 0.00 0.00 34.13 30.18 2fiy s GLU 41 CO 0.47 -1.46 0.00 0.41 0.02 0.00 0.00 175.26 174.70 2fiy n GLY 42 N 4.95 0.43 3.77 -1.39 0.00 -1.26 -5.02 105.19 106.67 2fiy n GLY 42 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.90 3.77 0.30 1.61 5.04 -0.85 -4.99 115.29 118.28 2fiy s HIS 43 Ca 0.00 1.38 0.06 0.00 -1.54 0.00 0.00 55.06 54.95 2fiy s HIS 43 Cb 0.00 -2.67 0.73 0.00 0.04 0.00 0.00 32.58 30.69 2fiy s HIS 43 CO 0.00 0.42 1.78 -1.35 -2.34 0.00 0.00 174.74 173.25 2fiy h PRO 44 N 5.10 0.74 -0.79 2.88 0.11 -1.95 -0.35 132.00 137.75 2fiy h PRO 44 Ca -0.46 -0.04 -0.43 0.00 0.11 0.00 0.00 66.00 65.17 2fiy h PRO 44 Cb 1.21 -0.17 -0.25 0.00 0.11 0.00 0.00 31.00 31.90 2fiy h PRO 44 CO 0.68 0.49 0.40 -1.33 -0.21 0.00 0.00 178.00 178.03 2fiy n MET 45 N -4.77 2.19 -0.35 1.05 2.81 -1.26 -4.75 117.12 112.04 2fiy n MET 45 Ca 0.23 -3.13 0.05 0.00 -1.81 0.00 0.00 57.70 53.04 2fiy n MET 45 Cb 0.57 -2.08 0.20 0.00 -0.71 0.00 0.00 33.22 31.20 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 1.12 1.52 1.01 3.03 0.00 -1.26 -1.36 103.07 107.13 2fiy h GLY 46 Ca 0.50 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 2fiy h GLY 46 CO 0.92 0.20 0.33 -0.55 0.00 0.00 0.00 176.54 177.44 2fiy h ASP 47 N 1.00 0.90 -0.20 0.19 3.32 -1.85 -1.12 116.42 118.65 2fiy h ASP 47 Ca 0.46 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.35 2fiy h ASP 47 Cb 0.37 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 2fiy h ASP 47 CO -0.23 0.78 0.06 0.22 -1.72 0.00 0.00 179.24 178.35 2fiy h TYR 48 N 0.95 0.33 -0.92 4.55 3.20 -1.77 -1.94 116.97 121.38 2fiy h TYR 48 Ca 0.23 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.10 2fiy h TYR 48 Cb 0.12 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.25 2fiy h TYR 48 CO 0.01 0.41 0.61 -0.07 -1.64 0.00 0.00 178.16 177.47 2fiy h LEU 49 N 0.15 1.01 -0.75 2.82 3.38 -1.00 -1.23 115.31 119.70 2fiy h LEU 49 Ca 0.07 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 2fiy h LEU 49 Cb 0.24 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2fiy h LEU 49 CO -0.00 0.70 -0.43 0.03 0.09 0.00 0.00 178.44 178.83 2fiy h ARG 50 N 1.18 0.44 -0.41 1.13 3.08 -1.15 -0.89 114.38 117.75 2fiy h ARG 50 Ca 0.36 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 2fiy h ARG 50 Cb -0.02 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 2fiy h ARG 50 CO -0.10 0.79 0.19 1.25 -1.07 0.00 0.00 179.97 181.03 2fiy h LEU 51 N 0.36 0.55 -0.91 3.04 5.85 -0.49 -2.32 115.31 121.39 2fiy h LEU 51 Ca 0.03 -0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.52 2fiy h LEU 51 Cb 0.90 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2fiy h LEU 51 CO 0.08 0.53 -0.21 0.58 -0.34 0.00 0.00 178.44 179.08 2fiy h VAL 52 N 0.53 1.26 -0.83 1.05 2.07 -1.18 -2.80 116.25 116.35 2fiy h VAL 52 Ca 0.14 -1.22 0.04 0.00 0.82 0.00 0.00 66.70 66.48 2fiy h VAL 52 Cb 0.13 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 2fiy h VAL 52 CO -0.02 0.40 0.52 0.00 0.02 0.00 0.00 177.57 178.49 2fiy h ALA 53 N 1.27 1.10 -0.92 1.67 0.00 -0.89 -0.66 119.26 120.84 2fiy h ALA 53 Ca 0.08 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2fiy h ALA 53 Cb 0.64 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 2fiy h ALA 53 CO 0.05 0.32 0.60 0.78 0.00 0.00 0.00 179.25 181.00 2fiy h GLY 54 N 0.99 1.31 1.10 0.00 0.00 -1.17 -1.01 103.07 104.30 2fiy h GLY 54 Ca 0.34 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 47.15 2fiy h GLY 54 CO -0.14 0.44 0.27 -2.00 0.00 0.00 0.00 176.54 175.12 2fiy h LEU 55 N 1.21 1.05 -0.98 3.11 5.85 -1.16 -2.25 115.31 122.15 2fiy h LEU 55 Ca 0.35 -0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 2fiy h LEU 55 Cb -0.09 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.64 2fiy h LEU 55 CO -0.09 0.95 0.14 0.00 -0.34 0.00 0.00 178.44 179.10 2fiy h ARG 57 N 0.85 1.21 -0.56 0.00 3.08 -0.94 -1.66 114.38 116.36 2fiy h ARG 57 Ca 0.19 -0.16 -0.11 0.00 0.07 0.00 0.00 59.98 59.97 2fiy h ARG 57 Cb 0.31 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 2fiy h ARG 57 CO -0.00 0.91 -0.07 1.25 -1.07 0.00 0.00 179.97 180.99 2fiy h LEU 58 N 1.20 1.02 -0.85 3.04 5.85 -0.92 -2.23 115.31 122.42 2fiy h LEU 58 Ca 0.29 -0.34 0.06 0.00 0.84 0.00 0.00 57.88 58.74 2fiy h LEU 58 Cb 0.08 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.78 2fiy h LEU 58 CO -0.04 1.12 0.53 1.56 -0.34 0.00 0.00 178.44 181.27 2fiy h GLN 59 N 0.91 0.95 -0.45 1.25 4.20 -0.72 -1.04 115.11 120.21 2fiy h GLN 59 Ca 0.15 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 2fiy h GLN 59 Cb 0.63 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 2fiy h GLN 59 CO 0.04 0.63 0.20 0.37 -0.67 0.00 0.00 178.83 179.40 2fiy h GLN 60 N 0.98 0.67 -0.60 1.46 5.75 -1.03 -0.93 115.11 121.41 2fiy h GLN 60 Ca 0.37 -0.11 -0.05 0.00 -0.15 0.00 0.00 58.65 58.71 2fiy h GLN 60 Cb 0.15 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.56 2fiy h GLN 60 CO -0.17 0.59 0.18 0.00 -2.65 0.00 0.00 178.83 176.78 2fiy h ALA 61 N 1.04 1.19 0.61 3.38 0.00 -0.95 -1.02 119.26 123.51 2fiy h ALA 61 Ca 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2fiy h ALA 61 Cb 0.16 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.72 2fiy h ALA 61 CO -0.02 0.56 -0.29 -0.07 0.00 0.00 0.00 179.25 179.44 2fiy h LEU 62 N 0.88 -0.69 -1.43 0.00 3.38 -1.00 -2.49 115.31 113.96 2fiy h LEU 62 Ca 0.20 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.27 2fiy h LEU 62 Cb 0.27 0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 2fiy h LEU 62 CO -0.01 -0.47 0.48 0.25 0.09 0.00 0.00 178.44 178.79 2fiy h LEU 63 N -0.85 0.58 -0.76 1.67 5.85 -0.91 0.47 115.31 121.36 2fiy h LEU 63 Ca -0.08 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.65 2fiy h LEU 63 Cb 0.64 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2fiy h LEU 63 CO 0.14 0.35 0.00 0.44 -0.34 0.00 0.00 178.44 179.02 2fiy h ASP 64 N 0.64 0.00 -2.09 1.25 3.32 -1.13 -3.37 116.42 115.05 2fiy h ASP 64 Ca 0.34 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.82 2fiy h ASP 64 Cb 0.46 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.63 2fiy h ASP 64 CO -0.12 0.00 -1.07 -3.20 -1.72 0.00 0.00 179.24 173.13 2fiy n ASN 65 N -2.82 -0.03 -4.77 6.45 5.15 0.14 -5.08 115.26 114.30 2fiy n ASN 65 Ca 0.02 -2.61 -0.36 0.00 -0.60 0.00 0.00 54.58 51.04 2fiy n ASN 65 Cb 0.36 -0.60 -0.00 0.00 -0.53 0.00 0.00 39.78 39.01 2fiy n ASN 65 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 2fiy s PRO 66 N -0.83 3.53 1.04 1.20 0.02 -1.12 -4.79 135.00 134.04 2fiy s PRO 66 Ca 0.34 1.72 -0.14 0.00 0.02 0.00 0.00 61.00 62.94 2fiy s PRO 66 Cb 0.13 -2.21 0.21 0.00 0.02 0.00 0.00 34.50 32.66 2fiy s PRO 66 CO -0.13 -0.73 1.11 -1.25 -0.33 0.00 0.00 177.00 175.67 2fiy s PRO 67 N -2.99 0.10 0.27 5.54 0.04 -1.26 -4.97 135.00 131.72 2fiy s PRO 67 Ca 0.68 0.30 -0.30 0.00 0.04 0.00 0.00 61.00 61.72 2fiy s PRO 67 Cb -0.27 -1.72 -0.11 0.00 0.04 0.00 0.00 34.50 32.45 2fiy s PRO 67 CO 0.31 -2.91 1.51 0.00 0.04 0.00 0.00 177.00 175.95 2fiy s ALA 68 N -3.05 3.68 0.10 8.56 0.00 -1.26 -5.01 121.76 124.77 2fiy s ALA 68 Ca 0.67 1.44 0.03 0.00 0.00 0.00 0.00 51.96 54.10 2fiy s ALA 68 Cb -0.16 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.33 2fiy s ALA 68 CO 0.56 -0.86 -0.08 -0.51 0.00 0.00 0.00 175.76 174.87 2fiy s LEU 69 N -0.51 2.46 0.30 0.00 1.43 -1.26 -4.89 118.68 116.20 2fiy s LEU 69 Ca 0.61 -0.90 -0.29 0.00 -1.03 0.00 0.00 54.13 52.51 2fiy s LEU 69 Cb -0.45 -0.20 -0.10 0.00 0.03 0.00 0.00 46.19 45.48 2fiy s LEU 69 CO 0.46 -0.35 1.27 0.00 0.23 0.00 0.00 176.35 177.96 2fiy s ALA 70 N -2.98 3.49 0.74 4.21 0.00 -1.26 -5.01 121.76 120.95 2fiy s ALA 70 Ca 0.08 1.17 -0.11 0.00 0.00 0.00 0.00 51.96 53.11 2fiy s ALA 70 Cb 0.01 -3.45 0.04 0.00 0.00 0.00 0.00 23.12 19.71 2fiy s ALA 70 CO -0.02 -0.54 1.08 -1.25 0.00 0.00 0.00 175.76 175.03 2fiy s PRO 71 N -1.40 2.50 0.33 0.00 0.04 -1.26 -5.01 135.00 130.20 2fiy s PRO 71 Ca 0.50 1.10 -0.28 0.00 0.04 0.00 0.00 61.00 62.36 2fiy s PRO 71 Cb -0.38 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.14 2fiy s PRO 71 CO 0.48 -1.45 1.16 -0.51 0.04 0.00 0.00 177.00 176.72 2fiy s LEU 72 N -5.77 4.41 -0.32 -3.56 1.43 -1.26 -4.97 118.68 108.64 2fiy s LEU 72 Ca 0.60 2.37 -0.29 0.00 -1.03 0.00 0.00 54.13 55.78 2fiy s LEU 72 Cb -0.16 -3.76 -0.01 0.00 0.03 0.00 0.00 46.19 42.29 2fiy s LEU 72 CO 0.55 -0.38 1.58 -0.62 0.23 0.00 0.00 176.35 177.71 2fiy s ASP 73 N -0.90 6.25 0.32 2.29 2.15 -1.26 -4.89 116.67 120.64 2fiy s ASP 73 Ca 0.49 1.24 0.25 0.00 0.43 0.00 0.00 52.55 54.97 2fiy s ASP 73 Cb -0.33 -2.53 1.13 0.00 -0.30 0.00 0.00 42.92 40.89 2fiy s ASP 73 CO 0.42 -1.43 1.76 -0.65 -0.17 0.00 0.00 175.17 175.10 2fiy h PRO 74 N 11.22 0.00 0.09 4.34 0.11 -1.98 0.13 132.00 145.91 2fiy h PRO 74 Ca -0.31 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.65 2fiy h PRO 74 Cb 1.14 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.26 2fiy h PRO 74 CO 1.04 0.00 -0.71 1.49 -0.21 0.00 0.00 178.00 179.61 2fiy h GLU 75 N 0.00 0.20 -0.65 1.05 4.57 -1.98 -2.35 114.58 115.42 2fiy h GLU 75 Ca 0.00 -0.34 -0.09 0.00 -1.18 0.00 0.00 59.36 57.75 2fiy h GLU 75 Cb 0.28 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 2fiy h GLU 75 CO 0.00 1.16 0.06 -0.09 -1.18 0.00 0.00 179.01 178.96 2fiy h ARG 76 N -0.56 1.11 -0.86 1.92 2.43 -1.87 0.16 114.38 116.72 2fiy h ARG 76 Ca -0.14 -0.32 0.12 0.00 -0.81 0.00 0.00 59.98 58.83 2fiy h ARG 76 Cb 1.47 -0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 30.82 2fiy h ARG 76 CO 0.08 1.04 0.48 -0.07 -1.51 0.00 0.00 179.97 179.99 2fiy h LEU 77 N 1.02 0.64 -0.17 3.80 4.07 -1.10 -0.52 115.31 123.07 2fiy h LEU 77 Ca 0.19 0.07 -0.11 0.00 0.08 0.00 0.00 57.88 58.11 2fiy h LEU 77 Cb 0.50 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.19 2fiy h LEU 77 CO 0.02 0.32 -0.33 -0.09 -1.08 0.00 0.00 178.44 177.28 2fiy h ARG 78 N 0.74 0.52 -0.61 1.13 2.43 -0.77 -2.57 114.38 115.25 2fiy h ARG 78 Ca 0.44 -0.34 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 2fiy h ARG 78 Cb 0.51 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 2fiy h ARG 78 CO -0.30 0.95 0.24 0.87 -1.51 0.00 0.00 179.97 180.22 2fiy h LYS 79 N 0.16 0.91 -0.72 0.20 1.57 -0.51 -1.26 116.57 116.92 2fiy h LYS 79 Ca 0.01 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 2fiy h LYS 79 Cb 0.93 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.06 2fiy h LYS 79 CO 0.07 0.77 0.39 0.66 -0.57 0.00 0.00 179.45 180.77 2fiy h SER 80 N 0.85 0.89 -0.50 0.86 4.64 -1.12 0.25 113.55 119.42 2fiy h SER 80 Ca 0.20 -0.07 -0.06 0.00 -0.47 0.00 0.00 61.79 61.39 2fiy h SER 80 Cb 0.20 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 2fiy h SER 80 CO -0.02 0.72 0.06 -0.09 -0.87 0.00 0.00 176.83 176.63 2fiy h ARG 81 N 1.00 0.84 -0.61 4.77 2.43 -1.23 0.13 114.38 121.71 2fiy h ARG 81 Ca 0.25 -0.23 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 2fiy h ARG 81 Cb 0.03 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 2fiy h ARG 81 CO -0.04 0.84 0.14 1.49 -1.51 0.00 0.00 179.97 180.89 2fiy h GLU 82 N 0.71 0.98 -0.12 0.20 4.81 -0.44 -3.18 114.58 117.54 2fiy h GLU 82 Ca 0.15 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2fiy h GLU 82 Cb 0.42 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2fiy h GLU 82 CO 0.01 0.90 0.00 0.72 -0.73 0.00 0.00 179.01 179.91 2fiy n HIS 83 N -4.34 0.14 -2.33 0.92 8.25 0.81 -4.94 115.22 113.73 2fiy n HIS 83 Ca 0.03 -0.07 -0.15 0.00 -0.26 0.00 0.00 57.72 57.28 2fiy n HIS 83 Cb 0.25 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.36 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 1.22 -0.22 3.84 -1.41 0.00 -0.69 -5.01 105.19 102.93 2fiy n GLY 84 Ca 0.17 -0.26 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 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 -4.79 3.11 0.06 1.61 -1.94 0.38 -4.46 119.30 113.28 2fiy s MET 85 Ca 0.02 -0.65 -0.31 0.00 -1.71 0.00 0.00 55.69 53.04 2fiy s MET 85 Cb -0.01 -2.83 -0.08 0.00 2.01 0.00 0.00 34.83 33.93 2fiy s MET 85 CO 0.03 0.55 1.60 -2.14 -0.01 0.00 0.00 175.02 175.05 2fiy s PRO 86 N -2.71 4.22 0.50 2.03 0.02 -1.26 -4.34 135.00 133.46 2fiy s PRO 86 Ca 0.32 2.26 0.19 0.00 0.02 0.00 0.00 61.00 63.79 2fiy s PRO 86 Cb -0.12 -3.56 1.25 0.00 0.02 0.00 0.00 34.50 32.10 2fiy s PRO 86 CO 0.25 -0.69 2.05 -1.00 -0.33 0.00 0.00 177.00 177.28 2fiy h PRO 87 N 8.11 0.10 -0.52 5.54 0.13 -1.72 -1.46 132.00 142.19 2fiy h PRO 87 Ca -0.42 -0.01 -0.27 0.00 -0.87 0.00 0.00 66.00 64.43 2fiy h PRO 87 Cb 1.20 -0.02 -0.16 0.00 0.13 0.00 0.00 31.00 32.14 2fiy h PRO 87 CO 0.92 0.07 0.08 1.28 -0.23 0.00 0.00 178.00 180.12 2fiy n LEU 88 N -4.46 4.80 -3.42 1.56 4.77 -0.10 -4.87 117.00 115.28 2fiy n LEU 88 Ca 0.05 -3.78 -0.48 0.00 -0.03 0.00 0.00 56.01 51.76 2fiy n LEU 88 Cb 0.34 -0.69 -0.09 0.00 -2.33 0.00 0.00 43.42 40.65 2fiy n LEU 88 CO 0.35 1.25 1.26 0.00 -1.33 0.00 0.00 177.39 178.92 2fiy n ALA 89 N -1.12 -0.09 -0.10 -1.18 0.00 -0.55 -4.55 120.51 112.92 2fiy n ALA 89 Ca 0.40 0.20 -0.03 0.00 0.00 0.00 0.00 53.44 54.01 2fiy n ALA 89 Cb 1.18 -1.61 0.21 0.00 0.00 0.00 0.00 19.45 19.23 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 6.41 0.79 -0.24 0.00 -0.00 -1.62 -2.33 116.97 119.97 2fiy h TYR 90 Ca -0.13 -0.08 -0.12 0.00 0.00 0.00 0.00 58.73 58.39 2fiy h TYR 90 Cb 1.11 -0.23 -0.00 0.00 0.00 0.00 0.00 36.73 37.61 2fiy h TYR 90 CO 0.71 0.69 -0.33 0.22 -0.00 0.00 0.00 178.16 179.46 2fiy h ASP 91 N 0.73 0.71 0.53 0.10 3.58 -1.86 0.18 116.42 120.39 2fiy h ASP 91 Ca 0.16 -0.51 -0.03 0.00 0.42 0.00 0.00 57.03 57.07 2fiy h ASP 91 Cb 0.33 -0.20 0.01 0.00 1.72 0.00 0.00 39.33 41.18 2fiy h ASP 91 CO 0.00 1.07 -0.25 0.25 -2.88 0.00 0.00 179.24 177.43 2fiy h LEU 92 N 0.36 -0.60 -0.98 2.28 5.85 -1.92 -2.81 115.31 117.49 2fiy h LEU 92 Ca 0.03 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 2fiy h LEU 92 Cb 0.91 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 2fiy h LEU 92 CO 0.08 -0.38 0.13 -0.07 -0.34 0.00 0.00 178.44 177.85 2fiy h LEU 93 N -0.78 0.82 -0.93 2.25 4.07 -1.39 -2.41 115.31 116.94 2fiy h LEU 93 Ca -0.07 -0.15 -0.05 0.00 0.08 0.00 0.00 57.88 57.68 2fiy h LEU 93 Cb 0.58 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 42.07 2fiy h LEU 93 CO 0.12 0.80 0.18 1.62 -1.08 0.00 0.00 178.44 180.09 2fiy h VAL 94 N 0.84 1.24 0.00 1.22 3.04 -0.68 -2.70 116.25 119.20 2fiy h VAL 94 Ca 0.18 -0.84 -0.08 0.00 -1.01 0.00 0.00 66.70 64.95 2fiy h VAL 94 Cb 0.32 0.56 -0.01 0.00 -2.01 0.00 0.00 31.29 30.14 2fiy h VAL 94 CO 0.00 0.32 -0.37 0.03 -1.01 0.00 0.00 177.57 176.55 2fiy h ARG 95 N 0.94 0.00 0.00 4.17 3.08 -1.18 -3.10 114.38 118.29 2fiy h ARG 95 Ca 0.21 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.22 2fiy h ARG 95 Cb 0.29 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2fiy h ARG 95 CO -0.01 0.37 -0.19 0.93 -1.07 0.00 0.00 179.97 180.00 2fiy h GLU 96 N 0.00 0.00 0.00 0.04 5.08 -1.11 -3.48 114.58 115.11 2fiy h GLU 96 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2fiy h GLU 96 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2fiy h GLU 96 CO 0.05 0.19 0.00 0.41 -1.00 0.00 0.00 179.01 178.66 2fiy n GLY 97 N 0.66 0.62 0.06 -3.84 0.00 -1.16 -4.90 105.19 96.63 2fiy n GLY 97 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 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 0.96 1.34 0.60 4.61 0.00 -1.26 -1.39 120.51 125.36 2fiy n ALA 98 Ca 0.00 0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.62 2fiy n ALA 98 Cb 0.00 -1.22 0.42 0.00 0.00 0.00 0.00 19.45 18.65 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 -1.82 0.91 -0.16 0.00 4.27 -1.26 -4.43 117.44 114.94 2fiy n TRP 99 Ca 0.01 0.28 0.01 0.00 -3.89 0.00 0.00 57.50 53.90 2fiy n TRP 99 Cb 0.10 -0.95 0.27 0.00 -1.36 0.00 0.00 31.31 29.37 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 0.78 -2.04 5.67 3.38 -1.64 -0.15 115.31 121.31 2fiy h LEU 100 Ca 0.00 -0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.05 2fiy h LEU 100 Cb 0.68 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2fiy h LEU 100 CO 0.00 0.60 0.32 -0.65 0.09 0.00 0.00 178.44 178.80 2fiy h PRO 101 N 0.90 0.00 -0.48 1.13 0.11 -1.81 -0.58 132.00 131.27 2fiy h PRO 101 Ca 0.24 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.22 2fiy h PRO 101 Cb -0.04 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 2fiy h PRO 101 CO -0.04 0.00 -0.19 -1.49 -0.21 0.00 0.00 178.00 176.07 2fiy h TRP 102 N 0.00 1.07 -0.25 0.65 4.06 -1.33 -1.86 115.95 118.29 2fiy h TRP 102 Ca 0.19 -0.25 -0.01 0.00 2.06 0.00 0.00 58.89 60.88 2fiy h TRP 102 Cb 0.84 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 28.73 2fiy h TRP 102 CO 0.00 1.05 0.10 1.25 -3.56 0.00 0.00 178.44 177.27 2fiy h LEU 103 N 0.83 0.35 -0.63 -4.49 5.85 -1.17 -0.82 115.31 115.22 2fiy h LEU 103 Ca 0.11 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.74 2fiy h LEU 103 Cb 0.75 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.62 2fiy h LEU 103 CO 0.06 0.42 0.30 0.44 -0.34 0.00 0.00 178.44 179.32 2fiy h ASP 104 N 0.25 0.40 -0.06 1.25 3.32 -1.25 -1.43 116.42 118.89 2fiy h ASP 104 Ca 0.08 0.05 -0.16 0.00 0.02 