#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fk9 s ILE 5 N 0.00 4.65 0.51 0.52 1.09 -1.26 -5.06 121.20 121.65 1fk9 s ILE 5 Ca 0.00 0.95 -0.19 0.00 -1.10 0.00 0.00 60.65 60.32 1fk9 s ILE 5 Cb 0.00 -3.74 -0.07 0.00 -1.06 0.00 0.00 42.46 37.58 1fk9 s ILE 5 CO 0.00 -0.68 1.03 -1.83 -0.10 0.00 0.00 174.94 173.35 1fk9 s GLU 6 N -4.13 3.74 0.30 2.79 -1.05 -1.26 -4.78 118.70 114.31 1fk9 s GLU 6 Ca 0.56 1.25 -0.15 0.00 -0.15 0.00 0.00 54.97 56.48 1fk9 s GLU 6 Cb -0.10 -2.09 -0.09 0.00 -0.44 0.00 0.00 34.13 31.41 1fk9 s GLU 6 CO 0.34 -0.47 0.72 0.95 0.95 0.00 0.00 175.26 177.75 1fk9 s THR 7 N -2.19 4.68 -0.32 1.83 -4.23 -1.26 -4.96 115.64 109.19 1fk9 s THR 7 Ca 0.65 0.97 -0.19 0.00 -1.18 0.00 0.00 61.69 61.94 1fk9 s THR 7 Cb -0.15 -3.65 -0.01 0.00 1.34 0.00 0.00 72.50 70.04 1fk9 s THR 7 CO 0.25 -0.12 0.55 -0.69 -0.54 0.00 0.00 174.62 174.07 1fk9 s VAL 8 N -1.90 4.99 0.21 2.29 1.01 -1.26 -4.98 120.40 120.76 1fk9 s VAL 8 Ca 0.52 0.58 -0.31 0.00 0.00 0.00 0.00 61.98 62.77 1fk9 s VAL 8 Cb -0.11 -3.96 -0.11 0.00 0.00 0.00 0.00 36.38 32.20 1fk9 s VAL 8 CO 0.18 -0.16 1.62 -2.16 0.00 0.00 0.00 175.10 174.58 1fk9 s PRO 9 N 2.47 4.17 0.19 2.72 0.04 -1.26 -4.09 135.00 139.23 1fk9 s PRO 9 Ca 0.21 2.49 0.10 0.00 0.04 0.00 0.00 61.00 63.84 1fk9 s PRO 9 Cb -0.15 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 1fk9 s PRO 9 CO 0.12 -0.65 -0.21 0.08 0.04 0.00 0.00 177.00 176.38 1fk9 s VAL 10 N 0.84 2.14 0.01 -0.36 1.01 -1.26 -5.05 120.40 117.73 1fk9 s VAL 10 Ca 0.70 -2.01 -0.10 0.00 0.00 0.00 0.00 61.98 60.57 1fk9 s VAL 10 Cb -0.46 -2.02 0.01 0.00 0.00 0.00 0.00 36.38 33.90 1fk9 s VAL 10 CO 0.36 -0.22 0.20 -0.54 0.00 0.00 0.00 175.10 174.90 1fk9 s LYS 11 N -2.77 0.60 0.94 2.72 1.02 -1.26 -4.74 119.74 116.25 1fk9 s LYS 11 Ca 0.19 -0.44 -0.13 0.00 0.02 0.00 0.00 55.97 55.60 1fk9 s LYS 11 Cb -0.07 0.25 0.15 0.00 -0.52 0.00 0.00 37.83 37.65 1fk9 s LYS 11 CO 0.09 -0.16 1.17 -0.51 -0.92 0.00 0.00 175.35 175.01 1fk9 s LEU 12 N -1.64 2.04 0.55 3.17 1.43 -1.26 -2.67 118.68 120.30 1fk9 s LEU 12 Ca -0.11 0.81 -0.20 0.00 -1.03 0.00 0.00 54.13 53.60 1fk9 s LEU 12 Cb -0.05 -3.05 -0.05 0.00 0.03 0.00 0.00 46.19 43.07 1fk9 s LEU 12 CO 0.00 -2.66 1.17 -0.54 0.23 0.00 0.00 176.35 174.55 1fk9 s LYS 13 N -5.42 3.24 0.33 1.70 1.02 0.32 -4.45 119.74 116.50 1fk9 s LYS 13 Ca 0.66 1.72 -0.29 0.00 0.02 0.00 0.00 55.97 58.08 1fk9 s LYS 13 Cb -0.12 -2.02 -0.12 0.00 -0.52 0.00 0.00 37.83 35.05 1fk9 s LYS 13 CO 0.53 -0.96 1.44 -0.35 -0.92 0.00 0.00 175.35 175.09 1fk9 n PRO 14 N -1.33 2.44 0.00 -1.68 -0.04 -1.26 -2.69 135.00 130.44 1fk9 n PRO 14 Ca 0.12 0.86 0.00 0.00 -0.04 0.00 0.00 63.50 64.44 1fk9 n PRO 14 Cb 0.50 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.41 1fk9 n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fk9 n GLY 15 N 1.15 1.83 3.67 0.55 0.00 -1.26 -4.98 105.19 106.14 1fk9 n GLY 15 Ca 0.05 -0.24 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 1fk9 n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fk9 s MET 16 N 0.00 0.95 0.36 1.61 -1.94 -1.10 -5.06 119.30 114.13 1fk9 s MET 16 Ca 0.00 1.46 0.04 0.00 -1.71 0.00 0.00 55.69 55.48 1fk9 s MET 16 Cb 0.00 -1.73 -0.05 0.00 2.01 0.00 0.00 34.83 35.07 1fk9 s MET 16 CO 0.00 -2.65 0.08 0.34 -0.01 0.00 0.00 175.02 172.78 1fk9 s ASP 17 N -2.72 2.60 0.74 3.03 2.15 -1.26 -4.81 116.67 116.40 1fk9 s ASP 17 Ca 0.66 -1.50 -0.14 0.00 0.43 0.00 0.00 52.55 52.01 1fk9 s ASP 17 Cb -0.22 0.16 0.05 0.00 -0.30 0.00 0.00 42.92 42.60 1fk9 s ASP 17 CO 0.58 -0.74 1.17 -0.83 -0.17 0.00 0.00 175.17 175.19 1fk9 s GLY 18 N -3.55 2.18 0.41 2.66 0.00 -1.26 -4.96 107.32 102.80 1fk9 s GLY 18 Ca 0.30 0.74 -0.26 0.00 0.00 0.00 0.00 44.72 45.51 1fk9 s GLY 18 CO 0.14 1.13 1.26 2.56 0.00 0.00 0.00 173.10 178.19 1fk9 s PRO 19 N -4.11 3.98 -0.44 2.90 0.04 -1.26 -4.94 135.00 131.18 1fk9 s PRO 19 Ca 0.71 2.04 0.10 0.00 0.04 0.00 0.00 61.00 63.89 1fk9 s PRO 19 Cb -0.26 -2.72 0.33 0.00 0.04 0.00 0.00 34.50 31.89 1fk9 s PRO 19 CO 0.47 -0.44 0.76 1.63 0.04 0.00 0.00 177.00 179.46 1fk9 n LYS 20 N 0.10 1.56 -3.70 4.56 5.02 -1.25 -1.01 118.16 123.43 1fk9 n LYS 20 Ca 0.04 -3.78 -0.36 0.00 -2.02 0.00 0.00 58.31 52.19 1fk9 n LYS 20 Cb 0.45 -1.81 -0.07 0.00 -0.02 0.00 0.00 35.03 33.58 1fk9 n LYS 20 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1fk9 s VAL 21 N -2.79 5.38 0.25 -0.18 0.11 -0.79 -4.90 120.40 117.47 1fk9 s VAL 21 Ca 0.42 0.35 -0.30 0.00 -2.93 0.00 0.00 61.98 59.51 1fk9 s VAL 21 Cb 0.30 -3.51 -0.14 0.00 -1.53 0.00 0.00 36.38 31.50 1fk9 s VAL 21 CO -0.09 0.49 1.20 1.17 -3.33 0.00 0.00 175.10 174.54 1fk9 n LYS 22 N 2.98 1.59 -3.08 1.54 4.81 -1.26 -4.33 118.16 120.40 1fk9 n LYS 22 Ca -0.16 0.56 -0.41 0.00 -0.87 0.00 0.00 58.31 57.43 1fk9 n LYS 22 Cb 0.53 -2.08 -0.06 0.00 0.02 0.00 0.00 35.03 33.44 1fk9 n LYS 22 CO 0.00 0.00 0.00 -1.14 1.17 0.00 0.00 177.40 177.43 1fk9 s GLN 23 N -0.90 3.87 0.66 1.64 2.00 -1.26 -4.59 119.66 121.08 1fk9 s GLN 23 Ca 0.65 0.30 -0.18 0.00 -2.00 0.00 0.00 55.36 54.14 1fk9 s GLN 23 Cb -0.72 -3.74 -0.01 0.00 0.80 0.00 0.00 33.01 29.34 1fk9 s GLN 23 CO 0.55 -0.62 1.20 0.91 -0.50 0.00 0.00 175.29 176.82 1fk9 n TRP 24 N 5.98 1.56 -1.73 1.67 8.01 -1.26 -4.93 117.44 126.73 1fk9 n TRP 24 Ca -0.00 0.42 -0.41 0.00 -1.31 0.00 0.00 57.50 56.20 1fk9 n TRP 24 Cb 0.49 -2.22 0.01 0.00 -2.01 0.00 0.00 31.31 27.58 1fk9 n TRP 24 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.69 174.38 1fk9 n PRO 25 N -1.84 2.15 -4.20 -0.99 -0.02 -1.26 -4.99 135.00 123.85 1fk9 n PRO 25 Ca 0.15 0.76 -0.19 0.00 -2.02 0.00 0.00 63.50 62.20 1fk9 n PRO 25 Cb 0.48 -2.52 -0.16 0.00 -0.02 0.00 0.00 33.50 31.28 1fk9 n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1fk9 s LEU 26 N -2.13 1.46 0.89 2.45 1.43 -1.26 -5.13 118.68 116.39 1fk9 s LEU 26 Ca 0.60 -0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.43 1fk9 s LEU 26 Cb -0.48 -0.44 0.02 0.00 0.03 0.00 0.00 46.19 45.31 1fk9 s LEU 26 CO 0.58 -0.03 0.46 0.41 0.23 0.00 0.00 176.35 178.01 1fk9 n THR 27 N 3.82 0.55 0.20 5.49 -1.04 -1.26 -4.59 114.28 117.46 1fk9 n THR 27 Ca -0.23 -0.25 0.06 0.00 -2.04 0.00 0.00 64.05 61.59 1fk9 n THR 27 Cb 0.52 -0.67 0.43 0.00 -1.82 0.00 0.00 70.33 68.79 1fk9 n THR 27 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1fk9 h GLU 28 N -1.23 0.00 -0.15 -2.82 3.07 -1.99 0.37 114.58 111.84 1fk9 h GLU 28 Ca -0.44 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.28 1fk9 h GLU 28 Cb 1.30 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.20 1fk9 h GLU 28 CO 0.37 0.32 -0.51 1.49 -1.40 0.00 0.00 179.01 179.27 1fk9 h GLU 29 N 0.00 0.40 -0.05 2.33 4.81 -1.99 0.20 114.58 120.28 1fk9 h GLU 29 Ca -0.00 -0.24 -0.09 0.00 -0.13 0.00 0.00 59.36 58.90 1fk9 h GLU 29 Cb 0.67 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1fk9 h GLU 29 CO 0.04 0.82 -0.32 0.87 -0.73 0.00 0.00 179.01 179.69 1fk9 h LYS 30 N 0.31 0.31 -0.08 1.92 1.79 -1.69 -2.10 116.57 117.03 1fk9 h LYS 30 Ca 0.01 -0.26 0.03 0.00 -2.18 0.00 0.00 60.65 58.25 1fk9 h LYS 30 Cb 1.01 0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 31.68 1fk9 h LYS 30 CO 0.09 0.92 -0.14 0.82 -1.08 0.00 0.00 179.45 180.06 1fk9 h ILE 31 N -0.22 0.64 0.26 1.86 2.04 -0.15 -1.96 117.51 119.98 1fk9 h ILE 31 Ca -0.03 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 1fk9 h ILE 31 Cb 1.00 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1fk9 h ILE 31 CO 0.07 0.00 -0.34 0.11 0.00 0.00 0.00 178.15 177.98 1fk9 h LYS 32 N -0.19 -0.60 -1.00 2.37 1.57 -0.62 -1.28 116.57 116.81 1fk9 h LYS 32 Ca 0.08 0.04 0.29 0.00 -1.87 0.00 0.00 60.65 59.19 1fk9 h LYS 32 Cb 0.29 0.14 -0.14 0.00 0.08 0.00 0.00 32.23 32.60 1fk9 h LYS 32 CO -0.20 -0.40 0.58 0.00 -0.57 0.00 0.00 179.45 178.87 1fk9 h ALA 33 N -1.10 1.90 -0.30 3.86 0.00 -1.33 -1.25 119.26 121.04 1fk9 h ALA 33 Ca -0.03 0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 1fk9 h ALA 33 Cb 0.56 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1fk9 h ALA 33 CO -0.09 -0.45 -0.15 -0.07 0.00 0.00 0.00 179.25 178.49 1fk9 h LEU 34 N 0.43 0.65 -1.63 0.00 3.38 -0.86 -2.41 115.31 114.87 1fk9 h LEU 34 Ca 0.70 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 1fk9 h LEU 34 Cb 1.50 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 1fk9 h LEU 34 CO -0.55 0.92 -0.09 0.58 0.09 0.00 0.00 178.44 179.38 1fk9 h VAL 35 N 0.38 1.12 -0.02 1.22 2.07 -0.07 0.36 116.25 121.32 1fk9 h VAL 35 Ca 0.07 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 1fk9 h VAL 35 Cb 0.68 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1fk9 h VAL 35 CO 0.05 0.16 -0.03 -0.33 0.02 0.00 0.00 177.57 177.44 1fk9 h GLU 36 N 0.12 0.05 -0.78 1.57 5.08 -1.40 -1.56 114.58 117.66 1fk9 h GLU 36 Ca 0.03 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1fk9 h GLU 36 Cb 0.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1fk9 h GLU 36 CO 0.01 0.57 0.28 0.82 -1.00 0.00 0.00 179.01 179.69 1fk9 h ILE 37 N -0.46 1.26 0.00 3.13 2.04 -1.08 -2.33 117.51 120.08 1fk9 h ILE 37 Ca 0.00 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 64.99 1fk9 h ILE 37 Cb 0.56 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1fk9 h ILE 37 CO 0.01 0.35 0.00 0.00 0.00 0.00 0.00 178.15 178.51 1fk9 n THR 39 N -2.54 1.06 0.06 0.00 -1.04 -0.59 -2.84 114.28 108.39 1fk9 n THR 39 Ca 0.04 -0.68 -0.15 0.00 -2.04 0.00 0.00 64.05 61.22 1fk9 n THR 39 Cb 0.40 -0.63 -0.06 0.00 -1.82 0.00 0.00 70.33 68.23 1fk9 n THR 39 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1fk9 h GLU 40 N 0.00 0.49 0.00 -2.82 4.57 -1.39 -1.80 114.58 113.63 1fk9 h GLU 40 Ca -0.16 -0.51 0.00 0.00 -1.18 0.00 0.00 59.36 57.50 1fk9 h GLU 40 Cb 1.53 0.14 0.00 0.00 -0.16 0.00 0.00 28.75 30.26 1fk9 h GLU 40 CO 0.04 1.15 0.00 0.52 -1.18 0.00 0.00 179.01 179.54 1fk9 h MET 41 N 0.28 0.00 0.00 1.92 2.86 -1.53 -0.07 114.93 118.39 1fk9 h MET 41 Ca -0.09 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.46 1fk9 h MET 41 Cb 1.58 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.23 1fk9 h MET 41 CO 0.17 0.00 -1.46 -1.91 1.06 0.00 0.00 176.91 174.77 1fk9 n GLU 42 N -2.82 0.63 0.02 1.72 2.13 -1.13 -0.97 120.64 120.22 1fk9 n GLU 42 Ca 0.02 0.09 -0.14 0.00 0.66 0.00 0.00 57.16 57.79 1fk9 n GLU 42 Cb 0.34 -1.74 -0.03 0.00 0.27 0.00 0.00 31.44 30.28 1fk9 n GLU 42 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1fk9 h LYS 43 N 0.00 0.59 0.00 5.31 3.64 -0.79 -3.03 116.57 122.29 1fk9 h LYS 43 Ca -0.11 -0.52 0.00 0.00 -1.27 0.00 0.00 60.65 58.76 1fk9 h LYS 43 Cb 1.33 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.26 1fk9 h LYS 43 CO 0.02 1.14 -0.33 0.39 -2.27 0.00 0.00 179.45 178.40 1fk9 n GLU 44 N -3.86 0.01 0.00 1.90 4.71 -0.09 -4.95 120.64 118.36 1fk9 n GLU 44 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.09 1fk9 n GLU 44 Cb 0.76 -1.51 0.00 0.00 -1.01 0.00 0.00 31.44 29.68 1fk9 n GLU 44 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1fk9 n GLY 45 N 1.49 2.22 0.37 0.62 0.00 -0.83 -4.89 105.19 104.18 1fk9 n GLY 45 Ca 0.06 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.36 1fk9 n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fk9 h LYS 46 N 2.49 0.22 -4.79 1.61 1.79 -1.36 -3.40 116.57 113.13 1fk9 h LYS 46 Ca 0.00 -0.01 -0.32 0.00 -2.18 0.00 0.00 60.65 58.14 1fk9 h LYS 46 Cb 0.00 -0.05 -0.15 0.00 -1.58 0.00 0.00 32.23 30.45 1fk9 h LYS 46 CO 0.00 0.15 -0.61 0.96 -1.08 0.00 0.00 179.45 178.87 1fk9 s ILE 47 N -5.54 0.35 -0.08 1.86 -4.36 -0.74 0.17 121.20 112.86 1fk9 s ILE 47 Ca -0.09 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 58.13 1fk9 s ILE 47 Cb 0.30 -2.58 0.04 0.00 1.25 0.00 0.00 42.46 41.47 1fk9 s ILE 47 CO 0.80 0.00 0.42 -0.44 0.24 0.00 0.00 174.94 175.95 1fk9 s SER 48 N -3.27 -0.37 0.16 4.36 0.01 -0.77 -4.14 113.70 109.70 1fk9 s SER 48 Ca 0.38 0.51 -0.30 0.00 1.31 0.00 0.00 55.95 57.84 1fk9 s SER 48 Cb 0.07 0.59 -0.08 0.00 0.21 0.00 0.00 66.02 66.81 1fk9 s SER 48 CO 0.14 -0.35 1.30 -0.75 0.41 0.00 0.00 173.24 173.99 1fk9 s LYS 49 N -0.66 4.39 0.15 12.44 2.20 -1.26 -2.62 119.74 134.38 1fk9 s LYS 49 Ca -0.08 2.01 0.05 0.00 -0.36 0.00 0.00 55.97 57.60 1fk9 s LYS 49 Cb -0.04 -3.23 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1fk9 s LYS 49 CO 0.04 -0.27 -0.12 0.96 -0.36 0.00 0.00 175.35 175.59 1fk9 s ILE 50 N 0.41 1.31 0.72 5.43 -4.36 0.13 -4.98 121.20 119.86 1fk9 s ILE 50 Ca 0.58 -1.95 -0.11 0.00 -0.26 0.00 0.00 60.65 58.91 1fk9 s ILE 50 Cb -0.35 -1.75 0.02 0.00 1.25 0.00 0.00 42.46 41.63 1fk9 s ILE 50 CO 0.35 -0.60 1.07 -0.83 0.24 0.00 0.00 174.94 175.17 1fk9 s GLY 51 N -2.92 1.65 0.00 6.27 0.00 -1.26 -4.26 107.32 106.80 1fk9 s GLY 51 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.79 1fk9 s GLY 51 CO 0.02 0.27 0.32 -1.05 0.00 0.00 0.00 173.10 172.66 1fk9 n PRO 52 N -3.15 0.44 0.11 2.90 -0.02 -1.26 -2.91 135.00 131.11 1fk9 n PRO 52 Ca 0.07 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.59 1fk9 n PRO 52 Cb 0.55 -1.25 0.01 0.00 -0.02 0.00 0.00 33.50 32.79 1fk9 n PRO 52 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1fk9 h GLU 53 N 0.81 0.00 -6.21 -0.52 -0.00 -2.02 -3.43 114.58 103.22 1fk9 h GLU 53 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 59.36 58.84 1fk9 h GLU 53 Cb 0.32 0.00 -0.06 0.00 -0.00 0.00 0.00 28.75 29.01 1fk9 h GLU 53 CO 0.00 0.29 1.17 1.21 -0.00 0.00 0.00 179.01 181.68 1fk9 s ASN 54 N -6.04 5.85 0.00 3.06 3.84 -1.15 -4.89 114.94 115.62 1fk9 s ASN 54 Ca 0.02 -0.23 0.15 0.00 0.21 0.00 0.00 52.86 53.01 1fk9 s ASN 54 Cb 0.08 -2.55 0.89 0.00 -0.55 0.00 0.00 41.25 39.12 1fk9 s ASN 54 CO 0.76 -2.03 1.33 -0.81 -2.79 0.00 0.00 177.10 173.56 1fk9 n PRO 55 N 9.28 0.59 -3.73 0.43 -0.04 -1.26 -4.82 135.00 135.45 1fk9 n PRO 55 