#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fy2 n GLU 9 N 0.00 0.56 -2.72 4.33 1.02 -1.26 -4.85 120.64 117.72 2fy2 n GLU 9 Ca 0.00 0.02 -0.40 0.00 -0.02 0.00 0.00 57.16 56.75 2fy2 n GLU 9 Cb 0.00 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 29.86 2fy2 n GLU 9 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2fy2 s GLU 10 N -2.09 4.81 0.22 3.49 2.02 -1.26 -4.98 118.70 120.92 2fy2 s GLU 10 Ca 0.28 1.51 -0.31 0.00 0.02 0.00 0.00 54.97 56.47 2fy2 s GLU 10 Cb 0.13 -3.29 -0.11 0.00 0.10 0.00 0.00 34.13 30.97 2fy2 s GLU 10 CO 0.24 0.44 1.55 0.45 0.02 0.00 0.00 175.26 177.96 2fy2 s SER 11 N -0.94 6.53 0.00 -0.19 0.15 -1.26 -4.89 113.70 113.10 2fy2 s SER 11 Ca 0.42 2.74 0.21 0.00 0.70 0.00 0.00 55.95 60.03 2fy2 s SER 11 Cb -0.26 -2.61 0.87 0.00 -1.71 0.00 0.00 66.02 62.31 2fy2 s SER 11 CO 0.32 -0.83 1.61 0.61 1.20 0.00 0.00 173.24 176.16 2fy2 n GLY 12 N 2.96 0.00 3.81 9.45 0.00 -1.26 -4.91 105.19 115.24 2fy2 n GLY 12 Ca 0.11 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 2fy2 n GLY 12 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fy2 s LEU 13 N -1.62 3.16 0.54 0.99 1.43 -1.26 -5.04 118.68 116.88 2fy2 s LEU 13 Ca 0.32 1.66 -0.14 0.00 -1.03 0.00 0.00 54.13 54.94 2fy2 s LEU 13 Cb 0.17 -4.50 -0.06 0.00 0.03 0.00 0.00 46.19 41.82 2fy2 s LEU 13 CO 0.26 -1.47 0.99 -2.16 0.23 0.00 0.00 176.35 174.20 2fy2 s PRO 14 N -4.92 3.82 0.39 1.29 0.04 -1.26 -4.77 135.00 129.59 2fy2 s PRO 14 Ca 0.59 0.85 -0.17 0.00 0.04 0.00 0.00 61.00 62.31 2fy2 s PRO 14 Cb -0.15 -2.13 -0.10 0.00 0.04 0.00 0.00 34.50 32.17 2fy2 s PRO 14 CO 0.53 -0.36 0.84 0.15 0.04 0.00 0.00 177.00 178.21 2fy2 s LYS 15 N -4.43 4.07 0.00 4.56 1.02 -1.26 -1.76 119.74 121.94 2fy2 s LYS 15 Ca 0.57 0.86 -0.33 0.00 0.02 0.00 0.00 55.97 57.08 2fy2 s LYS 15 Cb -0.10 -2.30 -0.12 0.00 -0.52 0.00 0.00 37.83 34.78 2fy2 s LYS 15 CO 0.39 0.03 1.82 -0.11 -0.92 0.00 0.00 175.35 176.56 2fy2 n LEU 16 N -0.64 3.49 -4.77 3.17 7.94 -1.26 -4.89 117.00 120.05 2fy2 n LEU 16 Ca 0.05 0.99 -0.41 0.00 -1.11 0.00 0.00 56.01 55.54 2fy2 n LEU 16 Cb 0.54 -1.41 -0.03 0.00 0.53 0.00 0.00 43.42 43.05 2fy2 n LEU 16 CO 0.40 -0.06 0.95 -2.16 -1.11 0.00 0.00 177.39 175.41 2fy2 s PRO 17 N 3.25 4.41 -0.35 1.96 0.04 -1.26 -4.86 135.00 138.18 2fy2 s PRO 17 Ca 0.88 2.14 -0.16 0.00 0.04 0.00 0.00 61.00 63.90 2fy2 s PRO 17 Cb -0.65 -3.10 -0.01 0.00 0.04 0.00 0.00 34.50 30.79 2fy2 s PRO 17 CO 0.46 -0.13 0.40 0.08 0.04 0.00 0.00 177.00 177.86 2fy2 s VAL 18 N -1.05 5.13 0.69 -0.36 1.01 -1.26 -4.86 120.40 119.69 2fy2 s VAL 18 Ca 0.49 0.04 -0.15 0.00 0.00 0.00 0.00 61.98 62.36 2fy2 s VAL 18 Cb -0.38 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.14 2fy2 s VAL 18 CO 0.50 -0.16 1.15 -2.16 0.00 0.00 0.00 175.10 174.43 2fy2 s PRO 19 N 2.10 2.48 0.28 2.72 0.04 -1.26 -4.94 135.00 136.42 2fy2 s PRO 19 Ca 0.13 1.57 -0.29 0.00 0.04 0.00 0.00 61.00 62.44 2fy2 s PRO 19 Cb -0.16 -1.90 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 2fy2 s PRO 19 CO 0.12 -1.53 1.41 -1.25 0.04 0.00 0.00 177.00 175.79 2fy2 s PRO 20 N -4.00 4.28 0.16 0.56 0.04 -1.26 -4.91 135.00 129.88 2fy2 s PRO 20 Ca 0.70 2.30 -0.20 0.00 0.04 0.00 0.00 61.00 63.85 2fy2 s PRO 20 Cb -0.24 -3.09 0.08 0.00 0.04 0.00 0.00 34.50 31.28 2fy2 s PRO 20 CO 0.43 -0.36 1.64 1.25 0.04 0.00 0.00 177.00 179.99 2fy2 h LEU 21 N 4.42 -0.65 -1.67 -3.56 5.85 -1.98 -0.92 115.31 116.79 2fy2 h LEU 21 Ca -0.47 0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 2fy2 h LEU 21 Cb 1.22 0.34 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 2fy2 h LEU 21 CO 0.73 -0.23 -0.10 1.56 -0.34 0.00 0.00 178.44 180.07 2fy2 h GLN 22 N -0.14 0.08 -0.33 1.25 1.08 -1.94 -2.18 115.11 112.93 2fy2 h GLN 22 Ca 0.18 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.33 2fy2 h GLN 22 Cb 0.41 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.82 2fy2 h GLN 22 CO -0.44 0.19 0.07 0.37 -0.95 0.00 0.00 178.83 178.06 2fy2 h GLN 23 N 0.08 0.53 -0.37 1.46 4.15 -1.55 -1.85 115.11 117.56 2fy2 h GLN 23 Ca 0.02 -0.14 -0.07 0.00 0.77 0.00 0.00 58.65 59.23 2fy2 h GLN 23 Cb 0.23 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 2fy2 h GLN 23 CO 0.01 0.61 -0.04 1.15 -1.93 0.00 0.00 178.83 178.63 2fy2 h THR 24 N 0.37 1.27 -0.65 2.39 2.02 -1.12 -2.11 112.91 115.08 2fy2 h THR 24 Ca 0.10 -1.08 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 2fy2 h THR 24 Cb 0.32 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 2fy2 h THR 24 CO 0.00 0.36 0.35 -0.07 0.37 0.00 0.00 175.52 176.53 2fy2 h LEU 25 N 0.48 0.82 -0.24 2.58 3.38 -1.35 0.97 115.31 121.96 2fy2 h LEU 25 Ca 0.10 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2fy2 h LEU 25 Cb 0.53 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2fy2 h LEU 25 CO 0.03 0.69 0.02 0.00 0.09 0.00 0.00 178.44 179.27 2fy2 h ALA 26 N 1.17 0.32 -0.62 1.53 0.00 -1.29 -2.16 119.26 118.20 2fy2 h ALA 26 Ca 0.23 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2fy2 h ALA 26 Cb 0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2fy2 h ALA 26 CO -0.03 0.02 0.40 1.15 0.00 0.00 0.00 179.25 180.79 2fy2 h THR 27 N 0.19 1.13 -0.09 0.00 2.02 -1.19 -1.08 112.91 113.90 2fy2 h THR 27 Ca 0.07 -0.28 0.04 0.00 0.77 0.00 0.00 66.41 67.01 2fy2 h THR 27 Cb 0.37 0.25 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 2fy2 h THR 27 CO 0.01 0.15 -0.19 0.22 0.37 0.00 0.00 175.52 176.08 2fy2 h TYR 28 N 0.82 -0.49 -0.72 3.16 3.20 -0.64 0.37 116.97 122.66 2fy2 h TYR 28 Ca 0.24 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.11 2fy2 h TYR 28 Cb -0.06 0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 2fy2 h TYR 28 CO -0.04 -0.27 0.39 -0.07 -1.64 0.00 0.00 178.16 176.54 2fy2 h LEU 29 N -0.26 0.91 -1.33 2.82 3.38 -1.20 -1.89 115.31 117.74 2fy2 h LEU 29 Ca 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2fy2 h LEU 29 Cb 0.38 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2fy2 h LEU 29 CO -0.24 0.75 0.40 -0.61 0.09 0.00 0.00 178.44 178.83 2fy2 h GLN 30 N 1.00 0.85 -0.28 1.13 -0.00 -0.53 -0.42 115.11 116.86 2fy2 h GLN 30 Ca 0.25 -0.06 -0.14 0.00 -0.00 0.00 0.00 58.65 58.70 2fy2 h GLN 30 Cb 0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 27.48 27.33 2fy2 h GLN 30 CO -0.04 0.58 -0.41 0.00 0.00 0.00 0.00 178.83 178.96 2fy2 n MET 32 N -4.03 0.55 -0.34 0.00 2.81 -0.78 -4.60 117.12 110.73 2fy2 n MET 32 Ca -0.02 -0.05 -0.02 0.00 -1.81 0.00 0.00 57.70 55.80 2fy2 n MET 32 Cb 0.54 -1.63 0.04 0.00 -0.71 0.00 0.00 33.22 31.45 2fy2 n MET 32 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2fy2 h ARG 33 N 0.00 -0.04 -0.03 0.03 2.43 -1.21 0.29 114.38 115.86 2fy2 h ARG 33 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2fy2 h ARG 33 Cb 0.93 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 2fy2 h ARG 33 CO 0.00 -0.03 0.00 -2.39 -1.51 0.00 0.00 179.97 176.04 2fy2 n HIS 34 N -5.47 0.04 0.47 2.20 1.44 -1.26 -3.56 115.22 109.08 2fy2 n HIS 34 Ca 0.09 -0.02 0.07 0.00 -2.01 0.00 0.00 57.72 55.85 2fy2 n HIS 34 Cb 0.39 0.00 0.08 0.00 0.12 0.00 0.00 29.99 30.58 2fy2 n HIS 34 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2fy2 n LEU 35 N -0.60 2.29 -4.18 2.39 4.77 0.10 -4.96 117.00 116.81 2fy2 n LEU 35 Ca 0.15 -1.14 -0.11 0.00 -0.03 0.00 0.00 56.01 54.89 2fy2 n LEU 35 Cb 0.12 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.07 2fy2 n LEU 35 CO 0.12 0.45 -0.28 0.68 -1.33 0.00 0.00 177.39 177.03 2fy2 s VAL 36 N -1.13 0.14 0.99 4.08 -7.23 -1.12 -5.03 120.40 111.09 2fy2 s VAL 36 Ca 0.18 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.29 2fy2 s VAL 36 Cb 0.12 -2.22 0.19 0.00 0.56 0.00 0.00 36.38 35.03 2fy2 s VAL 36 CO 0.18 -0.30 1.10 -0.94 -0.31 0.00 0.00 175.10 174.83 2fy2 s SER 37 N -3.11 2.39 0.12 4.85 1.04 -1.26 -4.76 113.70 112.98 2fy2 s SER 37 Ca 0.29 1.92 -0.15 0.00 0.48 0.00 0.00 55.95 58.49 2fy2 s SER 37 Cb 0.07 -2.46 -0.03 0.00 0.10 0.00 0.00 66.02 63.70 2fy2 s SER 37 CO 0.06 -3.39 1.55 -0.33 0.98 0.00 0.00 173.24 172.11 2fy2 h GLU 38 N -2.06 0.70 -0.22 4.02 5.08 -1.99 0.67 114.58 120.78 2fy2 h GLU 38 Ca -0.49 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 57.63 2fy2 h GLU 38 Cb 1.29 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 2fy2 h GLU 38 CO 0.46 0.81 0.13 1.49 -1.00 0.00 0.00 179.01 180.89 2fy2 h GLU 39 N 0.52 0.30 -0.71 2.33 4.81 -1.99 0.06 114.58 119.90 2fy2 h GLU 39 Ca 0.11 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 2fy2 h GLU 39 Cb 0.51 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 2fy2 h GLU 39 CO 0.03 0.27 0.22 0.37 -0.73 0.00 0.00 179.01 179.16 2fy2 h GLN 40 N 0.26 1.10 -0.40 1.92 4.15 -1.89 -2.11 115.11 118.14 2fy2 h GLN 40 Ca 0.08 -0.23 -0.02 0.00 0.77 0.00 0.00 58.65 59.25 2fy2 h GLN 40 Cb 0.05 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.56 2fy2 h GLN 40 CO -0.01 0.94 0.18 0.35 -1.93 0.00 0.00 178.83 178.36 2fy2 h PHE 41 N 1.06 0.60 -1.00 3.99 3.57 -0.54 -0.13 116.94 124.49 2fy2 h PHE 41 Ca 0.23 -0.04 0.10 0.00 3.53 0.00 0.00 57.97 61.79 2fy2 h PHE 41 Cb 0.30 -0.18 -0.08 0.00 2.79 0.00 0.00 35.95 38.79 2fy2 h PHE 41 CO 0.02 0.51 0.64 0.00 -2.23 0.00 0.00 178.31 177.25 2fy2 h ARG 42 N 0.51 1.03 -0.41 1.11 3.08 -0.66 0.20 114.38 119.24 2fy2 h ARG 42 Ca 0.14 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 59.97 2fy2 h ARG 42 Cb 0.15 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2fy2 h ARG 42 CO -0.02 0.68 -0.34 0.87 -1.07 0.00 0.00 179.97 180.09 2fy2 h LYS 43 N 1.06 0.95 -0.20 0.04 1.57 -0.76 -2.82 116.57 116.42 2fy2 h LYS 43 Ca 0.47 -0.48 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 2fy2 h LYS 43 Cb 0.36 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2fy2 h LYS 43 CO -0.22 1.14 -0.30 0.77 -0.57 0.00 0.00 179.45 180.27 2fy2 h SER 44 N 0.78 0.39 -0.41 0.86 0.02 -0.03 -1.13 113.55 114.03 2fy2 h SER 44 Ca 0.07 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2fy2 h SER 44 Cb 0.94 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.35 2fy2 h SER 44 CO 0.09 0.69 0.26 1.56 -1.14 0.00 0.00 176.83 178.29 2fy2 h GLN 45 N 0.34 0.55 -0.44 3.45 4.20 -0.49 0.43 115.11 123.15 2fy2 h GLN 45 Ca 0.05 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.62 2fy2 h GLN 45 Cb 0.71 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 2fy2 h GLN 45 CO 0.05 0.38 -0.12 0.00 -0.67 0.00 0.00 178.83 178.48 2fy2 h ALA 46 N 1.14 0.61 -0.23 3.87 0.00 -1.25 0.06 119.26 123.45 2fy2 h ALA 46 Ca 0.15 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2fy2 h ALA 46 Cb -0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2fy2 h ALA 46 CO -0.03 0.50 0.15 0.82 0.00 0.00 0.00 179.25 180.69 2fy2 h ILE 47 N 0.69 1.07 -0.54 0.00 2.04 -0.93 -0.72 117.51 119.12 2fy2 h ILE 47 Ca 0.11 -0.14 -0.11 0.00 1.00 0.00 0.00 64.86 65.71 2fy2 h ILE 47 Cb 0.66 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 2fy2 h ILE 47 CO 0.05 0.07 -0.10 0.58 0.00 0.00 0.00 178.15 178.74 2fy2 h VAL 48 N 0.31 1.27 -0.21 1.67 2.07 -0.85 -0.56 116.25 119.94 2fy2 h VAL 48 Ca 0.09 -1.26 0.03 0.00 0.82 0.00 0.00 66.70 66.38 2fy2 h VAL 48 Cb -0.02 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 2fy2 h VAL 48 CO -0.02 0.44 0.01 -0.61 0.02 0.00 0.00 177.57 177.42 2fy2 h GLN 49 N 0.91 0.08 -0.54 1.57 5.75 -0.72 -0.59 115.11 121.57 2fy2 h GLN 49 Ca 0.14 -0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.53 2fy2 h GLN 49 Cb 0.67 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.18 2fy2 h GLN 49 CO 0.05 0.05 -0.07 0.37 -2.65 0.00 0.00 178.83 176.58 2fy2 h GLN 50 N 0.08 0.99 -0.64 1.69 4.15 -0.94 -2.49 115.11 117.95 2fy2 h GLN 50 Ca 0.10 -0.34 -0.06 0.00 0.77 0.00 0.00 58.65 59.12 2fy2 h GLN 50 Cb 0.11 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.70 2fy2 h GLN 50 CO -0.15 1.02 0.18 0.35 -1.93 0.00 0.00 178.83 178.29 2fy2 h PHE 51 N 0.89 1.04 -0.54 3.99 3.57 -0.71 -3.16 116.94 122.01 2fy2 h PHE 51 Ca 0.15 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2fy2 h PHE 51 Cb 0.62 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.06 2fy2 h PHE 51 CO 0.04 0.84 0.00 0.41 -2.23 0.00 0.00 178.31 177.37 2fy2 n GLY 52 N -0.79 3.09 3.79 2.40 0.00 -0.26 -0.45 105.19 112.97 2fy2 n GLY 52 Ca 0.05 -0.91 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 2fy2 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fy2 s ALA 53 N -2.47 2.74 0.04 4.61 0.00 -0.94 -4.86 121.76 120.87 2fy2 s ALA 53 Ca 0.51 0.58 -0.36 0.00 0.00 0.00 0.00 51.96 52.69 2fy2 s ALA 53 Cb 0.37 -3.28 -0.15 0.00 0.00 0.00 0.00 23.12 20.06 2fy2 s ALA 53 CO 0.17 -0.70 1.51 -2.30 0.00 0.00 0.00 175.76 174.44 2fy2 n PRO 54 N -1.57 1.51 -1.14 0.00 -0.02 -1.26 -0.01 135.00 132.51 2fy2 n PRO 54 Ca 0.10 0.55 -0.05 0.00 -2.02 0.00 0.00 63.50 62.08 2fy2 n PRO 54 Cb 0.52 -2.25 -0.02 0.00 -0.02 0.00 0.00 33.50 31.73 2fy2 n PRO 54 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fy2 n GLY 55 N 3.16 0.73 2.61 -1.23 0.00 -1.26 -5.01 105.19 104.19 2fy2 n GLY 55 Ca 0.19 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.59 2fy2 n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fy2 n GLY 56 N -1.92 0.68 0.35 -0.02 0.00 0.99 -4.97 105.19 100.30 2fy2 n GLY 56 Ca -0.05 -2.01 -0.05 0.00 0.00 0.00 0.00 46.02 43.92 2fy2 n GLY 56 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2fy2 h LEU 57 N 0.00 1.10 -0.19 0.99 5.85 -1.83 -2.77 115.31 118.46 2fy2 h LEU 57 Ca -0.22 -0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.40 2fy2 h LEU 57 Cb 0.82 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 2fy2 h LEU 57 CO 0.24 0.94 -0.14 1.23 -0.34 0.00 0.00 178.44 180.37 2fy2 h GLY 58 N 1.19 -0.01 1.79 3.75 0.00 -1.08 0.75 103.07 109.46 2fy2 h GLY 58 Ca 0.28 0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.74 2fy2 h GLY 58 CO -0.03 -0.15 -0.10 0.83 0.00 0.00 0.00 176.54 177.09 2fy2 h GLU 59 N -0.14 0.26 -0.23 4.80 5.08 -1.75 0.61 114.58 123.21 2fy2 h GLU 59 Ca 0.11 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2fy2 h GLU 59 Cb 0.31 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2fy2 h GLU 59 CO -0.28 0.38 0.03 1.15 -1.00 0.00 0.00 179.01 179.29 2fy2 h THR 60 N 0.25 1.23 -0.48 1.13 2.02 -1.00 -1.50 112.91 114.56 2fy2 h THR 60 Ca 0.05 -0.79 -0.08 0.00 0.77 0.00 0.00 66.41 66.36 2fy2 h THR 60 Cb 0.35 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 2fy2 h THR 60 CO 0.02 0.25 -0.04 -0.07 0.37 0.00 0.00 175.52 176.05 2fy2 h LEU 61 N 0.18 0.80 -1.24 2.58 3.38 -0.42 -2.60 115.31 118.00 2fy2 h LEU 61 Ca 0.07 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2fy2 h LEU 61 Cb 0.34 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2fy2 h LEU 61 CO 0.01 0.89 0.47 -0.61 0.09 0.00 0.00 178.44 179.28 2fy2 h GLN 62 N 0.76 0.98 -0.47 1.13 5.75 -0.63 -0.49 115.11 122.14 2fy2 h GLN 62 Ca 0.14 -0.07 -0.12 0.00 -0.15 0.00 0.00 58.65 58.45 2fy2 h GLN 62 Cb 0.51 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.83 2fy2 h GLN 62 CO 0.03 0.67 -0.20 1.96 -2.65 0.00 0.00 178.83 178.64 2fy2 h GLN 63 N 1.00 0.94 -0.16 1.69 1.08 -0.91 -1.32 115.11 117.43 2fy2 h GLN 63 Ca 0.27 -0.38 -0.10 0.00 -1.45 0.00 0.00 58.65 56.98 2fy2 h GLN 63 Cb -0.08 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 2fy2 h GLN 63 CO -0.05 1.04 -0.36 0.87 -0.95 0.00 0.00 178.83 179.38 2fy2 h LYS 64 N 0.81 0.33 -0.39 1.46 1.57 -1.09 -0.93 116.57 118.33 2fy2 h LYS 64 Ca 0.11 -0.15 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 2fy2 h LYS 64 Cb 0.75 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 2fy2 h LYS 64 CO 0.06 0.65 -0.15 1.25 -0.57 0.00 0.00 179.45 180.69 2fy2 h LEU 65 N 0.28 0.82 -0.83 2.94 5.85 -0.87 0.26 115.31 123.75 2fy2 h LEU 65 Ca 0.03 -0.39 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 2fy2 h LEU 65 Cb 0.77 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 2fy2 h LEU 65 CO 0.06 1.02 0.36 -0.07 -0.34 0.00 0.00 178.44 179.47 2fy2 h LEU 66 N 0.61 1.11 -0.51 2.25 3.38 -0.97 0.44 115.31 121.61 2fy2 h LEU 66 Ca 0.09 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 2fy2 h LEU 66 Cb 0.69 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2fy2 h LEU 66 CO 0.05 0.96 0.11 -0.33 0.09 0.00 0.00 178.44 179.32 2fy2 h GLU 67 N 1.19 0.84 -0.77 1.13 5.08 -0.85 -2.28 114.58 118.92 2fy2 h GLU 67 Ca 0.28 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 2fy2 h GLU 67 Cb 0.18 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 2fy2 h GLU 67 CO -0.03 0.81 0.32 -0.09 -1.00 0.00 0.00 179.01 179.02 2fy2 h ARG 68 N 0.72 1.14 -0.77 2.33 2.43 0.32 -1.66 114.38 118.89 2fy2 h ARG 68 Ca 0.16 -0.19 0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2fy2 h ARG 68 Cb 0.37 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 29.68 2fy2 h ARG 68 CO 0.01 0.91 0.48 0.37 -1.51 0.00 0.00 179.97 180.23 2fy2 h GLN 69 N 1.11 0.90 -0.27 0.20 4.15 0.24 -0.94 115.11 120.51 2fy2 h GLN 69 Ca 0.26 -0.05 -0.07 0.00 0.77 0.00 0.00 58.65 59.55 2fy2 h GLN 69 Cb 0.19 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 2fy2 h GLN 69 CO -0.02 0.60 -0.11 1.49 -1.93 0.00 0.00 178.83 178.86 2fy2 h GLU 70 N 0.93 0.54 0.00 1.69 4.81 -0.97 -3.21 114.58 118.38 2fy2 h GLU 70 Ca 0.31 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2fy2 h GLU 70 Cb 0.05 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.41 2fy2 h GLU 70 CO -0.12 0.78 0.00 1.63 -0.73 0.00 0.00 179.01 180.57 2fy2 n LYS 71 N -4.48 0.14 -4.44 1.92 5.02 -0.66 -4.85 118.16 110.81 2fy2 n LYS 71 Ca -0.04 0.23 -0.22 0.00 -2.02 0.00 0.00 58.31 56.27 2fy2 n LYS 71 Cb 0.34 -1.70 -0.10 0.00 -0.02 0.00 0.00 35.03 33.54 2fy2 n LYS 71 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2fy2 s THR 72 N -3.12 1.93 0.14 -0.18 -4.23 -0.38 -5.03 115.64 104.76 2fy2 s THR 72 Ca 0.09 -2.21 -0.07 0.00 -1.18 0.00 0.00 61.69 58.31 2fy2 s THR 72 Cb 0.12 -2.36 -0.14 0.00 1.34 0.00 0.00 72.50 71.46 2fy2 s THR 72 CO 0.47 -0.37 1.36 0.00 -0.54 0.00 0.00 174.62 175.53 2fy2 h ALA 73 N 2.30 0.43 -2.65 3.99 0.00 -1.88 -3.43 119.26 118.02 2fy2 h ALA 73 Ca -0.40 -0.62 -0.32 0.00 0.00 0.00 0.00 54.91 53.58 2fy2 h ALA 73 Cb 1.24 -0.03 -0.36 0.00 0.00 0.00 0.00 17.79 18.64 2fy2 h ALA 73 CO 0.65 0.73 -0.63 1.21 0.00 0.00 0.00 179.25 181.21 2fy2 s ASN 74 N -7.06 1.29 0.52 0.00 3.84 -1.26 -4.44 114.94 107.84 2fy2 s ASN 74 Ca -0.08 -0.12 0.35 0.00 0.21 0.00 0.00 52.86 53.22 2fy2 s ASN 74 Cb 0.09 0.35 1.80 0.00 -0.55 0.00 0.00 41.25 42.94 2fy2 s ASN 74 CO 0.87 -0.31 2.06 4.11 -2.79 0.00 0.00 177.10 181.05 2fy2 h TRP 75 N 8.32 0.00 0.00 0.43 5.08 -1.83 -3.08 115.95 124.87 2fy2 h TRP 75 Ca -0.16 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.81 2fy2 h TRP 75 Cb 1.15 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.31 2fy2 h TRP 75 CO 0.19 0.00 -0.81 1.55 -1.28 0.00 0.00 178.44 178.09 2fy2 n VAL 76 N -2.79 0.00 -0.31 0.12 3.14 -1.26 -4.73 118.33 112.50 2fy2 n VAL 76 Ca -0.02 -0.22 -0.03 0.00 -2.96 0.00 0.00 64.34 61.11 2fy2 n VAL 76 Cb 0.11 0.84 0.02 0.00 -1.06 0.00 0.00 33.84 33.75 2fy2 n VAL 76 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2fy2 h SER 77 N 0.00 -1.38 0.10 6.55 0.02 -1.90 0.33 113.55 117.27 2fy2 h SER 77 Ca 0.00 0.28 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2fy2 h SER 77 Cb 0.37 0.70 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2fy2 h SER 77 CO 0.00 -0.30 -0.05 -0.08 -1.14 0.00 0.00 176.83 175.27 2fy2 h GLU 78 N -0.07 -0.13 -0.25 3.45 4.81 -1.85 -1.72 114.58 118.83 2fy2 h GLU 78 Ca 0.29 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.57 2fy2 h GLU 78 Cb 0.57 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.94 2fy2 h GLU 78 CO -0.86 0.16 0.01 1.88 -0.73 0.00 0.00 179.01 179.46 2fy2 h TYR 79 N -0.42 0.00 0.06 0.92 0.99 -1.72 -2.45 116.97 114.35 2fy2 h TYR 79 Ca -0.01 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2fy2 h TYR 79 Cb 0.35 0.04 0.00 0.00 1.00 0.00 0.00 36.73 38.12 2fy2 h TYR 79 CO 0.02 -0.03 -0.03 2.35 -0.00 0.00 0.00 178.16 180.47 2fy2 h TRP 80 N 0.09 -0.07 -0.82 4.88 7.01 -0.39 0.92 115.95 127.57 2fy2 h TRP 80 Ca 0.12 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.23 2fy2 h TRP 80 Cb 0.14 0.02 -0.08 0.00 -2.10 0.00 0.00 29.16 