0.00 0.00 57.03 57.03 2fiy h ASP 104 Cb 0.18 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2fiy h ASP 104 CO -0.01 0.24 -0.51 0.00 -1.72 0.00 0.00 179.24 177.24 2fiy h ALA 105 N 1.38 0.68 -0.04 3.45 0.00 -1.16 -1.08 119.26 122.49 2fiy h ALA 105 Ca 0.30 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2fiy h ALA 105 Cb 0.29 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2fiy h ALA 105 CO -0.24 0.68 0.03 1.25 0.00 0.00 0.00 179.25 180.97 2fiy h LEU 106 N 0.50 0.05 -0.45 0.00 6.46 -0.84 -0.47 115.31 120.55 2fiy h LEU 106 Ca 0.02 -0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.73 2fiy h LEU 106 Cb 1.06 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.96 2fiy h LEU 106 CO 0.10 0.05 0.19 -0.07 -0.62 0.00 0.00 178.44 178.10 2fiy h LEU 107 N 0.04 0.62 -1.99 2.25 3.38 -1.18 -1.78 115.31 116.64 2fiy h LEU 107 Ca 0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2fiy h LEU 107 Cb 0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2fiy h LEU 107 CO -0.00 0.61 -0.02 0.00 0.09 0.00 0.00 178.44 179.11 2fiy h ALA 108 N 1.04 1.93 -0.00 1.53 0.00 -1.11 -1.53 119.26 121.12 2fiy h ALA 108 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2fiy h ALA 108 Cb 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2fiy h ALA 108 CO -0.01 0.02 -0.11 0.41 0.00 0.00 0.00 179.25 179.57 2fiy n GLY 109 N -1.46 -1.09 1.85 0.00 0.00 -0.19 -4.06 105.19 100.24 2fiy n GLY 109 Ca -0.03 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.12 2.42 0.85 1.61 -0.00 -0.58 -4.86 117.16 115.49 2fiy n TYR 110 Ca 0.13 -2.16 -0.00 0.00 -0.00 0.00 0.00 57.90 55.87 2fiy n TYR 110 Cb 0.28 -0.38 0.03 0.00 -0.00 0.00 0.00 39.34 39.27 2fiy n TYR 110 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.86 176.51 2fiy n PRO 111 N -0.77 1.23 -3.74 2.98 -0.05 -1.24 -4.46 135.00 128.95 2fiy n PRO 111 Ca 0.42 -0.23 -0.24 0.00 -0.05 0.00 0.00 63.50 63.40 2fiy n PRO 111 Cb 0.93 -1.42 -0.17 0.00 -0.05 0.00 0.00 33.50 32.79 2fiy n PRO 111 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2fiy s ALA 112 N -0.87 0.68 0.25 0.55 0.00 -1.26 -5.16 121.76 115.95 2fiy s ALA 112 Ca 0.04 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.79 2fiy s ALA 112 Cb 0.03 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 2fiy s ALA 112 CO 0.01 -0.66 0.43 -1.25 0.00 0.00 0.00 175.76 174.28 2fiy s PRO 113 N 1.99 3.50 0.00 0.00 0.04 -1.26 -5.08 135.00 134.19 2fiy s PRO 113 Ca 0.04 -0.42 0.00 0.00 0.04 0.00 0.00 61.00 60.66 2fiy s PRO 113 Cb -0.13 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.60 2fiy s PRO 113 CO -0.06 0.34 0.04 0.00 0.04 0.00 0.00 177.00 177.37 2fiy n ALA 114 N -1.10 0.00 -1.94 8.56 0.00 -1.26 -4.90 120.51 119.87 2fiy n ALA 114 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.10 2fiy n ALA 114 Cb 0.55 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.17 2fiy n ALA 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2fiy s ASN 115 N -1.36 3.40 0.52 0.00 2.20 -1.26 -4.96 114.94 113.49 2fiy s ASN 115 Ca 0.00 0.23 0.31 0.00 -0.94 0.00 0.00 52.86 52.46 2fiy s ASN 115 Cb 0.00 -0.36 1.28 0.00 -2.00 0.00 0.00 41.25 40.18 2fiy s ASN 115 CO 0.00 -2.55 1.96 0.00 -2.94 0.00 0.00 177.10 173.57 2fiy h ALA 116 N -1.44 1.02 0.15 3.54 0.00 -2.00 -3.04 119.26 117.49 2fiy h ALA 116 Ca -0.44 -0.06 -0.30 0.00 0.00 0.00 0.00 54.91 54.11 2fiy h ALA 116 Cb 1.25 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.03 2fiy h ALA 116 CO 0.41 0.09 -1.42 0.00 0.00 0.00 0.00 179.25 178.32 2fiy h ALA 117 N 1.93 0.13 -0.65 0.00 0.00 -1.98 -1.58 119.26 117.11 2fiy h ALA 117 Ca -0.00 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 53.93 2fiy h ALA 117 Cb 0.55 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2fiy h ALA 117 CO 0.01 1.00 0.41 0.28 0.00 0.00 0.00 179.25 180.95 2fiy h VAL 118 N 0.08 1.18 -0.58 0.00 2.07 -1.94 0.19 116.25 117.26 2fiy h VAL 118 Ca -0.21 -0.36 -0.06 0.00 0.82 0.00 0.00 66.70 66.90 2fiy h VAL 118 Cb 2.03 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 2fiy h VAL 118 CO 0.20 0.18 0.14 1.23 0.02 0.00 0.00 177.57 179.33 2fiy h GLY 119 N 0.88 1.01 0.99 2.17 0.00 -1.53 0.16 103.07 106.75 2fiy h GLY 119 Ca 0.24 -0.63 0.01 0.00 0.00 0.00 0.00 47.33 46.94 2fiy h GLY 119 CO -0.05 0.59 0.54 0.00 0.00 0.00 0.00 176.54 177.62 2fiy h ALA 120 N 1.03 1.04 -0.19 3.60 0.00 -1.12 -1.17 119.26 122.44 2fiy h ALA 120 Ca 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2fiy h ALA 120 Cb 0.35 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2fiy h ALA 120 CO 0.00 0.43 0.08 0.00 0.00 0.00 0.00 179.25 179.76 2fiy h ALA 121 N 1.30 0.25 -0.47 0.00 0.00 -0.32 -1.50 119.26 118.52 2fiy h ALA 121 Ca 0.30 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2fiy h ALA 121 Cb -0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2fiy h ALA 121 CO -0.07 -0.15 0.30 -0.07 0.00 0.00 0.00 179.25 179.26 2fiy h LEU 122 N 0.16 0.55 -0.88 0.00 3.38 -0.88 -2.21 115.31 115.42 2fiy h LEU 122 Ca 0.06 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2fiy h LEU 122 Cb 0.18 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 2fiy h LEU 122 CO -0.00 0.42 0.58 -0.33 0.09 0.00 0.00 178.44 179.19 2fiy h GLU 123 N 0.63 1.15 -0.79 1.13 4.39 -1.10 0.59 114.58 120.58 2fiy h GLU 123 Ca 0.17 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 2fiy h GLU 123 Cb -0.05 -0.26 -0.04 0.00 -0.10 0.00 0.00 28.75 28.31 2fiy h GLU 123 CO -0.03 0.76 0.49 0.37 -1.16 0.00 0.00 179.01 179.44 2fiy h GLN 124 N 1.18 1.06 -0.42 2.33 4.15 -0.95 0.44 115.11 122.91 2fiy h GLN 124 Ca 0.33 -0.09 -0.11 0.00 0.77 0.00 0.00 58.65 59.55 2fiy h GLN 124 Cb -0.12 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.33 2fiy h GLN 124 CO -0.08 0.73 -0.17 -0.07 -1.93 0.00 0.00 178.83 177.31 2fiy h LEU 125 N 1.08 0.88 -0.51 -2.39 3.38 -0.89 -1.27 115.31 115.58 2fiy h LEU 125 Ca 0.29 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2fiy h LEU 125 Cb -0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 2fiy h LEU 125 CO -0.06 1.07 0.30 0.03 0.09 0.00 0.00 178.44 179.88 2fiy h ARG 126 N 0.68 0.70 0.00 1.13 3.08 -0.62 -3.00 114.38 116.36 2fiy h ARG 126 Ca 0.10 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2fiy h ARG 126 Cb 0.73 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2fiy h ARG 126 CO 0.06 0.52 0.00 0.93 -1.07 0.00 0.00 179.97 180.41 2fiy h GLU 127 N 0.69 0.00 -6.50 0.04 4.39 -0.88 -3.46 114.58 108.86 2fiy h GLU 127 Ca 0.18 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.35 2fiy h GLU 127 Cb 0.01 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2fiy h GLU 127 CO -0.03 0.00 0.72 0.00 -1.16 0.00 0.00 179.01 178.53 2fiy s ALA 128 N -3.33 3.55 0.90 3.43 0.00 -0.49 -5.00 121.76 120.83 2fiy s ALA 128 Ca 0.06 1.02 -0.11 0.00 0.00 0.00 0.00 51.96 52.92 2fiy s ALA 128 Cb 0.08 -3.53 0.13 0.00 0.00 0.00 0.00 23.12 19.80 2fiy s ALA 128 CO 0.59 -0.64 1.09 -1.83 0.00 0.00 0.00 175.76 174.97 2fiy s GLU 129 N 1.36 1.24 0.20 0.00 -1.05 -1.26 -4.71 118.70 114.48 2fiy s GLU 129 Ca 0.63 0.84 -0.14 0.00 -0.15 0.00 0.00 54.97 56.16 2fiy s GLU 129 Cb -0.34 -1.80 0.21 0.00 -0.44 0.00 0.00 34.13 31.76 2fiy s GLU 129 CO 0.29 -2.26 1.65 1.49 0.95 0.00 0.00 175.26 177.38 2fiy h GLU 130 N -1.56 0.04 -0.83 -4.83 4.81 -1.99 -1.31 114.58 108.91 2fiy h GLU 130 Ca -0.49 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.77 2fiy h GLU 130 Cb 1.28 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.61 2fiy h GLU 130 CO 0.54 0.03 0.55 0.78 -0.73 0.00 0.00 179.01 180.18 2fiy h GLY 131 N 0.04 1.17 1.02 1.92 0.00 -1.99 -1.45 103.07 103.79 2fiy h GLY 131 Ca 0.28 -0.41 -0.13 0.00 0.00 0.00 0.00 47.33 47.07 2fiy h GLY 131 CO -0.53 0.35 -0.29 -1.61 0.00 0.00 0.00 176.54 174.46 2fiy h GLN 132 N 1.03 0.79 -0.44 4.80 5.75 -1.69 -0.74 115.11 124.62 2fiy h GLN 132 Ca 0.33 -0.40 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 2fiy h GLN 132 Cb 0.03 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 2fiy h GLN 132 CO -0.10 1.03 0.24 0.00 -2.65 0.00 0.00 178.83 177.36 2fiy h ARG 133 N 0.57 0.61 -0.62 1.69 3.08 -0.90 -1.97 114.38 116.84 2fiy h ARG 133 Ca 0.06 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 2fiy h ARG 133 Cb 0.86 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 2fiy h ARG 133 CO 0.07 0.48 0.04 0.87 -1.07 0.00 0.00 179.97 180.37 2fiy h LYS 134 N 0.58 1.05 -0.35 0.04 1.57 -1.18 -0.74 116.57 117.54 2fiy h LYS 134 Ca 0.16 -0.31 0.04 0.00 -1.87 0.00 0.00 60.65 58.67 2fiy h LYS 134 Cb 0.04 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 