Ca 0.11 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.32 1fk9 n PRO 55 Cb 0.50 -1.40 -0.03 0.00 -0.04 0.00 0.00 33.50 32.54 1fk9 n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1fk9 s TYR 56 N -2.00 3.48 -0.28 0.54 2.02 -1.26 -4.78 117.35 115.07 1fk9 s TYR 56 Ca 0.22 0.24 -0.24 0.00 -0.37 0.00 0.00 57.07 56.93 1fk9 s TYR 56 Cb 0.10 -1.78 0.12 0.00 -0.40 0.00 0.00 41.96 40.01 1fk9 s TYR 56 CO 0.17 0.37 1.02 1.21 -1.57 0.00 0.00 175.55 176.75 1fk9 s ASN 57 N -3.48 -0.47 -0.05 2.29 2.47 -0.18 -4.64 114.94 110.87 1fk9 s ASN 57 Ca 0.37 0.88 0.05 0.00 0.42 0.00 0.00 52.86 54.58 1fk9 s ASN 57 Cb -0.10 0.93 -0.02 0.00 -1.45 0.00 0.00 41.25 40.60 1fk9 s ASN 57 CO 0.30 -0.15 -0.19 0.28 -3.72 0.00 0.00 177.10 173.62 1fk9 s THR 58 N 0.37 2.66 0.55 -5.21 -1.32 0.07 -1.89 115.64 110.86 1fk9 s THR 58 Ca 0.02 -0.86 -0.19 0.00 -1.21 0.00 0.00 61.69 59.45 1fk9 s THR 58 Cb -0.05 -2.01 -0.05 0.00 -1.51 0.00 0.00 72.50 68.87 1fk9 s THR 58 CO -0.07 0.58 1.10 -2.16 -2.21 0.00 0.00 174.62 171.85 1fk9 s PRO 59 N -0.48 3.38 0.10 7.08 0.04 -1.26 -4.25 135.00 139.60 1fk9 s PRO 59 Ca 0.06 1.48 -0.01 0.00 0.04 0.00 0.00 61.00 62.57 1fk9 s PRO 59 Cb -0.12 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 1fk9 s PRO 59 CO 0.01 -0.80 0.01 0.08 0.04 0.00 0.00 177.00 176.34 1fk9 s VAL 60 N -1.98 0.21 0.23 -0.36 1.01 -1.26 -2.03 120.40 116.23 1fk9 s VAL 60 Ca 0.70 -1.87 -0.22 0.00 0.00 0.00 0.00 61.98 60.58 1fk9 s VAL 60 Cb -0.21 -1.81 0.05 0.00 0.00 0.00 0.00 36.38 34.41 1fk9 s VAL 60 CO 0.28 -0.71 0.87 0.72 0.00 0.00 0.00 175.10 176.27 1fk9 s PHE 61 N -3.95 -0.07 -0.08 5.22 -0.00 -0.89 -4.70 117.98 113.50 1fk9 s PHE 61 Ca 0.16 -0.36 0.05 0.00 -0.00 0.00 0.00 56.93 56.78 1fk9 s PHE 61 Cb 0.08 0.70 -0.01 0.00 -0.00 0.00 0.00 43.02 43.79 1fk9 s PHE 61 CO -0.03 -1.09 -0.23 0.00 -0.00 0.00 0.00 175.22 173.87 1fk9 s ALA 62 N -3.13 2.23 -0.44 1.99 0.00 -1.26 -1.47 121.76 119.68 1fk9 s ALA 62 Ca 0.14 -1.00 0.07 0.00 0.00 0.00 0.00 51.96 51.17 1fk9 s ALA 62 Cb -0.04 -0.80 0.22 0.00 0.00 0.00 0.00 23.12 22.51 1fk9 s ALA 62 CO 0.06 0.35 0.50 0.44 0.00 0.00 0.00 175.76 177.11 1fk9 n ILE 63 N 3.22 -0.36 -0.44 0.00 -6.64 -0.75 -4.95 119.36 109.45 1fk9 n ILE 63 Ca -0.18 -4.04 -0.14 0.00 -1.77 0.00 0.00 62.75 56.62 1fk9 n ILE 63 Cb 0.52 -1.90 0.00 0.00 -1.44 0.00 0.00 39.64 36.82 1fk9 n ILE 63 CO 0.00 0.00 0.00 0.41 -1.77 0.00 0.00 176.55 175.19 1fk9 n THR 69 N 1.76 0.09 -3.78 7.28 -1.04 -1.26 -1.73 114.28 115.60 1fk9 n THR 69 Ca 0.24 -0.17 -0.29 0.00 -2.04 0.00 0.00 64.05 61.79 1fk9 n THR 69 Cb 0.49 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.85 1fk9 n THR 69 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1fk9 s LYS 70 N -0.35 0.89 0.01 -2.82 1.02 -1.26 -5.13 119.74 112.10 1fk9 s LYS 70 Ca 0.20 -0.84 0.04 0.00 0.02 0.00 0.00 55.97 55.39 1fk9 s LYS 70 Cb -0.19 -2.18 -0.01 0.00 -0.52 0.00 0.00 37.83 34.92 1fk9 s LYS 70 CO 0.22 -0.79 -0.13 -1.58 -0.92 0.00 0.00 175.35 172.16 1fk9 s TRP 71 N 1.64 1.17 -0.10 3.18 0.23 -1.26 -5.15 118.94 118.65 1fk9 s TRP 71 Ca 0.03 -0.26 -0.11 0.00 -2.03 0.00 0.00 56.10 53.73 1fk9 s TRP 71 Cb -0.18 -0.74 0.03 0.00 0.03 0.00 0.00 33.47 32.62 1fk9 s TRP 71 CO -0.15 -0.00 0.30 0.50 0.96 0.00 0.00 176.95 178.56 1fk9 s ARG 72 N -0.56 0.38 -0.37 4.98 3.00 -0.71 -5.01 118.95 120.67 1fk9 s ARG 72 Ca 0.04 0.35 -0.24 0.00 -1.00 0.00 0.00 55.73 54.89 1fk9 s ARG 72 Cb -0.06 0.18 0.01 0.00 0.00 0.00 0.00 34.95 35.09 1fk9 s ARG 72 CO 0.00 -0.06 0.81 0.21 0.00 0.00 0.00 175.30 176.27 1fk9 s LYS 73 N 0.01 3.77 -0.25 5.12 2.20 -1.26 -1.80 119.74 127.52 1fk9 s LYS 73 Ca -0.01 0.36 -0.05 0.00 -0.36 0.00 0.00 55.97 55.91 1fk9 s LYS 73 Cb -0.02 -3.81 -0.00 0.00 -1.51 0.00 0.00 37.83 32.48 1fk9 s LYS 73 CO 0.01 -0.87 0.01 -1.17 -0.36 0.00 0.00 175.35 172.96 1fk9 s LEU 74 N 3.18 3.27 -0.16 5.43 2.96 -0.54 -5.01 118.68 127.81 1fk9 s LEU 74 Ca 0.33 -0.49 -0.07 0.00 -0.22 0.00 0.00 54.13 53.68 1fk9 s LEU 74 Cb -0.13 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 1fk9 s LEU 74 CO 0.17 -0.08 0.08 -0.69 -1.32 0.00 0.00 176.35 174.52 1fk9 s VAL 75 N 1.49 4.99 -0.71 1.68 1.01 -1.26 -2.10 120.40 125.50 1fk9 s VAL 75 Ca 0.05 0.03 -0.19 0.00 0.00 0.00 0.00 61.98 61.87 1fk9 s VAL 75 Cb -0.15 -3.22 0.12 0.00 0.00 0.00 0.00 36.38 33.12 1fk9 s VAL 75 CO -0.01 0.50 0.85 -0.62 0.00 0.00 0.00 175.10 175.83 1fk9 s ASP 76 N -0.03 6.36 -0.04 3.32 3.68 -0.86 -4.89 116.67 124.21 1fk9 s ASP 76 Ca 0.07 -1.68 0.17 0.00 2.13 0.00 0.00 52.55 53.24 1fk9 s ASP 76 Cb -0.12 -2.33 0.55 0.00 -1.45 0.00 0.00 42.92 39.57 1fk9 s ASP 76 CO 0.01 -1.08 1.44 0.49 0.13 0.00 0.00 175.17 176.16 1fk9 n PHE 77 N 6.28 0.96 -0.29 -5.34 3.01 -1.26 -4.34 117.46 116.47 1fk9 n PHE 77 Ca 0.02 -0.43 0.07 0.00 1.01 0.00 0.00 57.45 58.13 1fk9 n PHE 77 Cb 0.45 -0.08 0.29 0.00 -0.01 0.00 0.00 39.48 40.13 1fk9 n PHE 77 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 1fk9 h ARG 78 N 3.39 0.86 0.26 -1.08 0.11 -1.90 0.12 114.38 116.16 1fk9 h ARG 78 Ca 0.00 -0.05 -0.01 0.00 0.10 0.00 0.00 59.98 60.02 1fk9 h ARG 78 Cb 0.96 -0.20 0.00 0.00 1.11 0.00 0.00 29.97 31.85 1fk9 h ARG 78 CO 0.08 0.57 -0.13 1.49 0.10 0.00 0.00 179.97 182.08 1fk9 h GLU 79 N 0.89 -0.34 -0.41 0.08 4.57 -2.01 -1.75 114.58 115.61 1fk9 h GLU 79 Ca 0.42 0.02 0.08 0.00 -1.18 0.00 0.00 59.36 58.70 1fk9 h GLU 79 Cb 0.41 0.08 -0.08 0.00 -0.16 0.00 0.00 28.75 29.00 1fk9 h GLU 79 CO -0.18 -0.05 -0.11 1.25 -1.18 0.00 0.00 179.01 178.75 1fk9 h LEU 80 N -0.64 -0.39 -1.46 1.64 5.85 -1.77 0.96 115.31 119.49 1fk9 h LEU 80 Ca -0.04 0.12 0.20 0.00 0.84 0.00 0.00 57.88 59.01 1fk9 h LEU 80 Cb 0.45 0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.67 1fk9 h LEU 80 CO 0.06 -0.14 0.60 0.78 -0.34 0.00 0.00 178.44 179.40 1fk9 h ASN 81 N -0.00 0.44 0.10 1.25 4.21 -0.65 0.58 115.58 121.52 1fk9 h ASN 81 Ca 0.20 0.05 -0.05 0.00 1.21 0.00 0.00 56.30 57.70 1fk9 h ASN 81 Cb 0.31 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.46 1fk9 h ASN 81 CO -0.43 0.17 -0.18 0.11 -1.29 0.00 0.00 177.43 175.81 1fk9 h LYS 82 N 0.44 0.17 0.00 0.81 1.57 0.11 -2.77 116.57 116.90 1fk9 h LYS 82 Ca 0.48 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 1fk9 h LYS 82 Cb 1.15 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1fk9 h LYS 82 CO -0.20 0.35 -0.96 0.54 -0.57 0.00 0.00 179.45 178.62 1fk9 n ARG 83 N -4.25 0.31 -2.73 3.15 1.74 0.17 -4.94 116.66 110.12 1fk9 n ARG 83 Ca -0.01 0.02 -0.41 0.00 -0.77 0.00 0.00 57.85 56.68 1fk9 n ARG 83 Cb 0.29 -1.62 -0.04 0.00 -1.02 0.00 0.00 32.46 30.06 1fk9 n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1fk9 s THR 84 N -3.20 4.50 0.97 0.55 2.01 0.58 0.12 115.64 121.17 1fk9 s THR 84 Ca 0.04 2.07 -0.14 0.00 0.31 0.00 0.00 61.69 63.97 1fk9 s THR 84 Cb 0.14 -4.32 -0.03 0.00 0.01 0.00 0.00 72.50 68.29 1fk9 s THR 84 CO 0.78 0.32 -0.04 0.00 -0.69 0.00 0.00 174.62 174.99 1fk9 n GLN 85 N 2.77 -0.19 -2.99 4.92 10.64 -1.09 -4.65 117.38 126.79 1fk9 n GLN 85 Ca 0.02 -0.03 -0.34 0.00 -1.83 0.00 0.00 57.00 54.82 1fk9 n GLN 85 Cb 0.49 -1.54 -0.06 0.00 -0.86 0.00 0.00 30.24 28.27 1fk9 n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1fk9 s ASP 86 N -1.64 6.95 0.36 2.61 1.01 -1.26 -4.91 116.67 119.78 1fk9 s ASP 86 Ca 0.51 1.50 0.09 0.00 0.71 0.00 0.00 52.55 55.35 1fk9 s ASP 86 Cb -0.20 -2.46 -0.06 0.00 1.01 0.00 0.00 42.92 41.22 1fk9 s ASP 86 CO 0.73 -0.19 0.04 -0.36 0.21 0.00 0.00 175.17 175.60 1fk9 s PHE 87 N -1.90 2.55 0.19 4.23 0.40 -1.26 -5.07 117.98 117.12 1fk9 s PHE 87 Ca 0.54 -0.47 -0.32 0.00 -0.60 0.00 0.00 56.93 56.07 1fk9 s PHE 87 Cb -0.12 -1.58 -0.11 0.00 0.51 0.00 0.00 43.02 41.72 1fk9 s PHE 87 CO 0.18 0.43 1.71 -0.46 0.70 0.00 0.00 175.22 177.78 1fk9 s TRP 88 N -2.54 2.85 -0.38 0.36 -0.11 -1.26 -4.78 118.94 113.07 1fk9 s TRP 88 Ca 0.36 0.35 -0.39 0.00 1.22 0.00 0.00 56.10 57.64 1fk9 s TRP 88 Cb 0.01 -4.11 -0.14 0.00 -1.50 0.00 0.00 33.47 27.73 1fk9 s TRP 88 CO 0.20 -4.22 2.08 -1.91 -4.62 0.00 0.00 176.95 168.48 1fk9 n GLU 89 N 4.18 0.77 -1.61 5.86 2.13 -1.26 -4.83 120.64 125.88 1fk9 n GLU 89 Ca 0.16 0.23 -0.45 0.00 0.66 0.00 0.00 57.16 57.76 1fk9 n GLU 89 Cb 0.36 -2.11 -0.04 0.00 0.27 0.00 0.00 31.44 29.92 1fk9 n GLU 89 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 1fk9 n VAL 90 N 6.43 0.47 -1.04 6.31 3.14 -1.26 -4.09 118.33 128.30 1fk9 n VAL 90 Ca 0.42 -0.28 0.00 0.00 -2.96 0.00 0.00 64.34 61.52 1fk9 n VAL 90 Cb 0.13 -2.21 0.00 0.00 -1.06 0.00 0.00 33.84 30.70 1fk9 n VAL 90 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1fk9 n GLN 91 N 7.91 -0.09 0.00 1.45 10.64 -1.26 -4.92 117.38 131.11 1fk9 n GLN 91 Ca 0.28 0.18 0.00 0.00 -1.83 0.00 0.00 57.00 55.63 1fk9 n GLN 91 Cb 0.37 -0.21 0.00 0.00 -0.86 0.00 0.00 30.24 29.54 1fk9 n GLN 91 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12 1fk9 n LEU 92 N 0.77 0.00 -4.93 2.61 7.94 -1.26 -4.84 117.00 117.29 1fk9 n LEU 92 Ca 0.00 0.25 -0.25 0.00 -1.11 0.00 0.00 56.01 54.90 1fk9 n LEU 92 Cb 0.10 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.05 1fk9 n LEU 92 CO 0.00 0.00 0.34 -0.83 -1.11 0.00 0.00 177.39 175.79 1fk9 s GLY 93 N 0.00 1.47 -0.03 -3.96 0.00 -1.26 -5.10 107.32 98.44 1fk9 s GLY 93 Ca 0.00 -0.75 0.04 0.00 0.00 0.00 0.00 44.72 44.01 1fk9 s GLY 93 CO 0.00 -0.60 -0.14 -0.26 0.00 0.00 0.00 173.10 172.11 1fk9 s ILE 94 N -2.61 3.13 0.02 0.90 -0.00 -1.26 -5.09 121.20 116.29 1fk9 s ILE 94 Ca 0.46 -0.78 -0.32 0.00 -0.00 0.00 0.00 60.65 60.01 1fk9 s ILE 94 Cb -0.10 -2.26 -0.10 0.00 -0.00 0.00 0.00 42.46 40.00 1fk9 s ILE 94 CO 0.41 0.53 1.91 -0.81 -0.00 0.00 0.00 174.94 176.98 1fk9 n PRO 95 N 2.10 2.61 -2.32 0.37 -0.04 -1.26 -4.96 135.00 131.50 1fk9 n PRO 95 Ca -0.17 0.96 -0.41 0.00 -0.04 0.00 0.00 63.50 63.84 1fk9 n PRO 95 Cb 0.52 -2.86 -0.03 0.00 -0.04 0.00 0.00 33.50 31.09 1fk9 n PRO 95 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1fk9 s HIS 96 N 3.90 3.37 0.53 0.54 2.46 -1.26 -4.91 115.29 119.92 1fk9 s HIS 96 Ca 0.89 1.42 0.30 0.00 0.47 0.00 0.00 55.06 58.14 1fk9 s HIS 96 Cb -0.53 -3.48 1.45 0.00 -0.13 0.00 0.00 32.58 29.89 1fk9 s HIS 96 CO 0.44 -1.33 1.89 -1.00 -2.47 0.00 0.00 174.74 172.26 1fk9 h PRO 97 N 4.82 0.04 0.00 2.88 0.13 -1.98 0.26 132.00 138.15 1fk9 h PRO 97 Ca -0.45 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1fk9 h PRO 97 Cb 1.21 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1fk9 h PRO 97 CO 0.73 0.02 0.00 0.00 -0.23 0.00 0.00 178.00 178.52 1fk9 n ALA 98 N -2.70 1.32 1.23 -0.56 0.00 -1.26 -1.82 120.51 116.72 1fk9 n ALA 98 Ca 0.19 0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.90 1fk9 n ALA 98 Cb 0.94 -1.34 0.29 0.00 0.00 0.00 0.00 19.45 19.35 1fk9 n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fk9 n GLY 99 N -0.72 0.13 3.90 0.00 0.00 0.08 -3.35 105.19 105.22 1fk9 n GLY 99 Ca 0.00 -0.53 -0.28 0.00 0.00 0.00 0.00 46.02 45.21 1fk9 n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fk9 s LEU 100 N -2.19 3.61 0.19 0.99 1.43 -0.76 -4.71 118.68 117.24 1fk9 s LEU 100 Ca 0.29 1.03 -0.05 0.00 -1.03 0.00 0.00 54.13 54.38 1fk9 s LEU 100 Cb 0.20 -3.99 -0.05 0.00 0.03 0.00 0.00 46.19 42.38 1fk9 s LEU 100 CO 0.41 -0.58 0.44 -0.54 0.23 0.00 0.00 176.35 176.30 1fk9 s LYS 101 N -4.62 3.63 0.23 1.70 3.01 -1.26 0.31 119.74 122.74 1fk9 s LYS 101 Ca 0.49 -0.07 -0.30 0.00 -1.01 0.00 0.00 55.97 55.08 1fk9 s LYS 101 Cb -0.10 -2.78 -0.09 0.00 -1.01 0.00 0.00 37.83 33.84 1fk9 s LYS 101 CO 0.43 0.38 1.34 0.21 0.51 0.00 0.00 175.35 178.23 1fk9 s LYS 102 N -2.98 4.36 0.12 1.68 2.20 -1.25 -4.87 119.74 118.99 1fk9 s LYS 102 Ca 0.42 2.14 0.10 0.00 -0.36 0.00 0.00 55.97 58.27 1fk9 s LYS 102 Cb -0.11 -3.15 -0.04 0.00 -1.51 0.00 0.00 37.83 33.02 1fk9 s LYS 102 CO 0.26 -0.28 -0.25 0.15 -0.36 0.00 0.00 175.35 174.87 1fk9 s LYS 103 N -0.47 1.34 0.05 4.03 -0.14 0.25 -4.94 119.74 119.86 1fk9 s LYS 103 Ca 0.56 -1.29 -0.17 0.00 -1.36 0.00 0.00 55.97 53.71 1fk9 s LYS 103 Cb -0.38 -1.77 -0.19 0.00 -1.68 0.00 0.00 37.83 33.81 1fk9 s LYS 103 CO 0.42 0.42 1.21 -0.22 -0.76 0.00 0.00 175.35 176.42 1fk9 h LYS 104 N 3.98 0.54 -3.00 1.68 3.11 -1.28 -3.35 116.57 118.26 1fk9 h LYS 104 Ca -0.49 -0.47 -0.13 0.00 -2.81 0.00 0.00 60.65 56.74 1fk9 h LYS 104 Cb 1.17 0.11 -0.22 0.00 -1.00 0.00 0.00 32.23 32.28 1fk9 h LYS 104 CO 0.39 1.10 -0.31 -1.54 -2.81 0.00 0.00 179.45 176.28 1fk9 s SER 105 N -6.77 -0.26 0.00 4.20 1.04 -0.62 -4.94 113.70 106.36 1fk9 s SER 105 Ca -0.12 0.37 -0.01 0.00 0.48 0.00 0.00 55.95 56.67 1fk9 s SER 105 Cb 0.06 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.66 1fk9 s SER 105 CO 0.84 -0.28 0.01 0.54 0.98 0.00 0.00 173.24 175.33 1fk9 s VAL 106 N -0.58 0.04 -0.09 5.02 0.11 -1.26 -0.61 120.40 123.03 1fk9 s VAL 106 Ca -0.07 -0.30 0.00 0.00 -2.93 0.00 0.00 61.98 58.69 1fk9 s VAL 106 Cb -0.04 -0.11 0.02 0.00 -1.53 0.00 0.00 36.38 34.72 1fk9 s VAL 106 CO 0.02 -0.16 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.66 1fk9 s THR 107 N -0.48 0.96 -0.13 5.04 2.01 0.35 -4.82 115.64 118.57 1fk9 s THR 107 Ca -0.05 -0.28 -0.18 0.00 0.31 0.00 0.00 61.69 61.48 1fk9 s THR 107 Cb -0.03 -0.96 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 1fk9 s THR 107 CO -0.00 0.34 0.49 0.54 -0.69 0.00 0.00 174.62 175.30 1fk9 s VAL 108 N 1.43 5.17 -0.17 3.82 0.11 -1.26 -0.49 120.40 129.00 1fk9 s VAL 108 Ca -0.01 0.97 -0.02 0.00 -2.93 0.00 0.00 61.98 59.99 1fk9 s VAL 108 Cb -0.13 -3.83 -0.01 0.00 -1.53 0.00 0.00 36.38 30.88 1fk9 s VAL 108 CO -0.05 0.30 -0.09 -0.76 -3.33 0.00 0.00 175.10 171.17 1fk9 s LEU 109 N 0.81 2.77 -0.14 2.54 1.02 1.00 -4.56 118.68 122.12 1fk9 s LEU 109 Ca 0.26 -0.37 -0.19 0.00 0.02 0.00 0.00 54.13 53.85 1fk9 s LEU 109 Cb -0.15 -1.66 -0.04 0.00 0.02 