27.15 2fy2 h TRP 80 CO -0.19 0.02 0.44 1.25 -2.79 0.00 0.00 178.44 177.17 2fy2 h LEU 81 N -0.15 0.58 0.04 0.65 5.85 -1.22 0.23 115.31 121.30 2fy2 h LEU 81 Ca -0.01 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 2fy2 h LEU 81 Cb 0.12 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.12 2fy2 h LEU 81 CO 0.01 0.30 -0.02 0.78 -0.34 0.00 0.00 178.44 179.18 2fy2 h ASN 82 N 0.70 -0.04 -0.81 1.25 2.35 -1.26 -2.25 115.58 115.52 2fy2 h ASN 82 Ca 0.42 -0.63 -0.00 0.00 -0.55 0.00 0.00 56.30 55.54 2fy2 h ASN 82 Cb 0.48 0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.82 2fy2 h ASN 82 CO -0.30 0.64 0.50 -0.78 -1.65 0.00 0.00 177.43 175.84 2fy2 h ASP 83 N -0.76 0.96 0.09 5.81 3.58 -0.55 -0.32 116.42 125.23 2fy2 h ASP 83 Ca -0.00 -0.06 -0.27 0.00 0.42 0.00 0.00 57.03 57.12 2fy2 h ASP 83 Cb 0.66 -0.24 0.03 0.00 1.72 0.00 0.00 39.33 41.50 2fy2 h ASP 83 CO 0.01 0.73 -1.12 -0.03 -2.88 0.00 0.00 179.24 175.95 2fy2 h MET 84 N 1.10 0.60 0.00 0.28 4.05 -0.67 -3.44 114.93 116.86 2fy2 h MET 84 Ca 0.29 -0.76 0.00 0.00 -0.28 0.00 0.00 59.70 58.95 2fy2 h MET 84 Cb -0.06 0.24 0.00 0.00 -0.80 0.00 0.00 31.60 30.98 2fy2 h MET 84 CO -0.06 1.34 0.00 0.66 0.23 0.00 0.00 176.91 179.08 2fy2 n TYR 85 N -3.87 -0.85 -0.19 1.39 4.02 -0.90 -4.78 117.16 111.97 2fy2 n TYR 85 Ca -0.13 0.15 0.25 0.00 -0.01 0.00 0.00 57.90 58.16 2fy2 n TYR 85 Cb 0.92 0.24 0.65 0.00 -0.02 0.00 0.00 39.34 41.14 2fy2 n TYR 85 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 2fy2 h LEU 86 N 0.00 0.13 0.00 7.72 3.38 -1.42 -0.51 115.31 124.61 2fy2 h LEU 86 Ca 0.00 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 2fy2 h LEU 86 Cb 0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2fy2 h LEU 86 CO 0.00 0.05 -0.45 0.78 0.09 0.00 0.00 178.44 178.91 2fy2 h ASN 87 N 0.13 0.00 -2.56 -0.43 2.35 -1.31 0.47 115.58 114.24 2fy2 h ASN 87 Ca 0.43 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.66 2fy2 h ASN 87 Cb 1.50 0.00 0.05 0.00 0.05 0.00 0.00 38.32 39.92 2fy2 h ASN 87 CO -0.07 0.30 1.09 0.21 -1.65 0.00 0.00 177.43 177.31 2fy2 s ASN 88 N -6.23 6.40 0.17 5.81 3.84 -0.20 -4.86 114.94 119.88 2fy2 s ASN 88 Ca 0.04 2.81 0.23 0.00 0.21 0.00 0.00 52.86 56.15 2fy2 s ASN 88 Cb 0.07 -2.58 0.17 0.00 -0.55 0.00 0.00 41.25 38.37 2fy2 s ASN 88 CO 0.73 -1.00 1.20 0.03 -2.79 0.00 0.00 177.10 175.26 2fy2 h ARG 89 N 8.10 0.00 -6.99 0.43 2.47 -1.88 -3.45 114.38 113.05 2fy2 h ARG 89 Ca -0.45 0.00 -0.56 0.00 -1.26 0.00 0.00 59.98 57.71 2fy2 h ARG 89 Cb 1.21 0.00 0.15 0.00 -1.65 0.00 0.00 29.97 29.69 2fy2 h ARG 89 CO 0.95 0.00 0.43 1.28 0.56 0.00 0.00 179.97 183.20 2fy2 n LEU 90 N -2.42 5.15 -4.77 3.04 4.77 -1.26 -1.12 117.00 120.38 2fy2 n LEU 90 Ca 0.02 0.89 -0.40 0.00 -0.03 0.00 0.00 56.01 56.48 2fy2 n LEU 90 Cb 0.50 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.07 2fy2 n LEU 90 CO 0.38 -1.08 1.07 0.00 -1.33 0.00 0.00 177.39 176.43 2fy2 s ALA 91 N -1.38 3.39 0.29 -1.18 0.00 -1.26 -4.23 121.76 117.39 2fy2 s ALA 91 Ca 0.76 1.46 -0.02 0.00 0.00 0.00 0.00 51.96 54.16 2fy2 s ALA 91 Cb -0.41 -3.57 0.43 0.00 0.00 0.00 0.00 23.12 19.56 2fy2 s ALA 91 CO 0.46 -1.04 1.94 -0.07 0.00 0.00 0.00 175.76 177.04 2fy2 h LEU 92 N 2.72 0.99 -9.76 0.00 3.38 -1.81 -3.35 115.31 107.47 2fy2 h LEU 92 Ca -0.50 -0.01 -0.53 0.00 0.09 0.00 0.00 57.88 56.92 2fy2 h LEU 92 Cb 1.25 -0.23 0.08 0.00 0.09 0.00 0.00 40.66 41.85 2fy2 h LEU 92 CO 0.63 0.69 0.92 -2.65 0.09 0.00 0.00 178.44 178.12 2fy2 n PRO 93 N -4.43 2.74 0.00 1.13 -0.02 -1.26 -0.51 135.00 132.64 2fy2 n PRO 93 Ca 0.12 0.98 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 2fy2 n PRO 93 Cb 0.08 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 30.78 2fy2 n PRO 93 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2fy2 n VAL 94 N 2.59 0.00 -0.04 -1.45 0.31 -1.26 -4.39 118.33 114.09 2fy2 n VAL 94 Ca 0.10 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.40 2fy2 n VAL 94 Cb 0.36 0.00 0.19 0.00 -0.91 0.00 0.00 33.84 33.49 2fy2 n VAL 94 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 2fy2 h ASN 95 N 0.00 0.61 0.00 4.52 2.35 -1.69 -1.55 115.58 119.82 2fy2 h ASN 95 Ca 0.00 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2fy2 h ASN 95 Cb 0.00 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.21 2fy2 h ASN 95 CO 0.00 0.76 -0.44 -0.24 -1.65 0.00 0.00 177.43 175.85 2fy2 n SER 96 N -4.18 1.20 -4.59 5.81 2.88 -0.48 -4.79 113.62 109.48 2fy2 n SER 96 Ca 0.01 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.13 2fy2 n SER 96 Cb 0.34 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.78 2fy2 n SER 96 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2fy2 s SER 97 N -3.94 6.41 0.85 -3.46 0.01 0.33 -4.57 113.70 109.33 2fy2 s SER 97 Ca 0.00 0.33 -0.11 0.00 1.31 0.00 0.00 55.95 57.48 2fy2 s SER 97 Cb 0.00 -2.55 0.10 0.00 0.21 0.00 0.00 66.02 63.78 2fy2 s SER 97 CO 0.00 -1.47 1.09 -2.16 0.41 0.00 0.00 173.24 171.12 2fy2 s PRO 98 N 4.94 1.66 0.01 12.44 0.04 -1.09 -4.32 135.00 148.68 2fy2 s PRO 98 Ca 0.49 0.86 0.03 0.00 0.04 0.00 0.00 61.00 62.42 2fy2 s PRO 98 Cb -0.09 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.59 2fy2 s PRO 98 CO 0.28 -1.98 -0.09 0.00 0.04 0.00 0.00 177.00 175.25 2fy2 s ALA 99 N -2.97 0.74 -0.14 8.56 0.00 -0.52 -0.84 121.76 126.58 2fy2 s ALA 99 Ca 0.62 -0.50 -0.01 0.00 0.00 0.00 0.00 51.96 52.07 2fy2 s ALA 99 Cb -0.17 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.80 2fy2 s ALA 99 CO 0.56 0.14 -0.10 0.08 0.00 0.00 0.00 175.76 176.44 2fy2 s VAL 100 N -0.51 3.23 -0.24 0.00 1.01 0.01 -1.37 120.40 122.53 2fy2 s VAL 100 Ca 0.01 -0.59 -0.08 0.00 0.00 0.00 0.00 61.98 61.32 2fy2 s VAL 100 Cb -0.05 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 2fy2 s VAL 100 CO 0.00 0.51 0.08 -0.63 0.00 0.00 0.00 175.10 175.05 2fy2 s ILE 101 N 0.49 4.45 0.81 2.22 1.09 0.02 -1.14 121.20 129.12 2fy2 s ILE 101 Ca -0.08 -0.13 -0.11 0.00 -1.10 0.00 0.00 60.65 59.24 2fy2 s ILE 101 Cb -0.15 -3.07 0.11 0.00 -1.06 0.00 0.00 42.46 38.28 2fy2 s ILE 101 CO 0.04 0.35 1.15 -0.36 -0.10 0.00 0.00 174.94 176.02 2fy2 s PHE 102 N 1.42 2.51 0.62 3.97 0.08 -0.67 -2.10 117.98 123.81 2fy2 s PHE 102 Ca 0.05 0.48 -0.18 0.00 0.12 0.00 0.00 56.93 57.40 2fy2 s PHE 102 Cb -0.15 -3.52 -0.02 0.00 -0.57 0.00 0.00 43.02 38.76 2fy2 s PHE 102 CO 0.04 -1.87 1.23 0.00 -0.10 0.00 0.00 175.22 174.52 2fy2 s ALA 103 N -3.52 2.46 0.32 5.36 0.00 -1.19 -4.73 121.76 120.46 2fy2 s ALA 103 Ca 0.65 1.05 -0.29 0.00 0.00 0.00 0.00 51.96 53.36 2fy2 s ALA 103 Cb -0.09 -3.48 -0.12 0.00 0.00 0.00 0.00 23.12 19.44 2fy2 s ALA 103 CO 0.48 -1.34 1.54 -2.13 0.00 0.00 0.00 175.76 174.31 2fy2 n ARG 104 N -1.78 2.64 -3.95 0.00 0.63 -1.26 -4.68 116.66 108.26 2fy2 n ARG 104 Ca 0.14 0.93 -0.22 0.00 -0.92 0.00 0.00 57.85 57.78 2fy2 n ARG 104 Cb 0.49 -2.69 -0.05 0.00 0.45 0.00 0.00 32.46 30.66 2fy2 n ARG 104 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2fy2 s GLN 105 N -1.03 2.49 -0.23 -0.14 -1.52 -0.29 -5.05 119.66 113.87 2fy2 s GLN 105 Ca 0.61 -1.49 0.01 0.00 -1.95 0.00 0.00 55.36 52.54 2fy2 s GLN 105 Cb -0.50 -2.28 0.06 0.00 -0.22 0.00 0.00 33.01 30.07 2fy2 s GLN 105 CO 0.54 0.05 -0.07 -1.58 -0.25 0.00 0.00 175.29 173.97 2fy2 s HIS 106 N -2.41 2.58 -0.61 0.91 5.65 -1.26 -4.29 115.29 115.85 2fy2 s HIS 106 Ca 0.40 -1.85 -0.00 0.00 0.25 0.00 0.00 55.06 53.86 2fy2 s HIS 106 Cb -0.03 -1.66 0.16 0.00 -1.18 0.00 0.00 32.58 29.87 2fy2 s HIS 106 CO 0.24 -0.79 0.40 -0.06 -0.65 0.00 0.00 174.74 173.89 2fy2 s PHE 107 N 1.34 3.36 0.23 3.88 2.99 -1.26 -4.95 117.98 123.57 2fy2 s PHE 107 Ca -0.06 -2.92 -0.06 0.00 0.00 0.00 0.00 56.93 53.89 2fy2 s PHE 107 Cb -0.19 -3.05 0.38 0.00 0.00 0.00 0.00 43.02 40.16 2fy2 s PHE 107 CO -0.06 -0.79 1.75 -1.35 -0.00 0.00 0.00 175.22 174.78 2fy2 h PRO 108 N 6.70 0.50 -5.37 0.24 0.11 -1.96 -3.44 132.00 128.78 2fy2 h PRO 108 Ca -0.02 -0.03 -0.54 0.00 0.11 0.00 0.00 66.00 65.53 2fy2 h PRO 108 Cb 0.91 -0.11 -0.13 0.00 0.11 0.00 0.00 31.00 31.78 2fy2 h PRO 108 CO 0.71 0.33 -0.60 0.20 -0.21 0.00 0.00 178.00 178.43 2fy2 s GLY 109 N -3.29 2.27 0.39 -0.55 0.00 -1.26 -5.03 107.32 99.85 2fy2 s GLY 109 Ca -0.13 -2.07 0.08 0.00 0.00 0.00 0.00 44.72 42.61 2fy2 s GLY 109 CO 0.76 -1.93 1.98 -0.84 0.00 0.00 0.00 173.10 173.08 2fy2 h THR 110 N 1.96 1.14 0.00 0.90 2.02 -1.93 -1.56 112.91 115.44 2fy2 h THR 110 Ca -0.42 -0.47 -0.03 0.00 0.77 0.00 0.00 66.41 66.26 2fy2 h THR 110 Cb 1.25 0.83 -0.00 0.00 -1.74 0.00 0.00 68.15 68.48 2fy2 h THR 110 CO 0.73 0.17 -0.14 0.44 0.37 0.00 0.00 175.52 177.09 2fy2 h ASP 111 N 0.42 0.00 -0.15 4.18 3.32 -1.96 -0.89 116.42 121.33 2fy2 h ASP 111 Ca 0.10 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.03 2fy2 h ASP 111 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2fy2 h ASP 111 CO -0.01 0.14 -0.37 0.44 -1.72 0.00 0.00 179.24 177.72 2fy2 h ASP 112 N 0.00 0.59 -0.16 6.45 3.32 -1.65 -0.54 116.42 124.42 2fy2 h ASP 112 Ca -0.00 -0.58 0.01 0.00 0.02 0.00 0.00 57.03 56.48 2fy2 h ASP 112 Cb 0.45 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2fy2 h ASP 112 CO 0.02 1.06 0.09 -0.61 -1.72 0.00 0.00 179.24 178.08 2fy2 h GLN 113 N 0.14 0.19 -0.49 3.56 4.15 -1.28 -2.09 115.11 119.29 2fy2 h GLN 113 Ca -0.00 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.36 2fy2 h GLN 113 Cb 0.98 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.61 2fy2 h GLN 113 CO 0.08 0.12 0.11 -0.07 -1.93 0.00 0.00 178.83 177.15 2fy2 h LEU 114 N 0.19 0.69 -0.78 -2.39 3.38 -1.15 -1.66 115.31 113.60 2fy2 h LEU 114 Ca 0.06 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2fy2 h LEU 114 Cb -0.00 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2fy2 h LEU 114 CO -0.03 0.69 0.12 0.03 0.09 0.00 0.00 178.44 179.34 2fy2 h ARG 115 N 0.72 1.04 -0.17 1.13 3.08 -0.83 0.72 114.38 120.07 2fy2 h ARG 115 Ca 0.16 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2fy2 h ARG 115 Cb 0.28 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 2fy2 h ARG 115 CO -0.00 0.95 0.09 0.35 -1.07 0.00 0.00 179.97 180.28 2fy2 h PHE 116 N 0.98 0.24 -0.59 3.04 3.57 -0.85 -0.57 116.94 122.77 2fy2 h PHE 116 Ca 0.20 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.71 2fy2 h PHE 116 Cb 0.40 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2fy2 h PHE 116 CO 0.03 0.25 0.37 0.00 -2.23 0.00 0.00 178.31 176.73 2fy2 h ALA 117 N 0.97 0.75 -0.58 2.41 0.00 -0.99 0.25 119.26 122.08 2fy2 h ALA 117 Ca 0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2fy2 h ALA 117 Cb 0.10 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2fy2 h ALA 117 CO -0.01 0.12 0.33 0.00 0.00 0.00 0.00 179.25 179.69 2fy2 h ALA 118 N 1.24 0.74 -0.48 0.00 0.00 -0.63 0.38 119.26 120.52 2fy2 h ALA 118 Ca 0.23 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2fy2 h ALA 118 Cb -0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2fy2 h ALA 118 CO -0.08 0.25 0.04 1.03 0.00 0.00 0.00 179.25 180.49 2fy2 h SER 119 N 0.79 0.79 -0.53 0.00 0.87 -0.52 -1.28 113.55 113.67 2fy2 h SER 119 Ca 0.21 -0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.46 2fy2 h SER 119 Cb 0.03 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.75 2fy2 h SER 119 CO -0.03 0.88 0.26 0.25 -0.53 0.00 0.00 176.83 177.65 2fy2 h LEU 120 N 0.68 0.70 -0.83 2.23 6.46 -0.14 -0.13 115.31 124.27 2fy2 h LEU 120 Ca 0.14 -0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 2fy2 h LEU 120 Cb 0.45 -0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 40.16 2fy2 h LEU 120 CO 0.02 0.64 0.49 0.40 -0.62 0.00 0.00 178.44 179.36 2fy2 h ILE 121 N 0.72 1.24 -0.85 4.05 2.04 -0.79 -0.19 117.51 123.73 2fy2 h ILE 121 Ca 0.18 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2fy2 h ILE 121 Cb 0.12 0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 36.24 2fy2 h ILE 121 CO -0.02 0.25 0.53 -1.28 0.00 0.00 0.00 178.15 177.63 2fy2 h SER 122 N 1.15 1.01 -0.57 1.72 0.87 -0.63 -1.30 113.55 115.79 2fy2 h SER 122 Ca 0.30 -0.05 -0.06 0.00 -1.23 0.00 0.00 61.79 60.74 2fy2 h SER 122 Cb -0.02 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 61.66 2fy2 h SER 122 CO -0.05 0.76 0.12 1.23 -0.53 0.00 0.00 176.83 178.36 2fy2 h GLY 123 N 1.16 1.04 0.93 5.77 0.00 -0.12 -1.97 103.07 109.89 2fy2 h GLY 123 Ca 0.31 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 2fy2 h GLY 123 CO -0.06 0.60 0.13 -2.08 0.00 0.00 0.00 176.54 175.12 2fy2 h VAL 124 N 0.92 1.15 -0.49 4.60 2.07 -0.21 -2.23 116.25 122.06 2fy2 h VAL 124 Ca 0.19 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 67.23 2fy2 h VAL 124 Cb 0.36 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 2fy2 h VAL 124 CO 0.00 0.15 0.04 -0.07 0.02 0.00 0.00 177.57 177.71 2fy2 h LEU 125 N 0.29 0.75 -0.81 2.57 3.38 -1.10 -0.53 115.31 119.86 2fy2 h LEU 125 Ca 0.09 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 2fy2 h LEU 125 Cb 0.12 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2fy2 h LEU 125 CO -0.01 0.79 -0.05 -1.28 0.09 0.00 0.00 178.44 177.98 2fy2 h SER 126 N 0.75 0.82 -0.30 -0.43 0.87 -1.23 -0.60 113.55 113.43 2fy2 h SER 126 Ca 0.15 -0.23 -0.14 0.00 -1.23 0.00 0.00 61.79 60.35 2fy2 h SER 126 Cb 0.39 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 2fy2 h SER 126 CO 0.01 0.92 -0.36 0.22 -0.53 0.00 0.00 176.83 177.09 2fy2 h TYR 127 N 0.78 0.94 0.00 2.24 3.20 -1.02 -2.63 116.97 120.47 2fy2 h TYR 127 Ca 0.14 -0.30 -0.06 0.00 3.14 0.00 0.00 58.73 61.65 2fy2 h TYR 127 Cb 0.53 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 2fy2 h TYR 127 CO 0.03 1.08 -0.30 -0.22 -1.64 0.00 0.00 178.16 177.11 2fy2 h LYS 128 N 0.53 0.00 -0.37 1.82 3.64 -0.90 -0.70 116.57 120.59 2fy2 h LYS 128 Ca 0.04 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.34 2fy2 h LYS 128 Cb 0.95 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.76 2fy2 h LYS 128 CO 0.09 0.30 -0.08 0.00 -2.27 0.00 0.00 179.45 177.48 2fy2 h ALA 129 N 1.70 0.51 -0.63 5.00 0.00 -0.93 0.25 119.26 125.17 2fy2 h ALA 129 Ca -0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 2fy2 h ALA 129 Cb 0.57 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2fy2 h ALA 129 CO 0.04 0.36 0.15 -0.07 0.00 0.00 0.00 179.25 179.73 2fy2 h LEU 130 N 0.51 0.95 0.59 0.00 3.38 -1.07 -0.96 115.31 118.72 2fy2 h LEU 130 Ca 0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 2fy2 h LEU 130 Cb 0.59 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2fy2 h LEU 130 CO 0.04 0.94 -0.31 0.25 0.09 0.00 0.00 178.44 179.45 2fy2 h LEU 131 N 0.92 -0.75 -2.29 1.67 6.46 -0.84 0.49 115.31 120.97 2fy2 h LEU 131 Ca 0.20 0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 57.99 2fy2 h LEU 131 Cb 0.36 0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 40.50 2fy2 h LEU 131 CO 0.00 -0.51 -0.01 0.44 -0.62 0.00 0.00 178.44 177.74 2fy2 h ASP 132 N -0.83 0.00 -0.32 1.25 3.32 -0.41 -0.11 116.42 119.32 2fy2 h ASP 132 Ca -0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.97 2fy2 h ASP 132 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2fy2 h ASP 132 CO 0.11 0.01 0.00 -1.54 -1.72 0.00 0.00 179.24 176.11 2fy2 n SER 133 N -3.14 2.65 -2.96 6.45 3.41 -0.37 -4.91 113.62 114.75 2fy2 n SER 133 Ca -0.01 -1.89 -0.21 0.00 -0.26 0.00 0.00 58.87 56.50 2fy2 n SER 133 Cb 0.18 -0.21 0.01 0.00 -0.26 0.00 0.00 64.21 63.94 2fy2 n SER 133 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2fy2 n HIS 134 N 0.97 -1.73 -1.28 7.33 8.25 -0.05 -4.86 115.22 123.84 2fy2 n HIS 134 Ca 0.18 0.38 -0.20 0.00 -0.26 0.00 0.00 57.72 57.81 2fy2 n HIS 134 Cb 0.47 -3.82 0.18 0.00 1.12 0.00 0.00 29.99 27.94 2fy2 n HIS 134 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2fy2 n SER 135 N -2.31 3.52 -4.72 0.41 7.64 0.16 -4.95 113.62 113.37 2fy2 n SER 135 Ca -0.11 -3.65 -0.38 0.00 1.01 0.00 0.00 58.87 55.74 2fy2 n SER 135 Cb 0.61 -0.80 -0.06 0.00 -1.01 0.00 0.00 64.21 62.95 2fy2 n SER 135 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2fy2 s ILE 136 N -3.31 5.18 -0.52 0.44 1.01 -1.25 -4.85 121.20 117.89 2fy2 s ILE 136 Ca 0.54 0.99 -0.32 0.00 0.00 0.00 0.00 60.65 61.86 2fy2 s ILE 136 Cb 0.47 -3.83 -0.13 0.00 0.01 0.00 0.00 42.46 38.97 2fy2 s ILE 136 CO 0.08 0.32 2.35 -2.65 0.00 0.00 0.00 174.94 175.05 2fy2 n PRO 137 N 3.68 0.81 0.00 2.79 -0.02 -1.26 -5.11 135.00 135.89 2fy2 n PRO 137 Ca -0.07 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 2fy2 n PRO 137 Cb 0.52 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2fy2 n PRO 137 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2fy2 n THR 138 N 7.44 0.00 -3.80 3.45 -1.04 -1.26 -5.15 114.28 113.92 2fy2 n THR 138 Ca 0.46 0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.53 2fy2 n THR 138 Cb 0.26 -0.61 0.00 0.00 -1.82 0.00 0.00 70.33 68.16 2fy2 n THR 138 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2fy2 n GLY 147 N 0.00 0.21 3.73 3.41 0.00 -1.26 -4.97 105.19 106.31 2fy2 n GLY 147 Ca 0.00 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 2fy2 n GLY 147 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2fy2 s GLN 148 N 0.00 4.55 0.38 1.61 0.74 -1.26 -5.01 119.66 120.67 2fy2 s GLN 148 Ca 0.00 1.72 -0.28 0.00 0.05 0.00 0.00 55.36 56.86 2fy2 s GLN 148 Cb 0.00 -3.30 -0.11 0.00 1.10 0.00 0.00 33.01 30.70 2fy2 s GLN 148 CO 0.00 -0.02 1.45 -2.30 -0.55 0.00 0.00 175.29 173.88 2fy2 n PRO 149 N 2.81 2.56 -4.43 1.67 -0.02 -1.26 -5.02 135.00 131.31 2fy2 n PRO 149 Ca 0.04 0.90 -0.25 0.00 -2.02 0.00 0.00 63.50 62.17 2fy2 n PRO 149 Cb 0.46 -2.61 -0.11 0.00 -0.02 0.00 0.00 33.50 31.22 2fy2 n PRO 149 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2fy2 s LEU 150 N -1.94 2.50 0.33 2.45 1.43 -1.26 -4.63 118.68 117.57 2fy2 s LEU 150 Ca 0.54 -0.94 -0.28 0.00 -1.03 0.00 0.00 54.13 52.42 2fy2 s LEU 150 Cb -0.49 -1.09 -0.10 0.00 0.03 0.00 0.00 46.19 44.54 2fy2 s LEU 150 CO 0.63 0.06 1.22 0.00 0.23 0.00 0.00 176.35 178.50 2fy2 n MET 152 N 0.73 1.93 -0.27 0.00 0.00 -1.26 -4.74 117.12 113.52 2fy2 n MET 152 Ca 0.01 -1.49 0.04 0.00 0.00 0.00 0.00 57.70 56.26 2fy2 n MET 152 Cb 0.44 -1.13 0.18 0.00 0.00 0.00 0.00 33.22 32.71 2fy2 n MET 152 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 2fy2 h LYS 153 N 1.11 0.60 -1.00 0.03 1.79 -1.97 -2.05 116.57 115.07 2fy2 h LYS 153 Ca 0.00 -0.04 0.21 0.00 -2.18 0.00 0.00 60.65 58.65 2fy2 h LYS 153 Cb 0.50 -0.14 -0.11 0.00 -1.58 0.00 0.00 32.23 30.90 2fy2 h LYS 153 CO 0.00 0.40 0.61 1.96 -1.08 0.00 0.00 179.45 181.33 2fy2 h GLN 154 N 0.62 0.67 -0.84 3.15 4.20 -1.86 0.02 115.11 121.06 2fy2 h GLN 154 Ca 0.41 -0.04 0.04 0.00 0.06 0.00 0.00 58.65 59.12 2fy2 h GLN 154 Cb 0.52 -0.15 -0.05 0.00 0.30 0.00 0.00 27.48 28.09 2fy2 h GLN 154 CO -0.32 0.44 0.55 1.88 -0.67 0.00 0.00 178.83 180.71 2fy2 h TYR 155 N 0.69 0.99 0.00 2.96 0.05 -1.73 -0.86 116.97 119.07 2fy2 h TYR 155 Ca 0.60 0.02 0.00 0.00 0.05 0.00 0.00 58.73 59.41 2fy2 h TYR 155 Cb 1.03 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 38.44 2fy2 h TYR 155 CO -0.00 0.56 0.00 0.66 -1.05 0.00 0.00 178.16 178.33 2fy2 n TYR 156 N -4.46 0.00 0.14 4.88 4.02 -0.01 -2.46 117.16 119.27 2fy2 n TYR 156 Ca 0.11 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 58.07 2fy2 n TYR 156 Cb 0.14 -0.06 0.12 0.00 -0.02 0.00 0.00 39.34 39.52 2fy2 n TYR 156 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2fy2 n GLY 157 N 0.49 1.40 0.11 2.72 0.00 -0.33 -4.42 105.19 105.16 2fy2 n GLY 157 Ca 0.16 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 2fy2 n GLY 157 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fy2 h LEU 158 N 2.46 0.26 -0.45 0.99 3.38 -1.47 -3.32 115.31 117.16 2fy2 h LEU 158 Ca 0.00 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2fy2 h LEU 158 Cb 0.67 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2fy2 h LEU 158 CO 0.00 0.40 -0.18 0.49 0.09 0.00 0.00 178.44 179.25 2fy2 n PHE 159 N -4.81 0.00 -0.97 1.13 3.01 -1.26 -4.53 117.46 110.03 2fy2 n PHE 159 Ca -0.04 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.50 2fy2 n PHE 159 Cb 0.15 0.00 0.30 0.00 -0.01 0.00 0.00 39.48 39.93 2fy2 n PHE 159 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2fy2 n SER 160 N -0.60 4.44 -4.63 4.37 3.41 -1.26 -4.39 113.62 114.97 2fy2 n SER 