2fiy h LYS 134 CO -0.03 1.00 0.11 0.00 -0.57 0.00 0.00 179.45 179.97 2fiy h ALA 135 N 1.06 0.39 -0.44 3.86 0.00 -0.93 0.93 119.26 124.14 2fiy h ALA 135 Ca 0.18 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 2fiy h ALA 135 Cb 0.50 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2fiy h ALA 135 CO 0.02 -0.29 -0.20 -1.49 0.00 0.00 0.00 179.25 177.30 2fiy h TRP 136 N 0.25 0.98 -0.43 0.00 6.55 -1.16 -1.88 115.95 120.26 2fiy h TRP 136 Ca 0.16 -0.22 -0.07 0.00 0.95 0.00 0.00 58.89 59.71 2fiy h TRP 136 Cb 0.14 -0.24 -0.02 0.00 -0.86 0.00 0.00 29.16 28.19 2fiy h TRP 136 CO -0.15 0.99 -0.00 0.00 -1.05 0.00 0.00 178.44 178.22 2fiy h ALA 137 N 1.01 0.58 -0.01 1.49 0.00 -0.82 -0.19 119.26 121.33 2fiy h ALA 137 Ca 0.11 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.76 2fiy h ALA 137 Cb 0.74 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2fiy h ALA 137 CO 0.06 0.37 -0.04 0.82 0.00 0.00 0.00 179.25 180.46 2fiy h ILE 138 N 0.60 0.88 -0.21 0.00 2.04 -0.75 -0.55 117.51 119.52 2fiy h ILE 138 Ca 0.12 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.03 2fiy h ILE 138 Cb 0.49 0.88 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 2fiy h ILE 138 CO 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 178.15 178.05 2fiy h ALA 139 N 0.93 0.04 -0.29 1.87 0.00 -1.26 -1.83 119.26 118.73 2fiy h ALA 139 Ca 0.02 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2fiy h ALA 139 Cb 0.10 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2fiy h ALA 139 CO -0.05 -0.55 0.16 1.25 0.00 0.00 0.00 179.25 180.06 2fiy h LEU 140 N -0.11 0.25 -0.03 0.00 5.85 -0.78 0.13 115.31 120.62 2fiy h LEU 140 Ca 0.12 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2fiy h LEU 140 Cb 0.29 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.27 2fiy h LEU 140 CO -0.28 0.19 0.00 0.18 -0.34 0.00 0.00 178.44 178.18 2fiy n LEU 141 N -4.94 0.10 -0.99 2.25 4.77 -0.24 -2.11 117.00 115.85 2fiy n LEU 141 Ca -0.01 0.51 0.10 0.00 -0.03 0.00 0.00 56.01 56.58 2fiy n LEU 141 Cb 0.05 -0.49 0.19 0.00 -2.33 0.00 0.00 43.42 40.84 2fiy n LEU 141 CO 0.32 -0.12 0.66 -1.54 -1.33 0.00 0.00 177.39 175.38 2fiy n SER 142 N -1.60 3.21 -0.04 -1.43 3.41 -0.70 -4.97 113.62 111.51 2fiy n SER 142 Ca 0.06 -1.92 -0.00 0.00 -0.26 0.00 0.00 58.87 56.74 2fiy n SER 142 Cb 0.29 -0.23 -0.00 0.00 -0.26 0.00 0.00 64.21 64.01 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 1.22 0.47 3.07 5.00 0.00 -0.84 -4.96 105.19 109.16 2fiy n GLY 143 Ca 0.17 -0.22 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.66 3.70 0.28 1.61 6.02 0.38 -4.82 117.38 121.90 2fiy n GLN 144 Ca -0.00 -3.85 0.17 0.00 -0.01 0.00 0.00 57.00 53.31 2fiy n GLN 144 Cb 0.06 -2.86 0.81 0.00 1.02 0.00 0.00 30.24 29.27 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 6.10 0.00 0.00 1.08 0.04 -1.91 -2.24 116.94 120.00 2fiy h PHE 145 Ca 0.33 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.10 2fiy h PHE 145 Cb 0.70 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.85 2fiy h PHE 145 CO 1.14 0.06 0.00 -0.25 -0.60 0.00 0.00 178.31 178.65 2fiy n ASP 146 N -3.28 0.00 -0.98 2.17 8.00 -1.26 -3.27 116.55 117.92 2fiy n ASP 146 Ca -0.01 0.24 0.10 0.00 0.71 0.00 0.00 54.79 55.82 2fiy n ASP 146 Cb 0.24 -0.39 0.19 0.00 -0.02 0.00 0.00 41.12 41.14 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 -1.39 3.22 -4.13 0.64 4.77 -0.84 -4.91 117.00 114.36 2fiy n LEU 147 Ca 0.08 -1.59 -0.11 0.00 -0.03 0.00 0.00 56.01 54.35 2fiy n LEU 147 Cb 0.20 -0.24 -0.11 0.00 -2.33 0.00 0.00 43.42 40.95 2fiy n LEU 147 CO 0.18 0.72 -0.39 -1.48 -1.33 0.00 0.00 177.39 175.09 2fiy s LEU 148 N -1.25 2.41 0.24 2.23 2.34 -1.20 -4.70 118.68 118.74 2fiy s LEU 148 Ca 0.33 -0.83 -0.30 0.00 0.06 0.00 0.00 54.13 53.40 2fiy s LEU 148 Cb 0.19 -0.11 -0.09 0.00 -0.56 0.00 0.00 46.19 45.63 2fiy s LEU 148 CO 0.26 -0.37 1.23 -2.84 -1.06 0.00 0.00 176.35 173.57 2fiy s PRO 149 N -2.97 4.47 0.37 1.48 0.02 -1.26 -4.91 135.00 132.20 2fiy s PRO 149 Ca 0.03 1.97 0.06 0.00 0.02 0.00 0.00 61.00 63.09 2fiy s PRO 149 Cb -0.01 -3.19 0.76 0.00 0.02 0.00 0.00 34.50 32.09 2fiy s PRO 149 CO -0.03 -0.09 1.96 0.00 -0.33 0.00 0.00 177.00 178.52 2fiy h ALA 150 N 4.63 1.72 0.00 -1.55 0.00 -1.99 -1.90 119.26 120.18 2fiy h ALA 150 Ca -0.46 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 2fiy h ALA 150 Cb 1.22 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2fiy h ALA 150 CO 0.72 0.16 -0.07 0.00 0.00 0.00 0.00 179.25 180.06 2fiy h ALA 151 N 1.62 1.07 0.00 0.00 0.00 -1.98 -2.72 119.26 117.25 2fiy h ALA 151 Ca 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2fiy h ALA 151 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2fiy h ALA 151 CO -0.10 0.09 -0.59 -0.07 0.00 0.00 0.00 179.25 178.58 2fiy h LEU 152 N 0.00 0.00 -0.23 0.00 4.07 -1.69 -3.40 115.31 114.06 2fiy h LEU 152 Ca -0.00 -0.02 0.06 0.00 0.08 0.00 0.00 57.88 57.99 2fiy h LEU 152 Cb 0.43 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.11 2fiy h LEU 152 CO 0.01 0.01 -0.17 0.58 -1.08 0.00 0.00 178.44 177.79 2fiy h VAL 153 N 0.00 0.52 -0.80 1.22 2.07 -1.43 -1.63 116.25 116.19 2fiy h VAL 153 Ca 0.00 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.62 2fiy h VAL 153 Cb 0.96 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 31.18 2fiy h VAL 153 CO 0.00 0.00 0.44 1.55 0.02 0.00 0.00 177.57 179.58 2fiy h PRO 154 N -0.17 0.72 -0.12 1.57 0.13 -1.76 0.28 132.00 132.65 2fiy h PRO 154 Ca 0.13 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 65.14 2fiy h PRO 154 Cb 0.37 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.34 2fiy h PRO 154 CO -0.33 0.47 -0.23 0.74 -0.23 0.00 0.00 178.00 178.42 2fiy h PHE 155 N 0.74 0.46 -0.12 1.56 0.04 -1.73 -0.77 116.94 117.12 2fiy h PHE 155 Ca 0.39 -0.17 -0.05 0.00 2.80 0.00 0.00 57.97 60.95 2fiy h PHE 155 Cb 0.39 -0.09 -0.00 0.00 2.20 0.00 0.00 35.95 38.45 2fiy h PHE 155 CO -0.07 0.85 -0.11 1.25 -0.60 0.00 0.00 178.31 179.62 2fiy h LEU 156 N -0.05 0.31 -0.63 1.54 5.85 -1.17 -2.30 115.31 118.85 2fiy h LEU 156 Ca 0.00 -0.47 0.10 0.00 0.84 0.00 0.00 57.88 58.35 2fiy h LEU 156 Cb 0.82 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.69 2fiy h LEU 156 CO 0.05 0.72 0.25 1.23 -0.34 0.00 0.00 178.44 180.35 2fiy h GLY 157 N -0.09 0.90 0.97 3.75 0.00 -0.52 -1.40 103.07 106.68 2fiy h GLY 157 Ca 0.02 -0.14 0.02 0.00 0.00 0.00 0.00 47.33 47.23 2fiy h GLY 157 CO 0.03 -0.01 0.55 0.00 0.00 0.00 0.00 176.54 177.10 2fiy h ALA 158 N 1.43 1.06 -0.51 3.60 0.00 -1.06 -0.42 119.26 123.36 2fiy h ALA 158 Ca 0.32 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 2fiy h ALA 158 Cb 0.40 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2fiy h ALA 158 CO -0.31 0.43 -0.17 0.00 0.00 0.00 0.00 179.25 179.20 2fiy h ALA 159 N 1.32 0.72 -0.55 0.00 0.00 -0.94 -2.23 119.26 117.57 2fiy h ALA 159 Ca 0.31 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 2fiy h ALA 159 Cb -0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2fiy h ALA 159 CO -0.08 0.68 -0.10 -0.07 0.00 0.00 0.00 179.25 179.68 2fiy h LEU 160 N 0.89 1.03 -0.45 0.00 3.38 -0.98 -1.90 115.31 117.28 2fiy h LEU 160 Ca 0.12 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.78 2fiy h LEU 160 Cb 0.75 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2fiy h LEU 160 CO 0.06 1.13 0.26 1.56 0.09 0.00 0.00 178.44 181.54 2fiy h GLN 161 N 0.92 0.50 -0.39 1.13 4.20 -0.94 -1.30 115.11 119.23 2fiy h GLN 161 Ca 0.14 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.79 2fiy h GLN 161 Cb 0.66 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2fiy h GLN 161 CO 0.05 0.33 0.10 0.28 -0.67 0.00 0.00 178.83 178.91 2fiy h VAL 162 N 0.52 1.23 -0.22 -0.54 2.07 -1.32 -0.61 116.25 117.37 2fiy h VAL 162 Ca 0.18 -0.77 0.04 0.00 0.82 0.00 0.00 66.70 66.98 2fiy h VAL 162 Cb 0.04 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 2fiy h VAL 162 CO -0.10 0.27 -0.06 0.00 0.02 0.00 0.00 177.57 177.70 2fiy h ALA 163 N 0.94 0.14 -0.08 1.67 0.00 -1.13 -0.48 119.26 120.32 2fiy h ALA 163 Ca 0.12 0.09 -0.24 0.00 0.00 0.00 0.00 54.91 54.88 2fiy h ALA 163 Cb 0.31 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.28 2fiy h ALA 163 CO 0.00 -0.48 -0.89 -1.49 0.00 0.00 0.00 179.25 176.40 2fiy h TRP 164 N -0.00 1.02 -0.54 0.00 6.55 -1.12 -1.97 115.95 119.88 2fiy h TRP 164 Ca 0.11 -0.49 0.02 0.00 0.95 0.00 0.00 58.89 59.48 2fiy h TRP 164 Cb 0.17 -0.14 -0.03 0.00 -0.86 0.00 0.00 29.16 28.29 2fiy h TRP 164 CO -0.23 1.32 0.33 0.77 -1.05 0.00 0.00 178.44 179.58 2fiy h SER 165 N 0.46 0.53 -0.49 -3.49 0.02 -1.08 0.19 113.55 109.69 2fiy h SER 165 Ca -0.08 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 60.94 2fiy h SER 165 Cb 1.53 -0.11 -0.06 0.00 0.14 0.00 0.00 62.40 63.89 2fiy h SER 165 CO 0.18 0.37 0.14 -0.74 -1.14 0.00 0.00 176.83 175.64 2fiy h HIS 166 N 0.65 0.23 -0.60 3.45 -0.00 -0.98 -0.64 115.15 117.26 2fiy h HIS 166 Ca 0.22 0.03 -0.09 0.00 -0.00 0.00 0.00 60.37 60.53 2fiy h HIS 166 Cb 0.01 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.37 2fiy h HIS 166 CO -0.06 0.05 0.04 -1.49 -0.00 0.00 0.00 177.93 176.46 2fiy h TRP 167 N 0.29 1.12 -0.84 5.26 6.55 -0.91 -3.00 115.95 124.41 2fiy h TRP 167 Ca 0.24 -0.18 -0.03 0.00 0.95 0.00 0.00 58.89 59.87 2fiy h TRP 167 Cb 0.29 -0.30 -0.04 0.00 -0.86 0.00 0.00 29.16 28.25 2fiy h TRP 167 CO -0.19 0.98 0.39 1.25 -1.05 0.00 0.00 178.44 179.82 2fiy h LEU 168 N 0.93 1.11 -0.21 -4.49 5.85 -0.19 -2.48 115.31 115.83 2fiy h LEU 168 Ca 0.17 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2fiy h LEU 168 Cb 0.51 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2fiy h LEU 168 CO 0.02 0.94 0.00 0.18 -0.34 0.00 0.00 178.44 179.25 2fiy n LEU 169 N -4.30 0.33 -0.39 2.25 4.77 -0.29 -2.38 117.00 117.00 2fiy n LEU 169 Ca 0.08 0.56 0.13 0.00 -0.03 0.00 0.00 56.01 56.75 2fiy n LEU 169 Cb 0.15 -0.49 0.28 0.00 -2.33 0.00 0.00 43.42 41.03 2fiy n LEU 169 CO 0.40 -0.28 0.59 0.61 -1.33 0.00 0.00 177.39 177.38 2fiy n GLY 170 N 0.50 -0.25 0.00 -0.72 0.00 -0.94 -5.10 105.19 98.67 2fiy n GLY 170 Ca 0.04 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.57 2fiy n GLY 170 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fiy n LEU 171 N -0.24 0.00 -4.69 0.99 4.77 -1.00 -5.10 117.00 111.72 2fiy n LEU 171 Ca 0.13 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.73 2fiy n LEU 171 Cb 0.40 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.42 2fiy n LEU 171 CO 0.24 0.00 0.13 -1.61 -1.33 0.00 0.00 177.39 174.82 2fiy s GLU 173 N 0.00 4.24 0.00 3.23 2.02 -1.26 -4.96 118.70 121.97 2fiy s GLU 173 Ca 0.00 0.30 0.00 0.00 0.02 0.00 0.00 54.97 55.29 2fiy s GLU 173 Cb 0.00 -3.50 0.00 0.00 0.10 0.00 0.00 34.13 30.73 2fiy s GLU 173 CO 0.00 0.04 0.00 0.41 0.02 0.00 0.00 175.26 175.73 2fiy n GLY 174 N 3.65 2.12 0.45 -1.39 0.00 -1.26 -4.90 105.19 103.86 2fiy n GLY 174 Ca -0.08 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.23 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 2.57 -3.40 4.61 0.00 -1.96 -3.19 119.26 117.89 2fiy h ALA 175 Ca 0.00 0.04 -0.67 0.00 0.00 0.00 0.00 54.91 54.28 2fiy h ALA 175 Cb 0.00 0.07 -0.34 0.00 0.00 0.00 0.00 17.79 17.52 2fiy h ALA 175 CO 0.00 -0.99 -0.79 0.08 0.00 0.00 0.00 179.25 177.56 2fiy s VAL 176 N -5.30 2.48 -0.03 0.00 1.01 -1.26 -4.47 120.40 112.83 2fiy s VAL 176 Ca -0.07 -1.20 0.02 0.00 0.00 0.00 0.00 61.98 60.73 2fiy s VAL 176 Cb 0.25 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 2fiy s VAL 176 CO 0.80 0.20 0.00 0.52 0.00 0.00 0.00 175.10 176.63 2fiy n VAL 177 N 4.59 0.17 -1.43 2.92 0.31 -1.21 -4.33 118.33 119.35 2fiy n VAL 177 Ca -0.17 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2fiy n VAL 177 Cb 0.46 -0.86 0.00 0.00 -0.91 0.00 0.00 33.84 32.53 2fiy n VAL 177 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2fiy n GLU 178 N -2.20 0.55 -1.97 5.55 -0.58 -1.26 -4.39 120.64 116.34 2fiy n GLU 178 Ca -0.04 0.00 -0.03 0.00 -0.42 0.00 0.00 57.16 56.67 2fiy n GLU 178 Cb 0.57 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.45 2fiy n GLU 178 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2fiy n THR 179 N -1.38 0.00 -0.57 2.62 -2.24 -1.26 -4.91 114.28 106.54 2fiy n THR 179 Ca 0.00 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2fiy n THR 179 Cb 0.00 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 2fiy n THR 179 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2fiy n ARG 182 N -0.19 0.33 0.00 -0.78 1.85 -1.26 -4.96 116.66 111.66 2fiy n ARG 182 Ca -0.03 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 56.95 2fiy n ARG 182 Cb 0.20 -0.03 0.27 0.00 -1.05 0.00 0.00 32.46 31.85 2fiy n ARG 182 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 2fiy n THR 183 N 0.00 0.00 -4.37 8.89 -2.24 -1.26 -4.92 114.28 110.38 2fiy n THR 183 Ca 0.00 -0.07 -0.26 0.00 -2.27 0.00 0.00 64.05 61.45 2fiy n THR 183 Cb 0.00 0.41 -0.10 0.00 -2.10 0.00 0.00 70.33 68.54 2fiy n THR 183 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2fiy s LEU 184 N -2.74 2.73 0.09 3.22 1.43 -1.26 -4.52 118.68 117.62 2fiy s LEU 184 Ca 0.17 -0.76 -0.33 0.00 -1.03 0.00 0.00 54.13 52.18 2fiy s LEU 184 Cb 0.18 -1.39 -0.12 0.00 0.03 0.00 0.00 46.19 44.89 2fiy s LEU 184 CO 0.62 0.09 1.73 0.00 0.23 0.00 0.00 176.35 179.02 2fiy h PRO 186 N 7.47 0.00 0.18 0.00 0.13 -1.96 0.18 132.00 137.99 2fiy h PRO 186 Ca -0.46 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.32 2fiy h PRO 186 Cb 1.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.39 2fiy h PRO 186 CO 0.92 0.07 -1.75 0.00 -0.23 0.00 0.00 178.00 177.02 2fiy h ALA 187 N 1.93 0.18 0.00 -0.56 0.00 -1.95 -3.39 119.26 115.47 2fiy h ALA 187 Ca -0.00 -1.16 0.00 0.00 0.00 0.00 0.00 54.91 53.75 2fiy h ALA 187 Cb 0.27 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2fiy h ALA 187 CO 0.01 1.05 -0.15 0.00 0.00 0.00 0.00 179.25 180.17 2fiy n GLY 189 N 0.61 0.56 3.87 0.00 0.00 0.61 -1.51 105.19 109.33 2fiy n GLY 189 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.00 6.56 0.77 1.61 0.01 -1.26 -4.51 113.70 114.88 2fiy s SER 190 Ca 0.00 1.25 -0.11 0.00 1.31 0.00 0.00 55.95 58.40 2fiy s SER 190 Cb 0.00 -2.37 0.06 0.00 0.21 0.00 0.00 66.02 63.92 2fiy s SER 190 CO 0.00 -0.43 1.10 -2.16 0.41 0.00 0.00 173.24 172.16 2fiy s PRO 191 N -3.85 2.21 0.64 12.44 0.04 -1.26 -0.57 135.00 144.65 2fiy s PRO 191 Ca 0.53 1.23 -0.15 0.00 0.04 0.00 0.00 61.00 62.65 2fiy s PRO 191 Cb -0.10 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 2fiy s PRO 191 CO 0.30 -1.69 1.08 -1.25 0.04 0.00 0.00 177.00 175.49 2fiy s PRO 192 N -4.80 3.01 0.06 0.56 0.04 -1.26 -1.75 135.00 130.87 2fiy s PRO 192 Ca 0.62 1.25 0.19 0.00 0.04 0.00 0.00 61.00 63.10 2fiy s PRO 192 Cb -0.18 -1.99 -0.15 0.00 0.04 0.00 0.00 34.50 32.23 2fiy s PRO 192 CO 0.55 -1.06 0.75 -0.12 0.04 0.00 0.00 177.00 177.15 2fiy n MET 193 N -2.39 0.63 -3.61 4.56 1.56 0.27 -3.36 117.12 114.79 2fiy n MET 193 Ca 0.09 0.10 -0.04 0.00 -0.27 0.00 0.00 57.70 57.59 2fiy n MET 193 Cb 0.53 -1.74 -0.02 0.00 2.15 0.00 0.00 33.22 34.15 2fiy n MET 193 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2fiy s ALA 194 N -3.10 -1.98 0.17 -5.12 0.00 -1.24 -4.73 121.76 105.75 2fiy s ALA 194 Ca -0.04 0.99 0.04 0.00 0.00 0.00 0.00 51.96 52.95 2fiy s ALA 194 Cb 0.10 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 2fiy s ALA 194 CO 0.82 -0.81 0.19 0.20 0.00 0.00 0.00 175.76 176.16 2fiy s GLY 195 N -2.58 1.68 -0.05 0.00 0.00 -0.51 -1.58 107.32 104.28 2fiy s GLY 195 Ca 0.10 -1.17 0.01 0.00 0.00 0.00 0.00 44.72 43.66 2fiy s GLY 195 CO -0.04 -1.18 -0.07 1.06 0.00 0.00 0.00 173.10 172.87 2fiy s MET 196 N -3.20 1.06 -0.28 2.90 -1.94 0.71 -1.41 119.30 117.15 2fiy s MET 196 Ca 0.32 -0.19 -0.07 0.00 -1.71 0.00 0.00 55.69 54.04 2fiy s MET 196 Cb -0.10 -0.99 -0.00 0.00 2.01 0.00 0.00 34.83 35.75 2fiy s MET 196 CO 0.25 -0.05 0.07 0.42 -0.01 0.00 0.00 175.02 175.70 2fiy s ILE 197 N 0.84 4.03 -0.11 2.53 1.09 -0.25 0.05 121.20 129.37 2fiy s ILE 197 Ca -0.12 -0.54 -0.00 0.00 -1.10 0.00 0.00 60.65 58.88 2fiy s ILE 197 Cb -0.15 -3.01 -0.02 0.00 -1.06 0.00 0.00 42.46 38.22 2fiy s ILE 197 CO 0.01 0.16 -0.09 -0.13 -0.10 0.00 0.00 174.94 174.79 2fiy s ARG 198 N 1.53 3.23 0.00 2.79 0.52 -0.45 -1.55 118.95 125.02 2fiy s ARG 198 Ca 0.04 -0.61 0.00 0.00 -0.52 0.00 0.00 55.73 54.63 2fiy s ARG 198 Cb -0.16 -2.67 0.00 0.00 0.52 0.00 0.00 34.95 32.64 2fiy s ARG 198 CO 0.02 0.36 0.00 0.00 0.02 0.00 0.00 175.30 175.71 2fiy n GLN 199 N 3.11 0.00 -0.72 3.54 -0.00 -1.26 -1.72 117.38 120.33 2fiy n GLN 199 Ca -0.18 0.00 -0.27 0.00 -0.00 0.00 0.00 57.00 56.55 2fiy n GLN 199 Cb 0.53 0.00 -0.07 0.00 -0.00 0.00 0.00 30.24 30.69 2fiy n GLN 199 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 2fiy n THR 204 N -0.41 0.00 -0.89 -0.39 -1.04 -1.26 -4.73 114.28 105.56 2fiy n THR 204 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 2fiy n THR 204 Cb 0.00 -0.27 0.14 0.00 -1.82 0.00 0.00 70.33 68.39 2fiy n THR 204 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2fiy s GLY 205 N 3.92 1.73 0.08 3.41 0.00 -1.26 -5.02 107.32 110.18 2fiy s GLY 205 Ca 0.68 0.53 -0.18 