0.00 0.00 46.19 44.36 1fk9 s LEU 109 CO 0.10 0.07 0.51 -0.62 0.02 0.00 0.00 176.35 176.43 1fk9 s ASP 110 N 0.91 6.68 -0.49 2.29 3.68 -1.26 0.53 116.67 129.01 1fk9 s ASP 110 Ca -0.02 0.81 -0.17 0.00 2.13 0.00 0.00 52.55 55.30 1fk9 s ASP 110 Cb -0.15 -2.30 0.07 0.00 -1.45 0.00 0.00 42.92 39.09 1fk9 s ASP 110 CO -0.00 -0.06 0.50 -0.69 0.13 0.00 0.00 175.17 175.05 1fk9 s VAL 111 N 0.93 5.07 0.37 1.11 1.01 0.22 -4.05 120.40 125.05 1fk9 s VAL 111 Ca 0.26 -0.80 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 1fk9 s VAL 111 Cb -0.15 -4.21 -0.05 0.00 0.00 0.00 0.00 36.38 31.97 1fk9 s VAL 111 CO 0.11 -0.68 0.67 -0.83 0.00 0.00 0.00 175.10 174.36 1fk9 s GLY 112 N 2.64 1.78 -1.91 4.51 0.00 -0.74 -3.86 107.32 109.75 1fk9 s GLY 112 Ca 0.09 -0.45 0.00 0.00 0.00 0.00 0.00 44.72 44.36 1fk9 s GLY 112 CO 0.09 -0.31 0.00 1.22 0.00 0.00 0.00 173.10 174.10 1fk9 n ASP 113 N -1.38 -5.63 0.00 1.64 8.00 -1.26 -3.93 116.55 113.99 1fk9 n ASP 113 Ca -0.00 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.69 1fk9 n ASP 113 Cb 0.54 -4.80 0.00 0.00 -0.02 0.00 0.00 41.12 36.84 1fk9 n ASP 113 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fk9 n ALA 114 N -0.73 -0.03 0.32 2.24 0.00 -1.25 -2.08 120.51 118.98 1fk9 n ALA 114 Ca -0.23 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.43 1fk9 n ALA 114 Cb 0.68 0.19 1.09 0.00 0.00 0.00 0.00 19.45 21.41 1fk9 n ALA 114 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1fk9 h TYR 115 N 0.00 0.00 -0.33 0.00 0.99 -1.91 -2.73 116.97 112.99 1fk9 h TYR 115 Ca 0.00 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.55 1fk9 h TYR 115 Cb 0.00 0.00 -0.10 0.00 1.00 0.00 0.00 36.73 37.63 1fk9 h TYR 115 CO -0.09 0.00 0.24 1.19 -0.00 0.00 0.00 178.16 179.50 1fk9 n PHE 116 N -3.10 1.04 -1.07 4.88 3.72 -0.88 -2.70 117.46 119.35 1fk9 n PHE 116 Ca -0.02 -1.11 0.00 0.00 -0.05 0.00 0.00 57.45 56.27 1fk9 n PHE 116 Cb 0.13 -0.56 0.00 0.00 -0.94 0.00 0.00 39.48 38.11 1fk9 n PHE 116 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1fk9 n SER 117 N 0.11 0.00 -4.13 4.37 7.64 -1.03 -4.97 113.62 115.60 1fk9 n SER 117 Ca 0.20 -1.00 -0.33 0.00 1.01 0.00 0.00 58.87 58.75 1fk9 n SER 117 Cb 0.82 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.87 1fk9 n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1fk9 s VAL 118 N 0.00 2.26 1.07 0.44 1.01 -1.21 -4.79 120.40 119.18 1fk9 s VAL 118 Ca 0.00 -1.06 -0.16 0.00 0.00 0.00 0.00 61.98 60.76 1fk9 s VAL 118 Cb 0.00 -2.06 0.10 0.00 0.00 0.00 0.00 36.38 34.43 1fk9 s VAL 118 CO 0.00 0.38 0.24 -0.81 0.00 0.00 0.00 175.10 174.91 1fk9 n PRO 119 N 4.60 -1.29 -5.28 2.72 -0.04 -1.26 -1.18 135.00 133.27 1fk9 n PRO 119 Ca -0.19 -0.35 -0.31 0.00 -0.04 0.00 0.00 63.50 62.61 1fk9 n PRO 119 Cb 0.48 -1.80 -0.16 0.00 -0.04 0.00 0.00 33.50 31.98 1fk9 n PRO 119 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1fk9 s LEU 120 N -1.91 2.05 -0.58 1.53 2.96 -0.28 -4.41 118.68 118.05 1fk9 s LEU 120 Ca 0.58 -0.47 -0.38 0.00 -0.22 0.00 0.00 54.13 53.64 1fk9 s LEU 120 Cb -0.16 -1.32 -0.18 0.00 0.50 0.00 0.00 46.19 45.04 1fk9 s LEU 120 CO 0.66 0.31 2.29 -0.67 -1.32 0.00 0.00 176.35 177.63 1fk9 n ASP 121 N 2.43 1.01 -0.33 3.68 2.03 -1.26 -4.75 116.55 119.35 1fk9 n ASP 121 Ca -0.16 0.45 -0.11 0.00 0.52 0.00 0.00 54.79 55.50 1fk9 n ASP 121 Cb 0.51 -1.01 -0.08 0.00 -0.72 0.00 0.00 41.12 39.82 1fk9 n ASP 121 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1fk9 h GLU 122 N 10.89 -0.11 0.00 -0.67 4.22 -1.95 1.09 114.58 128.05 1fk9 h GLU 122 Ca -0.13 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.32 1fk9 h GLU 122 Cb 1.37 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.64 1fk9 h GLU 122 CO 1.15 -0.07 0.41 -3.47 -2.18 0.00 0.00 179.01 174.85 1fk9 n ASP 123 N -5.31 0.05 -0.03 1.04 2.03 -1.26 -1.00 116.55 112.06 1fk9 n ASP 123 Ca 0.01 0.21 -0.03 0.00 0.52 0.00 0.00 54.79 55.51 1fk9 n ASP 123 Cb 0.30 -0.17 -0.06 0.00 -0.72 0.00 0.00 41.12 40.47 1fk9 n ASP 123 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1fk9 n PHE 124 N -1.36 0.00 -0.30 -0.67 7.35 0.37 -4.75 117.46 118.10 1fk9 n PHE 124 Ca -0.00 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.72 1fk9 n PHE 124 Cb 0.42 -0.36 0.11 0.00 0.35 0.00 0.00 39.48 40.00 1fk9 n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1fk9 h ARG 125 N 0.00 0.00 -1.13 -4.13 3.08 -0.41 0.21 114.38 112.01 1fk9 h ARG 125 Ca -0.18 -0.00 0.36 0.00 0.07 0.00 0.00 59.98 60.23 1fk9 h ARG 125 Cb 1.34 -0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.25 1fk9 h ARG 125 CO 0.01 0.00 0.69 1.57 -1.07 0.00 0.00 179.97 181.17 1fk9 h LYS 126 N 0.00 0.22 0.00 0.04 2.10 -1.86 0.93 116.57 118.01 1fk9 h LYS 126 Ca 0.41 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.04 1fk9 h LYS 126 Cb 0.63 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.91 1fk9 h LYS 126 CO -0.86 0.15 0.00 0.66 -2.00 0.00 0.00 179.45 177.40 1fk9 n TYR 127 N -4.85 0.51 -0.17 0.07 4.01 0.74 -2.11 117.16 115.35 1fk9 n TYR 127 Ca 0.33 0.21 0.11 0.00 -0.16 0.00 0.00 57.90 58.39 1fk9 n TYR 127 Cb 1.15 -0.84 0.30 0.00 -0.31 0.00 0.00 39.34 39.64 1fk9 n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1fk9 n THR 128 N -1.98 0.91 -1.69 -0.72 -2.24 0.32 -4.67 114.28 104.23 1fk9 n THR 128 Ca 0.02 -0.91 -0.42 0.00 -2.27 0.00 0.00 64.05 60.46 1fk9 n THR 128 Cb 0.16 0.46 -0.00 0.00 -2.10 0.00 0.00 70.33 68.84 1fk9 n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fk9 n ALA 129 N 1.50 1.16 -2.60 6.98 0.00 -0.90 -4.31 120.51 122.34 1fk9 n ALA 129 Ca 0.23 0.35 -0.09 0.00 0.00 0.00 0.00 53.44 53.93 1fk9 n ALA 129 Cb 0.58 -2.23 -0.07 0.00 0.00 0.00 0.00 19.45 17.72 1fk9 n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1fk9 s PHE 130 N -1.11 0.16 -0.02 0.00 -0.12 -0.86 -0.75 117.98 115.28 1fk9 s PHE 130 Ca 0.56 -0.58 0.01 0.00 -0.05 0.00 0.00 56.93 56.87 1fk9 s PHE 130 Cb -0.57 -0.04 0.02 0.00 -0.63 0.00 0.00 43.02 41.80 1fk9 s PHE 130 CO 0.61 -0.57 -0.01 0.95 -0.05 0.00 0.00 175.22 176.15 1fk9 s THR 131 N -3.87 0.21 -0.27 -4.49 -4.23 -1.26 -1.20 115.64 100.53 1fk9 s THR 131 Ca 0.06 0.01 -0.09 0.00 -1.18 0.00 0.00 61.69 60.49 1fk9 s THR 131 Cb 0.05 -0.26 -0.04 0.00 1.34 0.00 0.00 72.50 73.58 1fk9 s THR 131 CO -0.10 0.12 0.14 0.27 -0.54 0.00 0.00 174.62 174.51 1fk9 s ILE 132 N 0.67 4.85 0.33 2.99 -4.36 -0.91 -4.83 121.20 119.94 1fk9 s ILE 132 Ca -0.07 0.00 -0.28 0.00 -0.26 0.00 0.00 60.65 60.05 1fk9 s ILE 132 Cb -0.10 -3.30 -0.13 0.00 1.25 0.00 0.00 42.46 40.19 1fk9 s ILE 132 CO -0.01 0.29 1.24 -2.65 0.24 0.00 0.00 174.94 174.05 1fk9 n PRO 133 N 5.00 1.99 -3.03 0.37 -0.02 -1.26 -2.47 135.00 135.58 1fk9 n PRO 133 Ca -0.15 0.70 -0.39 0.00 -2.02 0.00 0.00 63.50 61.64 1fk9 n PRO 133 Cb 0.52 -2.25 -0.06 0.00 -0.02 0.00 0.00 33.50 31.69 1fk9 n PRO 133 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1fk9 s SER 134 N -0.36 7.33 0.12 2.55 1.04 -1.26 -4.89 113.70 118.24 1fk9 s SER 134 Ca 0.56 1.58 -0.33 0.00 0.48 0.00 0.00 55.95 58.24 1fk9 s SER 134 Cb -0.59 -2.48 -0.11 0.00 0.10 0.00 0.00 66.02 62.94 1fk9 s SER 134 CO 0.62 0.22 1.56 0.40 0.98 0.00 0.00 173.24 177.02 1fk9 h ILE 135 N 3.37 0.03 -3.35 -1.02 2.04 -1.94 -3.39 117.51 113.25 1fk9 h ILE 135 Ca -0.47 0.00 -0.53 0.00 1.00 0.00 0.00 64.86 64.86 1fk9 h ILE 135 Cb 1.21 0.03 0.06 0.00 -0.74 0.00 0.00 36.82 37.37 1fk9 h ILE 135 CO 0.66 0.00 0.77 0.21 0.00 0.00 0.00 178.15 179.79 1fk9 s ASN 136 N -4.84 6.63 0.05 1.72 2.47 -1.26 -4.94 114.94 114.78 1fk9 s ASN 136 Ca -0.16 2.68 -0.17 0.00 0.42 0.00 0.00 52.86 55.64 1fk9 s ASN 136 Cb 0.08 -2.62 -0.20 0.00 -1.45 0.00 0.00 41.25 37.06 1fk9 s ASN 136 CO 0.62 -0.72 1.21 -0.55 -3.72 0.00 0.00 177.10 173.93 1fk9 h ASN 137 N 5.11 0.72 -0.96 -4.21 -1.07 -2.00 -3.30 115.58 109.87 1fk9 h ASN 137 Ca -0.46 -0.68 0.19 0.00 0.07 0.00 0.00 56.30 55.42 1fk9 h ASN 137 Cb 1.22 -0.21 -0.11 0.00 -2.07 0.00 0.00 38.32 37.14 1fk9 h ASN 137 CO 0.78 1.29 0.55 -0.08 0.07 0.00 0.00 177.43 180.05 1fk9 h GLU 138 N 0.20 0.65 -6.99 4.14 4.22 -1.94 -3.42 114.58 111.44 1fk9 h GLU 138 Ca -0.06 -0.04 -0.46 0.00 0.08 0.00 0.00 59.36 58.88 1fk9 h GLU 138 Cb 1.33 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 1fk9 h GLU 138 CO 0.14 0.43 0.28 -0.08 -2.18 0.00 0.00 179.01 177.60 1fk9 s THR 139 N -5.87 4.48 0.89 0.32 -1.32 -1.24 -5.09 115.64 107.81 1fk9 s THR 139 Ca -0.11 1.32 -0.14 0.00 -1.21 0.00 0.00 61.69 61.55 1fk9 s THR 139 Cb 0.25 -3.62 0.14 0.00 -1.51 0.00 0.00 72.50 67.76 1fk9 s THR 139 CO 0.79 -0.33 1.24 -2.16 -2.21 0.00 0.00 174.62 171.96 1fk9 s PRO 140 N -3.23 1.24 0.51 7.08 0.04 -1.26 -4.74 135.00 134.64 1fk9 s PRO 140 Ca 0.60 -0.12 0.04 0.00 0.04 0.00 0.00 61.00 61.56 1fk9 s PRO 140 Cb -0.09 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.59 1fk9 s PRO 140 CO 0.16 -2.05 0.72 0.20 0.04 0.00 0.00 177.00 176.07 1fk9 s GLY 141 N -4.67 1.86 -0.05 0.56 0.00 -1.26 -4.36 107.32 99.39 1fk9 s GLY 141 Ca 0.68 -1.48 -0.21 0.00 0.00 0.00 0.00 44.72 43.70 1fk9 s GLY 141 CO 0.51 -1.21 0.62 -0.42 0.00 0.00 0.00 173.10 172.60 1fk9 s ILE 142 N -2.64 5.03 -0.24 0.90 1.09 -1.03 -4.93 121.20 119.37 1fk9 s ILE 142 Ca 0.57 1.28 -0.05 0.00 -1.10 0.00 0.00 60.65 61.35 1fk9 s ILE 142 Cb -0.10 -3.96 -0.01 0.00 -1.06 0.00 0.00 42.46 37.34 1fk9 s ILE 142 CO 0.37 0.33 0.00 -0.13 -0.10 0.00 0.00 174.94 175.41 1fk9 s ARG 143 N 0.41 3.32 0.15 2.79 0.52 -1.26 -2.13 118.95 122.75 1fk9 s ARG 143 Ca 0.33 -0.68 0.01 0.00 -0.52 0.00 0.00 55.73 54.87 1fk9 s ARG 143 Cb -0.17 -3.14 0.01 0.00 0.52 0.00 0.00 34.95 32.16 1fk9 s ARG 143 CO 0.16 -0.27 0.06 0.66 0.02 0.00 0.00 175.30 175.94 1fk9 n TYR 144 N 4.82 -0.48 -3.60 -0.53 4.02 -0.34 0.17 117.16 121.22 1fk9 n TYR 144 Ca -0.17 -0.70 -0.11 0.00 -0.01 0.00 0.00 57.90 56.90 1fk9 n TYR 144 Cb 0.50 -0.11 -0.06 0.00 -0.02 0.00 0.00 39.34 39.64 1fk9 n TYR 144 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 176.86 176.99 1fk9 s GLN 145 N -2.60 0.65 0.36 -0.72 -2.07 -1.08 -2.03 119.66 112.18 1fk9 s GLN 145 Ca 0.05 0.46 -0.26 0.00 -1.82 0.00 0.00 55.36 53.78 1fk9 s GLN 145 Cb -0.00 0.31 -0.09 0.00 -1.09 0.00 0.00 33.01 32.14 1fk9 s GLN 145 CO 0.03 -0.14 1.12 0.71 -1.32 0.00 0.00 175.29 175.69 1fk9 s TYR 146 N -0.38 3.28 -0.41 9.60 2.02 -1.26 -1.84 117.35 128.36 1fk9 s TYR 146 Ca -0.01 1.62 0.05 0.00 -0.37 0.00 0.00 57.07 58.36 1fk9 s TYR 146 Cb -0.03 -3.30 -0.02 0.00 -0.40 0.00 0.00 41.96 38.21 1fk9 s TYR 146 CO -0.00 -0.92 0.38 0.09 -1.57 0.00 0.00 175.55 173.53 1fk9 n ASN 147 N 0.42 0.69 -0.97 2.29 3.02 0.46 -4.65 115.26 116.51 1fk9 n ASN 147 Ca 0.03 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.73 1fk9 n ASN 147 Cb 0.47 0.64 0.00 0.00 -0.61 0.00 0.00 39.78 40.27 1fk9 n ASN 147 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1fk9 n VAL 148 N -0.60 0.00 -3.06 2.41 0.24 -1.10 -1.12 118.33 115.09 1fk9 n VAL 148 Ca 0.02 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.90 1fk9 n VAL 148 Cb 0.10 -0.06 -0.06 0.00 -1.47 0.00 0.00 33.84 32.35 1fk9 n VAL 148 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1fk9 s LEU 149 N 0.00 4.26 -0.19 1.34 1.43 -0.33 -4.17 118.68 121.02 1fk9 s LEU 149 Ca 0.00 0.11 -0.29 0.00 -1.03 0.00 0.00 54.13 52.91 1fk9 s LEU 149 Cb 0.00 -2.85 -0.01 0.00 0.03 0.00 0.00 46.19 43.36 1fk9 s LEU 149 CO 0.00 -0.68 1.32 -2.16 0.23 0.00 0.00 176.35 175.06 1fk9 s PRO 150 N 2.86 4.13 0.11 1.29 0.04 -1.26 -4.30 135.00 137.87 1fk9 s PRO 150 Ca 0.26 1.60 -0.35 0.00 0.04 0.00 0.00 61.00 62.56 1fk9 s PRO 150 Cb -0.14 -3.82 -0.17 0.00 0.04 0.00 0.00 34.50 30.41 1fk9 s PRO 150 CO 0.17 -0.84 1.06 0.94 0.04 0.00 0.00 177.00 178.37 1fk9 n GLN 151 N 6.87 0.63 0.00 4.56 -0.06 -1.26 -0.24 117.38 127.87 1fk9 n GLN 151 Ca 0.15 0.23 0.00 0.00 -2.00 0.00 0.00 57.00 55.37 1fk9 n GLN 151 Cb 0.45 -1.67 0.00 0.00 -4.06 0.00 0.00 30.24 24.96 1fk9 n GLN 151 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1fk9 n GLY 152 N 1.93 2.27 3.82 1.69 0.00 -1.26 -4.86 105.19 108.78 1fk9 n GLY 152 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1fk9 n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1fk9 s TRP 153 N -2.29 3.22 0.16 1.61 -0.00 0.66 -4.71 118.94 117.60 1fk9 s TRP 153 Ca 0.00 1.48 -0.16 0.00 -0.00 0.00 0.00 56.10 57.42 1fk9 s TRP 153 Cb 0.00 -2.90 0.08 0.00 -0.00 0.00 0.00 33.47 30.65 1fk9 s TRP 153 CO 0.00 -0.76 1.72 -0.22 -0.00 0.00 0.00 176.95 177.69 1fk9 h LYS 154 N 0.63 0.16 0.00 5.86 3.64 -1.90 -3.20 116.57 121.76 1fk9 h LYS 154 Ca -0.47 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1fk9 h LYS 154 Cb 1.20 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1fk9 h LYS 154 CO 0.59 0.10 -0.27 0.78 -2.27 0.00 0.00 179.45 178.39 1fk9 h GLY 155 N 0.16 0.00 -0.95 5.01 0.00 -1.94 -3.40 103.07 101.96 1fk9 h GLY 155 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.62 1fk9 h GLY 155 CO -0.24 0.00 -0.50 1.76 0.00 0.00 0.00 176.54 177.56 1fk9 h SER 156 N 0.00 -1.83 -0.64 0.19 0.02 -1.88 0.17 113.55 109.59 1fk9 h SER 156 Ca 0.00 0.32 0.11 0.00 -0.84 0.00 0.00 61.79 61.38 1fk9 h SER 156 Cb 0.99 0.86 -0.08 0.00 0.14 0.00 0.00 62.40 64.30 1fk9 h SER 156 CO 0.00 -0.26 0.21 -0.65 -1.14 0.00 0.00 176.83 174.99 1fk9 h PRO 157 N -0.02 0.36 -0.09 3.45 0.11 -1.79 0.88 132.00 134.88 1fk9 h PRO 157 Ca 0.23 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 66.16 1fk9 h PRO 157 Cb 0.50 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 31.54 1fk9 h PRO 157 CO -0.94 0.24 -0.59 0.00 -0.21 0.00 0.00 178.00 176.50 1fk9 h ALA 158 N 1.47 0.20 -0.35 -0.75 0.00 -1.50 -2.21 119.26 116.11 1fk9 h ALA 158 Ca 0.33 -0.54 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1fk9 h ALA 158 Cb 0.46 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1fk9 