160 Ca 0.02 -2.99 -0.27 0.00 -0.26 0.00 0.00 58.87 55.37 2fy2 n SER 160 Cb 0.12 -0.59 -0.08 0.00 -0.26 0.00 0.00 64.21 63.40 2fy2 n SER 160 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2fy2 s SER 161 N -1.60 4.59 -0.21 4.04 0.01 -1.25 -0.68 113.70 118.62 2fy2 s SER 161 Ca 0.46 -0.43 -0.11 0.00 1.31 0.00 0.00 55.95 57.18 2fy2 s SER 161 Cb 0.36 -0.92 0.07 0.00 0.21 0.00 0.00 66.02 65.74 2fy2 s SER 161 CO 0.11 0.11 0.49 -0.47 0.41 0.00 0.00 173.24 173.89 2fy2 s TYR 162 N -1.63 -0.78 -0.54 2.43 5.04 -0.92 -4.17 117.35 116.77 2fy2 s TYR 162 Ca 0.26 1.59 -0.17 0.00 -2.44 0.00 0.00 57.07 56.30 2fy2 s TYR 162 Cb -0.09 0.39 0.10 0.00 0.35 0.00 0.00 41.96 42.70 2fy2 s TYR 162 CO 0.17 -0.42 0.57 0.50 -1.34 0.00 0.00 175.55 175.03 2fy2 s ARG 163 N 1.69 3.03 0.23 4.97 3.52 -0.27 -0.37 118.95 131.76 2fy2 s ARG 163 Ca -0.08 -1.34 -0.30 0.00 -0.13 0.00 0.00 55.73 53.88 2fy2 s ARG 163 Cb -0.08 -4.22 -0.09 0.00 -1.56 0.00 0.00 34.95 29.01 2fy2 s ARG 163 CO -0.15 -1.32 1.05 -1.17 -0.81 0.00 0.00 175.30 172.90 2fy2 s LEU 164 N 2.18 4.56 0.56 -0.88 2.96 0.13 -4.59 118.68 123.60 2fy2 s LEU 164 Ca 0.08 2.12 -0.10 0.00 -0.22 0.00 0.00 54.13 56.02 2fy2 s LEU 164 Cb -0.25 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.78 2fy2 s LEU 164 CO 0.07 -0.09 0.94 -2.16 -1.32 0.00 0.00 176.35 173.79 2fy2 s PRO 165 N -1.02 3.63 0.13 0.98 0.04 -1.26 -1.07 135.00 136.42 2fy2 s PRO 165 Ca 0.45 0.60 -0.04 0.00 0.04 0.00 0.00 61.00 62.05 2fy2 s PRO 165 Cb -0.29 -2.19 -0.03 0.00 0.04 0.00 0.00 34.50 32.03 2fy2 s PRO 165 CO 0.37 -0.40 0.13 0.20 0.04 0.00 0.00 177.00 177.33 2fy2 s GLY 166 N -3.97 0.69 0.16 0.56 0.00 -1.25 -4.68 107.32 98.84 2fy2 s GLY 166 Ca 0.53 -1.19 -0.14 0.00 0.00 0.00 0.00 44.72 43.92 2fy2 s GLY 166 CO 0.48 -1.15 1.74 0.84 0.00 0.00 0.00 173.10 175.01 2fy2 h HIS 167 N 2.79 0.76 0.00 1.90 2.76 -1.89 -3.36 115.15 118.12 2fy2 h HIS 167 Ca -0.34 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 57.80 2fy2 h HIS 167 Cb 1.20 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.93 2fy2 h HIS 167 CO 0.43 0.59 -0.68 0.25 -1.30 0.00 0.00 177.93 177.23 2fy2 n THR 168 N -4.59 0.00 -3.79 6.26 -2.24 -1.26 -4.59 114.28 104.07 2fy2 n THR 168 Ca 0.02 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.65 2fy2 n THR 168 Cb 0.12 -0.24 -0.16 0.00 -2.10 0.00 0.00 70.33 67.95 2fy2 n THR 168 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2fy2 s GLN 169 N -1.54 -0.01 0.79 -0.78 0.74 -1.26 -4.65 119.66 112.96 2fy2 s GLN 169 Ca 0.00 0.18 -0.12 0.00 0.05 0.00 0.00 55.36 55.47 2fy2 s GLN 169 Cb 0.00 -0.27 0.07 0.00 1.10 0.00 0.00 33.01 33.90 2fy2 s GLN 169 CO 0.00 -0.17 1.11 -0.51 -0.55 0.00 0.00 175.29 175.17 2fy2 s ASP 170 N 1.06 4.60 -0.10 6.67 1.11 0.16 -3.85 116.67 126.32 2fy2 s ASP 170 Ca -0.09 1.20 0.02 0.00 0.18 0.00 0.00 52.55 53.86 2fy2 s ASP 170 Cb -0.13 -1.92 0.01 0.00 1.07 0.00 0.00 42.92 41.95 2fy2 s ASP 170 CO -0.03 -1.89 -0.14 -0.89 1.18 0.00 0.00 175.17 173.40 2fy2 s THR 171 N -3.24 1.39 -0.45 -1.27 2.01 -0.23 -4.85 115.64 108.99 2fy2 s THR 171 Ca 0.61 -0.59 -0.19 0.00 0.31 0.00 0.00 61.69 61.83 2fy2 s THR 171 Cb -0.13 -1.28 0.04 0.00 0.01 0.00 0.00 72.50 71.13 2fy2 s THR 171 CO 0.53 0.42 0.55 -0.22 -0.69 0.00 0.00 174.62 175.21 2fy2 s LEU 172 N 0.95 4.83 -0.14 4.42 2.96 -1.26 0.20 118.68 130.64 2fy2 s LEU 172 Ca -0.08 -0.68 -0.25 0.00 -0.22 0.00 0.00 54.13 52.90 2fy2 s LEU 172 Cb -0.15 -2.49 -0.02 0.00 0.50 0.00 0.00 46.19 44.03 2fy2 s LEU 172 CO -0.01 -0.73 0.80 -0.69 -1.32 0.00 0.00 176.35 174.40 2fy2 s VAL 173 N 2.45 4.93 -0.38 1.68 1.01 0.50 -4.95 120.40 125.64 2fy2 s VAL 173 Ca 0.15 1.58 -0.12 0.00 0.00 0.00 0.00 61.98 63.60 2fy2 s VAL 173 Cb -0.17 -4.11 0.03 0.00 0.00 0.00 0.00 36.38 32.13 2fy2 s VAL 173 CO 0.14 0.09 0.22 0.00 0.00 0.00 0.00 175.10 175.55 2fy2 s ALA 174 N 1.77 3.30 0.66 5.51 0.00 -1.26 -2.16 121.76 129.59 2fy2 s ALA 174 Ca 0.38 -1.73 0.00 0.00 0.00 0.00 0.00 51.96 50.61 2fy2 s ALA 174 Cb -0.17 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.31 2fy2 s ALA 174 CO 0.14 -1.41 0.00 0.94 0.00 0.00 0.00 175.76 175.43 2fy2 n GLN 175 N 5.02 3.04 0.00 0.00 7.27 0.15 -5.05 117.38 127.80 2fy2 n GLN 175 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.95 2fy2 n GLN 175 Cb 0.46 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.11 2fy2 n GLN 175 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2fy2 n MET 180 N 0.00 0.00 -0.84 3.69 0.00 -1.26 -4.97 117.12 113.74 2fy2 n MET 180 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 57.70 57.36 2fy2 n MET 180 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 33.22 33.32 2fy2 n MET 180 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 2fy2 n PRO 181 N 0.00 -0.24 -3.54 3.17 -0.04 -1.26 -5.00 135.00 128.10 2fy2 n PRO 181 Ca 0.00 -0.04 -0.18 0.00 -0.04 0.00 0.00 63.50 63.24 2fy2 n PRO 181 Cb 0.00 -1.68 -0.13 0.00 -0.04 0.00 0.00 33.50 31.65 2fy2 n PRO 181 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2fy2 s GLU 182 N -3.29 0.16 0.89 0.54 2.56 -1.26 -3.87 118.70 114.43 2fy2 s GLU 182 Ca 0.53 0.28 -0.12 0.00 0.00 0.00 0.00 54.97 55.67 2fy2 s GLU 182 Cb -0.20 -1.02 0.18 0.00 2.00 0.00 0.00 34.13 35.08 2fy2 s GLU 182 CO 0.71 -0.58 1.23 -1.25 -0.56 0.00 0.00 175.26 174.81 2fy2 s PRO 183 N 2.32 0.96 0.33 4.30 0.04 -1.26 -5.09 135.00 136.60 2fy2 s PRO 183 Ca 0.06 -0.58 -0.20 0.00 0.04 0.00 0.00 61.00 60.32 2fy2 s PRO 183 Cb -0.15 -1.98 -0.10 0.00 0.04 0.00 0.00 34.50 32.32 2fy2 s PRO 183 CO -0.11 -2.13 0.84 -1.21 0.04 0.00 0.00 177.00 174.44 2fy2 s GLU 184 N -5.68 4.25 0.19 4.56 2.02 -0.73 -4.96 118.70 118.35 2fy2 s GLU 184 Ca 0.72 0.99 -0.07 0.00 0.02 0.00 0.00 54.97 56.62 2fy2 s GLU 184 Cb -0.04 -2.53 -0.02 0.00 0.10 0.00 0.00 34.13 31.64 2fy2 s GLU 184 CO 0.51 0.18 0.27 -3.38 0.02 0.00 0.00 175.26 172.86 2fy2 s HIS 185 N -1.87 0.60 0.18 1.61 -3.43 -1.26 -1.14 115.29 109.99 2fy2 s HIS 185 Ca 0.53 -0.94 0.08 0.00 -0.80 0.00 0.00 55.06 53.93 2fy2 s HIS 185 Cb -0.13 -0.15 -0.04 0.00 -1.43 0.00 0.00 32.58 30.82 2fy2 s HIS 185 CO 0.18 -0.75 -0.15 0.14 -2.00 0.00 0.00 174.74 172.16 2fy2 s VAL 186 N -4.03 1.69 -0.22 -5.38 -7.23 -0.35 -1.28 120.40 103.59 2fy2 s VAL 186 Ca 0.24 -2.07 -0.08 0.00 -1.81 0.00 0.00 61.98 58.25 2fy2 s VAL 186 Cb 0.04 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 35.01 2fy2 s VAL 186 CO 0.05 -0.51 0.10 -0.63 -0.31 0.00 0.00 175.10 173.80 2fy2 s ILE 187 N -2.66 4.88 -0.24 -0.62 -1.09 -0.57 -1.05 121.20 119.85 2fy2 s ILE 187 Ca 0.19 0.01 -0.09 0.00 -2.23 0.00 0.00 60.65 58.53 2fy2 s ILE 187 Cb -0.02 -3.25 -0.04 0.00 -1.58 0.00 0.00 42.46 37.57 2fy2 s ILE 187 CO 0.06 0.39 0.12 -0.69 -1.23 0.00 0.00 174.94 173.59 2fy2 s VAL 188 N 0.92 4.98 -0.23 2.92 1.01 0.31 -0.49 120.40 129.82 2fy2 s VAL 188 Ca 0.05 0.05 -0.09 0.00 0.00 0.00 0.00 61.98 62.00 2fy2 s VAL 188 Cb -0.14 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 2fy2 s VAL 188 CO 0.03 0.35 0.11 0.00 0.00 0.00 0.00 175.10 175.59 2fy2 s ALA 189 N 1.15 3.38 -0.10 5.51 0.00 0.13 -0.80 121.76 131.02 2fy2 s ALA 189 Ca 0.06 -0.97 -0.04 0.00 0.00 0.00 0.00 51.96 51.01 2fy2 s ALA 189 Cb -0.14 -2.16 0.05 0.00 0.00 0.00 0.00 23.12 20.88 2fy2 s ALA 189 CO 0.05 -0.26 0.21 0.00 0.00 0.00 0.00 175.76 175.75 2fy2 n ASN 192 N -2.98 -4.97 -4.82 0.00 3.02 -1.26 -4.97 115.26 99.28 2fy2 n ASN 192 Ca -0.01 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.18 2fy2 n ASN 192 Cb 0.56 -2.79 -0.07 0.00 -0.61 0.00 0.00 39.78 36.87 2fy2 n ASN 192 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2fy2 s GLN 193 N -1.52 3.32 -0.11 3.52 -1.52 -0.32 -4.63 119.66 118.40 2fy2 s GLN 193 Ca 0.00 -0.21 -0.02 0.00 -1.95 0.00 0.00 55.36 53.18 2fy2 s GLN 193 Cb 0.00 -3.08 -0.03 0.00 -0.22 0.00 0.00 33.01 29.68 2fy2 s GLN 193 CO 0.00 0.75 -0.03 -0.06 -0.25 0.00 0.00 175.29 175.70 2fy2 s PHE 194 N -0.96 3.04 -0.01 0.91 0.40 -1.26 -0.96 117.98 119.13 2fy2 s PHE 194 Ca 0.14 -0.06 0.04 0.00 -0.60 0.00 0.00 56.93 56.46 2fy2 s PHE 194 Cb -0.12 -1.84 -0.01 0.00 0.51 0.00 0.00 43.02 41.56 2fy2 s PHE 194 CO 0.03 0.22 -0.14 -0.06 0.70 0.00 0.00 175.22 175.97 2fy2 s PHE 195 N -0.33 1.30 -0.22 0.36 0.40 0.02 -0.16 117.98 119.34 2fy2 s PHE 195 Ca 0.06 -0.26 -0.26 0.00 -0.60 0.00 0.00 56.93 55.87 2fy2 s PHE 195 Cb -0.12 -0.84 -0.01 0.00 0.51 0.00 0.00 43.02 42.56 2fy2 s PHE 195 CO 0.02 -0.04 0.87 0.08 0.70 0.00 0.00 175.22 176.85 2fy2 s VAL 196 N -0.27 4.82 -0.35 -0.44 1.01 0.13 -0.53 120.40 124.77 2fy2 s VAL 196 Ca 0.04 1.67 0.00 0.00 0.00 0.00 0.00 61.98 63.69 2fy2 s VAL 196 Cb -0.06 -4.16 0.09 0.00 0.00 0.00 0.00 36.38 32.25 2fy2 s VAL 196 CO -0.00 -0.06 0.09 -0.22 0.00 0.00 0.00 175.10 174.91 2fy2 s LEU 197 N 2.69 4.71 0.09 3.92 2.96 -0.22 -2.54 118.68 130.29 2fy2 s LEU 197 Ca 0.37 -1.91 -0.31 0.00 -0.22 0.00 0.00 54.13 52.07 2fy2 s LEU 197 Cb -0.16 -1.71 -0.08 0.00 0.50 0.00 0.00 46.19 44.74 2fy2 s LEU 197 CO 0.09 -0.41 1.53 -1.81 -1.32 0.00 0.00 176.35 174.43 2fy2 s ASP 198 N 1.33 6.69 -0.00 3.68 1.01 -1.26 -1.22 116.67 126.90 2fy2 s ASP 198 Ca 0.06 2.41 0.06 0.00 0.71 0.00 0.00 52.55 55.79 2fy2 s ASP 198 Cb -0.21 -2.57 -0.07 0.00 1.01 0.00 0.00 42.92 41.08 2fy2 s ASP 198 CO -0.05 -0.79 0.20 1.33 0.21 0.00 0.00 175.17 176.07 2fy2 n VAL 199 N 4.36 0.00 -3.81 -1.27 0.24 -0.29 -4.91 118.33 112.65 2fy2 n VAL 199 Ca 0.14 -0.28 -0.13 0.00 -2.04 0.00 0.00 64.34 62.03 2fy2 n VAL 199 Cb 0.41 0.77 -0.14 0.00 -1.47 0.00 0.00 33.84 33.41 2fy2 n VAL 199 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2fy2 s VAL 200 N -1.85 -0.02 -0.27 3.34 1.01 -1.08 -1.53 120.40 119.99 2fy2 s VAL 200 Ca 0.01 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 2fy2 s VAL 200 Cb 0.04 -0.16 0.14 0.00 0.00 0.00 0.00 36.38 36.40 2fy2 s VAL 200 CO 0.24 0.02 0.33 -0.63 0.00 0.00 0.00 175.10 175.06 2fy2 s ILE 201 N 0.39 -0.49 -1.01 2.22 1.01 0.17 -1.78 121.20 121.71 2fy2 s ILE 201 Ca -0.03 -0.33 -0.05 0.00 0.00 0.00 0.00 60.65 60.24 2fy2 s ILE 201 Cb -0.04 -0.93 -0.06 0.00 0.01 0.00 0.00 42.46 41.44 2fy2 s ILE 201 CO -0.02 -0.33 0.88 0.59 0.00 0.00 0.00 174.94 176.06 2fy2 n ASN 202 N 5.33 -5.98 -0.14 3.58 3.02 -1.26 -1.29 115.26 118.52 2fy2 n ASN 202 Ca -0.02 -0.67 -0.01 0.00 -0.03 0.00 0.00 54.58 53.85 2fy2 n ASN 202 Cb 0.48 -4.98 -0.01 0.00 -0.61 0.00 0.00 39.78 34.66 2fy2 n ASN 202 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2fy2 n PHE 203 N -3.23 -0.05 -2.99 3.10 3.01 -1.26 -4.88 117.46 111.16 2fy2 n PHE 203 Ca -0.09 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 57.97 2fy2 n PHE 203 Cb 0.62 -1.40 -0.04 0.00 -0.01 0.00 0.00 39.48 38.65 2fy2 n PHE 203 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2fy2 s ARG 204 N -1.25 4.38 -0.32 -1.08 1.81 -0.41 -5.04 118.95 117.04 2fy2 s ARG 204 Ca 0.00 0.93 0.03 0.00 -1.72 0.00 0.00 55.73 54.96 2fy2 s ARG 204 Cb 0.00 -3.50 0.10 0.00 -0.45 0.00 0.00 34.95 31.10 2fy2 s ARG 204 CO 0.00 -0.08 0.04 0.50 -0.68 0.00 0.00 175.30 175.08 2fy2 s ARG 205 N 1.30 1.37 -0.02 3.54 3.52 -1.26 0.45 118.95 127.85 2fy2 s ARG 205 Ca 0.38 -1.62 -0.23 0.00 -0.13 0.00 0.00 55.73 54.13 2fy2 s ARG 205 Cb -0.17 -2.89 -0.11 0.00 -1.56 0.00 0.00 34.95 30.21 2fy2 s ARG 205 CO 0.16 -0.91 0.63 1.28 -0.81 0.00 0.00 175.30 175.66 2fy2 n LEU 206 N 4.41 0.04 -4.77 -0.88 4.77 -0.59 -4.89 117.00 115.10 2fy2 n LEU 206 Ca 0.01 0.66 -0.34 0.00 -0.03 0.00 0.00 56.01 56.31 2fy2 n LEU 206 Cb 0.42 -0.52 0.04 0.00 -2.33 0.00 0.00 43.42 41.03 2fy2 n LEU 206 CO 0.19 -1.04 0.76 -0.94 -1.33 0.00 0.00 177.39 175.03 2fy2 s SER 207 N 0.12 5.20 0.53 -1.43 1.04 -1.26 -4.83 113.70 113.06 2fy2 s SER 207 Ca 0.52 2.07 0.21 0.00 0.48 0.00 0.00 55.95 59.24 2fy2 s SER 207 Cb -0.73 -2.56 1.34 0.00 0.10 0.00 0.00 66.02 64.17 2fy2 s SER 207 CO 0.33 -1.57 2.06 -0.08 0.98 0.00 0.00 173.24 174.96 2fy2 h GLU 208 N 0.31 0.00 -0.29 4.02 4.81 -1.89 -0.58 114.58 120.96 2fy2 h GLU 208 Ca -0.48 -0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 58.62 2fy2 h GLU 208 Cb 1.25 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.63 2fy2 h GLU 208 CO 0.54 0.00 -0.35 0.78 -0.73 0.00 0.00 179.01 179.25 2fy2 h GLY 209 N 0.00 0.82 1.50 1.92 0.00 -1.91 -2.34 103.07 103.06 2fy2 h GLY 209 Ca 0.15 -0.87 -0.12 0.00 0.00 0.00 0.00 47.33 46.49 2fy2 h GLY 209 CO -0.00 0.79 -0.33 -0.55 0.00 0.00 0.00 176.54 176.44 2fy2 h ASP 210 N 0.50 0.58 -0.62 0.19 3.32 -1.51 -2.37 116.42 116.52 2fy2 h ASP 210 Ca 0.04 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 2fy2 h ASP 210 Cb 0.94 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.30 2fy2 h ASP 210 CO 0.08 0.88 0.35 -0.07 -1.72 0.00 0.00 179.24 178.76 2fy2 h LEU 211 N 0.48 0.77 -0.42 1.55 3.38 -1.20 0.71 115.31 120.57 2fy2 h LEU 211 Ca 0.05 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2fy2 h LEU 211 Cb 0.81 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2fy2 h LEU 211 CO 0.07 0.63 0.27 0.15 0.09 0.00 0.00 178.44 179.65 2fy2 h PHE 212 N 0.84 0.51 -0.64 1.13 3.57 -1.18 0.13 116.94 121.31 2fy2 h PHE 212 Ca 0.22 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.70 2fy2 h PHE 212 Cb 0.03 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 2fy2 h PHE 212 CO -0.01 0.31 0.28 1.15 -2.23 0.00 0.00 178.31 177.81 2fy2 h THR 213 N 0.55 1.23 -0.55 4.41 2.02 -0.98 -1.79 112.91 117.78 2fy2 h THR 213 Ca 0.16 -0.67 -0.10 0.00 0.77 0.00 0.00 66.41 66.57 2fy2 h THR 213 Cb -0.04 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 2fy2 h THR 213 CO -0.05 0.27 -0.03 1.56 0.37 0.00 0.00 175.52 177.64 2fy2 h GLN 214 N 0.89 1.00 -0.66 6.66 1.08 -0.45 -2.52 115.11 121.10 2fy2 h GLN 214 Ca 0.22 -0.34 -0.04 0.00 -1.45 0.00 0.00 58.65 57.04 2fy2 h GLN 214 Cb 0.16 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.48 2fy2 h GLN 214 CO -0.02 1.01 0.26 -0.07 -0.95 0.00 0.00 178.83 179.06 2fy2 h LEU 215 N 0.88 0.90 -0.66 1.46 3.38 -0.52 -1.35 115.31 119.40 2fy2 h LEU 215 Ca 0.15 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2fy2 h LEU 215 Cb 0.58 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 2fy2 h LEU 215 CO 0.03 0.81 0.41 0.03 0.09 0.00 0.00 178.44 179.81 2fy2 h ARG 216 N 0.96 0.90 -0.51 1.13 3.08 -1.06 -0.65 114.38 118.22 2fy2 h ARG 216 Ca 0.22 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 2fy2 h ARG 216 Cb 0.20 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2fy2 h ARG 216 CO -0.02 0.63 0.28 0.87 -1.07 0.00 0.00 179.97 180.67 2fy2 h LYS 217 N 0.90 0.71 0.13 0.04 1.57 -0.99 -2.26 116.57 116.67 2fy2 h LYS 217 Ca 0.24 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2fy2 h LYS 217 Cb -0.04 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 2fy2 h LYS 217 CO -0.05 0.55 -0.18 0.82 -0.57 0.00 0.00 179.45 180.02 2fy2 h ILE 218 N 0.68 0.59 -0.96 1.86 2.04 -0.68 -0.90 117.51 120.15 2fy2 h ILE 218 Ca 0.18 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.21 2fy2 h ILE 218 Cb 0.04 0.59 -0.08 0.00 -0.74 0.00 0.00 36.82 36.63 2fy2 h ILE 218 CO -0.03 0.00 0.60 0.58 0.00 0.00 0.00 178.15 179.31 2fy2 h VAL 219 N -0.37 0.78 0.01 1.67 2.07 -0.96 0.12 116.25 119.57 2fy2 h VAL 219 Ca 0.02 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 2fy2 h VAL 219 Cb 0.37 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2fy2 h VAL 219 CO -0.08 0.13 -0.00 0.50 0.02 0.00 0.00 177.57 178.14 2fy2 h LYS 220 N 0.72 -0.01 -0.59 1.57 3.64 -0.79 -2.91 116.57 118.20 2fy2 h LYS 220 Ca 0.51 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.87 2fy2 h LYS 220 Cb 0.82 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 2fy2 h LYS 220 CO -0.27 0.45 0.31 0.52 -2.27 0.00 0.00 179.45 178.19 2fy2 h MET 221 N -0.47 0.84 -0.21 1.90 2.86 -0.62 -2.08 114.93 117.16 2fy2 h MET 221 Ca -0.00 -0.11 0.06 0.00 -2.06 0.00 0.00 59.70 57.59 2fy2 h MET 221 Cb 0.46 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2fy2 h MET 221 CO 0.00 0.66 0.26 0.00 1.06 0.00 0.00 176.91 178.89 2fy2 h ALA 222 N 1.13 1.79 -0.26 6.32 0.00 -0.79 0.20 119.26 127.66 2fy2 h ALA 222 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2fy2 h ALA 222 Cb 0.08 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2fy2 h ALA 222 CO -0.03 -0.37 0.00 0.43 0.00 0.00 0.00 179.25 179.28 2fy2 n SER 223 N -3.66 1.77 -4.53 0.00 7.64 -0.78 -4.83 113.62 109.23 2fy2 n SER 223 Ca 0.02 -1.86 -0.43 0.00 1.01 0.00 0.00 58.87 57.61 2fy2 n SER 223 Cb 0.38 -0.17 -0.05 0.00 -1.01 0.00 0.00 64.21 63.36 2fy2 n SER 223 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2fy2 s ASN 224 N -1.27 6.37 0.12 6.43 3.84 0.70 -4.94 114.94 126.19 2fy2 s ASN 224 Ca 0.28 -0.26 -0.20 0.00 0.21 0.00 0.00 52.86 52.89 2fy2 s ASN 224 Cb 0.15 -2.39 -0.06 0.00 -0.55 0.00 0.00 41.25 38.39 2fy2 s ASN 224 CO 0.21 -1.01 1.75 0.00 -2.79 0.00 0.00 177.10 175.26 2fy2 h ALA 225 N 9.09 0.19 0.00 1.71 0.00 -1.88 -2.05 119.26 126.32 2fy2 h ALA 225 Ca -0.25 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2fy2 h ALA 225 Cb 1.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2fy2 h ALA 225 CO 1.00 -0.37 0.00 0.00 0.00 0.00 0.00 179.25 179.89 2fy2 h ALA 226 N 1.10 1.00 -0.06 0.00 0.00 -1.98 -1.77 119.26 117.55 2fy2 h ALA 226 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2fy2 h ALA 226 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2fy2 h ALA 226 CO -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.18 2fy2 n ALA 227 N -1.83 2.41 -1.98 0.00 0.00 -0.85 -5.02 120.51 113.24 2fy2 n ALA 227 Ca -0.02 -0.68 -0.42 0.00 0.00 0.00 0.00 53.44 52.33 2fy2 n ALA 227 Cb 0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 19.45 19.18 2fy2 n ALA 227 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2fy2 s ARG 228 N -0.75 4.28 0.32 0.00 3.52 -0.67 -5.02 118.95 120.63 2fy2 s ARG 228 Ca 0.11 2.23 0.08 0.00 -0.13 0.00 0.00 55.73 58.03 2fy2 s ARG 228 Cb 0.07 -3.17 -0.04 0.00 -1.56 0.00 0.00 34.95 30.26 2fy2 s ARG 228 CO 0.11 -0.46 0.17 -0.51 -0.81 0.00 0.00 175.30 173.79 2fy2 s LEU 229 N 0.49 3.40 0.67 -0.88 1.43 -1.26 -5.07 118.68 117.46 2fy2 s LEU 229 Ca 0.64 -0.62 -0.17 0.00 -1.03 0.00 0.00 54.13 52.94 2fy2 s LEU 229 Cb -0.41 -1.93 -0.01 0.00 0.03 0.00 0.00 46.19 43.88 2fy2 s LEU 229 CO 0.36 -0.24 1.12 -2.65 0.23 0.00 0.00 176.35 175.17 2fy2 n PRO 230 N -1.17 0.84 -1.51 1.29 -0.02 -1.26 -4.85 135.00 128.31 2fy2 n PRO 230 Ca -0.04 0.34 -0.40 0.00 -2.02 0.00 0.00 63.50 61.38 2fy2 n PRO 230 Cb 0.60 -2.36 -0.01 0.00 -0.02 0.00 0.00 33.50 31.71 2fy2 n PRO 230 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2fy2 n PRO 231 N -1.76 3.08 -0.08 0.52 -0.04 -1.26 -4.75 135.00 130.70 2fy2 n PRO 231 Ca 0.15 -2.38 0.25 0.00 -0.04 0.00 0.00 63.50 61.47 2fy2 n PRO 231 Cb 0.48 -3.06 0.71 0.00 -0.04 0.00 0.00 33.50 31.60 2fy2 n PRO 231 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2fy2 h ILE 232 N 3.64 0.59 -0.00 0.52 1.08 -1.89 -0.97 117.51 120.48 2fy2 h ILE 232 Ca 0.67 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.14 2fy2 h ILE 232 Cb 0.49 0.63 -0.00 0.00 -3.07 0.00 0.00 36.82 34.87 2fy2 h ILE 232 CO 1.84 0.00 0.00 1.23 -0.69 0.00 0.00 178.15 180.53 2fy2 h GLY 233 N 0.00 0.00 1.87 5.37 0.00 -1.76 -1.61 103.07 106.94 2fy2 h GLY 233 Ca 0.33 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.68 2fy2 h GLY 233 CO -0.00 0.00 0.05 -2.00 0.00 0.00 0.00 176.54 174.58 2fy2 h LEU 234 N 0.00 0.00 -1.43 3.11 6.46 -1.31 -2.13 115.31 120.01 2fy2 h LEU 234 Ca 0.00 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.70 2fy2 h LEU 234 Cb 0.00 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.92 2fy2 h LEU 234 CO -0.00 0.00 -0.29 -0.07 -0.62 0.00 0.00 178.44 177.46 2fy2 h LEU 235 N 0.00 0.00 0.00 2.25 3.38 -1.48 -2.61 115.31 116.85 2fy2 h LEU 235 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2fy2 h LEU 235 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2fy2 h LEU 235 CO -0.00 0.29 0.00 0.35 0.09 0.00 0.00 178.44 179.17 2fy2 n THR 236 N -4.18 0.21 1.17 0.22 -2.24 -0.80 -2.87 114.28 105.80 2fy2 n THR 236 Ca -0.02 0.05 0.12 0.00 -2.27 0.00 0.00 64.05 61.94 2fy2 n THR 236 Cb 0.34 -0.65 0.23 0.00 -2.10 0.00 0.00 70.33 68.15 2fy2 n THR 236 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2fy2 