0.00 0.00 0.00 0.00 44.72 45.75 2fiy s GLY 205 CO 0.31 0.93 0.55 1.08 0.00 0.00 0.00 173.10 175.97 2fiy s LEU 206 N -6.33 4.49 -0.10 0.66 1.43 -0.70 -4.84 118.68 113.31 2fiy s LEU 206 Ca 0.66 1.21 -0.12 0.00 -1.03 0.00 0.00 54.13 54.85 2fiy s LEU 206 Cb -0.22 -2.93 -0.05 0.00 0.03 0.00 0.00 46.19 43.02 2fiy s LEU 206 CO 0.56 0.25 0.30 -0.60 0.23 0.00 0.00 176.35 177.09 2fiy s ARG 207 N -1.25 3.94 0.06 1.70 3.52 -1.26 -1.34 118.95 124.33 2fiy s ARG 207 Ca 0.30 0.15 0.07 0.00 -0.13 0.00 0.00 55.73 56.12 2fiy s ARG 207 Cb -0.19 -3.30 -0.03 0.00 -1.56 0.00 0.00 34.95 29.88 2fiy s ARG 207 CO 0.19 0.52 -0.20 0.71 -0.81 0.00 0.00 175.30 175.71 2fiy s TYR 208 N -0.42 1.73 0.04 5.12 1.51 0.11 -2.26 117.35 123.18 2fiy s TYR 208 Ca 0.19 -0.38 -0.08 0.00 -1.01 0.00 0.00 57.07 55.78 2fiy s TYR 208 Cb -0.14 -1.01 -0.05 0.00 -0.11 0.00 0.00 41.96 40.65 2fiy s TYR 208 CO 0.07 0.11 0.32 -0.51 -1.11 0.00 0.00 175.55 174.44 2fiy s LEU 209 N -1.37 4.36 -0.22 -1.29 1.43 0.42 -0.21 118.68 121.80 2fiy s LEU 209 Ca 0.06 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 53.82 2fiy s LEU 209 Cb -0.09 -2.82 0.03 0.00 0.03 0.00 0.00 46.19 43.35 2fiy s LEU 209 CO 0.02 0.22 -0.13 -0.55 0.23 0.00 0.00 176.35 176.13 2fiy s SER 210 N -1.75 3.86 0.20 2.29 0.15 -0.62 -1.11 113.70 116.73 2fiy s SER 210 Ca 0.30 -0.94 -0.31 0.00 0.70 0.00 0.00 55.95 55.70 2fiy s SER 210 Cb -0.13 -1.55 -0.11 0.00 -1.71 0.00 0.00 66.02 62.52 2fiy s SER 210 CO 0.17 -0.09 1.58 0.00 1.20 0.00 0.00 173.24 176.10 2fiy h SER 212 N 6.26 0.00 0.00 0.00 4.64 -1.57 -3.07 113.55 119.82 2fiy h SER 212 Ca -0.44 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.77 2fiy h SER 212 Cb 1.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 2fiy h SER 212 CO 0.89 0.08 -1.31 -0.11 -0.87 0.00 0.00 176.83 175.51 2fiy n LEU 213 N -4.15 1.87 -0.27 5.97 0.00 -1.26 -4.63 117.00 114.53 2fiy n LEU 213 Ca -0.03 0.32 0.10 0.00 0.00 0.00 0.00 56.01 56.40 2fiy n LEU 213 Cb 0.17 -0.73 -0.05 0.00 0.00 0.00 0.00 43.42 42.81 2fiy n LEU 213 CO 0.33 -0.09 0.15 0.00 0.00 0.00 0.00 177.39 177.77 2fiy n ALA 215 N -0.63 -0.01 -1.77 0.00 0.00 -1.16 -4.12 120.51 112.82 2fiy n ALA 215 Ca 0.06 0.01 -0.40 0.00 0.00 0.00 0.00 53.44 53.11 2fiy n ALA 215 Cb 0.38 -0.64 -0.00 0.00 0.00 0.00 0.00 19.45 19.19 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 -2.12 2.87 0.02 0.00 2.02 -0.62 -0.15 118.70 120.71 2fiy s GLU 217 Ca 0.54 -0.53 -0.01 0.00 0.02 0.00 0.00 54.97 54.99 2fiy s GLU 217 Cb -0.43 -2.72 -0.02 0.00 0.10 0.00 0.00 34.13 31.06 2fiy s GLU 217 CO 0.57 0.65 -0.02 1.67 0.02 0.00 0.00 175.26 178.15 2fiy s TRP 218 N -1.02 0.26 0.29 1.61 -2.14 -0.26 -1.84 118.94 115.84 2fiy s TRP 218 Ca 0.17 -0.54 -0.29 0.00 2.66 0.00 0.00 56.10 58.10 2fiy s TRP 218 Cb -0.11 -0.19 -0.10 0.00 -3.10 0.00 0.00 33.47 29.96 2fiy s TRP 218 CO 0.08 -0.21 1.34 -1.01 -2.66 0.00 0.00 176.95 174.48 2fiy s HIS 219 N -1.66 3.08 -0.09 1.66 3.76 -1.26 -0.44 115.29 120.34 2fiy s HIS 219 Ca -0.14 1.29 -0.04 0.00 -0.15 0.00 0.00 55.06 56.02 2fiy s HIS 219 Cb -0.08 -3.70 0.04 0.00 1.11 0.00 0.00 32.58 29.95 2fiy s HIS 219 CO -0.02 -2.05 0.19 -0.47 -0.85 0.00 0.00 174.74 171.54 2fiy s TYR 220 N -0.65 -0.24 0.22 1.40 5.04 -0.96 -4.82 117.35 117.35 2fiy s TYR 220 Ca 0.53 0.64 -0.31 0.00 -2.44 0.00 0.00 57.07 55.48 2fiy s TYR 220 Cb -0.40 -0.07 -0.14 0.00 0.35 0.00 0.00 41.96 41.70 2fiy s TYR 220 CO 0.48 -0.22 1.29 1.55 -1.34 0.00 0.00 175.55 177.31 2fiy n VAL 221 N 4.51 1.02 0.29 3.14 3.14 -1.26 -4.43 118.33 124.73 2fiy n VAL 221 Ca -0.21 -0.26 0.17 0.00 -2.96 0.00 0.00 64.34 61.09 2fiy n VAL 221 Cb 0.52 -1.21 0.83 0.00 -1.06 0.00 0.00 33.84 32.92 2fiy n VAL 221 CO 0.00 0.00 0.00 0.03 -6.46 0.00 0.00 176.83 170.40 2fiy h ARG 222 N 3.71 0.00 -2.12 1.45 3.08 -1.96 -3.31 114.38 115.23 2fiy h ARG 222 Ca -0.44 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 58.92 2fiy h ARG 222 Cb 1.31 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 31.01 2fiy h ARG 222 CO 0.72 0.05 0.20 0.44 -1.07 0.00 0.00 179.97 180.31 2fiy n ILE 223 N -3.27 4.14 -3.64 2.04 -0.00 -1.26 -4.99 119.36 112.39 2fiy n ILE 223 Ca -0.01 -5.45 -0.10 0.00 -0.00 0.00 0.00 62.75 57.19 2fiy n ILE 223 Cb 0.23 -1.41 -0.07 0.00 -0.00 0.00 0.00 39.64 38.39 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 -3.88 0.76 0.27 6.28 2.20 -1.25 -4.36 119.74 119.77 2fiy s LYS 224 Ca 0.46 1.11 -0.30 0.00 -0.36 0.00 0.00 55.97 56.88 2fiy s LYS 224 Cb 0.29 0.26 -0.10 0.00 -1.51 0.00 0.00 37.83 36.77 2fiy s LYS 224 CO -0.18 -0.13 1.44 0.00 -0.36 0.00 0.00 175.35 176.11 2fiy n SER 226 N 1.98 0.24 -0.04 0.00 3.41 -1.26 -1.12 113.62 116.83 2fiy n SER 226 Ca 0.05 0.54 -0.09 0.00 -0.26 0.00 0.00 58.87 59.12 2fiy n SER 226 Cb 0.40 -0.60 -0.03 0.00 -0.26 0.00 0.00 64.21 63.72 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 -1.74 0.00 -0.00 7.33 -0.00 -1.26 -4.78 115.22 114.76 2fiy n HIS 227 Ca 0.05 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.66 2fiy n HIS 227 Cb 0.29 -0.35 0.02 0.00 -0.00 0.00 0.00 29.99 29.95 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 -3.94 -0.93 -2.56 0.00 1.02 -0.28 -4.96 120.64 109.00 2fiy n GLU 229 Ca -0.04 0.27 -0.41 0.00 -0.02 0.00 0.00 57.16 56.96 2fiy n GLU 229 Cb 0.65 -3.98 -0.04 0.00 -0.02 0.00 0.00 31.44 28.04 2fiy n GLU 229 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2fiy s GLU 230 N -1.04 4.64 -0.02 3.49 0.41 -1.26 -4.50 118.70 120.42 2fiy s GLU 230 Ca 0.00 1.68 0.18 0.00 -0.41 0.00 0.00 54.97 56.42 2fiy s GLU 230 Cb 0.00 -3.28 -0.26 0.00 -1.78 0.00 0.00 34.13 28.81 2fiy s GLU 230 CO 0.00 0.15 0.52 -1.13 -0.49 0.00 0.00 175.26 174.31 2fiy n SER 231 N 2.19 0.78 -4.89 -0.19 3.41 -1.26 -0.79 113.62 112.87 2fiy n SER 231 Ca 0.02 -0.30 -0.32 0.00 -0.26 0.00 0.00 58.87 58.00 2fiy n SER 231 Cb 0.46 1.58 -0.05 0.00 -0.26 0.00 0.00 64.21 65.94 2fiy n SER 231 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2fiy s LYS 232 N -3.10 3.62 -1.39 4.33 1.02 -1.26 -4.49 119.74 118.47 2fiy s LYS 232 Ca -0.02 -0.07 0.00 0.00 0.02 0.00 0.00 55.97 55.90 2fiy s LYS 232 Cb 0.12 -2.92 0.00 0.00 -0.52 0.00 0.00 37.83 34.51 2fiy s LYS 232 CO 0.76 0.52 0.00 0.72 -0.92 0.00 0.00 175.35 176.44 2fiy n HIS 233 N 0.41 -0.39 -2.64 3.18 8.25 -1.26 -4.88 115.22 117.88 2fiy n HIS 233 Ca -0.05 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.04 2fiy n HIS 233 Cb 0.52 -2.88 -0.05 0.00 1.12 0.00 0.00 29.99 28.70 2fiy n HIS 233 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2fiy s LEU 234 N -3.84 4.22 0.12 2.41 1.43 -1.26 -4.37 118.68 117.40 2fiy s LEU 234 Ca 0.00 1.96 0.04 0.00 -1.03 0.00 0.00 54.13 55.10 2fiy s LEU 234 Cb 0.00 -4.11 -0.04 0.00 0.03 0.00 0.00 46.19 42.07 2fiy s LEU 234 CO 0.00 -0.31 -0.09 0.00 0.23 0.00 0.00 176.35 176.17 2fiy s ALA 235 N -1.65 1.27 -0.14 4.21 0.00 -0.92 -4.98 121.76 119.55 2fiy s ALA 235 Ca 0.55 -1.39 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 2fiy s ALA 235 Cb -0.21 0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.01 2fiy s ALA 235 CO 0.26 -0.11 -0.11 0.71 0.00 0.00 0.00 175.76 176.51 2fiy s TYR 236 N -3.19 1.88 -0.06 0.00 1.51 -1.26 -0.25 117.35 115.97 2fiy s TYR 236 Ca 0.13 -1.05 0.05 0.00 -1.01 0.00 0.00 57.07 55.19 2fiy s TYR 236 Cb 0.02 -1.43 -0.02 0.00 -0.11 0.00 0.00 41.96 40.42 2fiy s TYR 236 CO -0.01 -0.61 -0.21 -1.17 -1.11 0.00 0.00 175.55 172.44 2fiy s LEU 237 N 1.58 2.32 0.09 -1.29 1.98 -0.42 -4.91 118.68 118.02 2fiy s LEU 237 Ca 0.04 -0.41 0.00 0.00 -2.89 0.00 0.00 54.13 50.88 2fiy s LEU 237 Cb -0.13 -1.45 -0.04 0.00 0.66 0.00 0.00 46.19 45.23 2fiy s LEU 237 CO -0.09 0.26 -0.03 -0.94 -1.89 0.00 0.00 176.35 173.65 2fiy s SER 238 N -0.24 0.78 0.00 3.68 1.04 -1.26 0.43 113.70 118.13 2fiy s SER 238 Ca -0.00 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 55.39 2fiy s SER 238 Cb -0.13 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.15 2fiy s SER 238 CO 0.03 -0.56 0.00 -0.11 0.98 0.00 0.00 173.24 173.58 2fiy n LEU 239 N 0.00 0.00 0.00 2.42 0.00 -1.26 -5.07 117.00 113.09 2fiy n LEU 239 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.89 2fiy n LEU 239 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 43.42 44.03 2fiy n LEU 239 CO 0.30 0.00 0.00 0.61 0.00 0.00 0.00 177.39 178.30 2fiy n GLY 243 N 2.76 0.74 0.65 -3.96 0.00 -1.26 -5.01 105.19 99.11 2fiy n GLY 243 Ca 0.00 -2.25 -0.04 0.00 0.00 0.00 0.00 46.02 43.74 2fiy n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fiy n GLN 244 N -0.60 1.16 -1.44 1.61 10.64 -1.26 -5.11 117.38 122.37 