h ALA 158 CO -0.36 0.45 -0.04 0.82 0.00 0.00 0.00 179.25 180.12 1fk9 h ILE 159 N 0.18 1.22 0.21 0.00 2.04 -0.44 -1.20 117.51 119.52 1fk9 h ILE 159 Ca -0.05 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 1fk9 h ILE 159 Cb 1.24 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 1fk9 h ILE 159 CO 0.12 0.30 -0.10 0.15 0.00 0.00 0.00 178.15 178.62 1fk9 h PHE 160 N 0.54 -0.26 -0.49 1.37 3.04 -0.85 -2.57 116.94 117.72 1fk9 h PHE 160 Ca 0.11 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.15 1fk9 h PHE 160 Cb 0.40 0.09 -0.09 0.00 2.56 0.00 0.00 35.95 38.91 1fk9 h PHE 160 CO 0.02 0.11 -0.08 1.96 -2.02 0.00 0.00 178.31 178.29 1fk9 h GLN 161 N -0.71 0.03 0.02 1.11 1.08 -1.22 0.13 115.11 115.55 1fk9 h GLN 161 Ca -0.03 -0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.18 1fk9 h GLN 161 Cb 0.49 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.88 1fk9 h GLN 161 CO 0.05 0.02 -0.30 1.03 -0.95 0.00 0.00 178.83 178.68 1fk9 h SER 162 N 0.03 -0.93 -0.51 1.46 0.87 -1.24 -1.05 113.55 112.18 1fk9 h SER 162 Ca 0.24 0.10 0.09 0.00 -1.23 0.00 0.00 61.79 60.99 1fk9 h SER 162 Cb 0.37 0.35 -0.10 0.00 -0.44 0.00 0.00 62.40 62.58 1fk9 h SER 162 CO -0.48 -0.30 -0.37 0.28 -0.53 0.00 0.00 176.83 175.43 1fk9 h SER 163 N -0.39 -1.27 -0.37 6.23 0.02 -0.94 -0.63 113.55 116.19 1fk9 h SER 163 Ca 0.00 0.22 0.06 0.00 -0.84 0.00 0.00 61.79 61.24 1fk9 h SER 163 Cb 0.41 0.59 -0.09 0.00 0.14 0.00 0.00 62.40 63.46 1fk9 h SER 163 CO -0.19 -0.33 -0.46 -0.03 -1.14 0.00 0.00 176.83 174.68 1fk9 h MET 164 N -0.23 -0.36 0.00 3.45 -1.53 -0.37 0.52 114.93 116.41 1fk9 h MET 164 Ca 0.19 0.02 -0.00 0.00 -3.44 0.00 0.00 59.70 56.47 1fk9 h MET 164 Cb 0.56 0.08 -0.00 0.00 -0.55 0.00 0.00 31.60 31.69 1fk9 h MET 164 CO -0.63 -0.24 -0.01 1.79 0.14 0.00 0.00 176.91 177.95 1fk9 h THR 165 N -0.37 0.25 0.00 -0.77 1.35 -0.13 0.39 112.91 113.63 1fk9 h THR 165 Ca 0.11 -0.10 -0.18 0.00 -0.55 0.00 0.00 66.41 65.70 1fk9 h THR 165 Cb 0.60 1.07 -0.03 0.00 -1.73 0.00 0.00 68.15 68.07 1fk9 h THR 165 CO -0.56 0.01 -0.85 0.11 -0.25 0.00 0.00 175.52 173.98 1fk9 h LYS 166 N 0.00 0.00 0.03 4.72 1.57 0.13 -1.92 116.57 121.10 1fk9 h LYS 166 Ca -0.00 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 1fk9 h LYS 166 Cb 0.07 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.40 1fk9 h LYS 166 CO 0.00 0.85 -0.99 0.82 -0.57 0.00 0.00 179.45 179.57 1fk9 h ILE 167 N 0.00 1.32 -0.03 1.86 2.04 0.32 -3.25 117.51 119.77 1fk9 h ILE 167 Ca -0.01 -2.26 -0.14 0.00 1.00 0.00 0.00 64.86 63.45 1fk9 h ILE 167 Cb 1.54 2.52 -0.02 0.00 -0.74 0.00 0.00 36.82 40.13 1fk9 h ILE 167 CO 0.11 0.69 -0.61 -0.07 0.00 0.00 0.00 178.15 178.27 1fk9 h LEU 168 N 0.24 0.13 -0.23 1.44 4.07 -0.71 -3.36 115.31 116.89 1fk9 h LEU 168 Ca -0.13 -0.08 0.02 0.00 0.08 0.00 0.00 57.88 57.77 1fk9 h LEU 168 Cb 1.66 -0.04 -0.03 0.00 1.08 0.00 0.00 40.66 43.34 1fk9 h LEU 168 CO 0.19 0.71 -0.13 1.21 -1.08 0.00 0.00 178.44 179.33 1fk9 n GLU 169 N -3.84 -0.10 0.25 1.13 4.07 -0.72 -0.56 120.64 120.86 1fk9 n GLU 169 Ca -0.02 0.75 -0.12 0.00 -0.06 0.00 0.00 57.16 57.72 1fk9 n GLU 169 Cb 0.61 -1.12 -0.06 0.00 -0.06 0.00 0.00 31.44 30.81 1fk9 n GLU 169 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1fk9 h PRO 170 N 0.00 -0.69 -0.99 5.31 0.13 -1.77 -2.35 132.00 131.64 1fk9 h PRO 170 Ca 0.04 0.05 0.40 0.00 -0.87 0.00 0.00 66.00 65.61 1fk9 h PRO 170 Cb 0.09 0.16 -0.16 0.00 0.13 0.00 0.00 31.00 31.22 1fk9 h PRO 170 CO -0.21 -0.46 0.56 0.34 -0.23 0.00 0.00 178.00 177.99 1fk9 n PHE 171 N -4.26 1.01 0.03 1.56 7.35 -0.95 0.32 117.46 122.52 1fk9 n PHE 171 Ca -0.09 1.01 -0.12 0.00 -0.76 0.00 0.00 57.45 57.50 1fk9 n PHE 171 Cb 0.31 -1.43 -0.07 0.00 0.35 0.00 0.00 39.48 38.64 1fk9 n PHE 171 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1fk9 h ARG 172 N 0.00 0.01 0.00 -4.13 3.08 -0.30 -1.93 114.38 111.12 1fk9 h ARG 172 Ca 0.79 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.79 1fk9 h ARG 172 Cb 2.18 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 32.22 1fk9 h ARG 172 CO -0.66 0.10 -0.25 0.87 -1.07 0.00 0.00 179.97 178.96 1fk9 h LYS 173 N -0.08 0.00 -0.00 0.04 1.57 0.16 -1.14 116.57 117.11 1fk9 h LYS 173 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fk9 h LYS 173 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1fk9 h LYS 173 CO -0.00 0.25 -0.04 1.04 -0.57 0.00 0.00 179.45 180.13 1fk9 n GLN 174 N -3.88 0.28 -3.16 3.15 6.02 -0.77 -4.08 117.38 114.93 1fk9 n GLN 174 Ca -0.02 -0.02 -0.20 0.00 -0.01 0.00 0.00 57.00 56.75 1fk9 n GLN 174 Cb 0.33 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 30.05 1fk9 n GLN 174 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1fk9 n ASN 175 N -1.34 0.32 0.04 1.08 3.02 -0.45 -4.96 115.26 112.96 1fk9 n ASN 175 Ca 0.11 -2.89 0.04 0.00 -0.03 0.00 0.00 54.58 51.81 1fk9 n ASN 175 Cb 0.29 -0.48 0.18 0.00 -0.61 0.00 0.00 39.78 39.16 1fk9 n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1fk9 n PRO 176 N 0.84 0.04 0.03 3.52 -0.04 -1.08 -2.19 135.00 136.12 1fk9 n PRO 176 Ca 0.22 0.50 -0.21 0.00 -0.04 0.00 0.00 63.50 63.97 1fk9 n PRO 176 Cb 0.60 -1.62 -0.14 0.00 -0.04 0.00 0.00 33.50 32.30 1fk9 n PRO 176 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 1fk9 h ASP 177 N 0.00 0.43 -3.85 3.54 -0.00 -1.93 -3.46 116.42 111.15 1fk9 h ASP 177 Ca 0.00 -0.89 -0.51 0.00 -0.00 0.00 0.00 57.03 55.62 1fk9 h ASP 177 Cb 0.04 -0.14 0.05 0.00 -0.00 0.00 0.00 39.33 39.28 1fk9 h ASP 177 CO 0.00 1.53 0.57 -0.63 -0.00 0.00 0.00 179.24 180.71 1fk9 s ILE 178 N -2.46 3.04 -0.14 4.15 -1.09 -0.93 -4.78 121.20 118.99 1fk9 s ILE 178 Ca -0.17 1.04 0.00 0.00 -2.23 0.00 0.00 60.65 59.29 1fk9 s ILE 178 Cb 0.03 -3.66 -0.01 0.00 -1.58 0.00 0.00 42.46 37.24 1fk9 s ILE 178 CO 0.80 0.24 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.92 1fk9 s VAL 179 N -1.16 2.84 -0.11 2.92 1.01 -0.83 -5.00 120.40 120.07 1fk9 s VAL 179 Ca 0.47 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.74 1fk9 s VAL 179 Cb -0.36 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 33.84 1fk9 s VAL 179 CO 0.48 0.52 -0.14 -0.63 0.00 0.00 0.00 175.10 175.32 1fk9 s ILE 180 N 0.60 1.45 -0.12 2.22 1.01 -1.26 -1.23 121.20 123.88 1fk9 s ILE 180 Ca -0.08 -0.60 -0.01 0.00 0.00 0.00 0.00 60.65 59.95 1fk9 s ILE 180 Cb -0.16 -1.34 -0.02 0.00 0.01 0.00 0.00 42.46 40.95 1fk9 s ILE 180 CO 0.03 0.43 -0.08 -0.47 0.00 0.00 0.00 174.94 174.85 1fk9 s TYR 181 N 1.10 2.92 -0.14 3.97 6.14 -0.28 -4.99 117.35 126.07 1fk9 s TYR 181 Ca -0.04 -0.34 -0.07 0.00 0.64 0.00 0.00 57.07 57.25 1fk9 s TYR 181 Cb -0.14 -1.85 -0.04 0.00 0.42 0.00 0.00 41.96 40.34 1fk9 s TYR 181 CO -0.03 -0.01 0.09 -1.14 0.64 0.00 0.00 175.55 175.10 1fk9 s GLN 182 N 0.07 3.64 -0.24 4.97 0.74 -1.26 -1.37 119.66 126.21 1fk9 s GLN 182 Ca -0.03 -0.25 -0.03 0.00 0.05 0.00 0.00 55.36 55.11 1fk9 s GLN 182 Cb -0.14 -3.17 0.13 0.00 1.10 0.00 0.00 33.01 30.93 1fk9 s GLN 182 CO 0.03 0.55 0.35 -0.47 -0.55 0.00 0.00 175.29 175.21 1fk9 s TYR 183 N -0.38 -0.74 0.00 1.67 6.14 -0.92 -5.02 117.35 118.09 1fk9 s TYR 183 Ca 0.10 0.70 0.00 0.00 0.64 0.00 0.00 57.07 58.51 1fk9 s TYR 183 Cb -0.12 -0.06 0.00 0.00 0.42 0.00 0.00 41.96 42.21 1fk9 s TYR 183 CO 0.02 -0.72 0.00 -1.33 0.64 0.00 0.00 175.55 174.16 1fk9 n MET 184 N 5.36 0.00 -0.20 4.97 2.81 -1.26 -0.19 117.12 128.60 1fk9 n MET 184 Ca -0.04 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.91 1fk9 n MET 184 Cb 0.50 0.00 0.17 0.00 -0.71 0.00 0.00 33.22 33.18 1fk9 n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1fk9 n ASP 185 N 3.84 2.06 -4.80 7.83 9.92 -1.26 -4.89 116.55 129.25 1fk9 n ASP 185 Ca 0.00 -2.02 -0.24 0.00 -0.53 0.00 0.00 54.79 52.00 1fk9 n ASP 185 Cb 0.00 -0.27 -0.05 0.00 -0.64 0.00 0.00 41.12 40.16 1fk9 n ASP 185 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1fk9 s ASP 186 N -0.97 5.45 -0.30 -2.24 1.11 0.73 0.70 116.67 121.15 1fk9 s ASP 186 Ca 0.25 -0.22 -0.03 0.00 0.18 0.00 0.00 52.55 52.73 1fk9 s ASP 186 Cb 0.13 -1.38 0.11 0.00 1.07 0.00 0.00 42.92 42.85 1fk9 s ASP 186 CO 0.17 0.01 0.16 -0.22 1.18 0.00 0.00 175.17 176.47 1fk9 s LEU 187 N -3.49 0.47 -0.35 1.23 2.96 0.19 -2.17 118.68 117.51 1fk9 s LEU 187 Ca 0.32 -1.30 -0.27 0.00 -0.22 0.00 0.00 54.13 52.65 1fk9 s LEU 187 Cb -0.09 -0.23 0.02 0.00 0.50 0.00 0.00 46.19 46.39 1fk9 s LEU 187 CO 0.24 -0.42 1.00 -0.31 -1.32 0.00 0.00 176.35 175.54 1fk9 s TYR 188 N 2.04 3.10 -0.19 5.38 2.02 -0.47 -0.00 117.35 129.22 1fk9 s TYR 188 Ca 0.10 0.96 -0.01 0.00 -0.37 0.00 0.00 57.07 57.75 1fk9 s TYR 188 Cb -0.16 -3.70 0.01 0.00 -0.40 0.00 0.00 41.96 37.70 1fk9 s TYR 188 CO -0.33 -0.82 -0.14 0.08 -1.57 0.00 0.00 175.55 172.78 1fk9 s VAL 189 N 3.59 2.63 0.29 0.71 1.01 0.36 -1.12 120.40 127.87 1fk9 s VAL 189 Ca 0.42 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.70 1fk9 s VAL 189 Cb -0.12 -2.14 -0.06 0.00 0.00 0.00 0.00 36.38 34.06 1fk9 s VAL 189 CO 0.18 0.49 -0.03 -0.83 0.00 0.00 0.00 175.10 174.91 1fk9 s GLY 190 N 1.27 1.89 0.12 4.51 0.00 -0.36 0.13 107.32 114.88 1fk9 s GLY 190 Ca 0.03 -1.95 -0.25 0.00 0.00 0.00 0.00 44.72 42.55 1fk9 s GLY 190 CO -0.07 -1.84 1.06 -1.35 0.00 0.00 0.00 173.10 170.90 1fk9 s SER 191 N -3.46 -0.10 -0.25 1.64 1.04 0.22 -1.97 113.70 110.83 1fk9 s SER 191 Ca 0.31 -0.41 0.12 0.00 0.48 0.00 0.00 55.95 56.45 1fk9 s SER 191 Cb 0.05 0.41 0.56 0.00 0.10 0.00 0.00 66.02 67.15 1fk9 s SER 191 CO 0.13 -0.78 1.52 0.47 0.98 0.00 0.00 173.24 175.55 1fk9 n ASP 192 N -0.68 3.52 -4.83 7.02 8.00 -1.26 -0.88 116.55 127.43 1fk9 n ASP 192 Ca -0.05 -3.34 -0.32 0.00 0.71 0.00 0.00 54.79 51.78 1fk9 n ASP 192 Cb 0.61 -0.62 -0.05 0.00 -0.02 0.00 0.00 41.12 41.04 1fk9 n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1fk9 s LEU 193 N -3.02 3.76 0.29 0.64 1.43 -1.26 -4.84 118.68 115.67 1fk9 s LEU 193 Ca 0.46 1.61 -0.29 0.00 -1.03 0.00 0.00 54.13 54.87 1fk9 s LEU 193 Cb 0.38 -4.51 -0.10 0.00 0.03 0.00 0.00 46.19 41.99 1fk9 s LEU 193 CO 0.06 -0.49 1.35 -1.83 0.23 0.00 0.00 176.35 175.68 1fk9 s GLU 194 N -3.70 4.33 0.12 1.70 -1.05 -1.26 -4.60 118.70 114.24 1fk9 s GLU 194 Ca 0.60 2.23 0.02 0.00 -0.15 0.00 0.00 54.97 57.67 1fk9 s GLU 194 Cb -0.10 -3.10 0.34 0.00 -0.44 0.00 0.00 34.13 30.84 1fk9 s GLU 194 CO 0.24 -0.27 0.59 -0.89 0.95 0.00 0.00 175.26 175.88 1fk9 n ILE 195 N 1.51 -0.16 -0.04 1.83 5.41 -1.26 -0.12 119.36 126.52 1fk9 n ILE 195 Ca 0.03 0.82 -0.14 0.00 1.00 0.00 0.00 62.75 64.46 1fk9 n ILE 195 Cb 0.41 -1.23 -0.09 0.00 -0.71 0.00 0.00 39.64 38.03 1fk9 n ILE 195 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1fk9 h GLY 196 N 0.00 0.28 1.77 7.39 0.00 -2.01 -2.96 103.07 107.55 1fk9 h GLY 196 Ca 0.25 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 47.18 1fk9 h GLY 196 CO -0.34 0.30 -0.23 1.46 0.00 0.00 0.00 176.54 177.72 1fk9 h GLN 197 N -0.20 0.27 0.78 4.80 4.20 -0.87 -3.04 115.11 121.04 1fk9 h GLN 197 Ca 0.00 -0.09 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 1fk9 h GLN 197 Cb 0.74 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.51 1fk9 h GLN 197 CO 0.04 0.50 -0.38 1.25 -0.67 0.00 0.00 178.83 179.57 1fk9 h HIS 198 N 0.25 -0.97 0.00 2.96 2.76 -1.33 -2.14 115.15 116.67 1fk9 h HIS 198 Ca 0.04 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1fk9 h HIS 198 Cb 0.56 0.32 0.00 0.00 1.55 0.00 0.00 27.41 29.84 1fk9 h HIS 198 CO 0.01 -0.61 0.40 -0.09 -1.30 0.00 0.00 177.93 176.35 1fk9 h ARG 199 N -1.17 0.00 0.02 5.26 2.43 -1.50 0.60 114.38 120.01 1fk9 h ARG 199 Ca -0.11 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.03 1fk9 h ARG 199 Cb 0.81 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 1fk9 h ARG 199 CO 0.18 0.00 -0.18 1.15 -1.51 0.00 0.00 179.97 179.61 1fk9 h THR 200 N 0.00 1.71 -0.21 0.20 2.02 -1.35 -2.77 112.91 112.51 1fk9 h THR 200 Ca 0.00 -2.36 0.03 0.00 0.77 0.00 0.00 66.41 64.85 1fk9 h THR 200 Cb 0.81 3.30 -0.03 0.00 -1.74 0.00 0.00 68.15 70.49 1fk9 h THR 200 CO 0.00 0.60 0.01 0.11 0.37 0.00 0.00 175.52 176.62 1fk9 h LYS 201 N -0.93 0.08 -0.63 6.66 1.79 -0.29 0.55 116.57 123.81 1fk9 h LYS 201 Ca -0.04 -0.00 0.12 0.00 -2.18 0.00 0.00 60.65 58.55 1fk9 h LYS 201 Cb 1.09 -0.02 -0.12 0.00 -1.58 0.00 0.00 32.23 31.60 1fk9 h LYS 201 CO 0.00 0.05 -0.25 0.82 -1.08 0.00 0.00 179.45 179.00 1fk9 h ILE 202 N 0.08 0.25 0.00 1.86 1.08 -1.32 1.07 117.51 120.54 1fk9 h ILE 202 Ca 0.10 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.53 1fk9 h ILE 202 Cb 0.11 0.25 -0.00 0.00 -3.07 0.00 0.00 36.82 34.11 1fk9 h ILE 202 CO -0.15 0.00 -0.16 -0.33 -0.69 0.00 0.00 178.15 176.82 1fk9 h GLU 203 N -0.08 0.00 0.12 2.37 4.39 -1.04 0.11 114.58 120.46 1fk9 h GLU 203 Ca 0.28 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.97 1fk9 h GLU 203 Cb 0.