n SER 237 N -1.27 1.91 -4.29 3.42 3.41 -0.98 -4.47 113.62 111.33 2fy2 n SER 237 Ca 0.12 -1.48 -0.27 0.00 -0.26 0.00 0.00 58.87 56.98 2fy2 n SER 237 Cb 0.19 0.17 0.16 0.00 -0.26 0.00 0.00 64.21 64.47 2fy2 n SER 237 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2fy2 s ASP 238 N -2.26 3.48 0.81 4.04 -1.08 -1.14 -4.58 116.67 115.95 2fy2 s ASP 238 Ca 0.27 -0.08 -0.14 0.00 -0.52 0.00 0.00 52.55 52.08 2fy2 s ASP 238 Cb 0.19 -0.03 0.06 0.00 -1.46 0.00 0.00 42.92 41.68 2fy2 s ASP 238 CO 0.44 -2.47 1.03 0.61 0.52 0.00 0.00 175.17 175.31 2fy2 n GLY 239 N -3.42 -0.42 0.32 2.66 0.00 -1.26 -4.23 105.19 98.84 2fy2 n GLY 239 Ca 0.16 -0.51 -0.04 0.00 0.00 0.00 0.00 46.02 45.63 2fy2 n GLY 239 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2fy2 h ARG 240 N -0.93 1.03 -0.13 1.61 2.47 -1.29 -0.53 114.38 116.61 2fy2 h ARG 240 Ca -0.46 -0.20 -0.18 0.00 -1.26 0.00 0.00 59.98 57.89 2fy2 h ARG 240 Cb 1.30 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 29.46 2fy2 h ARG 240 CO 0.44 0.87 -0.67 0.77 0.56 0.00 0.00 179.97 181.94 2fy2 h SER 241 N 1.00 0.59 -0.45 7.04 0.02 -1.77 -1.32 113.55 118.66 2fy2 h SER 241 Ca 0.23 -0.36 -0.12 0.00 -0.84 0.00 0.00 61.79 60.70 2fy2 h SER 241 Cb 0.25 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 2fy2 h SER 241 CO -0.01 1.09 -0.16 -0.33 -1.14 0.00 0.00 176.83 176.28 2fy2 h GLU 242 N 0.36 0.93 -0.29 3.45 3.07 -1.84 -1.70 114.58 118.57 2fy2 h GLU 242 Ca -0.02 -0.36 -0.17 0.00 -0.50 0.00 0.00 59.36 58.31 2fy2 h GLU 242 Cb 1.24 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 29.09 2fy2 h GLU 242 CO 0.12 1.02 -0.49 2.35 -1.40 0.00 0.00 179.01 180.60 2fy2 h TRP 243 N 0.82 0.98 -0.91 4.33 -0.00 -1.06 -2.18 115.95 117.93 2fy2 h TRP 243 Ca 0.12 -0.33 0.00 0.00 -0.00 0.00 0.00 58.89 58.69 2fy2 h TRP 243 Cb 0.70 -0.19 -0.04 0.00 -0.00 0.00 0.00 29.16 29.63 2fy2 h TRP 243 CO 0.04 1.13 0.58 0.00 -0.00 0.00 0.00 178.44 180.19 2fy2 h ALA 244 N 0.81 1.16 -0.37 2.65 0.00 -1.06 0.23 119.26 122.67 2fy2 h ALA 244 Ca 0.03 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2fy2 h ALA 244 Cb 1.08 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2fy2 h ALA 244 CO 0.11 0.59 -0.06 1.49 0.00 0.00 0.00 179.25 181.38 2fy2 h GLU 245 N 1.25 0.69 -0.48 0.00 4.81 -1.19 -1.89 114.58 117.77 2fy2 h GLU 245 Ca 0.33 -0.25 -0.12 0.00 -0.13 0.00 0.00 59.36 59.19 2fy2 h GLU 245 Cb -0.10 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 2fy2 h GLU 245 CO -0.07 0.83 -0.17 0.00 -0.73 0.00 0.00 179.01 178.87 2fy2 h ALA 246 N 0.84 0.79 -0.41 2.92 0.00 -0.99 -2.62 119.26 119.79 2fy2 h ALA 246 Ca 0.10 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2fy2 h ALA 246 Cb 0.55 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2fy2 h ALA 246 CO 0.03 0.66 0.08 -0.09 0.00 0.00 0.00 179.25 179.93 2fy2 h ARG 247 N 0.83 0.61 -0.80 0.00 2.43 -0.48 -1.69 114.38 115.28 2fy2 h ARG 247 Ca 0.12 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 2fy2 h ARG 247 Cb 0.72 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.13 2fy2 h ARG 247 CO 0.06 0.58 0.43 1.15 -1.51 0.00 0.00 179.97 180.67 2fy2 h THR 248 N 0.60 1.24 -0.22 0.20 2.02 -0.97 -0.07 112.91 115.70 2fy2 h THR 248 Ca 0.14 -0.61 -0.03 0.00 0.77 0.00 0.00 66.41 66.68 2fy2 h THR 248 Cb 0.26 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 2fy2 h THR 248 CO -0.00 0.27 0.02 0.58 0.37 0.00 0.00 175.52 176.76 2fy2 h VAL 249 N 1.12 1.24 -0.23 3.16 2.07 -1.13 -3.20 116.25 119.28 2fy2 h VAL 249 Ca 0.28 -0.80 0.05 0.00 0.82 0.00 0.00 66.70 67.05 2fy2 h VAL 249 Cb 0.04 1.34 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 2fy2 h VAL 249 CO -0.04 0.25 -0.11 -0.07 0.02 0.00 0.00 177.57 177.61 2fy2 h LEU 250 N 0.16 -0.38 -1.97 2.57 3.38 -0.60 -2.55 115.31 115.92 2fy2 h LEU 250 Ca 0.07 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2fy2 h LEU 250 Cb 0.35 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2fy2 h LEU 250 CO 0.01 -0.15 0.17 0.58 0.09 0.00 0.00 178.44 179.14 2fy2 h VAL 251 N -0.08 0.00 -0.60 1.22 2.07 -1.03 -2.15 116.25 115.67 2fy2 h VAL 251 Ca 0.13 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.69 2fy2 h VAL 251 Cb 0.27 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 2fy2 h VAL 251 CO -0.29 0.00 0.40 0.11 0.02 0.00 0.00 177.57 177.81 2fy2 h LYS 252 N 0.00 0.62 -5.88 1.57 1.57 -1.51 -3.42 116.57 109.52 2fy2 h LYS 252 Ca 0.00 -0.04 -0.60 0.00 -1.87 0.00 0.00 60.65 58.14 2fy2 h LYS 252 Cb 0.33 -0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.44 2fy2 h LYS 252 CO 0.00 0.41 -0.20 0.34 -0.57 0.00 0.00 179.45 179.43 2fy2 s ASP 253 N -6.37 6.74 0.38 0.86 -1.08 -0.81 -5.00 116.67 111.38 2fy2 s ASP 253 Ca -0.09 0.87 0.04 0.00 -0.52 0.00 0.00 52.55 52.86 2fy2 s ASP 253 Cb 0.19 -2.25 0.73 0.00 -1.46 0.00 0.00 42.92 40.12 2fy2 s ASP 253 CO 0.75 0.22 2.03 -1.28 0.52 0.00 0.00 175.17 177.41 2fy2 h SER 254 N 5.45 0.62 -0.18 -0.34 0.87 -1.87 -2.06 113.55 116.04 2fy2 h SER 254 Ca -0.48 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.01 2fy2 h SER 254 Cb 1.20 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 63.00 2fy2 h SER 254 CO 0.67 0.45 -0.10 0.74 -0.53 0.00 0.00 176.83 178.06 2fy2 h THR 255 N 0.73 1.31 -0.92 2.23 2.02 -1.94 -2.69 112.91 113.65 2fy2 h THR 255 Ca 0.20 -1.17 -0.01 0.00 0.77 0.00 0.00 66.41 66.20 2fy2 h THR 255 Cb -0.08 1.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.99 2fy2 h THR 255 CO -0.04 0.35 0.53 0.78 0.37 0.00 0.00 175.52 177.50 2fy2 h ASN 256 N 0.06 1.14 -0.82 4.18 2.35 -1.74 -1.97 115.58 118.77 2fy2 h ASN 256 Ca 0.04 -0.09 0.05 0.00 -0.55 0.00 0.00 56.30 55.75 2fy2 h ASN 256 Cb 0.59 -0.29 -0.06 0.00 0.05 0.00 0.00 38.32 38.61 2fy2 h ASN 256 CO 0.03 0.89 0.52 0.03 -1.65 0.00 0.00 177.43 177.25 2fy2 h ARG 257 N 1.29 0.94 -0.16 0.81 3.08 -1.30 0.26 114.38 119.30 2fy2 h ARG 257 Ca 0.33 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 2fy2 h ARG 257 Cb -0.01 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.82 2fy2 h ARG 257 CO -0.06 0.62 0.05 -0.44 -1.07 0.00 0.00 179.97 179.07 2fy2 h ASP 258 N 0.97 0.23 -0.35 7.04 5.19 -1.08 -1.01 116.42 127.41 2fy2 h ASP 258 Ca 0.35 -0.21 -0.02 0.00 -0.62 0.00 0.00 57.03 56.52 2fy2 h ASP 258 Cb 0.10 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.54 2fy2 h ASP 258 CO -0.15 0.38 0.13 0.28 -3.12 0.00 0.00 179.24 176.76 2fy2 h SER 259 N 0.07 0.49 -0.56 6.45 0.02 -0.96 -1.84 113.55 117.22 2fy2 h SER 259 Ca 0.05 -0.18 0.03 0.00 -0.84 0.00 0.00 61.79 60.85 2fy2 h SER 259 Cb 0.24 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 2fy2 h SER 259 CO -0.00 0.54 0.34 -0.07 -1.14 0.00 0.00 176.83 176.49 2fy2 h LEU 260 N 0.41 0.55 -0.75 5.07 3.38 -0.94 -1.89 115.31 121.14 2fy2 h LEU 260 Ca 0.11 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.17 2fy2 h LEU 260 Cb 0.21 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 2fy2 h LEU 260 CO -0.01 0.38 0.41 -0.78 0.09 0.00 0.00 178.44 178.54 2fy2 h ASP 261 N 0.67 0.58 -0.61 -0.43 3.58 -0.82 0.94 116.42 120.33 2fy2 h ASP 261 Ca 0.23 0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.68 2fy2 h ASP 261 Cb 0.03 -0.06 -0.03 0.00 1.72 0.00 0.00 39.33 40.99 2fy2 h ASP 261 CO -0.10 0.34 0.20 0.24 -2.88 0.00 0.00 179.24 177.05 2fy2 h MET 262 N 0.71 0.97 -0.23 0.28 2.86 -0.62 -1.85 114.93 117.05 2fy2 h MET 262 Ca 0.36 -0.19 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 2fy2 h MET 262 Cb 0.32 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 2fy2 h MET 262 CO -0.24 0.83 -0.14 0.82 1.06 0.00 0.00 176.91 179.24 2fy2 h ILE 263 N 0.94 1.31 0.00 -1.22 2.04 -0.53 -2.63 117.51 117.42 2fy2 h ILE 263 Ca 0.21 -1.24 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 2fy2 h ILE 263 Cb 0.26 1.62 -0.00 0.00 -0.74 0.00 0.00 36.82 37.96 2fy2 h ILE 263 CO -0.01 0.38 -0.03 -0.33 0.00 0.00 0.00 178.15 178.17 2fy2 h GLU 264 N 0.21 0.00 -0.30 2.37 5.08 -0.57 -2.85 114.58 118.51 2fy2 h GLU 264 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2fy2 h GLU 264 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 2fy2 h GLU 264 CO 0.04 0.03 0.00 0.54 -1.00 0.00 0.00 179.01 178.62 2fy2 n ARG 265 N -3.59 2.50 -1.62 2.33 1.74 -0.72 -4.73 116.66 112.56 2fy2 n ARG 265 Ca -0.03 -1.93 -0.30 0.00 -0.77 0.00 0.00 57.85 54.83 2fy2 n ARG 265 Cb 0.12 -1.27 0.08 0.00 -1.02 0.00 0.00 32.46 30.37 2fy2 n ARG 265 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2fy2 h ILE 267 N -1.00 1.34 0.00 0.00 2.04 -1.39 -3.45 117.51 115.05 2fy2 h ILE 267 Ca -0.47 -2.19 0.00 0.00 1.00 0.00 0.00 64.86 63.20 2fy2 h ILE 267 Cb 1.27 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 39.54 2fy2 h ILE 267 CO 0.60 0.67 0.00 0.00 0.00 0.00 0.00 178.15 179.42 2fy2 s LEU 269 N 0.00 3.43 -0.17 0.00 1.02 -0.58 -1.50 118.68 120.88 2fy2 s LEU 269 Ca 0.00 -0.31 -0.01 0.00 0.02 0.00 0.00 54.13 53.83 2fy2 s LEU 269 Cb 0.00 -2.08 0.05 0.00 0.02 0.00 0.00 46.19 44.17 2fy2 s LEU 269 CO 0.00 0.10 -0.03 -0.69 0.02 0.00 0.00 176.35 175.75 2fy2 s VAL 270 N -1.68 0.97 -0.37 -1.59 1.01 0.36 -1.21 120.40 117.89 2fy2 s VAL 270 Ca 0.28 -0.63 -0.13 0.00 0.00 0.00 0.00 61.98 61.50 2fy2 s VAL 270 Cb -0.10 -1.23 0.00 0.00 0.00 0.00 0.00 36.38 35.05 2fy2 s VAL 270 CO 0.19 0.04 0.26 0.00 0.00 0.00 0.00 175.10 175.59 2fy2 s LEU 272 N 1.69 4.89 0.34 0.00 1.43 0.86 -0.58 118.68 127.31 2fy2 s LEU 272 Ca 0.05 -2.43 -0.27 0.00 -1.03 0.00 0.00 54.13 50.45 2fy2 s LEU 272 Cb -0.18 -2.42 -0.09 0.00 0.03 0.00 0.00 46.19 43.53 2fy2 s LEU 272 CO 0.10 -0.96 1.14 -1.81 0.23 0.00 0.00 176.35 175.05 2fy2 s ASP 273 N 3.41 6.88 1.25 2.29 1.11 -1.21 -4.41 116.67 125.99 2fy2 s ASP 273 Ca 0.39 2.32 -0.20 0.00 0.18 0.00 0.00 52.55 55.24 2fy2 s ASP 273 Cb -0.03 -2.62 0.30 0.00 1.07 0.00 0.00 42.92 41.64 2fy2 s ASP 273 CO -0.04 -0.42 1.06 0.00 1.18 0.00 0.00 175.17 176.95 2fy2 s ALA 274 N -1.31 0.26 0.43 5.23 0.00 -1.26 -1.79 121.76 123.32 2fy2 s ALA 274 Ca 0.51 -0.86 -0.26 0.00 0.00 0.00 0.00 51.96 51.35 2fy2 s ALA 274 Cb -0.31 -2.92 -0.09 0.00 0.00 0.00 0.00 23.12 19.79 2fy2 s ALA 274 CO 0.40 -3.81 1.38 -0.35 0.00 0.00 0.00 175.76 173.38 2fy2 n PRO 275 N -4.95 2.19 -1.29 0.00 -0.04 -1.26 -4.47 135.00 125.17 2fy2 n PRO 275 Ca 0.12 0.78 -0.30 0.00 -0.04 0.00 0.00 63.50 64.06 2fy2 n PRO 275 Cb 0.59 -2.54 0.11 0.00 -0.04 0.00 0.00 33.50 31.62 2fy2 n PRO 275 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2fy2 s GLY 276 N -0.45 1.65 -0.09 0.55 0.00 -1.26 -4.96 107.32 102.75 2fy2 s GLY 276 Ca 0.60 0.07 0.16 0.00 0.00 0.00 0.00 44.72 45.55 2fy2 s GLY 276 CO 0.59 0.48 0.20 0.61 0.00 0.00 0.00 173.10 174.98 2fy2 n GLY 277 N -1.33 -0.78 4.02 0.20 0.00 -1.26 -5.01 105.19 101.03 2fy2 n GLY 277 Ca 0.08 -0.33 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 2fy2 n GLY 277 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2fy2 s VAL 278 N -2.76 2.01 0.49 1.61 -7.23 -1.26 -5.08 120.40 108.18 2fy2 s VAL 278 Ca -0.07 -0.84 -0.22 0.00 -1.81 0.00 0.00 61.98 59.04 2fy2 s VAL 278 Cb 0.08 -2.17 -0.07 0.00 0.56 0.00 0.00 36.38 34.78 2fy2 s VAL 278 CO 0.68 0.00 1.16 -0.70 -0.31 0.00 0.00 175.10 175.93 2fy2 s GLU 279 N -4.92 3.58 0.00 4.82 2.12 -1.26 -4.93 118.70 118.11 2fy2 s GLU 279 Ca 0.65 1.74 0.00 0.00 0.36 0.00 0.00 54.97 57.73 2fy2 s GLU 279 Cb -0.05 -2.26 0.00 0.00 0.26 0.00 0.00 34.13 32.09 2fy2 s GLU 279 CO 0.42 -0.69 1.38 1.28 -0.54 0.00 0.00 175.26 177.11 2fy2 n LEU 280 N -0.80 3.83 -4.59 2.70 4.77 -1.26 -4.69 117.00 116.97 2fy2 n LEU 280 Ca 0.09 -1.79 -0.28 0.00 -0.03 0.00 0.00 56.01 53.99 2fy2 n LEU 280 Cb 0.49 -0.75 0.21 0.00 -2.33 0.00 0.00 43.42 41.04 2fy2 n LEU 280 CO 0.46 0.69 0.59 -0.94 -1.33 0.00 0.00 177.39 176.86 2fy2 s SER 281 N 1.51 1.81 0.23 -1.43 1.04 -1.26 -4.71 113.70 110.88 2fy2 s SER 281 Ca 0.00 1.27 -0.07 0.00 0.48 0.00 0.00 55.95 57.63 2fy2 s SER 281 Cb 0.00 -1.99 0.20 0.00 0.10 0.00 0.00 66.02 64.33 2fy2 s SER 281 CO 0.00 -3.65 1.84 0.44 0.98 0.00 0.00 173.24 172.85 2fy2 h ASP 282 N -2.25 1.12 -0.43 7.02 3.32 -1.97 -1.28 116.42 121.96 2fy2 h ASP 282 Ca -0.58 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 56.30 2fy2 h ASP 282 Cb 1.34 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.58 2fy2 h ASP 282 CO 0.55 0.92 0.06 0.74 -1.72 0.00 0.00 179.24 179.78 2fy2 h THR 283 N 1.25 1.25 -0.34 0.35 2.02 -1.91 -2.41 112.91 113.12 2fy2 h THR 283 Ca 0.31 -0.92 -0.11 0.00 0.77 0.00 0.00 66.41 66.46 2fy2 h THR 283 Cb 0.06 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 2fy2 h THR 283 CO -0.05 0.32 -0.21 0.45 0.37 0.00 0.00 175.52 176.40 2fy2 h HIS 284 N 0.58 0.86 -0.71 3.16 3.86 -1.78 -2.00 115.15 119.11 2fy2 h HIS 284 Ca 0.13 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 59.08 2fy2 h HIS 284 Cb 0.40 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.64 2fy2 h HIS 284 CO 0.03 0.96 0.32 0.00 0.86 0.00 0.00 177.93 180.10 2fy2 h ARG 285 N 0.51 1.02 -0.71 2.45 3.08 -1.25 -1.85 114.38 117.63 2fy2 h ARG 285 Ca 0.07 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 2fy2 h ARG 285 Cb 0.76 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 2fy2 h ARG 285 CO 0.06 0.80 0.20 0.00 -1.07 0.00 0.00 179.97 179.96 2fy2 h ALA 286 N 1.34 0.94 -0.92 0.04 0.00 -1.32 -2.38 119.26 116.96 2fy2 h ALA 286 Ca 0.24 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2fy2 h ALA 286 Cb 0.13 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 2fy2 h ALA 286 CO -0.03 0.64 0.59 -0.07 0.00 0.00 0.00 179.25 180.38 2fy2 h LEU 287 N 1.06 0.98 -0.93 0.00 3.38 -0.58 0.94 115.31 120.16 2fy2 h LEU 287 Ca 0.23 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.11 2fy2 h LEU 287 Cb 0.34 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2fy2 h LEU 287 CO -0.00 0.66 -0.16 -0.61 0.09 0.00 0.00 178.44 178.42 2fy2 h GLN 288 N 1.14 0.61 0.00 1.13 4.15 -1.04 -1.76 115.11 119.33 2fy2 h GLN 288 Ca 0.37 -0.20 -0.12 0.00 0.77 0.00 0.00 58.65 59.47 2fy2 h GLN 288 Cb 0.03 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 2fy2 h GLN 288 CO -0.13 0.74 -0.56 -0.07 -1.93 0.00 0.00 178.83 176.88 2fy2 h LEU 289 N 0.55 0.00 0.01 -2.39 -0.00 -0.84 0.26 115.31 112.90 2fy2 h LEU 289 Ca 0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2fy2 h LEU 289 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.25 2fy2 h LEU 289 CO 0.04 0.56 -0.01 -0.07 -0.00 0.00 0.00 178.44 178.96 2fy2 h LEU 290 N 0.00 -0.01 -1.74 1.67 3.38 -0.47 -3.43 115.31 114.71 2fy2 h LEU 290 Ca -0.01 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.22 2fy2 h LEU 290 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2fy2 h LEU 290 CO 0.07 0.76 -0.33 0.00 0.09 0.00 0.00 178.44 179.03 2fy2 n HIS 291 N -4.72 0.00 -0.63 1.13 1.44 -0.70 -4.04 115.22 107.69 2fy2 n HIS 291 Ca -0.09 -0.03 0.00 0.00 -2.01 0.00 0.00 57.72 55.59 2fy2 n HIS 291 Cb 0.37 -0.04 0.00 0.00 0.12 0.00 0.00 29.99 30.44 2fy2 n HIS 291 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2fy2 n GLY 292 N -0.04 0.14 1.83 -1.39 0.00 0.93 -2.46 105.19 104.19 2fy2 n GLY 292 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2fy2 n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fy2 n GLY 293 N -1.66 0.53 0.00 -0.02 0.00 -1.26 -0.54 105.19 102.24 2fy2 n GLY 293 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2fy2 n GLY 293 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fy2 n GLY 294 N -2.92 0.03 0.29 -0.02 0.00 -1.03 -4.25 105.19 97.29 2fy2 n GLY 294 Ca 0.00 -1.83 0.03 0.00 0.00 0.00 0.00 46.02 44.23 2fy2 n GLY 294 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2fy2 h TYR 295 N 0.00 0.70 -0.11 1.61 3.20 -1.87 0.22 116.97 120.71 2fy2 h TYR 295 Ca 0.00 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.93 2fy2 h TYR 295 Cb 0.00 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.07 2fy2 h TYR 295 CO 0.00 0.23 0.14 0.66 -1.64 0.00 0.00 178.16 177.55 2fy2 h SER 296 N 0.63 0.00 0.00 -2.11 4.64 -1.95 -3.40 113.55 111.36 2fy2 h SER 296 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2fy2 h SER 296 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 2fy2 h SER 296 CO -0.30 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 175.95 2fy2 n LYS 297 N -3.71 0.00 -0.22 4.77 4.76 -0.47 -4.98 118.16 118.31 2fy2 n LYS 297 Ca -0.00 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.51 2fy2 n LYS 297 Cb 0.25 0.00 0.16 0.00 -1.84 0.00 0.00 35.03 33.60 2fy2 n LYS 297 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2fy2 n ASN 298 N 0.00 2.99 0.24 4.39 3.02 0.30 -4.74 115.26 121.46 2fy2 n ASN 298 Ca 0.00 -2.65 0.15 0.00 -0.03 0.00 0.00 54.58 52.05 2fy2 n ASN 298 Cb 0.00 -0.36 0.83 0.00 -0.61 0.00 0.00 39.78 39.64 2fy2 n ASN 298 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2fy2 h GLY 299 N 1.11 0.00 -0.13 7.41 0.00 -0.40 -2.24 103.07 108.82 2fy2 h GLY 299 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2fy2 h GLY 299 CO 0.08 0.00 -0.75 0.00 0.00 0.00 0.00 176.54 175.87 2fy2 n ALA 300 N -2.38 4.20 -1.29 3.60 0.00 -1.26 -4.45 120.51 118.92 2fy2 n ALA 300 Ca -0.01 -0.57 -0.23 0.00 0.00 0.00 0.00 53.44 52.64 2fy2 n ALA 300 Cb 0.19 -0.84 -0.10 0.00 0.00 0.00 0.00 19.45 18.70 2fy2 n ALA 300 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2fy2 n ASN 301 N -1.05 6.28 -3.56 0.00 5.15 -0.84 -4.06 115.26 117.17 2fy2 n ASN 301 Ca 0.06 -2.81 -0.11 0.00 -0.60 0.00 0.00 54.58 51.12 2fy2 n ASN 301 Cb 0.37 -1.36 -0.04 0.00 -0.53 0.00 0.00 39.78 38.22 2fy2 n ASN 301 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2fy2 s ARG 302 N -0.06 1.78 -0.29 1.20 1.81 -1.26 -4.83 118.95 117.29 2fy2 s ARG 302 Ca 0.63 -1.49 0.04 0.00 -1.72 0.00 0.00 55.73 53.19 2fy2 s ARG 302 Cb 0.32 0.48 0.19 0.00 -0.45 0.00 0.00 34.95 35.49 2fy2 s ARG 302 CO -0.10 -0.75 0.58 -0.46 -0.68 0.00 0.00 175.30 173.89 2fy2 s TRP 303 N -3.40 -1.74 -0.17 -0.53 -0.11 -1.26 -4.38 118.94 107.35 2fy2 s TRP 303 Ca 0.25 1.20 0.19 0.00 1.22 0.00 0.00 56.10 58.96 2fy2 s TRP 303 Cb -0.01 0.35 0.32 0.00 -1.50 0.00 0.00 33.47 32.63 2fy2 s TRP 303 CO 0.14 -1.02 1.57 1.88 -4.62 0.00 0.00 176.95 174.89 2fy2 h TYR 304 N 8.01 0.00 0.00 5.86 -1.99 -1.87 -3.17 116.97 123.82 2fy2 h TYR 304 Ca -0.07 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.62 2fy2 h TYR 304 Cb 1.18 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.90 2fy2 h TYR 304 CO 0.22 0.31 -0.15 -0.44 -0.00 0.00 0.00 178.16 178.10 2fy2 h ASP 305 N 0.00 0.00 -3.43 3.88 3.32 -1.85 -3.41 116.42 114.92 2fy2 h ASP 305 Ca -0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 2fy2 h ASP 305 Cb 1.15 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 2fy2 h ASP 305 CO 0.04 0.15 0.45 -0.75 -1.72 0.00 0.00 179.24 177.42 2fy2 s LYS 306 N -4.47 4.56 0.18 3.56 2.47 -1.20 -1.11 119.74 123.73 2fy2 s LYS 306 Ca -0.04 1.62 -0.15 0.00 -1.56 0.00 0.00 55.97 55.84 2fy2 s LYS 306 Cb 0.15 -3.35 0.15 0.00 -1.46 0.00 0.00 37.83 33.32 2fy2 s LYS 306 CO 0.65 -0.01 1.68 0.77 0.16 0.00 0.00 175.35 178.59 2fy2 h SER 307 N 5.99 -0.28 -3.21 1.43 0.02 -1.80 -3.40 113.55 112.30 2fy2 h SER 307 Ca -0.43 0.12 -0.65 0.00 -0.84 0.00 0.00 61.79 59.99 2fy2 h SER 307 Cb 1.21 0.23 -0.34 0.00 0.14 0.00 0.00 62.40 63.64 2fy2 h SER 307 CO 0.75 -0.10 -0.86 -0.76 -1.14 0.00 0.00 176.83 174.72 2fy2 s LEU 308 N -10.60 2.01 -0.28 5.07 1.43 -1.26 -0.72 118.68 114.33 2fy2 s LEU 308 Ca -0.14 -0.56 0.02 0.00 -1.03 0.00 0.00 54.13 52.42 2fy2 s LEU 308 Cb 0.16 -1.36 0.08 0.00 0.03 0.00 0.00 46.19 45.09 2fy2 s LEU 308 CO 0.72 0.06 -0.01 -1.10 0.23 0.00 0.00 176.35 176.25 2fy2 s GLN 309 N 0.89 1.51 -0.09 1.70 -0.21 -0.64 -1.52 119.66 121.30 2fy2 s GLN 309 Ca -0.06 -1.30 -0.22 0.00 0.02 0.00 0.00 55.36 53.80 2fy2 s GLN 309 Cb -0.15 -2.70 -0.04 0.00 1.00 0.00 0.00 33.01 31.12 2fy2 s GLN 309 CO -0.02 -0.75 0.62 -0.06 -2.12 0.00 0.00 175.29 172.95 2fy2 s PHE 310 N 1.25 3.55 -0.17 0.91 0.40 -0.35 -0.40 117.98 123.17 2fy2 s PHE 310 Ca 0.01 1.12 -0.07 0.00 -0.60 0.00 0.00 56.93 57.39 2fy2 s PHE 310 Cb -0.19 -2.72 -0.04 0.00 0.51 0.00 0.00 43.02 40.58 2fy2 s PHE 310 CO -0.10 0.11 0.05 0.08 0.70 0.00 0.00 175.22 176.06 2fy2 s VAL 311 N 0.77 4.70 -0.48 -0.44 1.01 0.17 -0.27 120.40 125.86 2fy2 s VAL 311 Ca 0.33 -0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.27 2fy2 s VAL 311 Cb -0.17 -3.10 0.15 0.00 0.00 0.00 0.00 36.38 33.26 2fy2 s VAL 311 CO 0.15 0.47 0.30 -0.69 0.00 0.00 0.00 175.10 175.33 2fy2 s VAL 312 N 0.28 1.43 0.47 2.92 1.01 0.25 -1.52 120.40 125.25 2fy2 s VAL 312 Ca 0.03 -2.82 -0.22 0.00 0.00 0.00 0.00 61.98 58.97 2fy2 s VAL 312 Cb -0.12 -1.99 -0.08 0.00 0.00 0.00 0.00 36.38 34.19 2fy2 s VAL 312 CO 0.01 -0.97 1.11 -0.83 0.00 0.00 0.00 175.10 174.41 2fy2 s GLY 313 N 0.03 2.68 0.41 4.51 0.00 0.88 -3.34 107.32 112.49 2fy2 s GLY 313 Ca 0.21 0.79 0.07 0.00 0.00 0.00 0.00 44.72 45.80 2fy2 s GLY 313 CO -0.06 1.19 2.03 -0.09 0.00 0.00 0.00 173.10 176.17 2fy2 h ARG 314 N 1.83 0.48 -0.04 2.90 9.65 -1.57 -1.71 114.38 125.92 2fy2 h ARG 314 Ca -0.49 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.34 2fy2 h ARG 314 Cb 1.24 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.72 2fy2 h ARG 314 CO 0.60 0.36 0.00 -0.40 2.80 0.00 0.00 179.97 183.33 2fy2 n ASP 315 N -4.44 0.94 0.00 -3.80 5.75 -1.26 -4.62 116.55 109.12 2fy2 n ASP 315 Ca 0.02 -1.40 0.00 0.00 -0.01 0.00 0.00 54.79 53.40 2fy2 n ASP 315 Cb 0.10 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.17 2fy2 n ASP 315 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2fy2 n GLY 316 N 1.07 0.58 3.61 6.12 0.00 -0.64 -4.66 105.19 111.27 2fy2 n GLY 316 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 2fy2 n GLY 316 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fy2 s THR 317 N -2.00 4.41 0.14 2.61 2.01 -1.26 -1.14 115.64 120.41 2fy2 s THR 317 Ca 0.00 1.38 0.05 0.00 0.31 0.00 0.00 61.69 63.43 2fy2 s THR 317 Cb 0.00 -4.