2fiy n GLN 244 Ca 0.00 -0.55 -0.31 0.00 -1.83 0.00 0.00 57.00 54.31 2fiy n GLN 244 Cb 0.00 0.01 0.07 0.00 -0.86 0.00 0.00 30.24 29.46 2fiy n GLN 244 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 2fiy s PRO 245 N -2.41 2.59 0.14 2.61 0.04 -1.26 -4.98 135.00 131.73 2fiy s PRO 245 Ca 0.08 1.01 -0.11 0.00 0.04 0.00 0.00 61.00 62.02 2fiy s PRO 245 Cb -0.01 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 2fiy s PRO 245 CO 0.05 -1.36 1.48 0.00 0.04 0.00 0.00 177.00 177.20 2fiy h ALA 246 N -0.92 0.58 0.00 8.56 0.00 -1.99 -2.91 119.26 122.59 2fiy h ALA 246 Ca -0.44 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.01 2fiy h ALA 246 Cb 1.22 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2fiy h ALA 246 CO 0.55 0.68 0.00 -0.85 0.00 0.00 0.00 179.25 179.63 2fiy n GLU 247 N -4.05 0.07 -0.42 0.00 0.00 -1.26 -1.35 120.64 113.63 2fiy n GLU 247 Ca -0.02 0.45 0.08 0.00 0.00 0.00 0.00 57.16 57.67 2fiy n GLU 247 Cb 0.55 -1.68 0.26 0.00 0.00 0.00 0.00 31.44 30.57 2fiy n GLU 247 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2fiy n LYS 248 N -1.83 3.21 -2.29 3.44 4.76 -1.10 -5.05 118.16 119.31 2fiy n LYS 248 Ca 0.01 -2.59 -0.41 0.00 -2.87 0.00 0.00 58.31 52.45 2fiy n LYS 248 Cb 0.10 -1.66 -0.03 0.00 -1.84 0.00 0.00 35.03 31.59 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 -1.81 3.47 0.09 7.82 0.00 -0.45 -4.86 121.76 126.02 2fiy s ALA 249 Ca 0.39 1.06 -0.09 0.00 0.00 0.00 0.00 51.96 53.32 2fiy s ALA 249 Cb 0.26 -3.43 -0.21 0.00 0.00 0.00 0.00 23.12 19.73 2fiy s ALA 249 CO 0.17 -0.44 1.19 0.28 0.00 0.00 0.00 175.76 176.96 2fiy h VAL 250 N 3.50 1.37 -3.36 0.00 2.07 -1.89 -3.44 116.25 114.49 2fiy h VAL 250 Ca -0.46 -2.55 -0.62 0.00 0.82 0.00 0.00 66.70 63.89 2fiy h VAL 250 Cb 1.22 2.62 -0.16 0.00 -1.52 0.00 0.00 31.29 33.44 2fiy h VAL 250 CO 0.72 0.77 -0.55 -0.22 0.02 0.00 0.00 177.57 178.31 2fiy s LEU 251 N -7.70 3.88 -0.04 2.57 2.96 -1.26 0.30 118.68 119.39 2fiy s LEU 251 Ca -0.07 0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 53.92 2fiy s LEU 251 Cb 0.07 -2.00 0.03 0.00 0.50 0.00 0.00 46.19 44.79 2fiy s LEU 251 CO 0.90 0.14 0.01 -0.13 -1.32 0.00 0.00 176.35 175.95 2fiy s ARG 252 N 0.58 0.33 -0.24 1.98 0.52 -0.83 -4.64 118.95 116.66 2fiy s ARG 252 Ca 0.05 0.13 -0.23 0.00 -0.52 0.00 0.00 55.73 55.15 2fiy s ARG 252 Cb -0.13 -0.61 -0.01 0.00 0.52 0.00 0.00 34.95 34.72 2fiy s ARG 252 CO 0.01 -0.20 0.77 0.00 0.02 0.00 0.00 175.30 175.90 2fiy s ALA 253 N 1.42 3.62 -0.22 2.13 0.00 0.17 -2.24 121.76 126.64 2fiy s ALA 253 Ca -0.04 -0.20 -0.29 0.00 0.00 0.00 0.00 51.96 51.43 2fiy s ALA 253 Cb -0.13 -3.20 -0.00 0.00 0.00 0.00 0.00 23.12 19.79 2fiy s ALA 253 CO -0.03 -0.85 1.21 -2.00 0.00 0.00 0.00 175.76 174.09 2fiy s GLU 254 N 2.64 4.16 0.11 0.00 2.12 -0.10 -1.30 118.70 126.33 2fiy s GLU 254 Ca 0.33 1.45 0.07 0.00 0.36 0.00 0.00 54.97 57.18 2fiy s GLU 254 Cb -0.15 -3.76 -0.04 0.00 0.26 0.00 0.00 34.13 30.44 2fiy s GLU 254 CO 0.08 -0.80 -0.07 0.95 -0.54 0.00 0.00 175.26 174.88 2fiy s THR 255 N 3.64 3.51 -0.08 -1.70 -4.23 0.65 -1.45 115.64 115.97 2fiy s THR 255 Ca 0.52 -1.26 -0.00 0.00 -1.18 0.00 0.00 61.69 59.77 2fiy s THR 255 Cb -0.18 -2.66 0.03 0.00 1.34 0.00 0.00 72.50 71.02 2fiy s THR 255 CO 0.15 0.08 -0.04 0.00 -0.54 0.00 0.00 174.62 174.27 2fiy n PRO 257 N 4.85 0.03 -0.02 0.00 -0.04 -1.26 -0.32 135.00 138.24 2fiy n PRO 257 Ca -0.12 0.11 -0.21 0.00 -0.04 0.00 0.00 63.50 63.25 2fiy n PRO 257 Cb 0.50 -1.54 -0.13 0.00 -0.04 0.00 0.00 33.50 32.29 2fiy n PRO 257 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2fiy h SER 258 N 0.00 0.26 0.22 3.54 0.02 -1.92 -3.34 113.55 112.33 2fiy h SER 258 Ca 0.00 -0.80 0.00 0.00 -0.84 0.00 0.00 61.79 60.15 2fiy h SER 258 Cb 0.43 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2fiy h SER 258 CO 0.00 1.52 -0.90 0.00 -1.14 0.00 0.00 176.83 176.31 2fiy n GLN 260 N -1.61 -5.52 -3.27 0.00 1.13 0.57 -4.88 117.38 103.79 2fiy n GLN 260 Ca 0.04 0.82 -0.25 0.00 -1.94 0.00 0.00 57.00 55.67 2fiy n GLN 260 Cb 0.36 -5.72 -0.01 0.00 0.11 0.00 0.00 30.24 24.98 2fiy n GLN 260 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2fiy s GLY 261 N -2.89 1.43 0.02 1.08 0.00 -1.03 -0.47 107.32 105.47 2fiy s GLY 261 Ca 0.41 -0.81 0.01 0.00 0.00 0.00 0.00 44.72 44.33 2fiy s GLY 261 CO 0.51 -0.73 -0.05 -2.52 0.00 0.00 0.00 173.10 170.31 2fiy s TYR 262 N -2.34 0.40 -0.09 1.90 -0.85 -0.83 -1.08 117.35 114.46 2fiy s TYR 262 Ca 0.41 -0.40 0.02 0.00 -0.52 0.00 0.00 57.07 56.59 2fiy s TYR 262 Cb -0.10 -0.26 0.01 0.00 0.38 0.00 0.00 41.96 42.00 2fiy s TYR 262 CO 0.36 -0.10 -0.14 -1.17 -1.52 0.00 0.00 175.55 172.98 2fiy s LEU 263 N -1.15 1.65 0.16 -3.49 2.96 -0.53 -4.31 118.68 113.97 2fiy s LEU 263 Ca -0.09 -0.37 -0.30 0.00 -0.22 0.00 0.00 54.13 53.15 2fiy s LEU 263 Cb -0.08 -0.97 -0.07 0.00 0.50 0.00 0.00 46.19 45.57 2fiy s LEU 263 CO -0.00 0.01 1.06 -0.54 -1.32 0.00 0.00 176.35 175.56 2fiy s LYS 264 N 0.92 4.63 0.00 1.98 1.02 -1.26 -0.93 119.74 126.10 2fiy s LYS 264 Ca -0.09 1.63 0.03 0.00 0.02 0.00 0.00 55.97 57.56 2fiy s LYS 264 Cb -0.15 -3.31 -0.01 0.00 -0.52 0.00 0.00 37.83 33.84 2fiy s LYS 264 CO 0.00 0.12 -0.09 -0.65 -0.92 0.00 0.00 175.35 173.81 2fiy s GLN 265 N -0.24 0.71 -0.13 1.68 -0.21 -0.95 -1.43 119.66 119.10 2fiy s GLN 265 Ca 0.49 -0.41 -0.01 0.00 0.02 0.00 0.00 55.36 55.44 2fiy s GLN 265 Cb -0.27 -0.67 -0.02 0.00 1.00 0.00 0.00 33.01 33.04 2fiy s GLN 265 CO 0.33 0.18 -0.09 -0.06 -2.12 0.00 0.00 175.29 173.53 2fiy s PHE 266 N -0.40 2.90 -0.46 0.91 0.08 -0.50 -1.97 117.98 118.54 2fiy s PHE 266 Ca 0.02 -0.39 -0.11 0.00 0.12 0.00 0.00 56.93 56.57 2fiy s PHE 266 Cb -0.05 -1.86 0.10 0.00 -0.57 0.00 0.00 43.02 40.65 2fiy s PHE 266 CO -0.00 -0.04 0.34 0.71 -0.10 0.00 0.00 175.22 176.13 2fiy s TYR 267 N 0.12 3.35 0.47 0.36 2.02 0.15 -1.09 117.35 122.73 2fiy s TYR 267 Ca -0.04 -1.57 0.20 0.00 -0.37 0.00 0.00 57.07 55.29 2fiy s TYR 267 Cb -0.14 -3.32 1.28 0.00 -0.40 0.00 0.00 41.96 39.37 2fiy s TYR 267 CO 0.04 -0.93 2.08 -0.07 -1.57 0.00 0.00 175.55 175.10 2fiy h LEU 268 N 8.53 0.00 -1.41 -1.29 4.07 -1.49 -1.55 115.31 122.17 2fiy h LEU 268 Ca -0.24 0.00 0.35 0.00 0.08 0.00 0.00 57.88 58.07 2fiy h LEU 268 Cb 1.08 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.72 2fiy h LEU 268 CO 0.85 0.11 0.76 -0.08 -1.08 0.00 0.00 178.44 179.01 2fiy h GLU 269 N 0.00 0.22 0.00 1.13 4.81 -1.93 -2.17 114.58 116.63 2fiy h GLU 269 Ca -0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2fiy h GLU 269 Cb 0.23 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2fiy h GLU 269 CO 0.01 0.15 -1.57 1.19 -0.73 0.00 0.00 179.01 178.07 2fiy n PHE 270 N -4.64 0.16 -3.17 0.92 3.72 -0.59 -4.80 117.46 109.05 2fiy n PHE 270 Ca 0.31 0.05 0.03 0.00 -0.05 0.00 0.00 57.45 57.78 2fiy n PHE 270 Cb 1.16 -0.46 -0.02 0.00 -0.94 0.00 0.00 39.48 39.22 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 -4.27 -1.24 0.59 4.37 -1.08 -0.84 -4.86 116.67 109.34 2fiy s ASP 271 Ca -0.03 0.69 0.31 0.00 -0.52 0.00 0.00 52.55 53.00 2fiy s ASP 271 Cb 0.14 2.03 1.84 0.00 -1.46 0.00 0.00 42.92 45.47 2fiy s ASP 271 CO 0.87 -0.27 2.25 0.08 0.52 0.00 0.00 175.17 178.62 2fiy h ARG 272 N 8.02 0.00 -0.30 4.34 0.11 -1.82 -1.91 114.38 122.82 2fiy h ARG 272 Ca -0.19 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.89 2fiy h ARG 272 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 2fiy h ARG 272 CO 0.24 0.02 0.00 0.72 0.10 0.00 0.00 179.97 181.05 2fiy n HIS 273 N -3.73 0.39 -1.71 4.08 8.25 -1.26 -4.97 115.22 116.26 2fiy n HIS 273 Ca -0.03 -0.19 -0.42 0.00 -0.26 0.00 0.00 57.72 56.82 2fiy n HIS 273 Cb 0.10 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.21 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 0.60 1.48 -3.64 -1.41 0.00 -0.72 -4.93 120.51 111.89 2fiy n ALA 274 Ca 0.15 0.32 -0.18 0.00 0.00 0.00 0.00 53.44 53.73 2fiy n ALA 274 Cb 0.36 -2.29 -0.16 0.00 0.00 0.00 0.00 19.45 17.36 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 -0.37 0.64 0.27 0.00 2.15 -1.26 -5.04 116.67 113.08 2fiy s ASP 275 Ca 0.57 -0.07 0.00 0.00 0.43 0.00 0.00 52.55 53.48 2fiy s ASP 275 Cb -0.53 -0.32 0.55 0.00 -0.30 0.00 0.00 42.92 42.32 2fiy s ASP 275 CO 0.61 -0.07 1.81 0.00 -0.17 0.00 0.00 175.17 177.35 2fiy h ALA 276 N 7.16 1.43 0.00 3.66 0.00 -1.94 -0.75 119.26 128.82 2fiy h ALA 276 Ca -0.41 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 2fiy h ALA 276 Cb 1.14 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 2fiy h ALA 276 CO 0.48 0.11 -0.03 1.25 0.00 0.00 0.00 179.25 181.06 2fiy h LEU 