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 1fk9 h GLU 203 CO -0.68 0.16 -0.06 0.93 -1.16 0.00 0.00 179.01 178.20 1fk9 h GLU 204 N 0.00 -0.16 0.22 2.33 5.08 0.32 -2.57 114.58 119.79 1fk9 h GLU 204 Ca -0.00 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1fk9 h GLU 204 Cb 0.34 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1fk9 h GLU 204 CO 0.02 0.14 -0.51 1.25 -1.00 0.00 0.00 179.01 178.92 1fk9 h LEU 205 N -0.47 -1.49 -1.45 1.33 5.85 0.52 0.74 115.31 120.33 1fk9 h LEU 205 Ca -0.02 0.15 0.44 0.00 0.84 0.00 0.00 57.88 59.29 1fk9 h LEU 205 Cb 0.38 0.54 -0.12 0.00 0.37 0.00 0.00 40.66 41.82 1fk9 h LEU 205 CO 0.03 -0.58 0.89 0.03 -0.34 0.00 0.00 178.44 178.47 1fk9 h ARG 206 N -0.80 0.08 0.09 1.25 3.08 -0.75 0.62 114.38 117.93 1fk9 h ARG 206 Ca -0.02 -0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.73 1fk9 h ARG 206 Cb 0.78 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 1fk9 h ARG 206 CO -0.23 0.05 -1.53 1.96 -1.07 0.00 0.00 179.97 179.15 1fk9 h GLN 207 N 0.08 0.19 0.00 0.04 1.08 -0.85 -1.76 115.11 113.89 1fk9 h GLN 207 Ca 0.82 -0.33 -0.02 0.00 -1.45 0.00 0.00 58.65 57.68 1fk9 h GLN 207 Cb 2.64 0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 30.19 1fk9 h GLN 207 CO -0.39 1.02 -0.08 1.25 -0.95 0.00 0.00 178.83 179.69 1fk9 h HIS 208 N 0.05 0.00 0.09 2.96 2.76 0.24 0.16 115.15 121.42 1fk9 h HIS 208 Ca -0.24 0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 57.73 1fk9 h HIS 208 Cb 1.99 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.95 1fk9 h HIS 208 CO 0.05 0.08 -0.99 -0.07 -1.30 0.00 0.00 177.93 175.70 1fk9 h LEU 209 N 0.00 0.30 -1.42 0.26 3.38 -0.95 -3.30 115.31 113.59 1fk9 h LEU 209 Ca -0.00 -0.87 0.13 0.00 0.09 0.00 0.00 57.88 57.24 1fk9 h LEU 209 Cb 0.15 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 1fk9 h LEU 209 CO 0.01 1.44 0.53 0.25 0.09 0.00 0.00 178.44 180.76 1fk9 h LEU 210 N -0.52 0.55 -2.00 1.67 7.12 -0.35 0.26 115.31 122.05 1fk9 h LEU 210 Ca -0.21 0.03 0.04 0.00 0.13 0.00 0.00 57.88 57.87 1fk9 h LEU 210 Cb 1.55 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 41.59 1fk9 h LEU 210 CO 0.05 0.29 0.37 -0.09 -0.13 0.00 0.00 178.44 178.93 1fk9 h ARG 211 N 0.59 0.00 -0.27 1.25 2.43 -0.77 0.46 114.38 118.07 1fk9 h ARG 211 Ca 0.40 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.57 1fk9 h ARG 211 Cb 0.71 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 1fk9 h ARG 211 CO -0.16 0.00 0.00 0.91 -1.51 0.00 0.00 179.97 179.21 1fk9 n TRP 212 N -3.21 0.36 -0.13 2.20 7.02 0.79 -4.95 117.44 119.52 1fk9 n TRP 212 Ca 0.01 -0.48 0.00 0.00 -1.02 0.00 0.00 57.50 56.01 1fk9 n TRP 212 Cb 0.46 -0.03 0.00 0.00 -2.42 0.00 0.00 31.31 29.32 1fk9 n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1fk9 n GLY 213 N 0.33 0.57 3.66 6.99 0.00 0.16 -4.91 105.19 111.99 1fk9 n GLY 213 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1fk9 n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fk9 s LEU 214 N 0.00 4.15 -0.12 0.99 2.01 -0.39 -4.89 118.68 120.42 1fk9 s LEU 214 Ca 0.00 1.53 -0.01 0.00 0.01 0.00 0.00 54.13 55.66 1fk9 s LEU 214 Cb 0.00 -3.54 -0.02 0.00 0.01 0.00 0.00 46.19 42.64 1fk9 s LEU 214 CO 0.00 -0.68 -0.10 0.42 1.01 0.00 0.00 176.35 176.99 1fk9 s THR 215 N 3.18 3.31 0.22 5.49 -4.23 -1.25 -1.57 115.64 120.79 1fk9 s THR 215 Ca 0.49 -0.58 0.05 0.00 -1.18 0.00 0.00 61.69 60.46 1fk9 s THR 215 Cb -0.18 -2.39 -0.05 0.00 1.34 0.00 0.00 72.50 71.22 1fk9 s THR 215 CO 0.11 0.53 -0.04 0.42 -0.54 0.00 0.00 174.62 175.10 1fk9 s THR 216 N 0.14 1.22 0.39 3.99 -4.23 -1.26 -1.79 115.64 114.10 1fk9 s THR 216 Ca -0.05 -2.07 -0.25 0.00 -1.18 0.00 0.00 61.69 58.15 1fk9 s THR 216 Cb -0.15 -2.26 -0.09 0.00 1.34 0.00 0.00 72.50 71.35 1fk9 s THR 216 CO 0.04 -0.41 1.09 -2.16 -0.54 0.00 0.00 174.62 172.64 1fk9 s PRO 217 N -3.80 4.16 0.49 3.99 0.04 -1.26 -5.04 135.00 133.57 1fk9 s PRO 217 Ca 0.26 1.63 -0.06 0.00 0.04 0.00 0.00 61.00 62.87 1fk9 s PRO 217 Cb 0.04 -2.62 -0.04 0.00 0.04 0.00 0.00 34.50 31.93 1fk9 s PRO 217 CO 0.08 -0.17 0.80 0.16 0.04 0.00 0.00 177.00 177.90 1fk9 s ASP 218 N -1.40 6.27 0.03 6.66 3.84 -1.26 -4.78 116.67 126.03 1fk9 s ASP 218 Ca 0.57 0.96 0.01 0.00 -0.00 0.00 0.00 52.55 54.08 1fk9 s ASP 218 Cb -0.25 -2.26 0.10 0.00 -1.38 0.00 0.00 42.92 39.12 1fk9 s ASP 218 CO 0.32 -0.59 0.16 1.17 -0.00 0.00 0.00 175.17 176.22 1fk9 n LYS 219 N -2.27 -0.01 0.11 2.11 3.00 -1.26 0.19 118.16 120.04 1fk9 n LYS 219 Ca 0.01 0.14 0.01 0.00 -0.00 0.00 0.00 58.31 58.47 1fk9 n LYS 219 Cb 0.55 -0.24 -0.01 0.00 0.00 0.00 0.00 35.03 35.33 1fk9 n LYS 219 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 1fk9 h LYS 220 N 0.00 0.00 -1.05 1.64 3.64 -2.03 -3.30 116.57 115.47 1fk9 h LYS 220 Ca 0.07 0.00 -0.56 0.00 -1.27 0.00 0.00 60.65 58.89 1fk9 h LYS 220 Cb 0.16 0.00 -0.27 0.00 -0.41 0.00 0.00 32.23 31.71 1fk9 h LYS 220 CO -0.09 0.51 0.71 0.72 -2.27 0.00 0.00 179.45 179.03 1fk9 n HIS 221 N -3.17 2.90 -5.04 1.91 8.25 0.52 -4.92 115.22 115.67 1fk9 n HIS 221 Ca -0.01 -2.36 -0.30 0.00 -0.26 0.00 0.00 57.72 54.80 1fk9 n HIS 221 Cb 0.78 -1.16 -0.15 0.00 1.12 0.00 0.00 29.99 30.58 1fk9 n HIS 221 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1fk9 s GLN 222 N -3.29 1.87 0.37 -0.41 -0.21 -1.19 -4.53 119.66 112.27 1fk9 s GLN 222 Ca 0.56 -1.01 -0.27 0.00 0.02 0.00 0.00 55.36 54.67 1fk9 s GLN 222 Cb 0.45 -1.94 -0.09 0.00 1.00 0.00 0.00 33.01 32.44 1fk9 s GLN 222 CO 0.04 0.51 1.20 0.15 -2.12 0.00 0.00 175.29 175.07 1fk9 s LYS 223 N -0.95 4.21 0.19 2.91 1.02 -1.26 -5.04 119.74 120.81 1fk9 s LYS 223 Ca 0.11 1.94 0.09 0.00 0.02 0.00 0.00 55.97 58.12 1fk9 s LYS 223 Cb -0.10 -2.85 -0.04 0.00 -0.52 0.00 0.00 37.83 34.32 1fk9 s LYS 223 CO 0.01 -0.22 -0.10 -1.21 -0.92 0.00 0.00 175.35 172.91 1fk9 s GLU 224 N -2.05 2.03 0.77 1.68 0.41 -1.26 -4.51 118.70 115.77 1fk9 s GLU 224 Ca 0.53 -1.30 -0.15 0.00 -0.41 0.00 0.00 54.97 53.64 1fk9 s GLU 224 Cb -0.33 -2.14 0.00 0.00 -1.78 0.00 0.00 34.13 29.88 1fk9 s GLU 224 CO 0.43 0.43 0.71 -2.30 -0.49 0.00 0.00 175.26 174.03 1fk9 n PRO 225 N 0.00 0.24 -2.77 0.39 -0.02 -1.26 -4.47 135.00 127.11 1fk9 n PRO 225 Ca -0.11 0.13 -0.34 0.00 -2.02 0.00 0.00 63.50 61.17 1fk9 n PRO 225 Cb 0.56 -2.01 -0.06 0.00 -0.02 0.00 0.00 33.50 31.96 1fk9 n PRO 225 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1fk9 s PRO 226 N -3.22 4.22 -0.27 0.52 0.04 -1.26 -5.10 135.00 129.93 1fk9 s PRO 226 Ca 0.67 1.20 -0.18 0.00 0.04 0.00 0.00 61.00 62.73 1fk9 s PRO 226 Cb -0.32 -2.27 -0.02 0.00 0.04 0.00 0.00 34.50 31.93 1fk9 s PRO 226 CO 0.57 -0.04 0.53 -0.06 0.04 0.00 0.00 177.00 178.03 1fk9 s PHE 227 N -2.05 3.25 -0.25 0.56 0.08 0.22 -4.77 117.98 115.03 1fk9 s PHE 227 Ca 0.61 0.60 -0.29 0.00 0.12 0.00 0.00 56.93 57.97 1fk9 s PHE 227 Cb -0.12 -2.77 0.01 0.00 -0.57 0.00 0.00 43.02 39.57 1fk9 s PHE 227 CO 0.16 -0.33 1.13 -1.17 -0.10 0.00 0.00 175.22 174.91 1fk9 s LEU 228 N 2.36 4.05 -0.05 -0.37 1.98 -1.26 0.52 118.68 125.91 1fk9 s LEU 228 Ca 0.22 1.34 0.00 0.00 -2.89 0.00 0.00 54.13 52.79 1fk9 s LEU 228 Cb -0.16 -3.54 0.02 0.00 0.66 0.00 0.00 46.19 43.18 1fk9 s LEU 228 CO 0.10 -0.79 -0.02 0.86 -1.89 0.00 0.00 176.35 174.60 1fk9 s TRP 229 N 3.52 0.63 -0.38 5.38 -0.00 -0.16 -4.87 118.94 123.06 1fk9 s TRP 229 Ca 0.48 -0.15 -0.04 0.00 -0.00 0.00 0.00 56.10 56.39 1fk9 s TRP 229 Cb -0.16 -0.66 0.04 0.00 -0.00 0.00 0.00 33.47 32.69 1fk9 s TRP 229 CO 0.12 -0.22 0.10 -1.33 -0.00 0.00 0.00 176.95 175.62 1fk9 n MET 230 N 4.41 -2.64 0.00 5.86 2.81 -1.26 0.18 117.12 126.47 1fk9 n MET 230 Ca -0.20 0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 1fk9 n MET 230 Cb 0.50 -4.60 0.00 0.00 -0.71 0.00 0.00 33.22 28.41 1fk9 n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1fk9 n GLY 231 N -0.62 1.12 3.46 3.03 0.00 -1.26 -5.09 105.19 105.83 1fk9 n GLY 231 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1fk9 n GLY 231 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fk9 n TYR 232 N -1.72 -0.10 -3.64 1.61 4.02 0.13 -2.55 117.16 114.91 1fk9 n TYR 232 Ca 0.00 -2.78 -0.29 0.00 -0.01 0.00 0.00 57.90 54.81 1fk9 n TYR 232 Cb 0.00 0.07 -0.14 0.00 -0.02 0.00 0.00 39.34 39.25 1fk9 n TYR 232 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1fk9 s GLU 233 N -3.57 0.70 -0.32 -0.72 2.12 0.43 -0.99 118.70 116.36 1fk9 s GLU 233 Ca 0.27 -1.22 -0.21 0.00 0.36 0.00 0.00 54.97 54.17 1fk9 s GLU 233 Cb 0.01 -1.76 -0.00 0.00 0.26 0.00 0.00 34.13 32.64 1fk9 s GLU 233 CO 0.19 -1.08 0.67 -0.51 -0.54 0.00 0.00 175.26 173.99 1fk9 s LEU 234 N 1.33 4.15 0.38 2.70 1.43 0.18 -2.99 118.68 125.88 1fk9 s LEU 234 Ca 0.13 0.42 0.07 0.00 -1.03 0.00 0.00 54.13 53.73 1fk9 s LEU 234 Cb -0.20 -2.87 -0.01 0.00 0.03 0.00 0.00 46.19 43.14 1fk9 s LEU 234 CO -0.17 -0.54 0.47 -1.00 0.23 0.00 0.00 176.35 175.35 1fk9 s HIS 235 N 2.72 2.89 0.33 0.29 3.76 0.47 0.73 115.29 126.48 1fk9 s HIS 235 Ca 0.27 -0.35 0.12 0.00 -0.15 0.00 0.00 55.06 54.95 1fk9 s HIS 235 Cb -0.15 -2.16 0.58 0.00 1.11 0.00 0.00 32.58 31.96 1fk9 s HIS 235 CO 0.13 -0.18 1.74 -1.35 -0.85 0.00 0.00 174.74 174.23 1fk9 h PRO 236 N 0.85 0.00 -0.00 8.40 0.11 -1.92 -3.28 132.00 136.16 1fk9 h PRO 236 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1fk9 h PRO 236 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1fk9 h PRO 236 CO 0.51 0.47 0.00 -0.40 -0.21 0.00 0.00 178.00 178.37 1fk9 n ASP 237 N -3.98 1.95 -3.58 -2.05 3.85 -1.26 -0.58 116.55 110.90 1fk9 n ASP 237 Ca -0.02 -1.95 -0.05 0.00 -0.71 0.00 0.00 54.79 52.07 1fk9 n ASP 237 Cb 0.49 -0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.24 1fk9 n ASP 237 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 1fk9 s LYS 238 N -0.95 0.59 0.35 0.11 -2.85 -1.24 -4.50 119.74 111.26 1fk9 s LYS 238 Ca 0.00 -0.25 0.07 0.00 -1.00 0.00 0.00 55.97 54.79 1fk9 s LYS 238 Cb 0.00 0.25 -0.03 0.00 -2.06 0.00 0.00 37.83 35.99 1fk9 s LYS 238 CO 0.00 -0.26 0.26 1.67 0.10 0.00 0.00 175.35 177.11 1fk9 s TRP 239 N -2.76 1.78 -0.05 1.78 1.48 0.49 -0.39 118.94 121.27 1fk9 s TRP 239 Ca 0.09 -1.62 -0.30 0.00 -1.06 0.00 0.00 56.10 53.22 1fk9 s TRP 239 Cb -0.00 -0.80 0.10 0.00 -1.16 0.00 0.00 33.47 31.61 1fk9 s TRP 239 CO -0.05 -0.78 1.33 -0.08 -4.06 0.00 0.00 176.95 173.30 1fk9 s THR 240 N -3.38 0.00 0.32 0.66 -1.32 -1.16 -0.02 115.64 110.75 1fk9 s THR 240 Ca 0.37 -0.11 -0.03 0.00 -1.21 0.00 0.00 61.69 60.71 1fk9 s THR 240 Cb 0.02 -2.84 -0.04 0.00 -1.51 0.00 0.00 72.50 68.13 1fk9 s THR 240 CO 0.26 0.00 0.57 0.68 -2.21 0.00 0.00 174.62 173.92 1fk9 s VAL 241 N -2.04 5.04 0.47 5.08 -7.23 -1.26 -0.43 120.40 120.02 1fk9 s VAL 241 Ca 0.28 -0.08 -0.22 0.00 -1.81 0.00 0.00 61.98 60.16 1fk9 s VAL 241 Cb 0.01 -3.78 -0.10 0.00 0.56 0.00 0.00 36.38 33.06 1fk9 s VAL 241 CO -0.02 -0.44 0.79 1.67 -0.31 0.00 0.00 175.10 176.80 1fk9 n GLN 242 N -1.30 0.93 -1.67 4.82 7.27 -1.06 -4.52 117.38 121.86 1fk9 n GLN 242 Ca -0.02 0.34 -0.47 0.00 0.07 0.00 0.00 57.00 56.92 1fk9 n GLN 242 Cb 0.55 -1.85 -0.04 0.00 2.41 0.00 0.00 30.24 31.30 1fk9 n GLN 242 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1fk9 n PRO 243 N 0.09 2.08 -4.03 3.69 -0.04 -1.26 -4.97 135.00 130.56 1fk9 n PRO 243 Ca 0.11 0.75 -0.35 0.00 -0.04 0.00 0.00 63.50 63.97 1fk9 n PRO 243 Cb 0.42 -2.52 -0.13 0.00 -0.04 0.00 0.00 33.50 31.22 1fk9 n PRO 243 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1fk9 s ILE 244 N 1.28 3.73 -0.20 0.52 -1.09 -1.26 -5.09 121.20 119.09 1fk9 s ILE 244 Ca 0.81 -0.38 0.00 0.00 -2.23 0.00 0.00 60.65 58.85 1fk9 s ILE 244 Cb -0.70 -2.69 0.02 0.00 -1.58 0.00 0.00 42.46 37.51 1fk9 s ILE 244 CO 0.40 0.42 -0.16 0.54 -1.23 0.00 0.00 174.94 174.91 1fk9 s VAL 245 N 1.19 2.31 -0.39 2.92 0.11 -1.26 -4.92 120.40 120.37 1fk9 s VAL 245 Ca 0.03 -0.92 -0.26 0.00 -2.93 0.00 0.00 61.98 57.89 1fk9 s VAL 245 Cb -0.15 -2.02 0.02 0.00 -1.53 0.00 0.00 36.38 32.70 1fk9 s VAL 245 CO 0.00 0.46 0.94 -0.76 -3.33 0.00 0.00 175.10 172.42 1fk9 s LEU 246 N 1.31 3.98 0.94 2.54 1.43 -1.26 -5.02 118.68 122.60 1fk9 s LEU 246 Ca 0.04 0.52 -0.12 0.00 -1.03 0.00 0.00 54.13 53.53 1fk9 s LEU 246 Cb -0.14 -3.27 0.05 0.00 0.03 0.00 0.00 46.19 42.86 1fk9 s LEU 246 CO -0.11 -0.91 0.51 -0.81 0.23 0.00 0.00 176.35 175.27 1fk9 n PRO 247 N 6.89 -0.31 -4.88 1.29 -0.04 -1.26 -5.00 135.00 131.69 1fk9 n PRO 247 Ca 0.07 -0.04 -0.33 0.00 -0.04 0.00 0.00 63.50 63.16 1fk9 n PRO 247 Cb 0.48 -1.93 -0.15 0.00 -0.04 0.00 0.00 33.50 31.86 1fk9 n PRO 247 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1fk9 s GLU 248 N -3.76 3.26 -0.02 0.54 0.41 -1.26 -5.10 118.70 112.78 1fk9 s GLU 248 Ca 0.58 -0.75 -0.30 0.00 -0.41 0.00 0.00 54.97 54.09 1fk9 s GLU 248 Cb -0.22 -2.53 0.12 0.00 -1.78 0.00 0.00 34.13 29.72 1fk9 s GLU 248 CO 0.66 0.18 1.29 -1.59 -0.49 0.00 0.00 175.26 175.31 1fk9 s LYS 249 N 0.41 0.39 0.00 1.61 -2.85 -1.26 -5.04 119.74 113.00 1fk9 s LYS 249 Ca -0.13 -0.23 0.04 0.00 -1.00 0.00 0.00 55.97 54.65 1fk9 s LYS 249 Cb -0.16 0.13 -0.02 0.00 -2.06 0.00 0.00 37.83 35.71 1fk9 s LYS 249 CO 0.06 -0.18 0.27 -0.40 0.10 0.00 0.00 175.35 175.19 1fk9 n ASP 250 N -0.65 0.46 -3.97 0.03 5.68 -1.26 -4.89 116.55 111.94 1fk9 n ASP 250 Ca -0.06 -0.73 -0.31 0.00 -0.50 0.00 0.00 54.79 53.20 1fk9 n ASP 250 Cb 0.62 0.75 -0.15 0.00 -1.14 0.00 0.00 41.12 41.20 1fk9 n ASP 250 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1fk9 s SER 251 N -1.07 4.53 -0.24 -1.12 0.15 -1.26 -4.88 113.70 109.82 1fk9 s SER 251 Ca 0.02 -2.49 -0.13 0.00 0.70 0.00 0.00 55.95 54.05 1fk9 s SER 251 Cb 0.03 -1.59 -0.04 0.00 -1.71 0.00 0.00 66.02 62.70 1fk9 s SER 251 CO 0.12 -0.32 0.28 0.26 1.20 0.00 0.00 173.24 174.78 1fk9 s TRP 252 N 0.44 3.31 0.41 3.44 0.52 -1.26 -5.05 118.94 120.76 1fk9 s TRP 252 Ca 0.13 0.38 -0.03 0.00 0.02 0.00 0.00 56.10 56.60 1fk9 s TRP 252 Cb -0.22 -2.42 -0.04 0.00 -1.15 0.00 0.00 33.47 29.65 1fk9 s TRP 252 CO -0.05 -0.03 0.66 -0.08 0.02 0.00 0.00 176.95 177.47 1fk9 s THR 253 N 1.38 5.00 0.25 2.01 -1.32 -1.26 -1.43 115.64 120.27 1fk9 s THR 253 Ca 0.13 -0.10 -0.04 0.00 -1.21 0.00 0.00 61.69 60.47 1fk9 s THR 253 Cb -0.15 -3.85 0.23 0.00 -1.51 0.00 0.00 72.50 67.22 1fk9 s THR 253 CO 0.07 -0.68 1.70 0.58 -2.21 0.00 0.00 174.62 174.08 1fk9 h VAL 254 N 0.56 0.56 -0.20 5.08 2.07 0.58 0.11 116.25 125.00 1fk9 h VAL 254 Ca -0.48 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 66.93 1fk9 h VAL 254 Cb 1.21 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1fk9 h VAL 254 CO 0.62 0.06 0.11 -1.13 0.02 0.00 0.00 177.57 177.25 1fk9 h ASN 255 N 0.34 0.17 -0.23 0.57 -0.73 -0.78 -1.36 115.58 113.57 1fk9 h ASN 255 Ca 0.43 0.00 0.06 0.00 1.87 0.00 0.00 56.30 58.66 1fk9 h ASN 255 Cb 0.71 -0.03 -0.07 0.00 0.27 0.00 0.00 