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.00 2fy2 s THR 317 CO 0.00 -0.71 -0.12 0.00 -0.69 0.00 0.00 174.62 173.10 2fy2 n GLY 319 N 0.13 -0.77 2.90 0.00 0.00 -0.58 -1.66 105.19 105.20 2fy2 n GLY 319 Ca -0.12 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.78 2fy2 n GLY 319 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fy2 s VAL 320 N -3.00 -0.04 -0.21 1.61 0.11 -0.29 0.44 120.40 119.02 2fy2 s VAL 320 Ca 0.00 0.13 -0.12 0.00 -2.93 0.00 0.00 61.98 59.06 2fy2 s VAL 320 Cb 0.00 -0.17 -0.05 0.00 -1.53 0.00 0.00 36.38 34.64 2fy2 s VAL 320 CO 0.00 0.05 0.23 -0.69 -3.33 0.00 0.00 175.10 171.37 2fy2 s VAL 321 N 0.79 5.32 -0.10 2.04 1.01 0.46 -0.81 120.40 129.11 2fy2 s VAL 321 Ca -0.06 0.37 0.01 0.00 0.00 0.00 0.00 61.98 62.30 2fy2 s VAL 321 Cb -0.08 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 2fy2 s VAL 321 CO -0.03 0.35 -0.13 0.00 0.00 0.00 0.00 175.10 175.28 2fy2 s GLU 323 N -0.03 4.11 0.29 0.00 -6.30 0.10 -2.66 118.70 114.20 2fy2 s GLU 323 Ca -0.03 0.63 0.10 0.00 -2.50 0.00 0.00 54.97 53.17 2fy2 s GLU 323 Cb -0.14 -3.66 0.44 0.00 0.00 0.00 0.00 34.13 30.77 2fy2 s GLU 323 CO 0.04 -0.45 1.66 1.25 0.02 0.00 0.00 175.26 177.78 2fy2 h HIS 324 N 7.87 0.06 -0.71 5.30 2.76 -1.84 -3.38 115.15 125.20 2fy2 h HIS 324 Ca -0.26 -0.02 0.15 0.00 -2.20 0.00 0.00 60.37 58.04 2fy2 h HIS 324 Cb 1.11 -0.01 -0.13 0.00 1.55 0.00 0.00 27.41 29.93 2fy2 h HIS 324 CO 0.76 0.58 -0.09 0.66 -1.30 0.00 0.00 177.93 178.54 2fy2 h SER 325 N 0.04 -0.50 0.52 3.26 4.64 -1.94 -2.79 113.55 116.78 2fy2 h SER 325 Ca -0.00 0.20 -0.08 0.00 -0.47 0.00 0.00 61.79 61.43 2fy2 h SER 325 Cb 0.97 0.39 -0.01 0.00 -0.31 0.00 0.00 62.40 63.43 2fy2 h SER 325 CO 0.07 -0.20 -0.39 -0.65 -0.87 0.00 0.00 176.83 174.79 2fy2 h PRO 326 N 0.05 0.00 -2.64 4.77 0.11 -1.92 -3.47 132.00 128.89 2fy2 h PRO 326 Ca 0.37 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.55 2fy2 h PRO 326 Cb 0.60 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 31.60 2fy2 h PRO 326 CO -0.68 0.39 0.36 -0.59 -0.21 0.00 0.00 178.00 177.27 2fy2 s PHE 327 N -3.95 -0.33 0.42 0.65 -0.12 -1.05 -4.79 117.98 108.82 2fy2 s PHE 327 Ca -0.02 0.07 0.06 0.00 -0.05 0.00 0.00 56.93 57.00 2fy2 s PHE 327 Cb 0.13 0.60 0.06 0.00 -0.63 0.00 0.00 43.02 43.18 2fy2 s PHE 327 CO 0.71 -0.83 0.52 -0.25 -0.05 0.00 0.00 175.22 175.32 2fy2 n ASP 328 N -0.37 1.75 -0.26 1.98 8.00 -1.26 -4.71 116.55 121.68 2fy2 n ASP 328 Ca -0.10 -2.21 0.06 0.00 0.71 0.00 0.00 54.79 53.26 2fy2 n ASP 328 Cb 0.62 -0.24 0.20 0.00 -0.02 0.00 0.00 41.12 41.68 2fy2 n ASP 328 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2fy2 h GLY 329 N 0.18 1.17 0.87 0.44 0.00 -1.99 -2.24 103.07 101.50 2fy2 h GLY 329 Ca -0.22 -0.14 0.01 0.00 0.00 0.00 0.00 47.33 46.98 2fy2 h GLY 329 CO 0.32 -0.11 -0.02 -2.22 0.00 0.00 0.00 176.54 174.50 2fy2 h ILE 330 N 0.44 0.92 -0.36 2.60 1.08 -1.96 -0.88 117.51 119.35 2fy2 h ILE 330 Ca 0.43 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.80 2fy2 h ILE 330 Cb 0.66 0.92 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 2fy2 h ILE 330 CO -0.42 0.00 -0.16 0.58 -0.69 0.00 0.00 178.15 177.46 2fy2 h VAL 331 N -0.02 1.26 -0.55 1.67 2.07 -1.92 -2.01 116.25 116.74 2fy2 h VAL 331 Ca 0.03 -1.20 -0.04 0.00 0.82 0.00 0.00 66.70 66.31 2fy2 h VAL 331 Cb 0.06 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2fy2 h VAL 331 CO -0.07 0.40 0.17 0.25 0.02 0.00 0.00 177.57 178.35 2fy2 h LEU 332 N 0.59 0.80 -0.29 2.57 5.85 -1.03 -2.41 115.31 121.39 2fy2 h LEU 332 Ca 0.10 -0.20 -0.14 0.00 0.84 0.00 0.00 57.88 58.48 2fy2 h LEU 332 Cb 0.62 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 2fy2 h LEU 332 CO 0.04 0.79 -0.35 0.58 -0.34 0.00 0.00 178.44 179.16 2fy2 h VAL 333 N 0.77 1.30 -0.89 1.05 2.07 -1.03 -1.29 116.25 118.23 2fy2 h VAL 333 Ca 0.18 -1.53 0.02 0.00 0.82 0.00 0.00 66.70 66.19 2fy2 h VAL 333 Cb 0.28 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.61 2fy2 h VAL 333 CO -0.01 0.49 0.58 1.56 0.02 0.00 0.00 177.57 180.22 2fy2 h GLN 334 N 0.49 1.12 -0.07 1.57 1.08 -1.34 0.24 115.11 118.20 2fy2 h GLN 334 Ca 0.04 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 2fy2 h GLN 334 Cb 0.94 -0.25 -0.00 0.00 -0.05 0.00 0.00 27.48 28.11 2fy2 h GLN 334 CO 0.08 0.74 -0.01 0.00 -0.95 0.00 0.00 178.83 178.69 2fy2 h THR 336 N -0.19 1.08 0.00 0.00 2.02 -0.84 -1.94 112.91 113.04 2fy2 h THR 336 Ca 0.02 -0.20 -0.06 0.00 0.77 0.00 0.00 66.41 66.94 2fy2 h THR 336 Cb 0.38 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 2fy2 h THR 336 CO 0.01 0.08 -0.27 -0.33 0.37 0.00 0.00 175.52 175.38 2fy2 h GLU 337 N 0.21 0.00 -0.45 6.66 5.08 -0.59 -1.63 114.58 123.87 2fy2 h GLU 337 Ca 0.07 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.29 2fy2 h GLU 337 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2fy2 h GLU 337 CO -0.01 0.27 -0.23 1.25 -1.00 0.00 0.00 179.01 179.28 2fy2 h HIS 338 N 0.00 1.09 0.29 4.33 2.76 -1.10 -1.06 115.15 121.47 2fy2 h HIS 338 Ca -0.00 -0.28 -0.01 0.00 -2.20 0.00 0.00 60.37 57.88 2fy2 h HIS 338 Cb 0.47 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 29.18 2fy2 h HIS 338 CO 0.00 1.09 -0.17 -0.07 -1.30 0.00 0.00 177.93 177.48 2fy2 h LEU 339 N 0.78 -0.43 -0.89 0.26 3.38 -0.75 -0.50 115.31 117.16 2fy2 h LEU 339 Ca 0.10 0.02 0.24 0.00 0.09 0.00 0.00 57.88 58.33 2fy2 h LEU 339 Cb 0.81 0.12 -0.14 0.00 0.09 0.00 0.00 40.66 41.54 2fy2 h LEU 339 CO 0.07 -0.27 0.26 -0.07 0.09 0.00 0.00 178.44 178.52 2fy2 h LEU 340 N -0.43 0.03 -0.54 1.67 3.38 -1.35 0.33 115.31 118.41 2fy2 h LEU 340 Ca -0.04 0.20 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2fy2 h LEU 340 Cb 0.34 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2fy2 h LEU 340 CO 0.04 -0.15 -0.06 0.50 0.09 0.00 0.00 178.44 178.86 2fy2 h LYS 341 N 0.22 0.99 -0.04 1.13 3.64 -1.12 -2.24 116.57 119.15 2fy2 h LYS 341 Ca 0.56 -0.35 0.01 0.00 -1.27 0.00 0.00 60.65 59.61 2fy2 h LYS 341 Cb 1.14 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 2fy2 h LYS 341 CO -0.65 1.02 0.03 1.25 -2.27 0.00 0.00 179.45 178.83 2fy2 h HIS 342 N 0.87 0.00 0.00 1.91 2.76 0.13 0.16 115.15 120.97 2fy2 h HIS 342 Ca 0.15 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 2fy2 h HIS 342 Cb 0.61 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.57 2fy2 h HIS 342 CO 0.04 0.00 0.00 0.52 -1.30 0.00 0.00 177.93 177.19 2fy2 h MET 343 N 0.00 0.00 -0.00 5.26 2.86 -0.37 -2.79 114.93 119.89 2fy2 h MET 343 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2fy2 h MET 343 Cb 0.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.74 2fy2 h MET 343 CO -0.00 0.00 -0.09 0.25 1.06 0.00 0.00 176.91 178.13 2fy2 n THR 344 N -3.04 0.00 -3.44 2.22 -2.24 0.55 -4.92 114.28 103.41 2fy2 n THR 344 Ca 0.03 -0.04 -0.35 0.00 -2.27 0.00 0.00 64.05 61.42 2fy2 n THR 344 Cb 0.45 -0.22 -0.06 0.00 -2.10 0.00 0.00 70.33 68.41 2fy2 n THR 344 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2fy2 s GLN 345 N -2.53 3.89 0.01 -0.78 -0.21 -1.05 -5.01 119.66 113.97 2fy2 s GLN 345 Ca 0.28 0.36 -0.39 0.00 0.02 0.00 0.00 55.36 55.62 2fy2 s GLN 345 Cb 0.20 -2.94 -0.20 0.00 1.00 0.00 0.00 33.01 31.07 2fy2 s GLN 345 CO 0.48 0.50 1.06 -0.35 -2.12 0.00 0.00 175.29 174.85 2fy2 n PRO 346 N 0.78 0.03 -1.93 2.91 -0.04 -1.26 -4.80 135.00 130.68 2fy2 n PRO 346 Ca -0.06 0.01 -0.43 0.00 -0.04 0.00 0.00 63.50 62.99 2fy2 n PRO 346 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.46 2fy2 n PRO 346 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2fy2 s GLU 349 N -0.03 3.85 0.17 0.54 2.12 -1.26 -4.97 118.70 119.12 2fy2 s GLU 349 Ca 0.90 2.01 -0.30 0.00 0.36 0.00 0.00 54.97 57.94 2fy2 s GLU 349 Cb -1.25 -4.10 -0.08 0.00 0.26 0.00 0.00 34.13 28.96 2fy2 s GLU 349 CO 0.57 -1.25 1.23 -0.51 -0.54 0.00 0.00 175.26 174.75 2fy2 s LEU 350 N 5.27 4.43 0.00 2.70 1.43 -1.26 -4.90 118.68 126.35 2fy2 s LEU 350 Ca 0.79 2.25 -0.30 0.00 -1.03 0.00 0.00 54.13 55.84 2fy2 s LEU 350 Cb -0.31 -3.60 -0.08 0.00 0.03 0.00 0.00 46.19 42.23 2fy2 s LEU 350 CO 0.32 -0.42 1.87 -0.69 0.23 0.00 0.00 176.35 177.66 2fy2 s VAL 351 N 0.15 3.20 -0.02 -1.59 1.01 -1.26 -4.96 120.40 116.92 2fy2 s VAL 351 Ca 0.55 0.24 0.08 0.00 0.00 0.00 0.00 61.98 62.84 2fy2 s VAL 351 Cb -0.33 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.87 2fy2 s VAL 351 CO 0.36 -0.02 -0.25 -0.13 0.00 0.00 0.00 175.10 175.05 2fy2 s ARG 352 N 4.35 2.16 0.05 2.72 1.81 -1.26 -5.12 118.95 123.67 2fy2 s ARG 352 Ca 0.84 -0.91 -0.30 0.00 -1.72 0.00 0.00 55.73 53.64 2fy2 s ARG 352 Cb -0.40 -2.07 -0.04 0.00 -0.45 0.00 0.00 34.95 31.99 2fy2 s ARG 352 CO 0.38 0.55 0.99 0.45 -0.68 0.00 0.00 175.30 176.99 2fy2 s SER 353 N -0.59 7.39 0.57 0.23 0.15 -1.26 -4.76 113.70 115.43 2fy2 s SER 353 Ca 0.09 1.74 -0.18 0.00 0.70 0.00 0.00 55.95 58.30 2fy2 s SER 353 Cb -0.10 -2.58 -0.08 0.00 -1.71 0.00 0.00 66.02 61.55 2fy2 s SER 353 CO -0.01 -0.21 0.63 -0.81 1.20 0.00 0.00 173.24 174.04 2fy2 n PRO 354 N 3.49 0.60 -4.45 5.44 -0.04 -1.26 -4.41 135.00 134.37 2fy2 n PRO 354 Ca 0.05 0.23 -0.34 0.00 -0.04 0.00 0.00 63.50 63.40 2fy2 n PRO 354 Cb 0.50 -1.80 -0.11 0.00 -0.04 0.00 0.00 33.50 32.04 2fy2 n PRO 354 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2fy2 s MET 355 N -2.23 3.21 -0.13 0.54 -1.94 -1.26 -5.06 119.30 112.43 2fy2 s MET 355 Ca 0.70 -0.49 -0.04 0.00 -1.71 0.00 0.00 55.69 54.16 2fy2 s MET 355 Cb -0.44 -2.79 0.05 0.00 2.01 0.00 0.00 34.83 33.65 2fy2 s MET 355 CO 0.53 0.50 0.07 0.08 -0.01 0.00 0.00 175.02 176.18 2fy2 s VAL 356 N -0.35 0.04 0.80 -6.03 1.01 -1.26 -3.71 120.40 110.91 2fy2 s VAL 356 Ca 0.06 -0.03 -0.11 0.00 0.00 0.00 0.00 61.98 61.89 2fy2 s VAL 356 Cb -0.12 -0.52 0.09 0.00 0.00 0.00 0.00 36.38 35.82 2fy2 s VAL 356 CO 0.02 -0.10 1.16 -2.16 0.00 0.00 0.00 175.10 174.03 2fy2 s PRO 357 N 2.09 1.87 -0.39 2.72 0.04 -1.26 -5.13 135.00 134.94 2fy2 s PRO 357 Ca 0.03 -0.03 -0.13 0.00 0.04 0.00 0.00 61.00 60.90 2fy2 s PRO 357 Cb -0.15 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.42 2fy2 s PRO 357 CO -0.07 -1.61 0.26 -1.17 0.04 0.00 0.00 177.00 174.45 2fy2 s LEU 359 N -5.54 4.88 0.39 -3.56 2.96 -1.24 -5.07 118.68 111.50 2fy2 s LEU 359 Ca 0.63 -0.83 -0.24 0.00 -0.22 0.00 0.00 54.13 53.47 2fy2 s LEU 359 Cb -0.10 -2.12 -0.09 0.00 0.50 0.00 0.00 46.19 44.38 2fy2 s LEU 359 CO 0.48 -0.39 1.06 -2.16 -1.32 0.00 0.00 176.35 174.02 2fy2 s PRO 360 N 1.65 4.17 -0.08 0.98 0.04 -1.26 -5.01 135.00 135.49 2fy2 s PRO 360 Ca 0.04 1.54 -0.30 0.00 0.04 0.00 0.00 61.00 62.33 2fy2 s PRO 360 Cb -0.19 -2.57 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 2fy2 s PRO 360 CO 0.09 -0.14 1.45 0.00 0.04 0.00 0.00 177.00 178.44 2fy2 s ALA 361 N -1.62 3.62 0.45 8.56 0.00 -1.26 -5.00 121.76 126.51 2fy2 s ALA 361 Ca 0.57 0.74 -0.22 0.00 0.00 0.00 0.00 51.96 53.06 2fy2 s ALA 361 Cb -0.23 -3.66 -0.11 0.00 0.00 0.00 0.00 23.12 19.12 2fy2 s ALA 361 CO 0.29 -1.20 0.66 -0.35 0.00 0.00 0.00 175.76 175.16 2fy2 n PRO 362 N 6.51 0.74 -3.58 0.00 -0.04 -1.26 -4.93 135.00 132.44 2fy2 n PRO 362 Ca 0.15 0.27 -0.36 0.00 -0.04 0.00 0.00 63.50 63.52 2fy2 n PRO 362 Cb 0.44 -1.67 -0.08 0.00 -0.04 0.00 0.00 33.50 32.14 2fy2 n PRO 362 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2fy2 s ARG 363 N -1.79 4.18 0.21 0.54 0.52 -1.05 -4.90 118.95 116.66 2fy2 s ARG 363 Ca 0.65 -0.05 -0.30 0.00 -0.52 0.00 0.00 55.73 55.51 2fy2 s ARG 363 Cb -0.56 -3.48 -0.08 0.00 0.52 0.00 0.00 34.95 31.35 2fy2 s ARG 363 CO 0.57 0.15 1.00 0.50 0.02 0.00 0.00 175.30 177.54 2fy2 s ARG 364 N 0.77 4.75 -0.14 3.54 3.52 -1.26 0.18 118.95 130.30 2fy2 s ARG 364 Ca 0.13 1.57 -0.28 0.00 -0.13 0.00 0.00 55.73 57.03 2fy2 s ARG 364 Cb -0.13 -3.28 -0.01 0.00 -1.56 0.00 0.00 34.95 29.96 2fy2 s ARG 364 CO 0.04 0.33 0.93 -0.51 -0.81 0.00 0.00 175.30 175.28 2fy2 s LEU 365 N -0.85 4.21 0.27 -0.88 1.43 0.77 -4.91 118.68 118.72 2fy2 s LEU 365 Ca 0.44 1.37 -0.09 0.00 -1.03 0.00 0.00 54.13 54.82 2fy2 s LEU 365 Cb -0.27 -3.42 -0.07 0.00 0.03 0.00 0.00 46.19 42.47 2fy2 s LEU 365 CO 0.34 -0.43 0.59 -0.13 0.23 0.00 0.00 176.35 176.94 2fy2 s ARG 366 N 2.11 3.78 -0.00 1.70 0.52 -1.26 -4.73 118.95 121.06 2fy2 s ARG 366 Ca 0.44 0.27 0.03 0.00 -0.52 0.00 0.00 55.73 55.94 2fy2 s ARG 366 Cb -0.17 -2.60 -0.01 0.00 0.52 0.00 0.00 34.95 32.69 2fy2 s ARG 366 CO 0.15 0.24 -0.08 -1.58 0.02 0.00 0.00 175.30 174.04 2fy2 s TRP 367 N -1.96 0.73 -0.72 -0.53 0.52 -1.26 -4.55 118.94 111.18 2fy2 s TRP 367 Ca 0.48 -0.17 -0.11 0.00 0.02 0.00 0.00 56.10 56.32 2fy2 s TRP 367 Cb -0.11 -0.46 0.19 0.00 -1.15 0.00 0.00 33.47 31.93 2fy2 s TRP 367 CO 0.24 -0.01 0.62 0.21 0.02 0.00 0.00 176.95 178.03 2fy2 s LYS 368 N -0.32 3.20 0.90 4.98 2.47 -1.26 -4.98 119.74 124.73 2fy2 s LYS 368 Ca 0.02 -2.32 -0.12 0.00 -1.56 0.00 0.00 55.97 52.00 2fy2 s LYS 368 Cb -0.04 -4.22 0.13 0.00 -1.46 0.00 0.00 37.83 32.24 2fy2 s LYS 368 CO -0.00 -1.26 1.09 0.00 0.16 0.00 0.00 175.35 175.34 2fy2 s SER 370 N -3.44 0.12 0.32 0.00 1.04 -1.26 -5.02 113.70 105.46 2fy2 s SER 370 Ca 0.63 -1.07 0.04 0.00 0.48 0.00 0.00 55.95 56.03 2fy2 s SER 370 Cb -0.18 0.60 0.54 0.00 0.10 0.00 0.00 66.02 67.09 2fy2 s SER 370 CO 0.57 -1.18 1.83 -0.65 0.98 0.00 0.00 173.24 174.78 2fy2 h PRO 371 N 2.23 0.51 0.64 4.02 0.11 -1.99 -1.73 132.00 135.78 2fy2 h PRO 371 Ca -0.27 -0.13 -0.03 0.00 0.11 0.00 0.00 66.00 65.67 2fy2 h PRO 371 Cb 1.25 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.30 2fy2 h PRO 371 CO 0.37 0.60 -0.31 0.93 -0.21 0.00 0.00 178.00 179.38 2fy2 h GLU 372 N 0.47 -0.83 -0.93 1.05 5.08 -1.99 -2.60 114.58 114.84 2fy2 h GLU 372 Ca 0.09 0.06 0.19 0.00 -1.00 0.00 0.00 59.36 58.70 2fy2 h GLU 372 Cb 0.44 0.19 -0.11 0.00 0.50 0.00 0.00 28.75 29.77 2fy2 h GLU 372 CO 0.02 -0.51 0.50 0.82 -1.00 0.00 0.00 179.01 178.84 2fy2 h ILE 373 N -1.08 0.63 -0.78 3.13 1.08 -1.93 0.48 117.51 119.04 2fy2 h ILE 373 Ca -0.09 -0.21 0.04 0.00 -0.39 0.00 0.00 64.86 64.22 2fy2 h ILE 373 Cb 0.70 -0.02 -0.05 0.00 -3.07 0.00 0.00 36.82 34.38 2fy2 h ILE 373 CO 0.14 0.11 0.51 -0.61 -0.69 0.00 0.00 178.15 177.62 2fy2 h GLN 374 N 0.60 0.92 0.00 2.37 5.75 -1.24 0.12 115.11 123.63 2fy2 h GLN 374 Ca 0.54 -0.06 -0.12 0.00 -0.15 0.00 0.00 58.65 58.87 2fy2 h GLN 374 Cb 0.90 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 29.23 2fy2 h GLN 374 CO -0.43 0.61 -0.58 0.78 -2.65 0.00 0.00 178.83 176.56 2fy2 h GLY 375 N 0.94 0.00 1.48 2.39 0.00 0.31 -2.61 103.07 105.58 2fy2 h GLY 375 Ca 0.32 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.44 2fy2 h GLY 375 CO -0.09 0.00 -0.83 0.45 0.00 0.00 0.00 176.54 176.07 2fy2 h HIS 376 N 0.00 0.69 -0.23 5.60 3.86 0.24 -2.67 115.15 122.65 2fy2 h HIS 376 Ca -0.01 -0.33 -0.02 0.00 -1.16 0.00 0.00 60.37 58.85 2fy2 h HIS 376 Cb 1.03 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.40 2fy2 h HIS 376 CO 0.00 1.13 0.09 -0.07 0.86 0.00 0.00 177.93 179.93 2fy2 h LEU 377 N 0.32 0.33 -0.48 2.43 3.38 -0.74 -0.33 115.31 120.22 2fy2 h LEU 377 Ca -0.06 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 57.78 2fy2 h LEU 377 Cb 1.44 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 42.06 2fy2 h LEU 377 CO 0.15 0.42 0.22 0.00 0.09 0.00 0.00 178.44 179.32 2fy2 h ALA 378 N 0.92 0.60 0.10 1.53 0.00 -1.49 -0.38 119.26 120.55 2fy2 h ALA 378 Ca 0.08 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2fy2 h ALA 378 Cb 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2fy2 h ALA 378 CO -0.00 -0.14 -0.05 0.77 0.00 0.00 0.00 179.25 179.83 2fy2 h SER 379 N 0.44 -0.12 -1.00 0.00 0.02 -1.23 -2.56 113.55 109.10 2fy2 h SER 379 Ca 0.21 -0.07 0.08 0.00 -0.84 0.00 0.00 61.79 61.18 2fy2 h SER 379 Cb 0.15 0.03 -0.07 0.00 0.14 0.00 0.00 62.40 62.64 2fy2 h SER 379 CO -0.17 -0.01 0.64 0.28 -1.14 0.00 0.00 176.83 176.44 2fy2 h SER 380 N -0.22 1.01 -0.38 3.07 0.02 -0.80 0.16 113.55 116.41 2fy2 h SER 380 Ca -0.01 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2fy2 h SER 380 Cb 0.18 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 2fy2 h SER 380 CO 0.02 0.62 0.23 0.00 -1.14 0.00 0.00 176.83 176.56 2fy2 h ALA 381 N 1.47 0.48 -0.29 3.77 0.00 -0.87 0.12 119.26 123.95 2fy2 h ALA 381 Ca 0.45 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.25 2fy2 h ALA 381 Cb 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2fy2 h ALA 381 CO -0.20 -0.10 -0.19 1.49 0.00 0.00 0.00 179.25 180.25 2fy2 h GLU 382 N 0.47 0.64 -0.24 0.00 4.57 -1.01 -1.79 114.58 117.22 2fy2 h GLU 382 Ca 0.15 -0.30 0.03 0.00 -1.18 0.00 0.00 59.36 58.06 2fy2 h GLU 382 Cb -0.01 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.55 2fy2 h GLU 382 CO -0.06 0.89 0.06 0.87 -1.18 0.00 0.00 179.01 179.60 2fy2 h LYS 383 N 0.38 0.16 -0.24 1.92 1.79 -0.72 -1.57 116.57 118.29 2fy2 h LYS 383 Ca 0.06 -0.01 -0.06 0.00 -2.18 0.00 0.00 60.65 58.46 2fy2 h LYS 383 Cb 0.73 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.33 2fy2 h LYS 383 CO 0.05 0.11 -0.12 1.25 -1.08 0.00 0.00 179.45 179.66 2fy2 h LEU 384 N 0.16 0.37 -1.04 2.94 7.12 -0.76 -2.22 115.31 121.89 2fy2 h LEU 384 Ca 0.11 -0.09 -0.07 0.00 0.13 0.00 0.00 57.88 57.97 2fy2 h LEU 384 Cb 0.09 -0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 40.11 2fy2 h LEU 384 CO -0.13 0.52 -0.03 -0.61 -0.13 0.00 0.00 178.44 178.07 2fy2 h GLN 385 N 0.36 0.66 -0.48 1.25 5.75 -0.55 -1.77 115.11 120.33 2fy2 h GLN 385 Ca 0.07 -0.17 -0.05 0.00 -0.15 0.00 0.00 58.65 58.35 2fy2 h GLN 385 Cb 0.43 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 2fy2 h GLN 385 CO 0.02 0.70 0.08 0.00 -2.65 0.00 0.00 178.83 176.98 2fy2 h ARG 386 N 0.62 0.75 -0.50 1.69 3.08 -0.69 -2.06 114.38 117.26 2fy2 h ARG 386 Ca 0.12 -0.16 -0.11 0.00 0.07 0.00 0.00 59.98 59.90 2fy2 h ARG 386 Cb 0.43 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 2fy2 h ARG 386 CO 0.02 0.71 -0.13 0.82 -1.07 0.00 0.00 179.97 180.32 2fy2 h ILE 387 N 0.72 1.27 0.45 2.04 2.04 -1.16 -1.72 117.51 121.15 2fy2 h ILE 387 Ca 0.16 -1.28 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 2fy2 h ILE 387 Cb 0.33 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 2fy2 h ILE 387 CO 0.00 0.45 -0.22 0.58 0.00 0.00 0.00 178.15 178.96 2fy2 h VAL 388 N 0.84 0.56 0.00 1.67 2.07 -0.98 -2.03 116.25 118.37 2fy2 h VAL 388 Ca 0.13 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2fy2 h VAL 388 Cb 0.70 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2fy2 h VAL 388 CO 0.05 0.02 0.00 0.07 0.02 0.00 0.00 177.57 177.74 2fy2 h LYS 389 N -0.68 0.00 0.00 1.57 