277 N 0.86 0.00 -0.05 0.00 6.46 -1.96 -3.17 115.31 117.45 2fiy h LEU 277 Ca 0.49 -0.68 0.00 0.00 -0.12 0.00 0.00 57.88 57.57 2fiy h LEU 277 Cb 0.55 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.48 2fiy h LEU 277 CO -0.29 0.86 0.01 0.00 -0.62 0.00 0.00 178.44 178.40 2fiy h ALA 278 N -0.32 0.05 0.00 1.25 0.00 -1.83 -1.65 119.26 116.77 2fiy h ALA 278 Ca -0.01 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2fiy h ALA 278 Cb 0.70 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2fiy h ALA 278 CO -0.00 -0.47 -0.48 -0.44 0.00 0.00 0.00 179.25 177.86 2fiy h ASP 279 N 0.04 0.00 0.39 0.00 3.32 -1.33 -1.62 116.42 117.22 2fiy h ASP 279 Ca 0.02 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 2fiy h ASP 279 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2fiy h ASP 279 CO -0.02 0.48 -0.19 -0.78 -1.72 0.00 0.00 179.24 177.01 2fiy h ASP 280 N 0.00 -0.44 0.53 6.45 3.58 -1.43 -2.86 116.42 122.25 2fiy h ASP 280 Ca -0.00 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.40 2fiy h ASP 280 Cb 0.87 0.11 -0.00 0.00 1.72 0.00 0.00 39.33 42.03 2fiy h ASP 280 CO 0.06 -0.28 -0.16 -0.07 -2.88 0.00 0.00 179.24 175.91 2fiy h LEU 281 N -0.57 0.00 -0.34 2.28 3.38 -1.09 -1.90 115.31 117.07 2fiy h LEU 281 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2fiy h LEU 281 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2fiy h LEU 281 CO 0.09 0.16 -0.05 0.00 0.09 0.00 0.00 178.44 178.73 2fiy n ALA 282 N -2.27 2.69 -2.12 1.53 0.00 -0.63 -4.15 120.51 115.56 2fiy n ALA 282 Ca -0.01 -0.29 -0.03 0.00 0.00 0.00 0.00 53.44 53.11 2fiy n ALA 282 Cb 0.30 -1.35 0.09 0.00 0.00 0.00 0.00 19.45 18.50 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 -0.69 2.33 0.21 0.00 3.41 -0.71 -4.81 113.62 113.35 2fiy n SER 283 Ca 0.18 -3.11 0.15 0.00 -0.26 0.00 0.00 58.87 55.84 2fiy n SER 283 Cb 0.25 -0.42 0.65 0.00 -0.26 0.00 0.00 64.21 64.43 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 1.57 0.00 -1.66 1.04 3.38 -1.72 -1.50 115.31 116.42 2fiy h LEU 284 Ca 0.02 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.02 2fiy h LEU 284 Cb 1.39 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.12 2fiy h LEU 284 CO 0.24 0.00 0.28 0.00 0.09 0.00 0.00 178.44 179.05 2fiy h ALA 285 N 2.11 1.83 -0.02 1.53 0.00 -1.93 -2.70 119.26 120.08 2fiy h ALA 285 Ca 0.00 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 2fiy h ALA 285 Cb 0.33 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2fiy h ALA 285 CO 0.00 0.12 -0.83 1.25 0.00 0.00 0.00 179.25 179.79 2fiy h LEU 286 N 0.45 0.34 -0.99 0.00 5.85 -1.67 -2.43 115.31 116.86 2fiy h LEU 286 Ca 0.17 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.67 2fiy h LEU 286 Cb 0.11 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 2fiy h LEU 286 CO -0.04 1.03 0.65 0.44 -0.34 0.00 0.00 178.44 180.18 2fiy h ASP 287 N 0.17 1.09 -0.17 1.25 3.32 -1.57 -1.22 116.42 119.29 2fiy h ASP 287 Ca -0.04 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.95 2fiy h ASP 287 Cb 1.43 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.73 2fiy h ASP 287 CO 0.13 0.74 -0.06 0.24 -1.72 0.00 0.00 179.24 178.58 2fiy h MET 288 N 1.26 0.34 -0.30 3.56 2.86 -1.31 -0.11 114.93 121.22 2fiy h MET 288 Ca 0.40 -0.14 0.03 0.00 -2.06 0.00 0.00 59.70 57.93 2fiy h MET 288 Cb 0.00 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 2fiy h MET 288 CO -0.12 0.63 0.10 -0.09 1.06 0.00 0.00 176.91 178.49 2fiy h ARG 289 N 0.03 0.23 -0.49 1.72 9.65 -1.33 0.99 114.38 125.18 2fiy h ARG 289 Ca 0.04 -0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 58.85 2fiy h ARG 289 Cb 0.52 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.03 2fiy h ARG 289 CO 0.02 0.15 0.07 -0.07 2.80 0.00 0.00 179.97 182.94 2fiy h LEU 290 N 0.23 0.79 -1.04 3.80 3.38 -1.20 -1.78 115.31 119.49 2fiy h LEU 290 Ca 0.13 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 2fiy h LEU 290 Cb 0.10 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2fiy h LEU 290 CO -0.14 0.86 -0.10 0.00 0.09 0.00 0.00 178.44 179.15 2fiy h ALA 291 N 0.96 1.20 0.00 1.53 0.00 -0.82 -1.88 119.26 120.25 2fiy h ALA 291 Ca 0.15 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2fiy h ALA 291 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2fiy h ALA 291 CO 0.01 0.51 -0.25 0.93 0.00 0.00 0.00 179.25 180.46 2fiy h GLU 292 N 0.53 0.00 -0.37 0.00 5.08 -0.52 -2.47 114.58 116.83 2fiy h GLU 292 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2fiy h GLU 292 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2fiy h GLU 292 CO 0.03 0.25 0.00 -0.25 -1.00 0.00 0.00 179.01 178.03 2fiy n ASP 293 N -3.76 1.93 0.00 1.42 8.00 -0.69 -4.93 116.55 118.52 2fiy n ASP 293 Ca -0.01 -2.02 0.00 0.00 0.71 0.00 0.00 54.79 53.47 2fiy n ASP 293 Cb 0.35 -0.25 0.00 0.00 -0.02 0.00 0.00 41.12 41.20 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 1.03 0.51 3.75 0.44 0.00 -0.93 -5.06 105.19 104.93 2fiy n GLY 294 Ca 0.12 -0.89 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.00 3.21 0.07 1.61 1.51 -0.77 -4.94 117.35 116.05 2fiy s TYR 295 Ca 0.00 0.16 0.10 0.00 -1.01 0.00 0.00 57.07 56.32 2fiy s TYR 295 Cb 0.00 -1.72 -0.03 0.00 -0.11 0.00 0.00 41.96 40.10 2fiy s TYR 295 CO 0.00 0.52 -0.26 -0.48 -1.11 0.00 0.00 175.55 174.22 2fiy s LEU 296 N -1.66 2.21 -0.13 -1.29 -0.00 0.39 -3.90 118.68 114.29 2fiy s LEU 296 Ca 0.22 -0.63 -0.18 0.00 -0.00 0.00 0.00 54.13 53.54 2fiy s LEU 296 Cb -0.12 -1.25 -0.04 0.00 -0.00 0.00 0.00 46.19 44.78 2fiy s LEU 296 CO 0.12 0.23 0.46 -0.60 -0.00 0.00 0.00 176.35 176.56 2fiy s ARG 297 N -1.47 4.31 -0.12 1.48 3.52 -1.26 -1.96 118.95 123.45 2fiy s ARG 297 Ca 0.12 0.39 0.17 0.00 -0.13 0.00 0.00 55.73 56.29 2fiy s ARG 297 Cb -0.10 -3.45 0.26 0.00 -1.56 0.00 0.00 34.95 30.10 2fiy s ARG 297 CO 0.03 0.13 1.13 0.54 -0.81 0.00 0.00 175.30 176.33 2fiy n ARG 298 N 3.79 1.23 -3.89 5.12 1.74 -1.26 -4.95 116.66 118.44 2fiy n ARG 298 Ca -0.07 -2.43 -0.34 0.00 -0.77 0.00 0.00 57.85 54.23 2fiy n ARG 298 Cb 0.51 -1.41 -0.13 0.00 -1.02 0.00 0.00 32.46 30.41 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 -2.69 5.03 0.52 0.55 1.04 -1.26 -4.82 113.70 112.07 2fiy s SER 299 Ca 0.29 -2.11 -0.18 0.00 0.48 0.00 0.00 55.95 54.43 2fiy s SER 299 Cb 0.25 -1.74 -0.07 0.00 0.10 0.00 0.00 66.02 64.56 2fiy s SER 299 CO 0.03 -0.47 1.02 -2.16 0.98 0.00 0.00 173.24 172.64 2fiy s PRO 300 N 1.01 3.74 -0.22 4.02 0.04 -1.21 -4.70 135.00 137.66 2fiy s PRO 300 Ca 0.10 1.17 -0.04 0.00 0.04 0.00 0.00 61.00 62.27 2fiy s PRO 300 Cb -0.21 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 2fiy s PRO 300 CO -0.06 -0.46 -0.04 1.21 0.04 0.00 0.00 177.00 177.69 2fiy s ASN 301 N -2.57 4.31 0.00 6.66 3.04 -1.26 -4.18 114.94 120.95 2fiy s ASN 301 Ca 0.63 -0.44 0.30 0.00 0.04 0.00 0.00 52.86 53.40 2fiy s ASN 301 Cb -0.13 -1.74 1.52 0.00 -1.54 0.00 0.00 41.25 39.35 2fiy s ASN 301 CO 0.28 -0.03 2.05 0.18 -3.04 0.00 0.00 177.10 176.53 2fiy n LEU 302 N 4.79 0.06 0.00 3.21 4.77 -1.26 -2.88 117.00 125.69 2fiy n LEU 302 Ca -0.18 0.23 0.11 0.00 -0.03 0.00 0.00 56.01 56.14 2fiy n LEU 302 Cb 0.50 -0.25 -0.04 0.00 -2.33 0.00 0.00 43.42 41.30 2fiy n LEU 302 CO 0.29 0.01 -0.05 0.18 -1.33 0.00 0.00 177.39 176.49 2fiy n LEU 303 N -1.23 0.73 -3.69 2.23 4.77 -1.26 -3.97 117.00 114.58 2fiy n LEU 303 Ca 0.15 -0.27 -0.25 0.00 -0.03 0.00 0.00 56.01 55.62 2fiy n LEU 303 Cb 0.24 -0.06 -0.17 0.00 -2.33 0.00 0.00 43.42 41.10 2fiy n LEU 303 CO 0.23 0.16 -0.35 -0.22 -1.33 0.00 0.00 177.39 175.88 2fiy s LEU 304 N -3.38 0.56 0.28 2.23 0.20 -1.14 -3.35 118.68 114.08 2fiy s LEU 304 Ca 0.06 -0.41 -0.29 0.00 0.69 0.00 0.00 54.13 54.17 2fiy s LEU 304 Cb 0.16 -0.35 -0.10 0.00 -0.43 0.00 0.00 46.19 45.47 2fiy s LEU 304 CO 0.84 -0.29 1.26 0.00 -0.29 0.00 0.00 176.35 177.87 2fiy s ALA 305 N 2.04 3.49 0.02 5.97 0.00 -1.26 -4.59 121.76 127.42 2fiy s ALA 305 Ca 0.03 1.13 -0.29 0.00 0.00 0.00 0.00 51.96 52.82 2fiy s ALA 305 Cb -0.15 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 2fiy s ALA 305 CO -0.07 -0.50 0.95 -1.25 0.00 0.00 0.00 175.76 174.90 2fiy s PRO 306 N -1.21 4.58 -0.23 0.00 0.04 -1.26 -2.18 135.00 134.74 2fiy s PRO 306 Ca 0.50 1.38 0.02 0.00 0.04 0.00 0.00 61.00 62.94 2fiy s PRO 306 Cb -0.37 -3.44 0.04 0.00 0.04 0.00 0.00 34.50 30.77 2fiy s PRO 306 CO 0.46 0.02 -0.15 0.20 0.04 0.00 0.00 177.00 177.57 2fiy s GLY 307 N 0.77 1.55 0.00 0.56 0.00 -1.26 -5.08 107.32 103.85 2fiy s GLY 307 Ca 0.50 -1.53 0.00 0.00 0.00 0.00 0.00 44.72 43.69 2fiy s GLY 307 CO 0.28 0.47 0.00 0.61 0.00 0.00 0.00 173.10 174.45