38.32 39.20 1fk9 h ASN 255 CO -0.47 0.13 -0.34 0.44 -0.37 0.00 0.00 177.43 176.82 1fk9 h ASP 256 N 0.23 -1.08 -0.60 1.15 3.45 -1.11 -1.65 116.42 116.81 1fk9 h ASP 256 Ca 0.08 0.17 0.07 0.00 0.43 0.00 0.00 57.03 57.78 1fk9 h ASP 256 Cb 0.00 0.47 -0.06 0.00 -0.56 0.00 0.00 39.33 39.18 1fk9 h ASP 256 CO -0.04 -0.35 0.27 0.40 -1.57 0.00 0.00 179.24 177.95 1fk9 h ILE 257 N -0.35 0.86 -0.76 0.35 2.04 -0.77 -1.07 117.51 117.81 1fk9 h ILE 257 Ca 0.12 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.85 1fk9 h ILE 257 Cb 0.55 0.32 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 1fk9 h ILE 257 CO -0.43 0.09 0.47 1.56 0.00 0.00 0.00 178.15 179.85 1fk9 h GLN 258 N 0.50 0.87 -0.32 2.37 4.20 -0.47 0.19 115.11 122.45 1fk9 h GLN 258 Ca 0.29 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.82 1fk9 h GLN 258 Cb 0.28 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1fk9 h GLN 258 CO -0.24 0.58 -0.31 0.87 -0.67 0.00 0.00 178.83 179.06 1fk9 h LYS 259 N 0.90 0.68 0.40 1.46 1.79 -0.78 -0.11 116.57 120.91 1fk9 h LYS 259 Ca 0.32 -0.31 -0.02 0.00 -2.18 0.00 0.00 60.65 58.46 1fk9 h LYS 259 Cb 0.08 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1fk9 h LYS 259 CO -0.14 0.91 -0.19 1.25 -1.08 0.00 0.00 179.45 180.20 1fk9 h LEU 260 N 0.58 -0.45 -0.31 2.94 5.85 -0.57 0.11 115.31 123.46 1fk9 h LEU 260 Ca 0.07 -0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.82 1fk9 h LEU 260 Cb 0.82 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.91 1fk9 h LEU 260 CO 0.07 -0.28 -0.02 0.58 -0.34 0.00 0.00 178.44 178.45 1fk9 h VAL 261 N -0.59 0.75 -0.32 1.05 2.07 -0.89 0.38 116.25 118.70 1fk9 h VAL 261 Ca -0.05 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.51 1fk9 h VAL 261 Cb 0.44 0.68 -0.07 0.00 -1.52 0.00 0.00 31.29 30.82 1fk9 h VAL 261 CO 0.09 0.01 -0.16 1.23 0.02 0.00 0.00 177.57 178.76 1fk9 h GLY 262 N 0.06 0.09 0.96 2.17 0.00 -0.76 0.12 103.07 105.71 1fk9 h GLY 262 Ca 0.15 0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.67 1fk9 h GLY 262 CO -0.27 -0.17 -0.05 0.50 0.00 0.00 0.00 176.54 176.54 1fk9 h LYS 263 N -0.11 -0.15 -1.01 4.80 1.57 -0.09 -2.16 116.57 119.43 1fk9 h LYS 263 Ca 0.16 0.01 0.25 0.00 -1.87 0.00 0.00 60.65 59.21 1fk9 h LYS 263 Cb 0.36 0.03 -0.12 0.00 0.08 0.00 0.00 32.23 32.58 1fk9 h LYS 263 CO -0.39 -0.06 0.60 -0.07 -0.57 0.00 0.00 179.45 178.96 1fk9 h LEU 264 N -0.20 0.65 0.12 2.94 4.07 0.46 -1.62 115.31 121.73 1fk9 h LEU 264 Ca -0.02 0.14 -0.01 0.00 0.08 0.00 0.00 57.88 58.07 1fk9 h LEU 264 Cb 0.16 0.04 0.00 0.00 1.08 0.00 0.00 40.66 41.93 1fk9 h LEU 264 CO 0.03 0.09 -0.06 0.78 -1.08 0.00 0.00 178.44 178.20 1fk9 h ASN 265 N 0.55 -0.13 0.00 -0.43 2.35 -0.32 -2.78 115.58 114.82 1fk9 h ASN 265 Ca 0.65 -0.27 0.00 0.00 -0.55 0.00 0.00 56.30 56.13 1fk9 h ASN 265 Cb 1.28 0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.68 1fk9 h ASN 265 CO -0.47 0.21 0.37 -0.25 -1.65 0.00 0.00 177.43 175.64 1fk9 h TRP 266 N -0.50 0.00 0.03 1.19 2.91 -0.68 -0.59 115.95 118.31 1fk9 h TRP 266 Ca -0.02 0.00 -0.27 0.00 1.13 0.00 0.00 58.89 59.73 1fk9 h TRP 266 Cb 0.40 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 29.02 1fk9 h TRP 266 CO 0.03 0.00 -1.44 0.00 -1.03 0.00 0.00 178.44 176.00 1fk9 h ALA 267 N 1.23 0.52 -0.20 2.65 0.00 -1.20 -3.36 119.26 118.90 1fk9 h ALA 267 Ca 0.00 -1.21 0.06 0.00 0.00 0.00 0.00 54.91 53.76 1fk9 h ALA 267 Cb 0.74 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1fk9 h ALA 267 CO 0.00 1.37 0.40 0.77 0.00 0.00 0.00 179.25 181.79 1fk9 h SER 268 N 0.02 0.00 0.38 0.00 0.02 -1.03 0.23 113.55 113.16 1fk9 h SER 268 Ca -0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1fk9 h SER 268 Cb 1.93 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.47 1fk9 h SER 268 CO 0.11 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.80 1fk9 n GLN 269 N -3.27 0.11 0.00 3.45 10.64 -1.26 -3.23 117.38 123.83 1fk9 n GLN 269 Ca 0.02 0.20 0.00 0.00 -1.83 0.00 0.00 57.00 55.39 1fk9 n GLN 269 Cb 0.51 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.39 1fk9 n GLN 269 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.06 176.74 1fk9 n ILE 270 N -1.38 0.00 -2.91 -0.39 0.13 -0.06 -2.26 119.36 112.48 1fk9 n ILE 270 Ca 0.05 0.00 -0.43 0.00 -1.10 0.00 0.00 62.75 61.27 1fk9 n ILE 270 Cb 0.14 -0.22 -0.05 0.00 -0.84 0.00 0.00 39.64 38.68 1fk9 n ILE 270 CO 0.00 0.00 0.00 -0.31 2.80 0.00 0.00 176.55 179.04 1fk9 s TYR 271 N -1.43 2.98 0.18 9.51 2.02 0.61 -4.77 117.35 126.46 1fk9 s TYR 271 Ca 0.00 0.27 -0.24 0.00 -0.37 0.00 0.00 57.07 56.73 1fk9 s TYR 271 Cb 0.00 -3.75 -0.08 0.00 -0.40 0.00 0.00 41.96 37.73 1fk9 s TYR 271 CO 0.00 -1.01 0.76 -1.25 -1.57 0.00 0.00 175.55 172.48 1fk9 s PRO 272 N 3.44 4.48 0.00 -1.71 0.04 -1.26 -3.92 135.00 136.06 1fk9 s PRO 272 Ca 0.32 1.08 0.00 0.00 0.04 0.00 0.00 61.00 62.44 1fk9 s PRO 272 Cb -0.11 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1fk9 s PRO 272 CO 0.24 0.52 0.00 0.41 0.04 0.00 0.00 177.00 178.21 1fk9 n GLY 273 N 1.36 1.72 3.71 0.56 0.00 -1.26 -5.06 105.19 106.22 1fk9 n GLY 273 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1fk9 n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fk9 s ILE 274 N -2.30 2.43 0.04 -0.61 -1.09 -1.25 -4.93 121.20 113.48 1fk9 s ILE 274 Ca 0.00 0.20 0.05 0.00 -2.23 0.00 0.00 60.65 58.67 1fk9 s ILE 274 Cb 0.00 -3.13 -0.02 0.00 -1.58 0.00 0.00 42.46 37.73 1fk9 s ILE 274 CO 0.00 0.01 -0.16 -0.54 -1.23 0.00 0.00 174.94 173.02 1fk9 s LYS 275 N 1.73 1.05 0.00 2.79 1.02 -1.26 -5.00 119.74 120.07 1fk9 s LYS 275 Ca 0.75 -0.78 0.00 0.00 0.02 0.00 0.00 55.97 55.96 1fk9 s LYS 275 Cb -0.46 -1.08 0.00 0.00 -0.52 0.00 0.00 37.83 35.77 1fk9 s LYS 275 CO 0.33 0.27 0.12 0.28 -0.92 0.00 0.00 175.35 175.43 1fk9 n VAL 276 N 1.94 0.00 -0.38 3.17 0.31 -1.26 -4.88 118.33 117.23 1fk9 n VAL 276 Ca -0.18 -0.17 -0.06 0.00 -0.01 0.00 0.00 64.34 63.93 1fk9 n VAL 276 Cb 0.54 1.48 -0.02 0.00 -0.91 0.00 0.00 33.84 34.93 1fk9 n VAL 276 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1fk9 h ARG 277 N 0.00 -0.02 -0.28 5.55 2.43 -2.02 -2.27 114.38 117.78 1fk9 h ARG 277 Ca 0.00 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 1fk9 h ARG 277 Cb 0.24 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1fk9 h ARG 277 CO 0.00 -0.01 -0.40 1.96 -1.51 0.00 0.00 179.97 180.01 1fk9 h GLN 278 N -0.02 0.66 -1.59 0.20 1.08 -1.91 -2.15 115.11 111.37 1fk9 h GLN 278 Ca 0.26 -0.34 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 1fk9 h GLN 278 Cb 0.52 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 1fk9 h GLN 278 CO -0.95 0.95 0.00 1.28 -0.95 0.00 0.00 178.83 179.16 1fk9 n LEU 279 N -4.03 2.13 0.00 1.46 4.32 -0.85 -3.41 117.00 116.61 1fk9 n LEU 279 Ca -0.02 -1.02 0.00 0.00 -0.02 0.00 0.00 56.01 54.95 1fk9 n LEU 279 Cb 0.53 -0.39 0.00 0.00 -1.62 0.00 0.00 43.42 41.93 1fk9 n LEU 279 CO 0.46 0.37 0.00 0.29 -1.22 0.00 0.00 177.39 177.29 1fk9 n LYS 281 N 1.00 0.00 0.32 3.23 5.02 -0.81 -4.22 118.16 122.70 1fk9 n LYS 281 Ca 0.00 0.00 0.21 0.00 -2.02 0.00 0.00 58.31 56.50 1fk9 n LYS 281 Cb 0.29 0.00 1.06 0.00 -0.02 0.00 0.00 35.03 36.35 1fk9 n LYS 281 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1fk9 h LEU 282 N 0.00 0.00 0.00 -0.35 4.07 -1.87 -2.68 115.31 114.48 1fk9 h LEU 282 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1fk9 h LEU 282 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1fk9 h LEU 282 CO 0.00 0.01 0.00 0.18 -1.08 0.00 0.00 178.44 177.55 1fk9 n LEU 283 N -3.14 0.00 -4.71 1.67 7.99 -1.26 -4.78 117.00 112.77 1fk9 n LEU 283 Ca -0.02 0.35 -0.43 0.00 -0.01 0.00 0.00 56.01 55.91 1fk9 n LEU 283 Cb 0.14 -0.35 -0.03 0.00 -0.11 0.00 0.00 43.42 43.06 1fk9 n LEU 283 CO 0.23 -0.02 1.39 0.54 -1.51 0.00 0.00 177.39 178.02 1fk9 n ARG 284 N -1.35 2.74 -0.19 3.23 1.74 -1.01 -2.76 116.66 119.05 1fk9 n ARG 284 Ca 0.12 0.99 0.00 0.00 -0.77 0.00 0.00 57.85 58.18 1fk9 n ARG 284 Cb 0.26 -2.84 0.00 0.00 -1.02 0.00 0.00 32.46 28.86 1fk9 n ARG 284 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fk9 n GLY 285 N 4.01 1.40 3.43 -0.13 0.00 -1.26 -4.97 105.19 107.68 1fk9 n GLY 285 Ca 0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.73 1fk9 n GLY 285 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fk9 n THR 286 N -2.00 1.83 0.11 2.61 -2.24 -1.11 -4.94 114.28 108.54 1fk9 n THR 286 Ca 0.00 -0.50 0.03 0.00 -2.27 0.00 0.00 64.05 61.31 1fk9 n THR 286 Cb 0.00 -0.26 0.05 0.00 -2.10 0.00 0.00 70.33 68.03 1fk9 n THR 286 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1fk9 n LYS 287 N 0.94 1.22 -3.65 -0.78 2.85 -1.26 -5.03 118.16 112.44 1fk9 n LYS 287 Ca 0.15 -1.30 -0.01 0.00 -1.05 0.00 0.00 58.31 56.10 1fk9 n LYS 287 Cb 0.29 -1.14 -0.07 0.00 -0.65 0.00 0.00 35.03 33.47 1fk9 n LYS 287 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1fk9 s ALA 288 N -0.74 -2.36 0.50 0.58 0.00 -1.26 -4.99 121.76 113.48 1fk9 s ALA 288 Ca 0.10 1.72 0.23 0.00 0.00 0.00 0.00 51.96 54.01 1fk9 s ALA 288 Cb 0.06 -1.87 1.26 0.00 0.00 0.00 0.00 23.12 22.57 1fk9 s ALA 288 CO 0.09 -0.13 1.68 -0.07 0.00 0.00 0.00 175.76 177.33 1fk9 h LEU 289 N 3.46 0.00 -3.08 0.00 4.07 -1.96 0.24 115.31 118.04 1fk9 h LEU 289 Ca -0.27 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.69 1fk9 h LEU 289 Cb 1.19 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.93 1fk9 h LEU 289 CO 0.20 0.00 0.00 0.35 -1.08 0.00 0.00 178.44 177.91 1fk9 n THR 290 N -2.64 1.70 -2.86 0.22 -2.24 -1.26 -0.10 114.28 107.09 1fk9 n THR 290 Ca -0.02 -1.22 -0.37 0.00 -2.27 0.00 0.00 64.05 60.17 1fk9 n THR 290 Cb 0.42 0.18 -0.06 0.00 -2.10 0.00 0.00 70.33 68.76 1fk9 n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1fk9 s GLU 291 N -1.75 4.54 -0.18 -0.78 2.12 0.84 -4.78 118.70 118.71 1fk9 s GLU 291 Ca 0.47 1.23 -0.10 0.00 0.36 0.00 0.00 54.97 56.92 1fk9 s GLU 291 Cb 0.30 -2.90 -0.05 0.00 0.26 0.00 0.00 34.13 31.74 1fk9 s GLU 291 CO 0.23 0.35 0.17 0.08 -0.54 0.00 0.00 175.26 175.55 1fk9 s VAL 292 N -1.52 5.40 -0.21 3.70 1.01 -1.26 0.87 120.40 128.40 1fk9 s VAL 292 Ca 0.47 0.27 -0.01 0.00 0.00 0.00 0.00 61.98 62.70 1fk9 s VAL 292 Cb -0.19 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 32.70 1fk9 s VAL 292 CO 0.24 0.46 -0.12 -0.63 0.00 0.00 0.00 175.10 175.05 1fk9 s ILE 293 N 0.17 2.66 0.30 2.22 -1.09 -0.51 -4.96 121.20 119.99 1fk9 s ILE 293 Ca 0.11 -0.79 -0.29 0.00 -2.23 0.00 0.00 60.65 57.44 1fk9 s ILE 293 Cb -0.12 -2.20 -0.10 0.00 -1.58 0.00 0.00 42.46 38.47 1fk9 s ILE 293 CO 0.00 0.44 1.17 -2.16 -1.23 0.00 0.00 174.94 173.17 1fk9 s PRO 294 N 1.36 4.52 0.02 2.79 0.04 -1.26 -4.47 135.00 138.01 1fk9 s PRO 294 Ca 0.04 1.95 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 1fk9 s PRO 294 Cb -0.14 -3.13 -0.06 0.00 0.04 0.00 0.00 34.50 31.21 1fk9 s PRO 294 CO -0.08 0.06 1.43 -0.51 0.04 0.00 0.00 177.00 177.93 1fk9 s LEU 295 N -1.60 4.33 1.11 -3.56 1.43 -1.26 -5.00 118.68 114.12 1fk9 s LEU 295 Ca 0.46 2.18 -0.13 0.00 -1.03 0.00 0.00 54.13 55.61 1fk9 s LEU 295 Cb -0.35 -3.56 0.25 0.00 0.03 0.00 0.00 46.19 42.56 1fk9 s LEU 295 CO 0.45 -0.73 1.06 0.42 0.23 0.00 0.00 176.35 177.78 1fk9 s THR 296 N 2.26 1.94 0.17 5.49 -4.23 -1.26 -4.76 115.64 115.25 1fk9 s THR 296 Ca 0.65 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 61.44 1fk9 s THR 296 Cb -0.33 -2.31 0.29 0.00 1.34 0.00 0.00 72.50 71.49 1fk9 s THR 296 CO 0.28 0.00 1.91 -0.08 -0.54 0.00 0.00 174.62 176.19 1fk9 h GLU 297 N -2.33 0.00 0.21 3.99 4.81 -2.00 -2.04 114.58 117.22 1fk9 h GLU 297 Ca -0.57 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.34 1fk9 h GLU 297 Cb 1.33 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.74 1fk9 h GLU 297 CO 0.53 0.14 -1.40 0.93 -0.73 0.00 0.00 179.01 178.48 1fk9 h GLU 298 N 0.00 0.45 -0.50 1.92 3.07 -1.97 -3.09 114.58 114.45 1fk9 h GLU 298 Ca -0.00 -0.76 -0.11 0.00 -0.50 0.00 0.00 59.36 57.99 1fk9 h GLU 298 Cb 0.61 0.28 -0.02 0.00 -0.84 0.00 0.00 28.75 28.79 1fk9 h GLU 298 CO 0.02 1.36 -0.12 0.00 -1.40 0.00 0.00 179.01 178.87 1fk9 h ALA 299 N 0.31 0.85 -0.63 3.43 0.00 -1.78 -0.77 119.26 120.68 1fk9 h ALA 299 Ca -0.21 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.30 1fk9 h ALA 299 Cb 2.10 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.68 1fk9 h ALA 299 CO 0.25 0.65 0.21 0.93 0.00 0.00 0.00 179.25 181.29 1fk9 h GLU 300 N 0.83 0.97 -0.64 0.00 4.39 -1.48 -0.00 114.58 118.64 1fk9 h GLU 300 Ca 0.13 -0.20 -0.06 0.00 0.34 0.00 0.00 59.36 59.57 1fk9 h GLU 300 Cb 0.66 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.14 1fk9 h GLU 300 CO 0.05 0.84 0.18 1.25 -1.16 0.00 0.00 179.01 180.17 1fk9 h LEU 301 N 0.89 0.96 0.44 1.33 5.85 -1.42 -0.74 115.31 122.63 1fk9 h LEU 301 Ca 0.20 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1fk9 h LEU 301 Cb 0.27 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1fk9 h LEU 301 CO -0.01 0.93 -0.21 -0.08 -0.34 0.00 0.00 178.44 178.73 1fk9 h GLU 302 N 0.94 -0.57 -0.15 1.25 4.81 -0.81 -1.22 114.58 118.83 1fk9 h GLU 302 Ca 0.20 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.52 1fk9 h GLU 302 Cb 0.33 0.13 -0.07 0.00 0.63 0.00 0.00 28.75 29.77 1fk9 h GLU 302 CO -0.00 -0.29 -0.41 1.25 -0.73 0.00 0.00 179.01 178.83 1fk9 h LEU 303 N -0.80 -1.29 -0.71 1.64 6.46 -0.91 0.11 115.31 119.81 1fk9 h LEU 303 Ca -0.06 0.17 0.16 0.00 -0.12 0.00 0.00 57.88 58.03 1fk9 h LEU 303 Cb 0.55 0.53 -0.12 0.00 -0.73 0.00 0.00 40.66 40.89 1fk9 h LEU 303 CO 0.10 -0.42 0.01 0.00 -0.62 0.00 0.00 178.44 177.51 1fk9 h ALA 304 N 0.17 0.72 -0.41 1.25 0.00 -1.09 0.54 119.26 120.43 1fk9 h ALA 304 Ca 0.08 0.22 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1fk9 h ALA 304 Cb 0.62 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1fk9 