5.09 -1.45 -2.94 116.57 118.16 2fy2 h LYS 389 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.68 2fy2 h LYS 389 Cb 0.50 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.83 2fy2 h LYS 389 CO 0.10 0.00 -0.53 -0.97 -2.09 0.00 0.00 179.45 175.96 2fy2 h ASN 390 N 0.00 0.00 -3.34 7.07 -0.00 -1.05 -3.46 115.58 114.80 2fy2 h ASN 390 Ca 0.00 -0.03 -0.55 0.00 -0.00 0.00 0.00 56.30 55.72 2fy2 h ASN 390 Cb 0.51 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 38.80 2fy2 h ASN 390 CO 0.00 0.01 0.42 -0.22 -0.00 0.00 0.00 177.43 177.64 2fy2 s LEU 391 N -5.46 4.30 -0.47 0.34 2.96 -0.79 -1.47 118.68 118.09 2fy2 s LEU 391 Ca 0.04 1.53 -0.10 0.00 -0.22 0.00 0.00 54.13 55.38 2fy2 s LEU 391 Cb 0.09 -3.49 0.12 0.00 0.50 0.00 0.00 46.19 43.40 2fy2 s LEU 391 CO 0.73 -0.33 0.36 -0.62 -1.32 0.00 0.00 176.35 175.17 2fy2 s ASP 392 N 1.03 5.76 -0.02 3.68 2.15 0.32 -4.86 116.67 124.73 2fy2 s ASP 392 Ca 0.48 -1.85 0.08 0.00 0.43 0.00 0.00 52.55 51.69 2fy2 s ASP 392 Cb -0.19 -2.04 -0.02 0.00 -0.30 0.00 0.00 42.92 40.37 2fy2 s ASP 392 CO 0.22 -0.70 -0.25 0.12 -0.17 0.00 0.00 175.17 174.40 2fy2 s PHE 393 N 1.40 2.23 -0.04 -5.34 5.36 -1.26 -1.74 117.98 118.58 2fy2 s PHE 393 Ca 0.05 -0.43 -0.05 0.00 -0.96 0.00 0.00 56.93 55.54 2fy2 s PHE 393 Cb -0.26 -1.43 0.01 0.00 -0.34 0.00 0.00 43.02 40.99 2fy2 s PHE 393 CO 0.00 -0.05 0.13 -1.50 -1.46 0.00 0.00 175.22 172.35 2fy2 s ILE 394 N -0.56 0.01 -0.40 3.12 2.07 -0.28 -5.02 121.20 120.14 2fy2 s ILE 394 Ca 0.09 -0.09 -0.06 0.00 -1.41 0.00 0.00 60.65 59.18 2fy2 s ILE 394 Cb -0.10 -0.22 0.09 0.00 0.13 0.00 0.00 42.46 42.36 2fy2 s ILE 394 CO -0.01 -0.05 0.21 -0.69 -1.91 0.00 0.00 174.94 172.49 2fy2 s VAL 395 N -0.11 3.71 -0.21 4.00 1.01 -1.26 -1.05 120.40 126.49 2fy2 s VAL 395 Ca -0.02 -1.65 -0.06 0.00 0.00 0.00 0.00 61.98 60.25 2fy2 s VAL 395 Cb -0.02 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 2fy2 s VAL 395 CO 0.00 -0.53 0.02 -0.47 0.00 0.00 0.00 175.10 174.13 2fy2 s TYR 396 N 1.30 3.08 -0.43 5.22 5.04 0.70 -4.88 117.35 127.38 2fy2 s TYR 396 Ca 0.04 -0.35 -0.13 0.00 -2.44 0.00 0.00 57.07 54.19 2fy2 s TYR 396 Cb -0.23 -2.11 0.05 0.00 0.35 0.00 0.00 41.96 40.03 2fy2 s TYR 396 CO -0.01 -0.19 0.30 0.21 -1.34 0.00 0.00 175.55 174.53 2fy2 s LYS 397 N 1.00 2.86 -0.25 4.97 2.20 -1.26 0.14 119.74 129.39 2fy2 s LYS 397 Ca 0.02 -1.25 -0.29 0.00 -0.36 0.00 0.00 55.97 54.10 2fy2 s LYS 397 Cb -0.14 -3.93 0.01 0.00 -1.51 0.00 0.00 37.83 32.25 2fy2 s LYS 397 CO 0.02 -0.88 1.14 0.12 -0.36 0.00 0.00 175.35 175.39 2fy2 s PHE 398 N 1.58 3.08 -0.31 4.03 5.36 0.32 -4.91 117.98 127.13 2fy2 s PHE 398 Ca 0.03 1.21 0.12 0.00 -0.96 0.00 0.00 56.93 57.34 2fy2 s PHE 398 Cb -0.22 -3.52 0.31 0.00 -0.34 0.00 0.00 43.02 39.25 2fy2 s PHE 398 CO 0.06 -1.01 1.23 -0.40 -1.46 0.00 0.00 175.22 173.64 2fy2 n ASP 399 N 6.71 2.90 0.08 6.13 5.68 -1.26 -1.12 116.55 135.67 2fy2 n ASP 399 Ca 0.13 -2.58 -0.12 0.00 -0.50 0.00 0.00 54.79 51.71 2fy2 n ASP 399 Cb 0.46 -0.33 -0.07 0.00 -1.14 0.00 0.00 41.12 40.04 2fy2 n ASP 399 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 2fy2 h ASN 400 N 1.06 0.38 -5.46 -1.12 -1.24 -1.91 -3.46 115.58 103.82 2fy2 h ASN 400 Ca 0.00 -0.34 0.20 0.00 0.71 0.00 0.00 56.30 56.87 2fy2 h ASN 400 Cb 0.97 -0.12 -0.06 0.00 0.73 0.00 0.00 38.32 39.84 2fy2 h ASN 400 CO 0.07 1.18 0.61 -0.72 -1.29 0.00 0.00 177.43 177.28 2fy2 s TYR 401 N -3.02 -0.01 0.00 0.67 -0.85 -1.19 -4.99 117.35 107.97 2fy2 s TYR 401 Ca -0.04 -0.30 0.00 0.00 -0.52 0.00 0.00 57.07 56.21 2fy2 s TYR 401 Cb 0.09 0.65 0.00 0.00 0.38 0.00 0.00 41.96 43.08 2fy2 s TYR 401 CO 0.86 -0.76 0.00 0.41 -1.52 0.00 0.00 175.55 174.53 2fy2 n GLY 402 N -0.61 4.96 0.37 5.49 0.00 -1.20 -3.33 105.19 110.87 2fy2 n GLY 402 Ca -0.04 -0.74 0.05 0.00 0.00 0.00 0.00 46.02 45.29 2fy2 n GLY 402 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fy2 h LYS 403 N 0.00 1.05 -0.00 1.61 1.57 -0.66 -2.74 116.57 117.39 2fy2 h LYS 403 Ca 0.00 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2fy2 h LYS 403 Cb 0.00 -0.24 -0.05 0.00 0.08 0.00 0.00 32.23 32.02 2fy2 h LYS 403 CO 0.00 0.70 -0.31 1.15 -0.57 0.00 0.00 179.45 180.42 2fy2 h THR 404 N 1.08 0.32 -0.56 -0.16 2.02 -1.50 0.13 112.91 114.25 2fy2 h THR 404 Ca 0.46 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.62 2fy2 h THR 404 Cb 0.33 0.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 2fy2 h THR 404 CO -0.22 0.00 0.27 0.15 0.37 0.00 0.00 175.52 176.09 2fy2 h PHE 405 N -0.46 0.80 -0.51 3.16 3.57 -1.73 -2.63 116.94 119.15 2fy2 h PHE 405 Ca 0.06 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 2fy2 h PHE 405 Cb 0.54 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 2fy2 h PHE 405 CO -0.33 0.62 0.27 0.82 -2.23 0.00 0.00 178.31 177.46 2fy2 h ILE 406 N 0.75 1.18 -0.03 1.41 2.04 -1.16 -2.43 117.51 119.27 2fy2 h ILE 406 Ca 0.19 -0.46 -0.06 0.00 1.00 0.00 0.00 64.86 65.53 2fy2 h ILE 406 Cb 0.12 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2fy2 h ILE 406 CO -0.02 0.19 -0.25 0.11 0.00 0.00 0.00 178.15 178.18 2fy2 h LYS 407 N 0.67 0.06 0.00 2.37 1.57 -0.67 -0.08 116.57 120.48 2fy2 h LYS 407 Ca 0.18 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2fy2 h LYS 407 Cb 0.06 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2fy2 h LYS 407 CO -0.03 0.30 0.00 1.63 -0.57 0.00 0.00 179.45 180.78 2fy2 n LYS 408 N -4.23 0.04 -0.54 3.15 5.02 -0.93 -1.15 118.16 119.53 2fy2 n LYS 408 Ca -0.02 0.33 0.10 0.00 -2.02 0.00 0.00 58.31 56.70 2fy2 n LYS 408 Cb 0.31 -1.58 0.34 0.00 -0.02 0.00 0.00 35.03 34.08 2fy2 n LYS 408 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2fy2 n GLN 409 N -1.65 3.38 -3.33 1.97 1.13 -0.05 -4.91 117.38 113.92 2fy2 n GLN 409 Ca 0.02 -2.70 -0.24 0.00 -1.94 0.00 0.00 57.00 52.14 2fy2 n GLN 409 Cb 0.15 -1.79 0.04 0.00 0.11 0.00 0.00 30.24 28.74 2fy2 n GLN 409 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2fy2 n LYS 410 N 1.22 -5.69 -4.56 -1.09 5.02 -0.30 -4.98 118.16 107.77 2fy2 n LYS 410 Ca 0.25 0.80 -0.26 0.00 -2.02 0.00 0.00 58.31 57.08 2fy2 n LYS 410 Cb 0.80 -5.71 -0.14 0.00 -0.02 0.00 0.00 35.03 29.96 2fy2 n LYS 410 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2fy2 s SER 412 N -1.39 7.10 0.23 0.00 0.15 -1.26 -3.97 113.70 114.56 2fy2 s SER 412 Ca 0.08 2.22 -0.08 0.00 0.70 0.00 0.00 55.95 58.87 2fy2 s SER 412 Cb -0.09 -2.61 0.22 0.00 -1.71 0.00 0.00 66.02 61.83 2fy2 s SER 412 CO 0.03 -0.36 1.90 -0.65 1.20 0.00 0.00 173.24 175.36 2fy2 h PRO 413 N 5.23 1.16 -0.08 5.44 0.11 -1.92 -1.63 132.00 140.31 2fy2 h PRO 413 Ca -0.44 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 2fy2 h PRO 413 Cb 1.21 -0.26 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 2fy2 h PRO 413 CO 0.74 0.77 0.05 0.22 -0.21 0.00 0.00 178.00 179.57 2fy2 h ASP 414 N 1.20 0.10 -0.41 -2.05 3.58 -1.99 -1.27 116.42 115.57 2fy2 h ASP 414 Ca 0.33 -0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.67 2fy2 h ASP 414 Cb -0.12 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 2fy2 h ASP 414 CO -0.08 0.12 0.09 0.00 -2.88 0.00 0.00 179.24 176.50 2fy2 h ALA 415 N 0.98 1.25 -0.01 -0.78 0.00 -1.90 0.45 119.26 119.25 2fy2 h ALA 415 Ca 0.03 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2fy2 h ALA 415 Cb 0.05 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2fy2 h ALA 415 CO -0.01 0.51 0.00 0.35 0.00 0.00 0.00 179.25 180.11 2fy2 h PHE 416 N 0.72 0.01 -0.53 0.00 3.04 -1.05 -1.56 116.94 117.57 2fy2 h PHE 416 Ca 0.16 -0.00 -0.10 0.00 3.98 0.00 0.00 57.97 62.01 2fy2 h PHE 416 Cb 0.31 -0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.80 2fy2 h PHE 416 CO 0.02 0.15 -0.05 0.82 -2.02 0.00 0.00 178.31 177.23 2fy2 h ILE 417 N -0.13 1.26 -0.80 1.41 2.04 -1.00 -1.70 117.51 118.60 2fy2 h ILE 417 Ca 0.00 -1.16 0.02 0.00 1.00 0.00 0.00 64.86 64.72 2fy2 h ILE 417 Cb 0.15 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 2fy2 h ILE 417 CO -0.00 0.41 0.53 1.56 0.00 0.00 0.00 178.15 180.65 2fy2 h GLN 418 N 0.86 1.02 -0.20 2.37 1.08 -0.77 -0.23 115.11 119.24 2fy2 h GLN 418 Ca 0.15 -0.06 -0.14 0.00 -1.45 0.00 0.00 58.65 57.15 2fy2 h GLN 418 Cb 0.58 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.77 2fy2 h GLN 418 CO 0.03 0.67 -0.47 0.28 -0.95 0.00 0.00 178.83 178.40 2fy2 h VAL 419 N 1.05 1.31 -0.72 -0.54 2.07 -0.90 -2.66 116.25 115.87 2fy2 h VAL 419 Ca 0.30 -1.67 -0.05 0.00 0.82 0.00 0.00 66.70 66.10 2fy2 h VAL 419 Cb -0.07 1.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 2fy2 h VAL 419 CO -0.07 0.52 0.25 0.00 0.02 0.00 0.00 177.57 178.28 2fy2 h ALA 420 N 1.08 1.08 -0.47 1.67 0.00 -0.29 -1.85 119.26 120.48 2fy2 h ALA 420 Ca 0.02 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2fy2 h ALA 420 Cb 0.97 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2fy2 h ALA 420 CO 0.09 0.63 -0.00 -0.07 0.00 0.00 0.00 179.25 179.90 2fy2 h LEU 421 N 1.05 0.76 -0.37 0.00 3.38 -0.93 0.41 115.31 119.61 2fy2 h LEU 421 Ca 0.24 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2fy2 h LEU 421 Cb 0.26 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2fy2 h LEU 421 CO -0.01 0.82 0.11 1.56 0.09 0.00 0.00 178.44 181.01 2fy2 h GLN 422 N 0.74 0.58 -0.44 1.13 1.08 -1.09 -0.52 115.11 116.58 2fy2 h GLN 422 Ca 0.14 -0.13 -0.06 0.00 -1.45 0.00 0.00 58.65 57.16 2fy2 h GLN 422 Cb 0.45 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.78 2fy2 h GLN 422 CO 0.02 0.60 0.05 1.25 -0.95 0.00 0.00 178.83 179.80 2fy2 h LEU 423 N 0.44 0.71 -0.52 1.46 5.85 -1.08 -0.89 115.31 121.27 2fy2 h LEU 423 Ca 0.12 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.59 2fy2 h LEU 423 Cb 0.27 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 2fy2 h LEU 423 CO -0.00 0.80 0.30 0.00 -0.34 0.00 0.00 178.44 179.20 2fy2 h ALA 424 N 0.93 0.67 -0.25 1.25 0.00 -0.74 0.93 119.26 122.05 2fy2 h ALA 424 Ca 0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2fy2 h ALA 424 Cb 0.41 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2fy2 h ALA 424 CO 0.01 0.00 0.06 0.35 0.00 0.00 0.00 179.25 179.67 2fy2 h PHE 425 N 0.60 0.42 -0.31 0.00 3.57 -0.92 -2.59 116.94 117.70 2fy2 h PHE 425 Ca 0.21 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 2fy2 h PHE 425 Cb 0.04 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 2fy2 h PHE 425 CO -0.07 0.49 0.15 -0.92 -2.23 0.00 0.00 178.31 175.73 2fy2 h TYR 426 N 0.23 0.45 0.00 0.41 3.20 -0.76 0.66 116.97 121.15 2fy2 h TYR 426 Ca 0.08 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 2fy2 h TYR 426 Cb 0.28 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 2fy2 h TYR 426 CO 0.01 0.40 -0.18 0.07 -1.64 0.00 0.00 178.16 176.82 2fy2 h ARG 427 N 0.37 0.00 0.05 1.82 0.11 -0.84 0.48 114.38 116.37 2fy2 h ARG 427 Ca 0.11 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 59.95 2fy2 h ARG 427 Cb 0.12 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.18 2fy2 h ARG 427 CO -0.01 0.18 -1.24 1.25 0.10 0.00 0.00 179.97 180.25 2fy2 h LEU 428 N 0.00 0.17 -0.69 0.08 5.85 -1.19 -3.41 115.31 116.13 2fy2 h LEU 428 Ca -0.00 -0.73 0.00 0.00 0.84 0.00 0.00 57.88 57.99 2fy2 h LEU 428 Cb 0.46 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.43 2fy2 h LEU 428 CO 0.02 1.52 -0.37 1.41 -0.34 0.00 0.00 178.44 180.68 2fy2 n HIS 429 N -4.18 0.00 -2.28 1.25 8.25 0.20 -5.02 115.22 113.44 2fy2 n HIS 429 Ca -0.27 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.07 2fy2 n HIS 429 Cb 0.77 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.88 2fy2 n HIS 429 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2fy2 n ARG 430 N -0.38 -1.18 -3.56 -0.41 5.12 0.17 -4.99 116.66 111.44 2fy2 n ARG 430 Ca 0.05 0.57 -0.08 0.00 -1.93 0.00 0.00 57.85 56.47 2fy2 n ARG 430 Cb 0.29 -4.72 -0.03 0.00 -1.16 0.00 0.00 32.46 26.84 2fy2 n ARG 430 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 2fy2 s ARG 431 N -4.67 0.58 0.38 5.56 1.70 -1.25 -5.05 118.95 116.21 2fy2 s ARG 431 Ca 0.02 -0.11 0.06 0.00 -0.47 0.00 0.00 55.73 55.22 2fy2 s ARG 431 Cb -0.01 0.27 -0.00 0.00 -0.57 0.00 0.00 34.95 34.64 2fy2 s ARG 431 CO 0.03 -0.23 0.54 -0.51 -1.08 0.00 0.00 175.30 174.04 2fy2 s LEU 432 N -1.95 3.81 0.09 -1.89 1.43 -1.26 -3.97 118.68 114.94 2fy2 s LEU 432 Ca 0.05 -0.17 -0.08 0.00 -1.03 0.00 0.00 54.13 52.90 2fy2 s LEU 432 Cb -0.01 -2.79 -0.00 0.00 0.03 0.00 0.00 46.19 43.42 2fy2 s LEU 432 CO -0.05 -0.59 0.18 0.68 0.23 0.00 0.00 176.35 176.81 2fy2 s VAL 433 N -2.30 0.14 -0.04 -1.59 -7.23 -1.26 -5.01 120.40 103.11 2fy2 s VAL 433 Ca 0.48 -1.19 -0.35 0.00 -1.81 0.00 0.00 61.98 59.11 2fy2 s VAL 433 Cb -0.10 -1.34 -0.13 0.00 0.56 0.00 0.00 36.38 35.37 2fy2 s VAL 433 CO 0.33 -0.66 1.72 -2.65 -0.31 0.00 0.00 175.10 173.53 2fy2 n PRO 434 N -0.05 1.88 -4.75 4.82 -0.02 -1.26 -4.65 135.00 130.97 2fy2 n PRO 434 Ca -0.15 0.69 -0.31 0.00 -2.02 0.00 0.00 63.50 61.70 2fy2 n PRO 434 Cb 0.62 -2.46 -0.13 0.00 -0.02 0.00 0.00 33.50 31.51 2fy2 n PRO 434 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2fy2 s THR 435 N 2.80 2.81 -0.09 3.45 2.01 -1.26 -2.79 115.64 122.57 2fy2 s THR 435 Ca 0.89 -1.08 0.00 0.00 0.31 0.00 0.00 61.69 61.82 2fy2 s THR 435 Cb -0.78 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 2fy2 s THR 435 CO 0.50 0.41 -0.09 -0.47 -0.69 0.00 0.00 174.62 174.28 2fy2 s TYR 436 N -0.86 2.89 -0.21 4.92 5.04 -0.08 -4.08 117.35 124.97 2fy2 s TYR 436 Ca 0.14 -0.20 -0.06 0.00 -2.44 0.00 0.00 57.07 54.51 2fy2 s TYR 436 Cb -0.10 -1.77 0.10 0.00 0.35 0.00 0.00 41.96 40.54 2fy2 s TYR 436 CO 0.04 0.13 0.41 -2.00 -1.34 0.00 0.00 175.55 172.79 2fy2 s GLU 437 N -0.34 0.33 0.29 4.97 2.12 -1.18 -0.33 118.70 124.56 2fy2 s GLU 437 Ca 0.04 0.92 -0.29 0.00 0.36 0.00 0.00 54.97 56.00 2fy2 s GLU 437 Cb -0.12 0.15 -0.10 0.00 0.26 0.00 0.00 34.13 34.32 2fy2 s GLU 437 CO 0.02 -0.35 1.35 -1.12 -0.54 0.00 0.00 175.26 174.62 2fy2 s SER 438 N 2.60 6.75 -0.15 -1.70 0.01 -1.26 0.45 113.70 120.40 2fy2 s SER 438 Ca 0.02 2.64 0.02 0.00 1.31 0.00 0.00 55.95 59.94 2fy2 s SER 438 Cb -0.13 -2.64 0.02 0.00 0.21 0.00 0.00 66.02 63.48 2fy2 s SER 438 CO -0.14 -0.58 -0.20 0.00 0.41 0.00 0.00 173.24 172.73 2fy2 s ALA 439 N -0.62 2.19 0.07 1.44 0.00 -0.57 -4.84 121.76 119.44 2fy2 s ALA 439 Ca 0.53 -1.09 -0.31 0.00 0.00 0.00 0.00 51.96 51.09 2fy2 s ALA 439 Cb -0.40 -1.06 -0.06 0.00 0.00 0.00 0.00 23.12 21.60 2fy2 s ALA 439 CO 0.48 -0.20 1.23 0.45 0.00 0.00 0.00 175.76 177.72 2fy2 s SER 440 N 1.09 7.04 -0.34 0.00 0.15 -1.26 -1.10 113.70 119.29 2fy2 s SER 440 Ca -0.01 2.06 0.06 0.00 0.70 0.00 0.00 55.95 58.77 2fy2 s SER 440 Cb -0.14 -2.58 0.46 0.00 -1.71 0.00 0.00 66.02 62.05 2fy2 s SER 440 CO -0.07 -0.50 1.35 2.30 1.20 0.00 0.00 173.24 177.51 2fy2 n ILE 441 N 3.93 2.65 1.07 6.45 -5.35 -1.03 -4.60 119.36 122.47 2fy2 n ILE 441 Ca 0.09 -3.76 0.09 0.00 -0.27 0.00 0.00 62.75 58.90 2fy2 n ILE 441 Cb 0.46 -0.95 0.51 0.00 -1.74 0.00 0.00 39.64 37.92 2fy2 n ILE 441 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2fy2 n ARG 442 N -0.83 0.52 -0.30 6.28 1.74 -1.26 -2.42 116.66 120.38 2fy2 n ARG 442 Ca 0.43 0.01 -0.05 0.00 -0.77 0.00 0.00 57.85 57.47 2fy2 n ARG 442 Cb 0.90 -1.50 0.08 0.00 -1.02 0.00 0.00 32.46 30.92 2fy2 n ARG 442 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2fy2 h ARG 443 N 0.00 1.22 -6.10 5.56 3.08 -1.85 0.30 114.38 116.58 2fy2 h ARG 443 Ca 0.00 -0.20 -0.59 0.00 0.07 0.00 0.00 59.98 59.26 2fy2 h ARG 443 Cb 0.02 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 29.82 2fy2 h ARG 443 CO 0.00 0.95 -0.30 -0.06 -1.07 0.00 0.00 179.97 179.49 2fy2 s PHE 444 N -5.63 3.53 0.14 3.04 0.40 -1.01 -4.25 117.98 114.19 2fy2 s PHE 444 Ca -0.12 0.64 -0.33 0.00 -0.60 0.00 0.00 56.93 56.52 2fy2 s PHE 444 Cb 0.16 -2.05 -0.18 0.00 0.51 0.00 0.00 43.02 41.46 2fy2 s PHE 444 CO 0.84 0.49 0.83 1.04 0.70 0.00 0.00 175.22 179.12 2fy2 n GLN 445 N 0.54 0.29 -1.33 0.44 6.02 -0.72 -0.46 117.38 122.16 2fy2 n GLN 445 Ca -0.06 0.10 -0.13 0.00 -0.01 0.00 0.00 57.00 56.91 2fy2 n GLN 445 Cb 0.52 -1.36 -0.06 0.00 1.02 0.00 0.00 30.24 30.36 2fy2 n GLN 445 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2fy2 n GLU 446 N 1.27 -1.43 -1.79 -1.09 1.02 -1.26 -4.67 120.64 112.70 2fy2 n GLU 446 Ca 0.18 0.81 -0.42 0.00 -0.02 0.00 0.00 57.16 57.71 2fy2 n GLU 446 Cb 0.20 -5.04 -0.03 0.00 -0.02 0.00 0.00 31.44 26.55 2fy2 n GLU 446 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2fy2 s GLY 447 N -2.15 1.42 0.00 0.62 0.00 0.39 -4.94 107.32 102.66 2fy2 s GLY 447 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 44.72 46.08 2fy2 s GLY 447 CO 0.00 3.06 0.00 0.54 0.00 0.00 0.00 173.10 176.70 2fy2 n ARG 448 N 5.65 0.00 -3.79 2.90 5.12 -1.26 -4.19 116.66 121.09 2fy2 n ARG 448 Ca 0.17 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.96 2fy2 n ARG 448 Cb 0.39 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.66 2fy2 n ARG 448 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 2fy2 n VAL 449 N 0.00 0.00 -3.58 1.55 0.24 -1.26 -2.48 118.33 112.80 2fy2 n VAL 449 Ca 0.00 -1.60 0.00 0.00 -2.04 0.00 0.00 64.34 60.70 2fy2 n VAL 449 Cb 0.00 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.38 2fy2 n VAL 449 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2fy2 n ASP 450 N -1.65 0.00 -4.33 -1.34 -0.08 -0.26 -4.84 116.55 104.06 2fy2 n ASP 450 Ca 0.00 -0.87 -0.31 0.00 -1.51 0.00 0.00 54.79 52.09 2fy2 n ASP 450 Cb 0.54 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.85 2fy2 n ASP 450 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 2fy2 s ASN 451 N -0.71 3.16 -0.27 1.67 2.47 -1.26 -1.50 114.94 118.50 2fy2 s ASN 451 Ca 0.00 -0.44 -0.08 0.00 0.42 0.00 0.00 52.86 52.76 2fy2 s ASN 451 Cb 0.00 -0.44 -0.02 0.00 -1.45 0.00 0.00 41.25 39.33 2fy2 s ASN 451 CO 0.00 0.32 0.10 -0.63 -3.72 0.00 0.00 177.10 173.16 2fy2 s ILE 452 N -0.58 4.42 -0.87 -5.21 1.01 0.17 -4.79 121.20 115.36 2fy2 s ILE 452 Ca 0.09 -0.23 -0.18 0.00 0.00 0.00 0.00 60.65 60.32 2fy2 s ILE 452 Cb -0.10 -3.13 0.13 0.00 0.01 0.00 0.00 42.46 39.38 2fy2 s ILE 452 CO -0.00 0.26 1.03 -0.13 0.00 0.00 0.00 174.94 176.10 2fy2 s ARG 453 N 1.62 3.52 0.42 2.79 0.52 -1.26 -3.07 118.95 123.48 2fy2 s ARG 453 Ca 0.06 -1.74 0.30 0.00 -0.52 0.00 0.00 55.73 53.83 2fy2 s ARG 453 Cb -0.16 -4.74 1.33 0.00 0.52 0.00 0.00 34.95 31.90 2fy2 s ARG 453 CO 0.05 -1.70 1.89 0.77 0.02 0.00 0.00 175.30 176.33 2fy2 h SER 454 N 8.79 0.00 -0.42 0.23 0.02 -1.94 -3.33 113.55 116.89 2fy2 h SER 454 Ca 0.08 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.32 2fy2 h SER 454 Cb 1.04 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.53 2fy2 h SER 454 CO 1.07 0.00 3.17 0.00 -1.14 0.00 0.00 176.83 179.93 2fy2 n ALA 455 N -1.93 6.71 -1.68 3.77 0.00 -1.26 -4.83 120.51 121.29 2fy2 n ALA 455 Ca 0.00 -3.82 -0.30 0.00 0.00 0.00 0.00 53.44 49.32 2fy2 n ALA 455 Cb 0.21 -3.23 0.07 0.00 0.00 0.00 0.00 19.45 16.50 2fy2 n ALA 455 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2fy2 s THR 456 N 1.44 3.32 0.23 0.00 -4.23 -1.25 -4.92 115.64 110.23 2fy2 s THR 456 Ca 0.58 0.43 -0.07 0.00 -1.18 0.00 0.00 61.69 61.45 2fy2 s THR 456 Cb 0.16 -3.27 0.20 0.00 1.34 0.00 0.00 72.50 70.93 2fy2 s THR 456 CO -0.07 -0.56 1.84 -0.65 -0.54 0.00 0.00 174.62 174.65 2fy2 h PRO 457 N -0.89 1.26 -0.65 3.99 0.11 -1.91 -1.79 132.00 132.12 2fy2 h PRO 457 Ca -0.46 -0.16 -0.04 0.00 0.11 0.00 0.00 66.00 65.45 2fy2 h PRO 457 Cb 1.26 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 2fy2 h PRO 457 CO 0.61 0.93 0.22 0.93 -0.21 0.00 0.00 178.00 180.49 2fy2 h GLU 458 N 1.25 0.97 -0.85 1.05 3.07 -1.93 -1.66 114.58 116.49 2fy2 h GLU 458 Ca 0.31 -0.18 -0.03 0.00 -0.50 0.00 0.00 59.36 58.96 2fy2 h GLU 458 Cb 0.06 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 27.77 2fy2 h GLU 458 CO -0.05 0.82 0.41 0.00 -1.40 0.00 0.00 179.01 178.80 2fy2 h ALA 459 N 1.30 1.12 -0.40 3.43 0.00 -1.67 -1.34 119.26 121.70 2fy2 h ALA 459 Ca 0.22 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2fy2 h ALA 459 Cb 0.24 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2fy2 h ALA 459 CO -0.01 0.66 0.13 1.25 0.00 0.00 0.00 179.25 181.28 2fy2 h LEU 460 N 1.21 0.59 -1.04 0.00 5.85 -0.61 -0.66 115.31 120.64 2fy2 h LEU 460 Ca 0.29 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 2fy2 h LEU 460 Cb 0.11 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 2fy2 h LEU 460 CO -0.04 0.64 0.30 0.00 -0.34 0.00 0.00 178.44 179.00 2fy2 h ALA 461 N 0.97 1.25 0.08 1.25 0.00 -1.04 -1.01 119.26 120.76 2fy2 h ALA 461 Ca 0.13 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2fy2 h ALA 461 Cb 0.26 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2fy2 h ALA 461 CO -0.00 0.57 -0.04 0.35 0.00 0.00 0.00 179.25 180.12 2fy2 h PHE 462 N 0.97 -0.10 -0.27 0.00 3.57 -0.96 -2.26 116.94 117.89 2fy2 h PHE 462 Ca 0.23 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.67 2fy2 h PHE 462 Cb 0.14 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 2fy2 h PHE 462 CO 0.01 0.27 -0.10 -0.39 -2.23 0.00 0.00 178.31 175.87 2fy2 h VAL 463 N -0.50 1.21 -0.23 1.41 -1.51 -1.04 -2.14 116.25 113.44 2fy2 h VAL 463 Ca -0.01 -0.93 -0.05 0.00 -1.23 0.00 0.00 66.70 64.49 2fy2 h VAL 463 Cb 0.42 1.12 -0.01 0.00 -2.13 0.00 0.00 31.29 30.70 2fy2 h VAL 463 CO 0.02 0.30 -0.03 0.03 -1.23 0.00 0.00 177.57 176.66 2fy2 h ARG 464 N 0.42 0.43 -0.48 5.19 3.08 -1.19 -1.17 114.38 120.65 2fy2 h ARG 464 Ca 0.08 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 2fy2 h ARG 464 Cb 0.44 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 2fy2 h ARG 464 CO 0.02 0.64 0.28 0.00 -1.07 0.00 0.00 179.97 179.85 2fy2 h ALA 465 N 0.77 1.59 -0.10 0.04 0.00 -1.18 0.51 119.26 120.89 2fy2 h ALA 465 Ca 0.06 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 2fy2 h ALA 465 Cb 0.47 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.07 2fy2 h ALA 465 CO 0.02 0.36 -0.77 0.28 0.00 0.00 0.00 179.25 179.14 2fy2 h VAL 466 N 0.66 1.31 0.00 0.00 2.07 -1.20 -3.36 116.25 115.73 2fy2 h VAL 466 Ca 0.17 -2.01 0.00 0.00 0.82 0.00 0.00 66.70 65.68 2fy2 h VAL 466 Cb -0.01 2.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2fy2 h VAL 466 CO -0.03 0.62 -0.92 0.35 0.02 0.00 0.00 177.57 177.61 2fy2 n THR 467 N -4.00 0.46 -2.73 2.57 -2.24 -0.46 -4.69 114.28 103.18 2fy2 n THR 467 Ca -0.09 -0.42 -0.43 0.00 -2.27 0.00 0.00 64.05 60.84 2fy2 n THR 467 Cb 0.74 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2fy2 n THR 467 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2fy2 n ASP 468 N -2.39 5.06 -0.25 3.42 -0.08 0.15 -4.84 116.55 117.62 2fy2 n ASP 468 Ca 0.01 -2.95 0.04 0.00 -1.51 0.00 0.00 54.79 50.38 2fy2 n ASP 468 Cb 0.50 -1.67 0.13 0.00 2.34 0.00 0.00 41.12 42.42 2fy2 n ASP 468 CO 0.00 0.00 0.00 0.45 0.12 0.00 0.00 177.20 177.77 2fy2 h HIS 469 N 7.34 -0.14 0.00 -0.67 3.86 -1.88 -0.24 115.15 123.43 2fy2 h HIS 469 Ca 0.39 0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.66 2fy2 h HIS 469 Cb 0.87 0.18 0.00 0.00 1.06 0.00 0.00 27.41 29.52 2fy2 h HIS 469 CO 1.28 -0.26 0.00 1.63 0.86 0.00 0.00 177.93 181.45 2fy2 n LYS 470 N -5.38 0.12 0.03 2.45 5.02 -1.26 -1.28 118.16 117.86 2fy2 n LYS 470 Ca 0.12 0.62 -0.05 0.00 -2.02 0.00 0.00 58.31 56.98 2fy2 n LYS 470 Cb 0.44 -1.90 -0.10 0.00 -0.02 0.00 0.00 35.03 33.45 2fy2 n LYS 470 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2fy2 h ALA 471 N 2.00 0.63 -5.95 7.82 0.00 -1.42 -3.48 119.26 118.86 2fy2 h ALA 471 Ca 0.00 -1.08 -0.41 0.00 0.00 0.00 0.00 54.91 53.43 2fy2 h ALA 471 Cb 0.00 0.22 0.09 0.00 0.00 0.00 0.00 17.79 18.11 2fy2 h ALA 471 CO 0.00 1.25 -0.74 0.00 0.00 0.00 0.00 179.25 179.76 2fy2 n ALA 472 N -2.43 -1.56 -1.97 0.00 0.00 -0.41 -4.91 120.51 109.24 2fy2 n ALA 472 Ca -0.09 0.17 -0.42 0.00 0.00 0.00 0.00 53.44 53.11 2fy2 n ALA 472 Cb 0.94 -4.10 -0.03 0.00 0.00 0.00 0.00 19.45 16.26 2fy2 n ALA 472 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2fy2 s VAL 473 N -3.37 2.72 0.48 0.00 1.01 -1.26 -4.94 120.40 115.05 2fy2 s VAL 473 Ca 0.39 0.52 -0.24 0.00 0.00 0.00 0.00 61.98 62.66 2fy2 s VAL 473 Cb -0.18 -3.34 -0.07 0.00 0.00 0.00 0.00 36.38 32.79 2fy2 s VAL 473 CO 0.77 0.04 1.35 -2.65 0.00 0.00 0.00 175.10 174.60 2fy2 n PRO 474 N 3.90 1.92 -0.17 2.72 -0.02 -1.26 -4.79 135.00 137.30 2fy2 n PRO 474 Ca 0.13 0.69 0.09 0.00 -2.02 0.00 0.00 63.50 62.39 2fy2 n PRO 474 Cb 0.39 -2.53 0.40 0.00 -0.02 0.00 0.00 33.50 31.74 2fy2 n PRO 474 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fy2 h ALA 475 N 1.86 1.81 -0.94 3.55 0.00 -1.99 0.05 119.26 123.60 2fy2 h ALA 475 Ca -0.50 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2fy2 h ALA 475 Cb 1.29 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 2fy2 h ALA 475 CO 0.59 0.05 0.55 0.66 0.00 0.00 0.00 179.25 181.10 2fy2 h SER 476 N 0.64 1.14 -0.33 0.00 4.64 -1.96 -0.59 113.55 117.10 2fy2 h SER 476 Ca 0.32 -0.08 -0.11 0.00 -0.47 0.00 0.00 61.79 61.45 2fy2 h SER 476 Cb 0.41 -0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 2fy2 h SER 476 CO -0.11 0.89 -0.22 -0.08 -0.87 0.00 0.00 176.83 176.43 2fy2 h GLU 477 N 1.30 0.74 -1.01 4.77 4.57 -1.39 -2.73 114.58 120.84 2fy2 h GLU 477 Ca 0.34 -0.35 0.05 0.00 -1.18 0.00 0.00 59.36 58.21 2fy2 h GLU 477 Cb -0.03 -0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.49 2fy2 h GLU 477 CO -0.06 0.97 0.66 0.87 -1.18 0.00 0.00 179.01 180.26 2fy2 h LYS 478 N 0.51 1.20 -0.67 1.92 1.57 -0.68 -1.06 116.57 119.36 2fy2 h LYS 478 Ca 0.07 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2fy2 h LYS 478 Cb 0.78 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 32.78 2fy2 h LYS 478 CO 0.06 0.80 0.32 1.25 -0.57 0.00 0.00 179.45 181.31 2fy2 h LEU 479 N 1.24 0.89 -0.37 2.94 5.85 -0.97 0.26 115.31 125.14 2fy2 h LEU 479 Ca 0.41 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 59.00 2fy2 h LEU 479 Cb 0.06 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2fy2 h LEU 479 CO -0.14 0.77 0.24 -0.07 -0.34 0.00 0.00 178.44 178.90 2fy2 h LEU 480 N 0.94 0.42 -1.36 2.25 3.38 -1.03 0.01 115.31 119.92 2fy2 h LEU 480 Ca 0.23 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 2fy2 h LEU 480 Cb 0.13 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2fy2 h LEU 480 CO -0.03 0.31 -0.10 -0.07 0.09 0.00 0.00 178.44 178.65 2fy2 h LEU 481 N 0.50 0.29 0.25 1.67 3.38 -0.76 -1.10 115.31 119.54 2fy2 h LEU 481 Ca 0.13 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2fy2 h LEU 481 Cb -0.05 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2fy2 h LEU 481 CO -0.03 0.43 -0.12 0.25 0.09 0.00 0.00 178.44 179.06 2fy2 h LEU 482 N 0.30 -0.28 -1.58 1.67 6.46 0.42 -1.78 115.31 120.51 2fy2 h LEU 482 Ca 0.06 -0.17 -0.02 0.00 -0.12 0.00 0.00 57.88 57.63 2fy2 h LEU 482 Cb 0.36 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.35 2fy2 h LEU 482 CO 0.02 0.02 0.01 0.11 -0.62 0.00 0.00 178.44 177.98 2fy2 h LYS 483 N -0.59 0.28 -0.13 1.25 1.79 -0.76 -1.90 116.57 116.50 2fy2 h LYS 483 Ca -0.03 -0.04 -0.15 0.00 -2.18 0.00 0.00 60.65 58.25 2fy2 h LYS 483 Cb 0.43 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.02 2fy2 h LYS 483 CO 0.06 0.29 -0.56 0.22 -1.08 0.00 0.00 179.45 178.38 2fy2 h ASP 484 N 0.27 0.46 -0.45 0.86 3.58 -1.10 -1.13 116.42 118.91 2fy2 h ASP 484 Ca 0.07 -0.25 -0.08 0.00 0.42 0.00 0.00 57.03 57.19 2fy2 h ASP 484 Cb 0.17 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.07 2fy2 h ASP 484 CO 0.00 0.92 -0.04 0.00 -2.88 0.00 0.00 179.24 177.25 2fy2 h ALA 485 N 1.09 0.61 -0.49 -0.78 0.00 -0.69 -0.46 119.26 118.54 2fy2 h ALA 485 Ca 0.00 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.51 2fy2 h ALA 485 Cb 1.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2fy2 h ALA 485 CO 0.10 0.44 -0.12 0.82 0.00 0.00 0.00 179.25 180.49 2fy2 h ILE 486 N 0.66 1.26 -0.52 0.00 2.04 -1.27 0.08 117.51 119.78 2fy2 h ILE 486 Ca 0.12 -1.24 -0.02 0.00 1.00 0.00 0.00 64.86 64.72 2fy2 h ILE 486 Cb 0.55 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 2fy2 h ILE 486 CO 0.03 0.43 0.24 -0.09 0.00 0.00 0.00 178.15 178.76 2fy2 h ARG 487 N 0.81 0.75 -0.63 2.37 2.43 -1.01 -0.87 114.38 118.23 2fy2 h ARG 487 Ca 0.13 -0.12 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 2fy2 h ARG 487 Cb 0.65 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 2fy2 h ARG 487 CO 0.05 0.64 0.22 0.00 -1.51 0.00 0.00 179.97 179.36 2fy2 h ALA 488 N 1.08 0.83 0.02 2.80 0.00 -0.76 -0.40 119.26 122.83 2fy2 h ALA 488 Ca 0.18 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2fy2 h ALA 488 Cb 0.14 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2fy2 h ALA 488 CO -0.02 0.48 -0.09 0.37 0.00 0.00 0.00 179.25 179.99 2fy2 h GLN 489 N 0.91 -0.17 -0.77 0.00 5.75 -0.60 -0.57 115.11 119.67 2fy2 h GLN 489 Ca 0.21 0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.70 2fy2 h GLN 489 Cb 0.27 0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.82 2fy2 h GLN 489 CO -0.01 -0.11 0.42 1.15 -2.65 0.00 0.00 178.83 177.63 2fy2 h THR 490 N -0.17 1.23 -0.65 2.39 2.02 -1.02 -1.05 112.91 115.65 2fy2 h THR 490 Ca 0.03 -0.57 -0.03 0.00 0.77 0.00 0.00 66.41 66.61 2fy2 h THR 490 Cb 0.21 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 66.80 2fy2 h THR 490 CO -0.09 0.26 0.30 0.00 0.37 0.00 0.00 175.52 176.36 2fy2 h ALA 491 N 1.22 0.84 -0.58 6.16 0.00 -0.72 -0.85 119.26 125.33 2fy2 h ALA 491 Ca 0.27 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 2fy2 h ALA 491 Cb 0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2fy2 h ALA 491 CO -0.04 0.42 -0.02 -0.92 0.00 0.00 0.00 179.25 178.69 2fy2 h TYR 492 N 0.90 1.13 -0.26 0.00 3.20 -0.81 -1.43 116.97 119.71 2fy2 h TYR 492 Ca 0.22 -0.20 0.04 0.00 3.14 0.00 0.00 58.73 61.93 2fy2 h TYR 492 Cb 0.15 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 2fy2 h TYR 492 CO 0.01 1.01 0.02 1.15 -1.64 0.00 0.00 178.16 178.70 2fy2 h THR 493 N 0.92 0.83 -0.79 1.81 2.02 -0.81 0.61 112.91 117.50 2fy2 h THR 493 Ca 0.16 -0.03 -0.05 0.00 0.77 0.00 0.00 66.41 67.26 2fy2 h THR 493 Cb 0.57 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 2fy2 h THR 493 CO 0.03 0.02 0.31 0.58 0.37 0.00 0.00 175.52 176.83 2fy2 h VAL 494 N 0.10 1.26 -0.15 3.16 2.07 -0.99 -1.55 116.25 120.15 2fy2 h VAL 494 Ca 0.12 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.83 2fy2 h VAL 494 Cb 0.15 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 2fy2 h VAL 494 CO -0.19 0.33 0.10 -0.03 0.02 0.00 0.00 177.57 177.80 2fy2 h MET 495 N 1.15 0.20 -0.03 1.57 -1.53 -0.63 -2.45 114.93 113.21 2fy2 h MET 495 Ca 0.26 -0.01 -0.00 0.00 -3.44 0.00 0.00 59.70 56.51 2fy2 h MET 495 Cb 0.21 -0.04 -0.00 0.00 -0.55 0.00 0.00 31.60 31.22 2fy2 h MET 495 CO -0.02 0.15 0.01 0.00 0.14 0.00 0.00 176.91 177.20 2fy2 h ALA 496 N 1.04 0.03 0.00 0.39 0.00 -0.63 0.83 119.26 120.92 2fy2 h ALA 496 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2fy2 h ALA 496 Cb -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2fy2 h ALA 496 CO -0.01 -0.43 -0.14 -0.84 0.00 0.00 0.00 179.25 177.84 2fy2 h ILE 497 N -0.04 0.87 -0.33 0.00 3.07 -1.25 -1.00 117.51 118.83 2fy2 h ILE 497 Ca 0.01 -0.50 0.00 0.00 1.55 0.00 0.00 64.86 65.92 2fy2 h ILE 497 Cb 0.08 1.29 0.00 0.00 -0.27 0.00 0.00 36.82 37.92 2fy2 h ILE 497 CO -0.00 0.13 0.00 0.35 -1.05 0.00 0.00 178.15 177.58 2fy2 n THR 498 N -4.05 0.59 -1.47 0.16 -2.24 -0.93 -4.67 114.28 101.65 2fy2 n THR 498 Ca -0.02 -0.48 -0.10 0.00 -2.27 0.00 0.00 64.05 61.18 2fy2 n THR 498 Cb 0.22 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.53 2fy2 n THR 498 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fy2 n GLY 499 N 0.91 0.89 1.40 3.38 0.00 -0.38 -4.84 105.19 106.55 2fy2 n GLY 499 Ca 0.11 -0.56 0.03 0.00 0.00 0.00 0.00 46.02 45.61 2fy2 n GLY 499 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2fy2 n MET 500 N -2.55 3.38 -0.47 1.61 2.81 0.27 -4.52 117.12 117.64 2fy2 n MET 500 Ca -0.10 -3.01 0.00 0.00 -1.81 0.00 0.00 57.70 52.78 2fy2 n MET 500 Cb 0.38 -2.02 0.00 0.00 -0.71 0.00 0.00 33.22 30.87 2fy2 n MET 500 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2fy2 n ALA 501 N -0.28 0.00 -0.02 3.04 0.00 -1.23 -4.78 120.51 117.23 2fy2 n ALA 501 Ca 0.29 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.74 2fy2 n ALA 501 Cb 1.10 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.48 2fy2 n ALA 501 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2fy2 n ILE 502 N -0.98 0.26 0.35 0.00 -5.35 -1.26 -4.64 119.36 107.74 2fy2 n ILE 502 Ca 0.00 -0.28 -0.18 0.00 -0.27 0.00 0.00 62.75 62.03 2fy2 n ILE 502 Cb 0.00 -0.20 -0.09 0.00 -1.74 0.00 0.00 39.64 37.62 2fy2 n ILE 502 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 2fy2 h ASP 503 N 0.00 -0.85 -0.89 7.28 5.19 -1.98 -1.16 116.42 124.00 2fy2 h ASP 503 Ca -0.10 0.04 0.02 0.00 -0.62 0.00 0.00 57.03 56.36 2fy2 h ASP 503 Cb 0.92 0.24 -0.05 0.00 0.18 0.00 0.00 39.33 40.62 2fy2 h ASP 503 CO 0.01 -0.56 0.59 0.78 -3.12 0.00 0.00 179.24 176.94 2fy2 h ASN 504 N -0.90 1.01 0.39 6.45 2.35 -1.93 -1.12 115.58 121.82 2fy2 h ASN 504 Ca -0.08 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 2fy2 h ASN 504 Cb 0.72 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.84 2fy2 h ASN 504 CO 0.10 0.72 -0.20 -0.74 -1.65 0.00 0.00 177.43 175.66 2fy2 h HIS 505 N 1.19 -0.52 -0.91 1.19 2.76 -1.79 -1.23 115.15 115.84 2fy2 h HIS 505 Ca 0.33 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.50 2fy2 h HIS 505 Cb -0.10 0.18 -0.04 0.00 1.55 0.00 0.00 27.41 28.99 2fy2 h HIS 505 CO -0.00 -0.32 0.59 -0.07 -1.30 0.00 0.00 177.93 176.83 2fy2 h LEU 506 N -0.55 1.07 -0.00 0.26 3.38 -0.98 -1.42 115.31 117.07 2fy2 h LEU 506 Ca -0.05 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.89 2fy2 h LEU 506 Cb 0.43 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2fy2 h LEU 506 CO 0.08 0.79 -0.09 0.25 0.09 0.00 0.00 178.44 179.56 2fy2 h LEU 507 N 1.25 -0.27 -0.77 1.67 5.85 -0.91 0.17 115.31 122.30 2fy2 h LEU 507 Ca 0.33 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 59.07 2fy2 h LEU 507 Cb -0.11 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2fy2 h LEU 507 CO -0.07 -0.14 0.38 0.00 -0.34 0.00 0.00 178.44 178.28 2fy2 h ALA 508 N 0.82 1.00 -0.77 1.25 0.00 -0.90 -0.37 119.26 120.28 2fy2 h ALA 508 Ca 0.04 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2fy2 h ALA 508 Cb 0.21 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2fy2 h ALA 508 CO -0.10 0.55 0.29 -0.07 0.00 0.00 0.00 179.25 179.93 2fy2 h LEU 509 N 1.09 1.08 -0.03 0.00 3.38 -0.92 -0.12 115.31 119.79 2fy2 h LEU 509 Ca 0.27 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2fy2 h LEU 509 Cb 0.11 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2fy2 h LEU 509 CO -0.03 0.97 0.01 -0.09 0.09 0.00 0.00 178.44 179.39 2fy2 h ARG 510 N 1.13 0.05 0.00 1.13 2.43 -0.08 -2.06 114.38 116.98 2fy2 h ARG 510 Ca 0.26 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.31 2fy2 h ARG 510 Cb 0.24 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 2fy2 h ARG 510 CO -0.02 0.23 -0.52 0.93 -1.51 0.00 0.00 179.97 179.09 2fy2 h GLU 511 N -0.14 0.00 -0.12 0.20 4.39 -0.96 -1.11 114.58 116.83 2fy2 h GLU 511 Ca 0.01 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.59 2fy2 h GLU 511 Cb 0.20 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2fy2 h GLU 511 CO -0.00 0.52 -0.46 -0.07 -1.16 0.00 0.00 179.01 177.83 2fy2 h LEU 512 N 0.00 0.32 -0.17 1.33 3.38 -0.95 -1.87 115.31 117.35 2fy2 h LEU 512 Ca -0.01 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 2fy2 h LEU 512 Cb 0.93 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 2fy2 h LEU 512 CO 0.07 0.74 -0.09 0.00 0.09 0.00 0.00 178.44 179.26 2fy2 h ALA 513 N 1.27 0.24 -0.83 1.53 0.00 -1.00 -2.83 119.26 117.64 2fy2 h ALA 513 Ca 0.02 -0.28 0.13 0.00 0.00 0.00 0.00 54.91 54.77 2fy2 h ALA 513 Cb 0.91 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.58 2fy2 h ALA 513 CO 0.07 0.06 0.54 -0.09 0.00 0.00 0.00 179.25 179.84 2fy2 h ARG 514 N 0.04 0.64 -0.06 0.00 2.43 -0.97 0.38 114.38 116.83 2fy2 h ARG 514 Ca 0.04 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 2fy2 h ARG 514 Cb 0.56 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 2fy2 h ARG 514 CO 0.03 0.42 -0.28 0.00 -1.51 0.00 0.00 179.97 178.63 2fy2 h ALA 515 N 1.61 1.42 -0.07 2.80 0.00 -1.15 -2.81 119.26 121.07 2fy2 h ALA 515 Ca 0.41 -0.28 -0.23 0.00 0.00 0.00 0.00 54.91 54.80 2fy2 h ALA 515 Cb 0.65 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.39 2fy2 h ALA 515 CO -0.17 0.42 -0.85 0.52 0.00 0.00 0.00 179.25 179.17 2fy2 h MET 516 N 0.10 0.69 -1.93 0.00 2.86 -0.08 -3.46 114.93 113.11 2fy2 h MET 516 Ca 0.02 -0.66 0.03 0.00 -2.06 0.00 0.00 59.70 57.02 2fy2 h MET 516 Cb 0.55 0.17 -0.22 0.00 0.06 0.00 0.00 31.60 32.15 2fy2 h MET 516 CO 0.04 1.26 0.08 0.00 1.06 0.00 0.00 176.91 179.35 2fy2 h ALA 518 N 6.67 2.15 -1.74 0.00 0.00 -1.83 -3.36 119.26 121.15 2fy2 h ALA 518 Ca -0.30 -0.01 -0.59 0.00 0.00 0.00 0.00 54.91 54.01 2fy2 h ALA 518 Cb 1.22 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 2fy2 h ALA 518 CO 0.15 -0.59 0.73 0.00 0.00 0.00 0.00 179.25 179.55 2fy2 s ALA 519 N -4.72 3.12 0.67 0.00 0.00 -1.26 -4.95 121.76 114.63 2fy2 s ALA 519 Ca -0.05 -0.98 -0.16 0.00 0.00 0.00 0.00 51.96 50.78 2fy2 s ALA 519 Cb 0.16 -3.83 0.01 0.00 0.00 0.00 0.00 23.12 19.46 2fy2 s ALA 519 CO 0.59 -2.42 1.15 -0.51 0.00 0.00 0.00 175.76 174.58 2fy2 s LEU 520 N 4.29 3.40 0.71 0.00 1.43 -1.26 -4.93 118.68 122.32 2fy2 s LEU 520 Ca 0.37 2.17 -0.16 0.00 -1.03 0.00 0.00 54.13 55.49 2fy2 s LEU 520 Cb -0.10 -4.57 0.03 0.00 0.03 0.00 0.00 46.19 41.58 2fy2 s LEU 520 CO 0.23 -1.85 1.22 -2.84 0.23 0.00 0.00 176.35 173.35 2fy2 s PRO 521 N -3.92 2.22 0.55 1.29 0.02 -1.26 -4.79 135.00 129.11 2fy2 s PRO 521 Ca 0.71 1.81 0.25 0.00 0.02 0.00 0.00 61.00 63.79 2fy2 s PRO 521 Cb -0.25 -1.84 1.44 0.00 0.02 0.00 0.00 34.50 33.88 2fy2 s PRO 521 CO 0.41 -1.78 2.03 1.49 -0.33 0.00 0.00 177.00 178.82 2fy2 h GLU 522 N -0.13 0.00 -0.81 5.54 4.81 -1.96 -1.10 114.58 120.93 2fy2 h GLU 522 Ca -0.48 0.00 0.19 0.00 -0.13 0.00 0.00 59.36 58.93 2fy2 h GLU 522 Cb 1.30 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 30.57 2fy2 h GLU 522 CO 0.50 0.00 0.27 1.98 -0.73 0.00 0.00 179.01 181.03 2fy2 h MET 523 N 0.00 0.32 -0.02 1.92 4.05 -1.89 0.80 114.93 120.11 2fy2 h MET 523 Ca 0.19 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.59 2fy2 h MET 523 Cb 0.80 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.53 2fy2 h MET 523 CO -0.00 0.21 -0.41 1.19 0.23 0.00 0.00 176.91 178.13 2fy2 n PHE 524 N -5.11 0.00 0.29 1.39 3.01 -0.45 -3.99 117.46 112.60 2fy2 n PHE 524 Ca 0.18 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.75 2fy2 n PHE 524 Cb 0.54 -0.01 -0.03 0.00 -0.01 0.00 0.00 39.48 39.97 2fy2 n PHE 524 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 2fy2 n MET 525 N 0.03 0.48 -1.64 -1.08 2.81 -0.59 -4.65 117.12 112.47 2fy2 n MET 525 Ca 0.10 -0.01 -0.47 0.00 -1.81 0.00 0.00 57.70 55.51 2fy2 n MET 525 Cb 0.47 -1.65 -0.04 0.00 -0.71 0.00 0.00 33.22 31.29 2fy2 n MET 525 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2fy2 n ASP 526 N -2.26 2.56 0.15 7.83 4.64 0.17 -4.84 116.55 124.80 2fy2 n ASP 526 Ca -0.00 1.11 0.14 0.00 -1.38 0.00 0.00 54.79 54.66 2fy2 n ASP 526 Cb 0.50 -1.36 0.69 0.00 -1.04 0.00 0.00 41.12 39.91 2fy2 n ASP 526 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 2fy2 h GLU 527 N 5.05 0.00 -0.89 -0.67 4.57 -1.91 -0.77 114.58 119.96 2fy2 h GLU 527 Ca -0.45 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 57.70 2fy2 h GLU 527 Cb 1.28 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.83 2fy2 h GLU 527 CO 0.82 0.00 0.47 1.15 -1.18 0.00 0.00 179.01 180.27 2fy2 h THR 528 N 0.00 1.26 -0.19 0.32 2.02 -1.94 0.47 112.91 114.85 2fy2 h THR 528 Ca 0.11 -0.67 -0.07 0.00 0.77 0.00 0.00 66.41 66.56 2fy2 h THR 528 Cb 0.46 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2fy2 h THR 528 CO -0.00 0.30 -0.14 0.22 0.37 0.00 0.00 175.52 176.27 2fy2 h TYR 529 N 1.25 0.50 -0.83 3.16 5.03 -1.44 -1.50 116.97 123.15 2fy2 h TYR 529 Ca 0.31 -0.14 0.01 0.00 2.58 0.00 0.00 58.73 61.50 2fy2 h TYR 529 Cb 0.05 -0.11 -0.04 0.00 1.55 0.00 0.00 36.73 38.18 2fy2 h TYR 529 CO 0.01 0.76 0.54 -0.07 -1.32 0.00 0.00 178.16 178.08 2fy2 h LEU 530 N 0.10 0.93 -0.72 2.82 3.38 -1.12 -2.32 115.31 118.39 2fy2 h LEU 530 Ca 0.04 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 2fy2 h LEU 530 Cb 0.65 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2fy2 h LEU 530 CO 0.04 0.67 -0.42 -0.03 0.09 0.00 0.00 178.44 178.79 2fy2 h MET 531 N 1.10 0.49 0.00 1.13 4.05 -0.89 -2.98 114.93 117.83 2fy2 h MET 531 Ca 0.31 -0.25 -0.00 0.00 -0.28 0.00 0.00 59.70 59.48 2fy2 h MET 531 Cb -0.10 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 30.71 2fy2 h MET 531 CO -0.08 0.82 -0.01 0.66 0.23 0.00 0.00 176.91 178.53 2fy2 h SER 532 N 0.40 0.00 -0.46 1.39 4.64 -0.69 -2.07 113.55 116.76 2fy2 h SER 532 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2fy2 h SER 532 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2fy2 h SER 532 CO 0.08 0.01 0.00 0.59 -0.87 0.00 0.00 176.83 176.63 2fy2 n ASN 533 N -3.17 4.32 -4.21 4.97 3.02 -1.13 -4.75 115.26 114.31 2fy2 n ASN 533 Ca -0.02 -2.63 -0.42 0.00 -0.03 0.00 0.00 54.58 51.49 2fy2 n ASN 533 Cb 0.12 -0.52 -0.06 0.00 -0.61 0.00 0.00 39.78 38.71 2fy2 n ASN 533 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2fy2 s ARG 534 N -2.15 3.09 -1.11 3.52 0.52 -0.78 -5.01 118.95 117.03 2fy2 s ARG 534 Ca 0.44 -2.52 -0.22 0.00 -0.52 0.00 0.00 55.73 52.91 2fy2 s ARG 534 Cb 0.31 -4.08 0.01 0.00 0.52 0.00 0.00 34.95 31.71 2fy2 s ARG 534 CO 0.17 -1.23 1.72 -0.06 0.02 0.00 0.00 175.30 175.92 2fy2 s PHE 535 N 0.01 2.36 0.57 -0.53 0.08 -1.26 -4.50 117.98 114.71 2fy2 s PHE 535 Ca 0.18 -0.55 0.27 0.00 0.12 0.00 0.00 56.93 56.94 2fy2 s PHE 535 Cb -0.15 -4.46 1.70 0.00 -0.57 0.00 0.00 43.02 39.54 2fy2 s PHE 535 CO -0.06 -1.72 2.23 0.28 -0.10 0.00 0.00 175.22 175.84 2fy2 h VAL 536 N 6.40 0.62 -3.59 -0.44 2.07 -1.86 -3.32 116.25 116.12 2fy2 h VAL 536 Ca 0.26 -0.04 -0.63 0.00 0.82 0.00 0.00 66.70 67.11 2fy2 h VAL 536 Cb 0.95 1.02 -0.39 0.00 -1.52 0.00 0.00 31.29 31.36 2fy2 h VAL 536 CO 1.36 0.01 -0.76 -0.22 0.02 0.00 0.00 177.57 177.98 2fy2 s LEU 537 N -7.92 3.40 -0.25 2.57 0.20 -1.23 -0.18 118.68 115.28 2fy2 s LEU 537 Ca -0.05 -1.64 -0.07 0.00 0.69 0.00 0.00 54.13 53.06 2fy2 s LEU 537 Cb 0.15 -1.33 -0.02 0.00 -0.43 0.00 0.00 46.19 44.56 2fy2 s LEU 537 CO 0.57 -0.32 0.06 -0.55 -0.29 0.00 0.00 176.35 175.83 2fy2 s SER 538 N 1.22 5.05 0.38 3.68 0.15 -1.03 -0.90 113.70 122.25 2fy2 s SER 538 Ca 0.03 -0.29 0.04 0.00 0.70 0.00 0.00 55.95 56.43 2fy2 s SER 538 Cb -0.19 -1.90 -0.06 0.00 -1.71 0.00 0.00 66.02 62.17 2fy2 s SER 538 CO -0.10 -0.05 0.05 0.42 1.20 0.00 0.00 173.24 174.75 2fy2 s THR 539 N 1.59 1.31 -0.27 6.45 -4.23 0.55 -1.47 115.64 119.57 2fy2 s THR 539 Ca 0.06 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.30 2fy2 s THR 539 Cb -0.15 -2.70 0.17 0.00 1.34 0.00 0.00 72.50 71.16 2fy2 s THR 539 CO 0.03 0.00 1.30 -0.94 -0.54 0.00 0.00 174.62 174.47 2fy2 s SER 540 N -3.61 -0.15 -0.19 3.99 1.04 -0.86 -4.20 113.70 109.71 2fy2 s SER 540 Ca 0.30 0.25 -0.08 0.00 0.48 0.00 0.00 55.95 56.91 2fy2 s SER 540 Cb 0.07 0.23 -0.04 0.00 0.10 0.00 0.00 66.02 66.39 2fy2 s SER 540 CO 0.14 -0.08 0.07 -1.58 0.98 0.00 0.00 173.24 172.77 2fy2 s GLN 541 N -0.37 3.94 -0.55 4.02 0.74 -1.26 -2.03 119.66 124.15 2fy2 s GLN 541 Ca 0.06 -0.36 0.05 0.00 0.05 0.00 0.00 55.36 55.16 2fy2 s GLN 541 Cb -0.03 -3.25 0.18 0.00 1.10 0.00 0.00 33.01 31.01 2fy2 s GLN 541 CO -0.10 0.20 0.43 0.28 -0.55 0.00 0.00 175.29 175.55 2fy2 n VAL 542 N 3.77 0.16 -2.38 1.34 0.31 -0.14 -4.96 118.33 116.44 2fy2 n VAL 542 Ca -0.16 -4.14 -0.41 0.00 -0.01 0.00 0.00 64.34 59.62 2fy2 n VAL 542 Cb 0.52 -1.91 -0.04 0.00 -0.91 0.00 0.00 33.84 31.50 2fy2 n VAL 542 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2fy2 s PRO 543 N -0.75 4.55 0.10 5.55 0.04 -1.26 -4.48 135.00 138.75 2fy2 s PRO 543 Ca 0.30 1.90 0.03 0.00 0.04 0.00 0.00 61.00 63.27 2fy2 s PRO 543 Cb 0.02 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.34 2fy2 s PRO 543 CO -0.18 0.06 -0.09 0.95 0.04 0.00 0.00 177.00 177.78 2fy2 s THR 544 N -0.87 0.91 -0.77 1.26 -4.23 -1.26 -5.02 115.64 105.66 2fy2 s THR 544 Ca 0.47 -1.69 0.19 0.00 -1.18 0.00 0.00 61.69 59.49 2fy2 s THR 544 Cb -0.34 -1.41 -0.22 0.00 1.34 0.00 0.00 72.50 71.88 2fy2 s THR 544 CO 0.42 -0.61 0.75 0.35 -0.54 0.00 0.00 174.62 175.00 2fy2 n THR 545 N 0.46 0.00 -2.89 3.99 -2.24 -1.26 -4.95 114.28 107.38 2fy2 n THR 545 Ca -0.15 -0.11 -0.18 0.00 -2.27 0.00 0.00 64.05 61.33 2fy2 n THR 545 Cb 0.58 0.85 0.02 0.00 -2.10 0.00 0.00 70.33 69.68 2fy2 n THR 545 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2fy2 s THR 546 N -2.89 2.86 -0.87 4.28 2.01 -1.26 -4.99 115.64 114.78 2fy2 s THR 546 Ca 0.05 -0.89 -0.06 0.00 0.31 0.00 0.00 61.69 61.09 2fy2 s THR 546 Cb 0.14 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.65 2fy2 s THR 546 CO 0.79 0.00 2.91 1.21 -0.69 0.00 0.00 174.62 178.84 2fy2 n GLU 547 N -2.02 3.24 -4.33 4.92 2.13 -1.26 -4.86 120.64 118.46 2fy2 n GLU 547 Ca 0.08 -2.31 -0.17 0.00 0.66 0.00 0.00 57.16 55.42 2fy2 n GLU 547 Cb 0.59 -2.40 -0.10 0.00 0.27 0.00 0.00 31.44 29.80 2fy2 n GLU 547 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2fy2 s MET 548 N -0.01 1.31 0.04 5.31 0.23 -1.26 -3.15 119.30 121.77 2fy2 s MET 548 Ca 0.62 -1.64 -0.10 0.00 -1.03 0.00 0.00 55.69 53.54 2fy2 s MET 548 Cb 0.27 -0.72 0.01 0.00 -1.53 0.00 0.00 34.83 32.85 2fy2 s MET 548 CO -0.10 -0.03 0.22 -0.59 -2.03 0.00 0.00 175.02 172.50 2fy2 s PHE 549 N -3.32 0.02 0.13 3.16 -0.12 -0.89 -4.80 117.98 112.15 2fy2 s PHE 549 Ca 0.26 -0.22 0.05 0.00 -0.05 0.00 0.00 56.93 56.97 2fy2 s PHE 549 Cb 0.04 -0.00 -0.04 0.00 -0.63 0.00 0.00 43.02 42.39 2fy2 s PHE 549 CO 0.07 -0.45 0.06 0.00 -0.05 0.00 0.00 175.22 174.85 2fy2 s TYR 552 N -3.31 -0.30 0.80 0.00 -0.85 -1.26 -1.44 117.35 110.99 2fy2 s TYR 552 Ca -0.00 -0.07 -0.06 0.00 -0.52 0.00 0.00 57.07 56.42 2fy2 s TYR 552 Cb 0.00 0.65 0.15 0.00 0.38 0.00 0.00 41.96 43.15 2fy2 s TYR 552 CO -0.09 -1.10 1.11 0.20 -1.52 0.00 0.00 175.55 174.15 2fy2 s GLY 553 N -2.86 1.77 0.97 5.49 0.00 -0.58 -4.53 107.32 107.57 2fy2 s GLY 553 Ca 0.08 -1.55 -0.12 0.00 0.00 0.00 0.00 44.72 43.13 2fy2 s GLY 553 CO 0.00 -0.91 1.10 -4.14 0.00 0.00 0.00 173.10 169.14 2fy2 s PRO 554 N -5.40 0.66 -0.01 2.90 0.02 -1.26 -4.61 135.00 127.30 2fy2 s PRO 554 Ca 0.69 0.55 0.11 0.00 0.02 0.00 0.00 61.00 62.38 2fy2 s PRO 554 Cb -0.05 -1.76 -0.15 0.00 0.02 0.00 0.00 34.50 32.57 2fy2 s PRO 554 CO 0.47 -2.58 0.40 1.33 -0.33 0.00 0.00 177.00 176.29 2fy2 n VAL 555 N -4.08 0.00 -4.24 3.83 0.24 -1.26 -4.74 118.33 108.07 2fy2 n VAL 555 Ca 0.06 -0.25 -0.18 0.00 -2.04 0.00 0.00 64.34 61.93 2fy2 n VAL 555 Cb 0.57 0.71 -0.13 0.00 -1.47 0.00 0.00 33.84 33.52 2fy2 n VAL 555 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2fy2 s VAL 556 N -2.35 0.93 0.34 3.34 -7.23 -1.26 -4.98 120.40 109.19 2fy2 s VAL 556 Ca 0.01 -1.00 0.13 0.00 -1.81 0.00 0.00 61.98 59.31 2fy2 s VAL 556 Cb 0.08 -0.88 0.33 0.00 0.56 0.00 0.00 36.38 36.47 2fy2 s VAL 556 CO 0.47 -0.10 1.65 -0.65 -0.31 0.00 0.00 175.10 176.16 2fy2 h PRO 557 N 4.82 0.25 -0.84 4.82 0.11 -1.97 -0.46 132.00 138.72 2fy2 h PRO 557 Ca -0.37 -0.01 -0.42 0.00 0.11 0.00 0.00 66.00 65.30 2fy2 h PRO 557 Cb 1.19 -0.06 -0.25 0.00 0.11 0.00 0.00 31.00 31.99 2fy2 h PRO 557 CO 0.43 0.16 0.47 0.27 -0.21 0.00 0.00 178.00 179.13 2fy2 n ASN 558 N -5.12 3.62 -3.29 -2.05 6.94 -1.26 -4.53 115.26 109.57 2fy2 n ASN 558 Ca 0.31 -3.60 -0.15 0.00 -0.02 0.00 0.00 54.58 51.11 2fy2 n ASN 558 Cb 0.97 -0.79 -0.03 0.00 -2.36 0.00 0.00 39.78 37.57 2fy2 n ASN 558 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2fy2 n GLY 559 N -1.04 3.79 3.52 4.83 0.00 -0.18 -4.83 105.19 111.27 2fy2 n GLY 559 Ca 0.53 -2.28 -0.25 0.00 0.00 0.00 0.00 46.02 44.01 2fy2 n GLY 559 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fy2 s TYR 560 N -1.82 2.33 -0.23 1.61 1.51 0.75 -4.25 117.35 117.25 2fy2 s TYR 560 Ca 0.02 -0.48 0.01 0.00 -1.01 0.00 0.00 57.07 55.61 2fy2 s TYR 560 Cb -0.00 -1.26 0.05 0.00 -0.11 0.00 0.00 41.96 40.64 2fy2 s TYR 560 CO 0.01 0.59 -0.08 0.20 -1.11 0.00 0.00 175.55 175.16 2fy2 s GLY 561 N -3.57 1.33 -0.28 0.71 0.00 0.19 -2.47 107.32 103.23 2fy2 s GLY 561 Ca 0.32 -1.36 0.00 0.00 0.00 0.00 0.00 44.72 43.68 2fy2 s GLY 561 CO 0.16 0.82 0.04 0.00 0.00 0.00 0.00 173.10 174.11 2fy2 s ALA 562 N 1.36 1.83 -0.22 3.20 0.00 -0.54 -0.05 121.76 127.34 2fy2 s ALA 562 Ca -0.05 -1.60 -0.02 0.00 0.00 0.00 0.00 51.96 50.30 2fy2 s ALA 562 Cb -0.18 -1.57 0.01 0.00 0.00 0.00 0.00 23.12 21.38 2fy2 s ALA 562 CO -0.07 -1.46 -0.09 0.00 0.00 0.00 0.00 175.76 174.14 2fy2 s TYR 564 N 1.38 2.63 -0.36 0.00 1.13 -0.86 -0.75 117.35 120.51 2fy2 s TYR 564 Ca 0.04 -0.22 0.00 0.00 -1.41 0.00 0.00 57.07 55.48 2fy2 s TYR 564 Cb -0.15 -1.27 0.12 0.00 -1.10 0.00 0.00 41.96 39.56 2fy2 s TYR 564 CO -0.07 0.53 0.16 1.21 -2.51 0.00 0.00 175.55 174.87 2fy2 s ASN 565 N -2.93 3.79 0.06 -0.18 3.84 -0.14 -0.96 114.94 118.42 2fy2 s ASN 565 Ca 0.26 -2.05 -0.30 0.00 0.21 0.00 0.00 52.86 50.98 2fy2 s ASN 565 Cb -0.08 -0.88 -0.05 0.00 -0.55 0.00 0.00 41.25 39.69 2fy2 s ASN 565 CO 0.16 -0.35 0.97 -2.16 -2.79 0.00 0.00 177.10 172.93 2fy2 s PRO 566 N 1.11 4.64 0.47 0.43 0.04 -1.26 -1.58 135.00 138.84 2fy2 s PRO 566 Ca 0.13 1.44 0.05 0.00 0.04 0.00 0.00 61.00 62.67 2fy2 s PRO 566 Cb -0.20 -3.41 -0.03 0.00 0.04 0.00 0.00 34.50 30.90 2fy2 s PRO 566 CO -0.13 0.10 0.14 -0.65 0.04 0.00 0.00 177.00 176.50 2fy2 s GLN 567 N 0.43 2.18 0.25 4.56 -1.52 0.12 -4.81 119.66 120.88 2fy2 s GLN 567 Ca 0.49 -2.09 -0.03 0.00 -1.95 0.00 0.00 55.36 51.78 2fy2 s GLN 567 Cb -0.22 -1.81 0.43 0.00 -0.22 0.00 0.00 33.01 31.18 2fy2 s GLN 567 CO 0.29 -0.27 1.81 -1.35 -0.25 0.00 0.00 175.29 175.52 2fy2 h PRO 568 N 1.33 0.78 -0.03 2.91 0.11 -1.96 -0.36 132.00 134.78 2fy2 h PRO 568 Ca -0.42 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2fy2 h PRO 568 Cb 1.28 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2fy2 h PRO 568 CO 0.71 0.51 0.00 0.39 -0.21 0.00 0.00 178.00 179.40 2fy2 n GLU 569 N -4.74 0.42 -4.02 1.05 -0.58 -1.26 -1.48 120.64 110.02 2fy2 n GLU 569 Ca 0.14 -0.96 -0.11 0.00 -0.42 0.00 0.00 57.16 55.82 2fy2 n GLU 569 Cb 0.30 -1.07 -0.05 0.00 -0.57 0.00 0.00 31.44 30.05 2fy2 n GLU 569 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2fy2 s THR 570 N -0.47 0.00 -0.07 2.62 -4.23 -1.21 -3.14 115.64 109.13 2fy2 s THR 570 Ca 0.05 -1.46 -0.03 0.00 -1.18 0.00 0.00 61.69 59.07 2fy2 s THR 570 Cb 0.03 -2.37 0.04 0.00 1.34 0.00 0.00 72.50 71.55 2fy2 s THR 570 CO 0.04 0.00 0.15 -0.63 -0.54 0.00 0.00 174.62 173.64 2fy2 s ILE 571 N -3.69 -0.18 -0.02 2.99 1.01 -0.28 0.16 121.20 121.18 2fy2 s ILE 571 Ca 0.25 0.30 -0.18 0.00 0.00 0.00 0.00 60.65 61.02 2fy2 s ILE 571 Cb -0.00 -0.26 -0.05 0.00 0.01 0.00 0.00 42.46 42.15 2fy2 s ILE 571 CO 0.12 0.13 0.51 -0.22 0.00 0.00 0.00 174.94 175.48 2fy2 s LEU 572 N 1.91 4.41 -0.13 2.97 2.96 -0.62 -0.52 118.68 129.66 2fy2 s LEU 572 Ca -0.01 1.03 0.01 0.00 -0.22 0.00 0.00 54.13 54.95 2fy2 s LEU 572 Cb -0.12 -2.77 0.02 0.00 0.50 0.00 0.00 46.19 43.82 2fy2 s LEU 572 CO -0.06 0.16 -0.16 -0.36 -1.32 0.00 0.00 176.35 174.62 2fy2 s PHE 573 N -0.35 2.17 -0.33 5.38 0.08 0.12 -0.96 117.98 124.08 2fy2 s PHE 573 Ca 0.27 -1.12 -0.07 0.00 0.12 0.00 0.00 56.93 56.13 2fy2 s PHE 573 Cb -0.17 -1.56 0.03 0.00 -0.57 0.00 0.00 43.02 40.75 2fy2 s PHE 573 CO 0.15 -0.59 0.11 0.00 -0.10 0.00 0.00 175.22 174.79 2fy2 s ILE 575 N 1.43 2.78 0.13 0.00 1.01 -0.21 -1.41 121.20 124.93 2fy2 s ILE 575 Ca -0.01 -0.73 0.09 0.00 0.00 0.00 0.00 60.65 60.00 2fy2 s ILE 575 Cb -0.19 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 2fy2 s ILE 575 CO 0.03 0.51 -0.21 -0.94 0.00 0.00 0.00 174.94 174.33 2fy2 s SER 576 N 0.81 2.67 0.19 3.58 1.04 0.93 -1.12 113.70 121.79 2fy2 s SER 576 Ca -0.05 -0.75 -0.24 0.00 0.48 0.00 0.00 55.95 55.40 2fy2 s SER 576 Cb -0.15 -0.15 0.06 0.00 0.10 0.00 0.00 66.02 65.87 2fy2 s SER 576 CO 0.00 0.04 0.92 -0.94 0.98 0.00 0.00 173.24 174.25 2fy2 s SER 577 N -2.16 -0.17 -0.13 7.02 1.04 -0.71 0.55 113.70 119.13 2fy2 s SER 577 Ca 0.10 -0.49 -0.05 0.00 0.48 0.00 0.00 55.95 55.99 2fy2 s SER 577 Cb -0.09 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 2fy2 s SER 577 CO 0.05 -1.02 0.05 -0.36 0.98 0.00 0.00 173.24 172.95 2fy2 s PHE 578 N -3.27 3.28 0.39 5.02 0.40 -1.26 -0.52 117.98 122.03 2fy2 s PHE 578 Ca 0.13 0.21 0.33 0.00 -0.60 0.00 0.00 56.93 56.99 2fy2 s PHE 578 Cb -0.02 -1.92 1.65 0.00 0.51 0.00 0.00 43.02 43.23 2fy2 s PHE 578 CO 0.04 0.40 2.12 0.45 0.70 0.00 0.00 175.22 178.93 2fy2 h HIS 579 N 5.69 0.00 -0.05 0.36 3.86 -1.58 -2.53 115.15 120.91 2fy2 h HIS 579 Ca -0.46 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 58.70 2fy2 h HIS 579 Cb 1.19 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.65 2fy2 h HIS 579 CO 0.63 0.07 -0.17 1.03 0.86 0.00 0.00 177.93 180.34 2fy2 h SER 580 N 0.00 0.07 -3.58 2.45 0.87 -1.93 -3.39 113.55 108.04 2fy2 h SER 580 Ca -0.00 -0.01 -0.64 0.00 -1.23 0.00 0.00 61.79 59.91 2fy2 h SER 580 Cb 0.31 -0.02 -0.14 0.00 -0.44 0.00 0.00 62.40 62.11 2fy2 h SER 580 CO 0.01 0.25 0.13 0.00 -0.53 0.00 0.00 176.83 176.69 2fy2 h ALA 582 N 8.56 1.17 0.07 0.00 0.00 -1.85 -3.18 119.26 124.03 2fy2 h ALA 582 Ca -0.26 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2fy2 h ALA 582 Cb 1.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2fy2 h ALA 582 CO 0.84 0.09 -0.03 0.00 0.00 0.00 0.00 179.25 180.15 2fy2 h ALA 583 N 1.93 -0.09 -2.51 0.00 0.00 -1.93 -3.46 119.26 113.19 2fy2 h ALA 583 Ca -0.00 -0.28 -0.50 0.00 0.00 0.00 0.00 54.91 54.13 2fy2 h ALA 583 Cb 0.31 0.04 0.07 0.00 0.00 0.00 0.00 17.79 18.20 2fy2 h ALA 583 CO 0.01 -0.24 0.41 0.95 0.00 0.00 0.00 179.25 180.39 2fy2 s THR 584 N -3.57 3.32 -0.26 0.00 -4.23 -1.20 -5.05 115.64 104.64 2fy2 s THR 584 Ca -0.15 0.78 -0.07 0.00 -1.18 0.00 0.00 61.69 61.07 2fy2 s THR 584 Cb 0.00 -3.29 0.13 0.00 1.34 0.00 0.00 72.50 70.68 2fy2 s THR 584 CO 0.59 -0.22 0.55 -0.55 -0.54 0.00 0.00 174.62 174.45 2fy2 s SER 585 N -1.99 -0.79 0.16 3.99 0.15 -1.26 -4.92 113.70 109.03 2fy2 s SER 585 Ca 0.70 1.16 -0.13 0.00 0.70 0.00 0.00 55.95 58.39 2fy2 s SER 585 Cb -0.22 1.88 0.04 0.00 -1.71 0.00 0.00 66.02 66.02 2fy2 s SER 585 CO 0.29 -0.24 1.67 0.28 1.20 0.00 0.00 173.24 176.44 2fy2 h SER 586 N 8.07 0.77 0.20 5.45 0.02 -1.90 -0.53 113.55 125.62 2fy2 h SER 586 Ca -0.18 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.56 2fy2 h SER 586 Cb 1.12 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.43 2fy2 h SER 586 CO 0.15 0.79 -0.22 0.28 -1.14 0.00 0.00 176.83 176.68 2fy2 h SER 587 N 0.72 -0.61 -0.84 3.07 0.02 -1.93 0.36 113.55 114.34 2fy2 h SER 587 Ca 0.17 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 2fy2 h SER 587 Cb 0.30 0.21 -0.04 0.00 0.14 0.00 0.00 62.40 63.01 2fy2 h SER 587 CO -0.00 -0.32 0.50 0.11 -1.14 0.00 0.00 176.83 175.97 2fy2 h LYS 588 N -0.46 1.15 -0.60 3.45 1.57 -1.96 -1.14 116.57 118.57 2fy2 h LYS 588 Ca 0.01 -0.11 -0.08 0.00 -1.87 0.00 0.00 60.65 58.60 2fy2 h LYS 588 Cb 0.45 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2fy2 h LYS 588 CO -0.07 0.82 0.06 0.35 -0.57 0.00 0.00 179.45 180.04 2fy2 h PHE 589 N 1.16 1.06 -0.82 -1.35 3.57 -0.83 0.11 116.94 119.84 2fy2 h PHE 589 Ca 0.30 -0.15 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 2fy2 h PHE 589 Cb -0.03 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.38 2fy2 h PHE 589 CO -0.00 0.92 0.36 0.00 -2.23 0.00 0.00 178.31 177.36 2fy2 h ALA 590 N 1.13 1.10 -0.44 2.41 0.00 -0.47 -0.51 119.26 122.47 2fy2 h ALA 590 Ca 0.18 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2fy2 h ALA 590 Cb 0.46 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2fy2 h ALA 590 CO 0.02 0.66 0.10 -0.22 0.00 0.00 0.00 179.25 179.81 2fy2 h LYS 591 N 1.17 0.71 -0.01 0.00 1.63 -0.67 -2.08 116.57 117.33 2fy2 h LYS 591 Ca 0.28 -0.17 -0.05 0.00 -0.85 0.00 0.00 60.65 59.86 2fy2 h LYS 591 Cb 0.16 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 2fy2 h LYS 591 CO -0.03 0.72 -0.22 0.00 -3.45 0.00 0.00 179.45 176.47 2fy2 h ALA 592 N 0.96 1.63 -0.37 5.00 0.00 -0.29 -1.53 119.26 124.66 2fy2 h ALA 592 Ca 0.14 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2fy2 h ALA 592 Cb 0.33 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2fy2 h ALA 592 CO 0.00 0.28 -0.14 0.28 0.00 0.00 0.00 179.25 179.68 2fy2 h VAL 593 N 0.01 1.28 -0.06 0.00 2.07 -0.70 -0.52 116.25 118.33 2fy2 h VAL 593 Ca -0.00 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.28 2fy2 h VAL 593 Cb 0.39 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 2fy2 h VAL 593 CO 0.03 0.41 0.04 -0.08 0.02 0.00 0.00 177.57 177.99 2fy2 h GLU 594 N 0.54 0.08 -0.62 1.57 4.81 -0.71 -0.11 114.58 120.13 2fy2 h GLU 594 Ca 0.09 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2fy2 h GLU 594 Cb 0.67 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.00 2fy2 h GLU 594 CO 0.05 0.06 0.25 0.93 -0.73 0.00 0.00 179.01 179.57 2fy2 h GLU 595 N 0.07 0.90 -0.45 1.92 5.08 -1.25 -0.99 114.58 119.87 2fy2 h GLU 595 Ca 0.02 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.16 2fy2 h GLU 595 Cb -0.00 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 2fy2 h GLU 595 CO -0.00 0.74 -0.04 0.77 -1.00 0.00 0.00 179.01 179.47 2fy2 h SER 596 N 0.89 0.81 -0.35 1.42 0.02 -0.62 0.98 113.55 116.71 2fy2 h SER 596 Ca 0.21 -0.33 -0.11 0.00 -0.84 0.00 0.00 61.79 60.72 2fy2 h SER 596 Cb 0.17 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 2fy2 h SER 596 CO -0.02 0.95 -0.19 -0.07 -1.14 0.00 0.00 176.83 176.37 2fy2 h LEU 597 N 0.66 0.84 -0.06 5.07 3.38 -0.73 -1.10 115.31 123.36 2fy2 h LEU 597 Ca 0.12 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2fy2 h LEU 597 Cb 0.56 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 2fy2 h LEU 597 CO 0.03 1.01 -0.01 0.40 0.09 0.00 0.00 178.44 179.96 2fy2 h ILE 598 N 0.73 1.28 -0.71 1.22 1.08 -1.04 -1.24 117.51 118.83 2fy2 h ILE 598 Ca 0.11 -0.87 0.12 0.00 -0.39 0.00 0.00 64.86 63.82 2fy2 h ILE 598 Cb 0.70 1.75 -0.08 0.00 -3.07 0.00 0.00 36.82 36.12 2fy2 h ILE 598 CO 0.05 0.24 0.30 0.44 -0.69 0.00 0.00 178.15 178.50 2fy2 h ASP 599 N -0.22 0.33 -0.11 1.72 3.45 -0.68 -1.19 116.42 119.73 2fy2 h ASP 599 Ca 0.02 0.09 -0.11 0.00 0.43 0.00 0.00 57.03 57.45 2fy2 h ASP 599 Cb 0.39 0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 2fy2 h ASP 599 CO 0.00 0.16 -0.29 0.24 -1.57 0.00 0.00 179.24 177.79 2fy2 h MET 600 N 0.49 0.58 0.41 3.56 2.86 -1.09 -1.50 114.93 120.24 2fy2 h MET 600 Ca 0.37 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.75 2fy2 h MET 600 Cb 0.49 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.13 2fy2 h MET 600 CO -0.34 0.81 -0.19 -0.09 1.06 0.00 0.00 176.91 178.15 2fy2 h ARG 601 N 0.50 -0.52 -0.93 1.72 2.43 -0.32 -1.40 114.38 115.86 2fy2 h ARG 601 Ca 0.07 0.04 0.12 0.00 -0.81 0.00 0.00 59.98 59.39 2fy2 h ARG 601 Cb 0.75 0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 30.35 2fy2 h ARG 601 CO 0.06 -0.30 0.60 -0.44 -1.51 0.00 0.00 179.97 178.37 2fy2 h ASP 602 N -0.63 0.81 -0.39 -3.80 3.32 -1.15 -1.08 116.42 113.51 2fy2 h ASP 602 Ca -0.06 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 2fy2 h ASP 602 Cb 0.47 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 2fy2 h ASP 602 CO 0.09 0.45 0.16 -0.07 -1.72 0.00 0.00 179.24 178.15 2fy2 h LEU 603 N 0.88 0.54 0.00 1.55 3.38 -1.02 -1.87 115.31 118.78 2fy2 h LEU 603 Ca 0.45 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.26 2fy2 h LEU 603 Cb 0.50 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2fy2 h LEU 603 CO -0.21 0.56 0.00 0.00 0.09 0.00 0.00 178.44 178.87 2fy2 n SER 605 N -1.14 2.08 0.00 0.00 7.64 -0.64 -4.81 113.62 116.75 2fy2 n SER 605 Ca 0.14 -3.81 0.00 0.00 1.01 0.00 0.00 58.87 56.21 2fy2 n SER 605 Cb 0.12 -0.57 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 2fy2 n SER 605 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2fy2 n LEU 606 N -1.12 1.68 0.00 -3.43 4.77 -1.19 -4.99 117.00 112.71 2fy2 n LEU 606 Ca 0.25 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 2fy2 n LEU 606 Cb 0.83 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 2fy2 n LEU 606 CO 0.06 -0.22 0.00 -0.11 -1.33 0.00 0.00 177.39 175.79