h ALA 304 CO -0.40 -0.41 0.05 0.93 0.00 0.00 0.00 179.25 179.42 1fk9 h GLU 305 N 0.11 0.62 -0.06 0.00 5.08 0.11 -1.66 114.58 118.79 1fk9 h GLU 305 Ca 0.38 -0.13 -0.15 0.00 -1.00 0.00 0.00 59.36 58.46 1fk9 h GLU 305 Cb 0.65 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.81 1fk9 h GLU 305 CO -0.61 0.61 -0.56 -0.91 -1.00 0.00 0.00 179.01 176.54 1fk9 h ASN 306 N 0.60 0.59 -0.44 1.42 2.35 0.17 -1.79 115.58 118.48 1fk9 h ASN 306 Ca 0.13 -0.69 0.08 0.00 -0.55 0.00 0.00 56.30 55.27 1fk9 h ASN 306 Cb 0.30 -0.18 -0.10 0.00 0.05 0.00 0.00 38.32 38.40 1fk9 h ASN 306 CO 0.00 1.19 -0.34 0.03 -1.65 0.00 0.00 177.43 176.67 1fk9 h ARG 307 N 0.03 -0.23 0.09 0.81 3.08 0.29 0.47 114.38 118.93 1fk9 h ARG 307 Ca -0.05 0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.03 1fk9 h ARG 307 Cb 1.23 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.30 1fk9 h ARG 307 CO 0.11 -0.15 -0.25 0.93 -1.07 0.00 0.00 179.97 179.54 1fk9 h GLU 308 N -0.24 -0.43 -0.47 0.04 4.39 -1.32 0.79 114.58 117.35 1fk9 h GLU 308 Ca 0.18 0.03 0.08 0.00 0.34 0.00 0.00 59.36 59.99 1fk9 h GLU 308 Cb 0.54 0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.23 1fk9 h GLU 308 CO -0.57 -0.28 0.10 0.82 -1.16 0.00 0.00 179.01 177.91 1fk9 h ILE 309 N -0.44 0.75 -0.12 3.13 2.04 -0.35 -1.61 117.51 120.90 1fk9 h ILE 309 Ca 0.04 -0.08 -0.10 0.00 1.00 0.00 0.00 64.86 65.71 1fk9 h ILE 309 Cb 0.48 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1fk9 h ILE 309 CO -0.16 0.04 -0.37 -0.07 0.00 0.00 0.00 178.15 177.59 1fk9 h LEU 310 N 0.24 0.26 -0.82 1.44 3.38 0.38 -3.22 115.31 116.96 1fk9 h LEU 310 Ca 0.23 -0.10 0.19 0.00 0.09 0.00 0.00 57.88 58.29 1fk9 h LEU 310 Cb 0.30 -0.07 -0.12 0.00 0.09 0.00 0.00 40.66 40.86 1fk9 h LEU 310 CO -0.30 0.62 0.29 0.50 0.09 0.00 0.00 178.44 179.64 1fk9 h LYS 311 N 0.21 0.34 -4.92 1.13 3.11 0.16 -3.38 116.57 113.23 1fk9 h LYS 311 Ca 0.02 -0.02 -0.64 0.00 -2.81 0.00 0.00 60.65 57.20 1fk9 h LYS 311 Cb 0.76 -0.08 -0.17 0.00 -1.00 0.00 0.00 32.23 31.74 1fk9 h LYS 311 CO 0.06 0.23 -0.51 -1.83 -2.81 0.00 0.00 179.45 174.59 1fk9 s GLU 312 N -5.97 3.96 0.34 1.90 -1.05 -1.21 -5.06 118.70 111.61 1fk9 s GLU 312 Ca -0.12 -0.31 -0.28 0.00 -0.15 0.00 0.00 54.97 54.11 1fk9 s GLU 312 Cb 0.23 -3.65 -0.12 0.00 -0.44 0.00 0.00 34.13 30.15 1fk9 s GLU 312 CO 0.77 -0.16 1.39 -2.30 0.95 0.00 0.00 175.26 175.90 1fk9 n PRO 313 N 5.00 2.33 -4.53 -4.83 -0.02 -1.26 -4.97 135.00 126.72 1fk9 n PRO 313 Ca -0.14 0.82 -0.25 0.00 -2.02 0.00 0.00 63.50 61.91 1fk9 n PRO 313 Cb 0.52 -2.47 -0.11 0.00 -0.02 0.00 0.00 33.50 31.42 1fk9 n PRO 313 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1fk9 s VAL 314 N -0.90 1.84 -0.11 -1.45 0.11 -1.26 -5.16 120.40 113.48 1fk9 s VAL 314 Ca 0.57 -2.08 -0.18 0.00 -2.93 0.00 0.00 61.98 57.35 1fk9 s VAL 314 Cb -0.54 -2.75 0.04 0.00 -1.53 0.00 0.00 36.38 31.60 1fk9 s VAL 314 CO 0.60 -0.12 0.46 -1.38 -3.33 0.00 0.00 175.10 171.33 1fk9 s HIS 315 N -2.85 -0.44 0.13 1.54 -3.43 -1.26 -4.76 115.29 104.21 1fk9 s HIS 315 Ca 0.33 0.95 -0.12 0.00 -0.80 0.00 0.00 55.06 55.43 1fk9 s HIS 315 Cb 0.06 0.19 -0.07 0.00 -1.43 0.00 0.00 32.58 31.34 1fk9 s HIS 315 CO 0.16 -0.35 0.49 0.20 -2.00 0.00 0.00 174.74 173.24 1fk9 s GLY 316 N -0.45 2.39 0.31 -1.38 0.00 0.97 -4.82 107.32 104.34 1fk9 s GLY 316 Ca -0.06 -0.25 0.02 0.00 0.00 0.00 0.00 44.72 44.44 1fk9 s GLY 316 CO 0.03 -0.01 0.48 0.54 0.00 0.00 0.00 173.10 174.14 1fk9 s VAL 317 N -1.49 5.12 0.46 1.40 0.11 -0.55 -0.38 120.40 125.07 1fk9 s VAL 317 Ca 0.37 -0.66 -0.01 0.00 -2.93 0.00 0.00 61.98 58.75 1fk9 s VAL 317 Cb -0.14 -3.85 -0.01 0.00 -1.53 0.00 0.00 36.38 30.85 1fk9 s VAL 317 CO 0.19 -0.47 0.70 -0.31 -3.33 0.00 0.00 175.10 171.88 1fk9 s TYR 318 N -2.20 3.29 0.23 1.54 2.02 -1.26 -4.43 117.35 116.54 1fk9 s TYR 318 Ca 0.38 0.36 -0.31 0.00 -0.37 0.00 0.00 57.07 57.13 1fk9 s TYR 318 Cb -0.09 -2.32 -0.10 0.00 -0.40 0.00 0.00 41.96 39.04 1fk9 s TYR 318 CO 0.33 -0.36 1.54 -0.47 -1.57 0.00 0.00 175.55 175.02 1fk9 s TYR 319 N -2.61 2.97 -0.49 2.71 6.04 0.15 -4.72 117.35 121.40 1fk9 s TYR 319 Ca 0.48 0.79 0.04 0.00 0.04 0.00 0.00 57.07 58.42 1fk9 s TYR 319 Cb -0.10 -3.93 0.13 0.00 -1.04 0.00 0.00 41.96 37.01 1fk9 s TYR 319 CO 0.39 -3.23 0.23 0.34 -1.54 0.00 0.00 175.55 171.74 1fk9 s ASP 320 N 0.70 4.34 0.48 4.32 3.68 -1.26 -3.94 116.67 125.00 1fk9 s ASP 320 Ca 0.65 -2.86 0.38 0.00 2.13 0.00 0.00 52.55 52.85 1fk9 s ASP 320 Cb -0.44 -1.60 1.56 0.00 -1.45 0.00 0.00 42.92 40.99 1fk9 s ASP 320 CO 0.40 -0.26 1.60 -0.65 0.13 0.00 0.00 175.17 176.39 1fk9 h PRO 321 N 6.68 0.03 -0.55 4.34 0.11 -1.98 -0.33 132.00 140.30 1fk9 h PRO 321 Ca -0.07 -0.00 0.11 0.00 0.11 0.00 0.00 66.00 66.15 1fk9 h PRO 321 Cb 0.91 -0.01 -0.10 0.00 0.11 0.00 0.00 31.00 31.92 1fk9 h PRO 321 CO 0.65 0.02 -0.05 0.77 -0.21 0.00 0.00 178.00 179.18 1fk9 h SER 322 N 0.03 -0.34 -2.30 -2.05 0.02 -2.03 -3.44 113.55 103.44 1fk9 h SER 322 Ca 0.87 0.15 -0.45 0.00 -0.84 0.00 0.00 61.79 61.53 1fk9 h SER 322 Cb 3.06 0.28 0.02 0.00 0.14 0.00 0.00 62.40 65.90 1fk9 h SER 322 CO -0.29 -0.13 -0.17 -0.54 -1.14 0.00 0.00 176.83 174.56 1fk9 s LYS 323 N -6.18 2.96 0.64 3.45 1.02 -0.13 -5.11 119.74 116.38 1fk9 s LYS 323 Ca -0.14 -0.77 -0.11 0.00 0.02 0.00 0.00 55.97 54.97 1fk9 s LYS 323 Cb 0.17 -2.64 -0.03 0.00 -0.52 0.00 0.00 37.83 34.82 1fk9 s LYS 323 CO 0.73 -0.26 1.04 -0.51 -0.92 0.00 0.00 175.35 175.43 1fk9 s ASP 324 N -4.26 5.98 -0.16 2.83 1.01 -1.26 -4.91 116.67 115.91 1fk9 s ASP 324 Ca 0.50 1.50 -0.06 0.00 0.71 0.00 0.00 52.55 55.19 1fk9 s ASP 324 Cb -0.10 -2.48 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 1fk9 s ASP 324 CO 0.35 -1.04 0.07 -0.76 0.21 0.00 0.00 175.17 174.01 1fk9 s LEU 325 N -5.21 3.89 -0.04 1.23 1.43 -1.26 -4.16 118.68 114.56 1fk9 s LEU 325 Ca 0.56 0.16 0.06 0.00 -1.03 0.00 0.00 54.13 53.88 1fk9 s LEU 325 Cb -0.12 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.13 1fk9 s LEU 325 CO 0.52 0.25 -0.21 -0.63 0.23 0.00 0.00 176.35 176.52 1fk9 s ILE 326 N -0.09 1.69 -0.09 -0.59 -1.09 0.19 -0.86 121.20 120.36 1fk9 s ILE 326 Ca 0.07 -0.88 0.05 0.00 -2.23 0.00 0.00 60.65 57.65 1fk9 s ILE 326 Cb -0.12 -1.43 -0.00 0.00 -1.58 0.00 0.00 42.46 39.33 1fk9 s ILE 326 CO 0.01 0.48 -0.24 0.00 -1.23 0.00 0.00 174.94 173.96 1fk9 s ALA 327 N -0.22 2.19 -0.04 9.38 0.00 -0.09 -0.64 121.76 132.33 1fk9 s ALA 327 Ca 0.01 -1.00 0.07 0.00 0.00 0.00 0.00 51.96 51.04 1fk9 s ALA 327 Cb -0.11 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 1fk9 s ALA 327 CO 0.01 0.34 -0.25 -2.00 0.00 0.00 0.00 175.76 173.86 1fk9 s GLU 328 N 0.15 2.29 -0.05 0.00 2.12 0.22 -0.94 118.70 122.49 1fk9 s GLU 328 Ca -0.13 -0.89 0.04 0.00 0.36 0.00 0.00 54.97 54.36 1fk9 s GLU 328 Cb -0.16 -2.04 -0.00 0.00 0.26 0.00 0.00 34.13 32.18 1fk9 s GLU 328 CO 0.07 0.44 -0.17 0.42 -0.54 0.00 0.00 175.26 175.48 1fk9 s ILE 329 N -0.33 1.44 0.12 -3.70 1.01 -1.07 -1.40 121.20 117.26 1fk9 s ILE 329 Ca 0.02 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.99 1fk9 s ILE 329 Cb -0.12 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 1fk9 s ILE 329 CO 0.02 0.42 -0.10 -1.10 0.00 0.00 0.00 174.94 174.17 1fk9 s GLN 330 N 0.08 0.94 -0.22 2.79 1.11 0.14 -4.15 119.66 120.35 1fk9 s GLN 330 Ca -0.05 -1.31 -0.10 0.00 0.01 0.00 0.00 55.36 53.92 1fk9 s GLN 330 Cb -0.12 -0.55 -0.05 0.00 -1.01 0.00 0.00 33.01 31.28 1fk9 s GLN 330 CO 0.02 0.07 0.14 0.21 0.01 0.00 0.00 175.29 175.75 1fk9 s LYS 331 N -3.31 4.08 -0.47 2.91 2.20 -1.26 -0.46 119.74 123.43 1fk9 s LYS 331 Ca 0.11 -0.27 0.08 0.00 -0.36 0.00 0.00 55.97 55.53 1fk9 s LYS 331 Cb 0.00 -3.47 0.38 0.00 -1.51 0.00 0.00 37.83 33.23 1fk9 s LYS 331 CO -0.00 0.14 0.96 0.00 -0.36 0.00 0.00 175.35 176.09 1fk9 n GLN 332 N 4.03 2.62 0.00 4.03 10.64 0.31 -4.68 117.38 134.34 1fk9 n GLN 332 Ca -0.15 -4.28 0.00 0.00 -1.83 0.00 0.00 57.00 50.74 1fk9 n GLN 332 Cb 0.52 -2.01 0.00 0.00 -0.86 0.00 0.00 30.24 27.89 1fk9 n GLN 332 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1fk9 n GLY 333 N -0.20 3.32 3.66 2.61 0.00 -1.23 -4.68 105.19 108.65 1fk9 n GLY 333 Ca 0.29 -1.92 -0.48 0.00 0.00 0.00 0.00 46.02 43.91 1fk9 n GLY 333 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1fk9 n GLN 334 N -1.03 2.07 -1.27 1.61 7.27 -1.26 0.15 117.38 124.92 1fk9 n GLN 334 Ca 0.00 0.74 -0.09 0.00 0.07 0.00 0.00 57.00 57.71 1fk9 n GLN 334 Cb 0.00 -2.67 -0.04 0.00 2.41 0.00 0.00 30.24 29.94 1fk9 n GLN 334 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1fk9 n GLY 335 N 4.70 1.05 3.08 1.69 0.00 -1.26 -4.99 105.19 109.46 1fk9 n GLY 335 Ca 0.25 -0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 1fk9 n GLY 335 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fk9 s GLN 336 N -2.57 2.36 0.12 1.61 2.00 0.12 -4.27 119.66 119.03 1fk9 s GLN 336 Ca 0.00 -1.27 0.10 0.00 -2.00 0.00 0.00 55.36 52.19 1fk9 s GLN 336 Cb 0.00 -2.87 -0.04 0.00 0.80 0.00 0.00 33.01 30.90 1fk9 s GLN 336 CO 0.00 -0.52 -0.22 -1.58 -0.50 0.00 0.00 175.29 172.47 1fk9 s TRP 337 N 1.14 2.44 0.02 1.67 0.52 0.78 0.12 118.94 125.62 1fk9 s TRP 337 Ca -0.07 -0.31 0.02 0.00 0.02 0.00 0.00 56.10 55.76 1fk9 s TRP 337 Cb -0.19 -1.31 -0.01 0.00 -1.15 0.00 0.00 33.47 30.81 1fk9 s TRP 337 CO -0.06 0.36 -0.07 0.95 0.02 0.00 0.00 176.95 178.15 1fk9 s THR 338 N -1.10 0.51 0.17 2.01 -4.23 0.39 -0.76 115.64 112.64 1fk9 s THR 338 Ca 0.16 -0.69 -0.09 0.00 -1.18 0.00 0.00 61.69 59.89 1fk9 s THR 338 Cb -0.10 -0.51 -0.01 0.00 1.34 0.00 0.00 72.50 73.22 1fk9 s THR 338 CO 0.08 -0.14 0.30 -0.72 -0.54 0.00 0.00 174.62 173.61 1fk9 s TYR 339 N -0.78 0.38 -0.09 3.99 -0.85 0.43 0.25 117.35 120.69 1fk9 s TYR 339 Ca -0.04 -0.74 -0.12 0.00 -0.52 0.00 0.00 57.07 55.65 1fk9 s TYR 339 Cb -0.06 -0.03 0.03 0.00 0.38 0.00 0.00 41.96 42.28 1fk9 s TYR 339 CO 0.00 -0.74 0.31 1.14 -1.52 0.00 0.00 175.55 174.73 1fk9 s GLN 340 N -3.97 0.44 -0.17 -3.49 0.00 -0.50 -0.55 119.66 111.43 1fk9 s GLN 340 Ca 0.17 0.25 0.01 0.00 -0.00 0.00 0.00 55.36 55.79 1fk9 s GLN 340 Cb 0.03 0.21 0.01 0.00 0.00 0.00 0.00 33.01 33.26 1fk9 s GLN 340 CO 0.01 -0.08 -0.18 0.42 0.00 0.00 0.00 175.29 175.46 1fk9 s ILE 341 N -0.26 2.33 0.27 3.63 1.01 0.29 -0.61 121.20 127.86 1fk9 s ILE 341 Ca -0.04 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 59.76 1fk9 s ILE 341 Cb -0.03 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 1fk9 s ILE 341 CO 0.01 0.53 0.14 -0.72 0.00 0.00 0.00 174.94 174.90 1fk9 s TYR 342 N 1.08 1.48 0.00 3.97 -0.85 0.18 -0.73 117.35 122.48 1fk9 s TYR 342 Ca -0.00 -1.35 0.00 0.00 -0.52 0.00 0.00 57.07 55.20 1fk9 s TYR 342 Cb -0.14 -0.78 0.00 0.00 0.38 0.00 0.00 41.96 41.42 1fk9 s TYR 342 CO -0.06 -0.53 0.00 1.04 -1.52 0.00 0.00 175.55 174.47 1fk9 n GLN 343 N -0.47 0.00 -4.10 -3.49 6.02 -1.25 0.57 117.38 114.65 1fk9 n GLN 343 Ca 0.02 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.66 1fk9 n GLN 343 Cb 0.65 -0.78 -0.11 0.00 1.02 0.00 0.00 30.24 31.03 1fk9 n GLN 343 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1fk9 s GLU 344 N -1.99 3.80 -0.22 -1.09 2.12 -1.26 -4.70 118.70 115.36 1fk9 s GLU 344 Ca 0.00 -0.43 -0.18 0.00 0.36 0.00 0.00 54.97 54.72 1fk9 s GLU 344 Cb 0.00 -3.12 -0.08 0.00 0.26 0.00 0.00 34.13 31.19 1fk9 s GLU 344 CO 0.00 0.18 0.90 -2.30 -0.54 0.00 0.00 175.26 173.50 1fk9 n PRO 345 N 3.79 0.00 -0.09 4.30 -0.02 -1.26 0.19 135.00 141.91 1fk9 n PRO 345 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 1fk9 n PRO 345 Cb 0.52 -0.62 0.00 0.00 -0.02 0.00 0.00 33.50 33.38 1fk9 n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1fk9 n PHE 346 N 3.19 0.00 -2.78 6.00 3.01 -1.26 -4.94 117.46 120.68 1fk9 n PHE 346 Ca 0.23 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.26 1fk9 n PHE 346 Cb -0.01 -0.26 -0.02 0.00 -0.01 0.00 0.00 39.48 39.17 1fk9 n PHE 346 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1fk9 s LYS 347 N -0.03 3.69 0.08 -1.08 1.02 0.13 -4.97 119.74 118.58 1fk9 s LYS 347 Ca 0.00 -1.67 -0.31 0.00 0.02 0.00 0.00 55.97 54.02 1fk9 s LYS 347 Cb 0.00 -5.13 -0.09 0.00 -0.52 0.00 0.00 37.83 32.09 1fk9 s LYS 347 CO 0.00 -1.96 1.71 -0.80 -0.92 0.00 0.00 175.35 173.38 1fk9 s ASN 348 N 4.03 6.55 -0.04 2.83 0.01 -1.26 -3.91 114.94 123.15 1fk9 s ASN 348 Ca 0.40 2.57 -0.04 0.00 -0.71 0.00 0.00 52.86 55.08 1fk9 s ASN 348 Cb -0.02 -2.56 -0.28 0.00 0.41 0.00 0.00 41.25 38.80 1fk9 s ASN 348 CO -0.07 -0.92 0.69 -0.07 -1.51 0.00 0.00 177.10 175.21 1fk9 h LEU 349 N 8.62 0.41 -7.00 0.60 3.38 -1.14 -1.47 115.31 118.70 1fk9 h LEU 349 Ca -0.44 -0.66 0.05 0.00 0.09 0.00 0.00 57.88 56.92 1fk9 h LEU 349 Cb 1.21 -0.13 -0.18 0.00 0.09 0.00 0.00 40.66 41.64 1fk9 h LEU 349 CO 0.94 1.57 0.43 -0.75 0.09 0.00 0.00 178.44 180.71 1fk9 s LYS 350 N -2.59 0.83 0.32 1.13 2.20 -0.92 -4.42 119.74 116.29 1fk9 s LYS 350 Ca -0.13 -0.06 0.03 0.00 -0.36 0.00 0.00 55.97 55.46 1fk9 s LYS 350 Cb 0.07 0.39 -0.01 0.00 -1.51 0.00 0.00 37.83 36.76 1fk9 s LYS 350 CO 0.83 -0.31 0.12 0.25 -0.36 0.00 0.00 175.35 175.88 1fk9 n THR 351 N 0.30 0.00 0.00 3.43 -2.24 -0.96 0.11 114.28 114.92 1fk9 n THR 351 Ca -0.12 -1.92 0.00 0.00 -2.27 0.00 0.00 64.05 59.74 1fk9 n THR 351 Cb 0.60 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 1fk9 n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fk9 n GLY 352 N -0.21 1.11 3.48 3.38 0.00 0.29 -4.32 105.19 108.92 1fk9 n GLY 352 Ca -0.04 -0.93 -0.24 0.00 0.00 0.00 0.00 46.02 44.81 1fk9 n GLY 352 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fk9 s LYS 353 N -2.00 1.68 -0.11 1.61 1.02 -1.26 -0.42 119.74 120.26 1fk9 s LYS 353 Ca 0.00 -1.80 -0.05 0.00 0.02 0.00 0.00 55.97 54.14 1fk9 s LYS 353 Cb 0.00 -1.69 0.05 0.00 -0.52 0.00 0.00 37.83 35.67 1fk9 s LYS 353 CO 0.00 0.27 0.25 -0.47 -0.92 0.00 0.00 175.35 174.48 1fk9 s TYR 354 N -2.58 -0.35 0.00 3.18 6.14 0.06 -4.96 117.35 118.84 1fk9 s TYR 354 Ca 0.30 0.83 0.00 0.00 0.64 0.00 0.00 57.07 58.84 1fk9 s TYR 354 Cb -0.03 0.03 0.00 0.00 0.42 0.00 0.00 41.96 42.39 1fk9 s TYR 354 CO 0.15 -0.26 0.06 0.00 0.64 0.00 0.00 175.55 176.14 1fk9 n ALA 355 N 4.43 0.93 -1.38 3.97 0.00 -1.26 -0.15 120.51 127.04 1fk9 n ALA 355 Ca -0.22 -0.06 -0.59 0.00 0.00 0.00 0.00 53.44 52.57 1fk9 n ALA 355 Cb 0.52 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.87 1fk9 n ALA 355 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1fk9 n ARG 356 N -0.32 0.27 -3.24 0.00 0.63 -1.26 -4.85 116.66 107.89 1fk9 n ARG 356 Ca 0.00 0.08 -0.46 0.00 -0.92 0.00 0.00 57.85 56.55 1fk9 n ARG 356 Cb 0.04 -1.72 -0.03 0.00 0.45 0.00 0.00 32.46 31.19 1fk9 n ARG 356 CO 0.00 0.00 0.00 1.41 -2.51 0.00 0.00 177.63 176.53 1fk9 s MET 357 N 5.48 3.32 -0.54 -0.14 -2.45 -1.26 -5.02 119.30 118.69 1fk9 s MET 357 Ca 1.15 -1.95 -0.24 0.00 -1.25 0.00 0.00 55.69 53.40 1fk9 s MET 357 Cb -1.35 -4.41 0.04 0.00 1.25 0.00 0.00 34.83 30.36 1fk9 s MET 357 CO 0.65 -1.40 0.92 1.03 1.05 0.00 0.00 175.02 177.27 1fk9 s ARG 358 N 1.33 3.34 0.00 4.11 0.52 -1.26 -4.87 118.95 122.12 1fk9 s ARG 358 Ca 0.14 -0.26 0.00 0.00 -0.52 0.00 0.00 55.73 55.09 1fk9 s ARG 358 Cb -0.18 -4.04 0.00 0.00 0.52 0.00 0.00 34.95 31.25 1fk9 s ARG 358 CO -0.03 -1.43 0.00 0.41 0.02 0.00 0.00 175.30 174.27 1fk9 n GLY 359 N 5.10 1.73 0.33 -3.53 0.00 -1.26 -4.77 105.19 102.79 1fk9 n GLY 359 Ca 0.02 -1.83 -0.01 0.00 0.00 0.00 0.00 46.02 44.21 1fk9 n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fk9 h ALA 360 N 0.00 1.17 -2.84 4.61 0.00 -1.98 -3.43 119.26 116.78 1fk9 h ALA 360 Ca 0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 1fk9 h ALA 360 Cb 0.00 -0.28 -0.19 0.00 0.00 0.00 0.00 17.79 17.31 1fk9 h ALA 360 CO 0.00 0.38 -0.71 -1.01 0.00 0.00 0.00 179.25 177.90 1fk9 s HIS 361 N -6.08 0.60 0.00 0.00 3.76 -1.26 -3.74 115.29 108.57 1fk9 s HIS 361 Ca -0.13 -0.65 0.00 0.00 -0.15 0.00 0.00 55.06 54.13 1fk9 s HIS 361 Cb 0.18 -0.37 0.00 0.00 1.11 0.00 0.00 32.58 33.49 1fk9 s HIS 361 CO 0.80 -0.15 0.00 0.25 -0.85 0.00 0.00 174.74 174.78 1fk9 n THR 362 N 1.05 0.00 -4.15 1.30 -2.24 -1.18 -4.98 114.28 104.08 1fk9 n THR 362 Ca -0.20 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.47 1fk9 n THR 362 Cb 0.57 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.70 1fk9 n THR 362 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1fk9 s ASN 363 N -0.14 0.17 0.50 3.42 2.20 -1.26 -0.42 114.94 119.42 1fk9 s ASN 363 Ca 0.00 -1.26 0.15 0.00 -0.94 0.00 0.00 52.86 50.81 1fk9 s ASN 363 Cb 0.00 0.37 1.21 0.00 -2.00 0.00 0.00 41.25 40.83 1fk9 s ASN 363 CO 0.00 -0.83 2.14 0.44 -2.94 0.00 0.00 177.10 175.91 1fk9 h ASP 364 N 2.66 0.07 -0.17 3.54 3.45 -1.94 -1.28 116.42 122.74 1fk9 h ASP 364 Ca -0.35 -0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.07 1fk9 h ASP 364 Cb 1.23 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 39.98 1fk9 h ASP 364 CO 0.53 0.05 -0.05 0.58 -1.57 0.00 0.00 179.24 178.78 1fk9 h VAL 365 N 0.08 1.29 -0.04 -1.35 2.07 -1.95 0.39 116.25 116.74 1fk9 h VAL 365 Ca 0.02 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 66.50 1fk9 h VAL 365 Cb -0.01 1.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1fk9 h VAL 365 CO -0.00 0.31 0.00 0.50 0.02 0.00 0.00 177.57 178.40 1fk9 h LYS 366 N 0.04 0.08 0.15 1.57 3.64 -1.91 -0.60 116.57 119.53 1fk9 h LYS 366 Ca 0.04 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1fk9 h LYS 366 Cb 0.49 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 1fk9 h LYS 366 CO 0.02 0.34 -0.16 0.37 -2.27 0.00 0.00 179.45 177.74 1fk9 h GLN 367 N -0.20 -0.34 -0.66 1.90 4.15 -1.24 0.19 115.11 118.91 1fk9 h GLN 367 Ca 0.01 0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.54 1fk9 h GLN 367 Cb 0.30 0.08 -0.07 0.00 0.21 0.00 0.00 27.48 28.01 1fk9 h GLN 367 CO 0.00 -0.23 0.32 1.25 -1.93 0.00 0.00 178.83 178.25 1fk9 h LEU 368 N -0.35 0.43 -1.39 -2.39 7.12 -0.19 0.17 115.31 118.71 1fk9 h LEU 368 Ca 0.01 0.05 -0.03 0.00 0.13 0.00 0.00 57.88 58.04 1fk9 h LEU 368 Cb 0.34 -0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.44 1fk9 h LEU 368 CO -0.05 0.26 0.04 0.74 -0.13 0.00 0.00 178.44 179.29 1fk9 h THR 369 N 0.57 1.16 0.00 1.05 2.02 -0.52 -0.76 112.91 116.43 1fk9 h THR 369 Ca 0.32 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 1fk9 h THR 369 Cb 0.31 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1fk9 h THR 369 CO -0.25 0.21 -0.21 -0.33 0.37 0.00 0.00 175.52 175.31 1fk9 h GLU 370 N 0.43 0.00 -0.03 6.66 5.08 0.22 -2.61 114.58 124.33 1fk9 h GLU 370 Ca 0.10 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.22 1fk9 h GLU 370 Cb 0.23 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.49 1fk9 h GLU 370 CO 0.00 0.21 -0.94 0.00 -1.00 0.00 0.00 179.01 177.29 1fk9 h ALA 371 N 1.79 0.28 -0.61 3.43 0.00 0.26 -2.85 119.26 121.56 1fk9 h ALA 371 Ca -0.00 -0.68 0.04 0.00 0.00 0.00 0.00 54.91 54.27 1fk9 h ALA 371 Cb 0.72 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1fk9 h ALA 371 CO 0.03 0.74 0.36 0.28 0.00 0.00 0.00 179.25 180.65 1fk9 h VAL 372 N 0.36 1.03 0.14 0.00 2.07 -1.03 -1.16 116.25 117.66 1fk9 h VAL 372 Ca -0.09 -0.24 0.01 0.00 0.82 0.00 0.00 66.70 67.20 1fk9 h VAL 372 Cb 1.57 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1fk9 h VAL 372 CO 0.18 0.13 -0.16 1.56 0.02 0.00 0.00 177.57 179.29 1fk9 h GLN 373 N 0.69 -0.33 -0.13 1.57 1.08 -1.41 0.49 115.11 117.07 1fk9 h GLN 373 Ca 0.26 0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.52 1fk9 h GLN 373 Cb 0.08 0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 27.53 1fk9 h GLN 373 CO -0.13 -0.22 -0.21 -0.22 -0.95 0.00 0.00 178.83 177.10 1fk9 h LYS 374 N -0.34 -0.25 -0.66 1.46 3.64 -1.25 0.54 116.57 119.71 1fk9 h LYS 374 Ca 0.01 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.48 1fk9 h LYS 374 Cb 0.34 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.16 1fk9 h LYS 374 CO -0.06 -0.17 0.35 0.82 -2.27 0.00 0.00 179.45 178.12 1fk9 h ILE 375 N -0.26 0.93 -0.39 2.00 2.04 -0.90 -0.52 117.51 120.41 1fk9 h ILE 375 Ca 0.10 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1fk9 h ILE 375 Cb 0.41 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1fk9 h ILE 375 CO -0.28 0.12 0.21 0.74 0.00 0.00 0.00 178.15 178.93 1fk9 h THR 376 N 0.63 1.15 -0.05 -0.27 2.02 0.95 -0.44 112.91 116.90 1fk9 h THR 376 Ca 0.30 -0.39 0.01 0.00 0.77 0.00 0.00 66.41 67.10 1fk9 h THR 376 Cb 0.23 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1fk9 h THR 376 CO -0.21 0.16 0.01 0.74 0.37 0.00 0.00 175.52 176.59 1fk9 h THR 377 N 0.50 0.98 0.00 3.16 2.02 0.99 -2.10 112.91 118.46 1fk9 h THR 377 Ca 0.14 -0.01 -0.07 0.00 0.77 0.00 0.00 66.41 67.24 1fk9 h THR 377 Cb 0.06 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 1fk9 h THR 377 CO -0.02 0.01 -0.32 1.05 0.37 0.00 0.00 175.52 176.61 1fk9 h GLU 378 N 0.03 0.00 -0.05 6.66 4.11 -1.01 -2.33 114.58 121.99 1fk9 h GLU 378 Ca 0.02 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.44 1fk9 h GLU 378 Cb 0.02 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 1fk9 h GLU 378 CO -0.03 0.32 -0.01 0.77 0.07 0.00 0.00 179.01 180.13 1fk9 h SER 379 N 0.00 0.09 -0.40 3.06 0.02 -0.74 0.71 113.55 116.29 1fk9 h SER 379 Ca -0.00 -0.34 0.03 0.00 -0.84 0.00 0.00 61.79 60.63 1fk9 h SER 379 Cb 0.77 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 1fk9 h SER 379 CO 0.04 0.41 0.27 0.40 -1.14 0.00 0.00 176.83 176.81 1fk9 h ILE 380 N -0.23 1.04 -0.17 3.27 2.04 -1.26 0.42 117.51 122.62 1fk9 h ILE 380 Ca 0.01 -0.15 -0.12 0.00 1.00 0.00 0.00 64.86 65.60 1fk9 h ILE 380 Cb 0.37 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1fk9 h ILE 380 CO 0.00 0.08 -0.38 0.58 0.00 0.00 0.00 178.15 178.44 1fk9 h VAL 381 N 0.44 1.34 0.04 1.67 2.07 -1.02 -1.35 116.25 119.45 1fk9 h VAL 381 Ca 0.16 -1.63 -0.29 0.00 0.82 0.00 0.00 66.70 65.77 1fk9 h VAL 381 Cb 0.11 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 1fk9 h VAL 381 CO -0.04 0.50 -1.58 0.40 0.02 0.00 0.00 177.57 176.87 1fk9 h ILE 382 N 0.21 1.04 0.00 4.57 2.04 -0.28 -3.40 117.51 121.68 1fk9 h ILE 382 Ca 0.00 -2.80 0.00 0.00 1.00 0.00 0.00 64.86 63.06 1fk9 h ILE 382 Cb 0.98 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 39.64 1fk9 h ILE 382 CO 0.08 0.70 0.00 0.79 0.00 0.00 0.00 178.15 179.72 1fk9 n TRP 383 N -3.25 0.00 -1.00 1.37 8.01 0.14 -4.57 117.44 118.15 1fk9 n TRP 383 Ca -0.16 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.03 1fk9 n TRP 383 Cb 1.03 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.33 1fk9 n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1fk9 n GLY 384 N 0.80 0.72 3.29 6.99 0.00 -0.51 -4.96 105.19 111.52 1fk9 n GLY 384 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1fk9 n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fk9 s LYS 385 N -0.00 1.02 0.09 1.61 -2.85 -1.25 -4.87 119.74 113.49 1fk9 s LYS 385 Ca 0.00 -0.92 -0.12 0.00 -1.00 0.00 0.00 55.97 53.93 1fk9 s LYS 385 Cb 0.00 0.40 -0.06 0.00 -2.06 0.00 0.00 37.83 36.11 1fk9 s LYS 385 CO 0.00 -0.37 0.44 0.95 0.10 0.00 0.00 175.35 176.47 1fk9 s THR 386 N -3.87 5.02 0.31 3.79 -4.23 -1.26 -3.55 115.64 111.85 1fk9 s THR 386 Ca 0.07 0.60 -0.14 0.00 -1.18 0.00 0.00 61.69 61.05 1fk9 s THR 386 Cb 0.03 -3.68 -0.09 0.00 1.34 0.00 0.00 72.50 70.11 1fk9 s THR 386 CO -0.08 0.31 0.70 -2.16 -0.54 0.00 0.00 174.62 172.85 1fk9 s PRO 387 N -1.81 3.96 0.24 3.99 0.04 -1.26 -4.85 135.00 135.30 1fk9 s PRO 387 Ca 0.33 0.59 -0.30 0.00 0.04 0.00 0.00 61.00 61.67 1fk9 s PRO 387 Cb -0.15 -2.47 -0.09 0.00 0.04 0.00 0.00 34.50 31.84 1fk9 s PRO 387 CO 0.18 0.18 1.13 0.15 0.04 0.00 0.00 177.00 178.68 1fk9 s LYS 388 N -2.98 4.58 -0.05 4.56 1.02 -0.04 -4.74 119.74 122.09 1fk9 s LYS 388 Ca 0.53 1.82 -0.04 0.00 0.02 0.00 0.00 55.97 58.30 1fk9 s LYS 388 Cb -0.10 -3.22 -0.04 0.00 -0.52 0.00 0.00 37.83 33.95 1fk9 s LYS 388 CO 0.18 0.09 0.15 -0.06 -0.92 0.00 0.00 175.35 174.79 1fk9 s PHE 389 N -0.67 3.52 -0.34 3.18 0.40 -0.92 -0.91 117.98 122.24 1fk9 s PHE 389 Ca 0.48 0.39 -0.00 0.00 -0.60 0.00 0.00 56.93 57.20 1fk9 s PHE 389 Cb -0.32 -1.86 0.08 0.00 0.51 0.00 0.00 43.02 41.44 1fk9 s PHE 389 CO 0.39 0.66 0.07 0.15 0.70 0.00 0.00 175.22 177.19 1fk9 s LYS 390 N -1.56 2.03 -0.01 0.44 1.02 -0.11 -0.64 119.74 120.92 1fk9 s LYS 390 Ca 0.22 -1.61 0.03 0.00 0.02 0.00 0.00 55.97 54.62 1fk9 s LYS 390 Cb -0.12 -3.30 -0.03 0.00 -0.52 0.00 0.00 37.83 33.86 1fk9 s LYS 390 CO 0.12 -0.85 -0.07 -0.51 -0.92 0.00 0.00 175.35 173.13 1fk9 s LEU 391 N 1.11 3.16 -0.03 3.17 1.43 -0.62 -2.59 118.68 124.32 1fk9 s LEU 391 Ca 0.03 -0.12 -0.02 0.00 -1.03 0.00 0.00 54.13 52.99 1fk9 s LEU 391 Cb -0.21 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 1fk9 s LEU 391 CO -0.04 0.30 2.40 -0.81 0.23 0.00 0.00 176.35 178.43 1fk9 n PRO 392 N 1.69 1.30 -3.93 1.29 -0.04 -1.26 0.03 135.00 134.09 1fk9 n PRO 392 Ca -0.16 -0.36 -0.10 0.00 -0.04 0.00 0.00 63.50 62.84 1fk9 n PRO 392 Cb 0.53 -1.29 -0.12 0.00 -0.04 0.00 0.00 33.50 32.58 1fk9 n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1fk9 s ILE 393 N 0.07 0.07 0.14 0.52 2.07 -1.26 0.15 121.20 122.95 1fk9 s ILE 393 Ca 0.19 -0.55 -0.15 0.00 -1.41 0.00 0.00 60.65 58.72 1fk9 s ILE 393 Cb 0.10 -0.19 -0.07 0.00 0.13 0.00 0.00 42.46 42.42 1fk9 s ILE 393 CO -0.00 -0.30 0.56 -1.10 -1.91 0.00 0.00 174.94 172.18 1fk9 s GLN 394 N -0.91 4.03 0.47 3.50 -0.21 -1.26 -4.42 119.66 120.85 1fk9 s GLN 394 Ca -0.10 0.55 0.14 0.00 0.02 0.00 0.00 55.36 55.97 1fk9 s GLN 394 Cb -0.06 -2.98 1.11 0.00 1.00 0.00 0.00 33.01 32.07 1fk9 s GLN 394 CO -0.00 0.50 2.05 0.87 -2.12 0.00 0.00 175.29 176.59 1fk9 h LYS 395 N 3.73 0.27 -0.14 2.91 1.57 -1.99 -1.57 116.57 121.34 1fk9 h LYS 395 Ca -0.49 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.27 1fk9 h LYS 395 Cb 1.20 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1fk9 h LYS 395 CO 0.65 0.18 0.05 1.49 -0.57 0.00 0.00 179.45 181.25 1fk9 h GLU 396 N 0.28 0.21 -0.80 3.15 4.81 -1.99 -1.95 114.58 118.29 1fk9 h GLU 396 Ca 0.17 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1fk9 h GLU 396 Cb 0.33 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 1fk9 h GLU 396 CO -0.04 0.32 0.47 1.15 -0.73 0.00 0.00 179.01 180.19 1fk9 h THR 397 N 0.06 1.23 0.08 0.32 2.02 -1.71 -1.21 112.91 113.70 1fk9 h THR 397 Ca 0.05 -0.53 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 1fk9 h THR 397 Cb 0.19 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 1fk9 h THR 397 CO -0.00 0.24 -0.04 -0.25 0.37 0.00 0.00 175.52 175.85 1fk9 h TRP 398 N 1.11 -0.09 -0.24 3.16 7.01 -1.28 -2.58 115.95 123.04 1fk9 h TRP 398 Ca 0.29 -0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.31 1fk9 h TRP 398 Cb -0.02 0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.06 1fk9 h TRP 398 CO -0.00 0.07 0.16 0.93 -2.79 0.00 0.00 178.44 176.81 1fk9 h GLU 399 N -0.24 0.20 0.01 2.65 5.08 -1.20 0.37 114.58 121.45 1fk9 h GLU 399 Ca -0.01 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1fk9 h GLU 399 Cb 0.21 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1fk9 h GLU 399 CO 0.02 0.13 -0.01 1.15 -1.00 0.00 0.00 179.01 179.30 1fk9 h THR 400 N 0.20 1.08 -0.32 1.13 2.02 -0.84 -2.67 112.91 113.51 1fk9 h THR 400 Ca 0.10 -0.28 -0.14 0.00 0.77 0.00 0.00 66.41 66.86 1fk9 h THR 400 Cb 0.14 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 1fk9 h THR 400 CO -0.02 0.07 -0.36 -0.25 0.37 0.00 0.00 175.52 175.33 1fk9 h TRP 401 N -0.14 0.86 0.00 3.16 2.91 -1.12 -3.16 115.95 118.47 1fk9 h TRP 401 Ca -0.00 -0.24 0.00 0.00 1.13 0.00 0.00 58.89 59.77 1fk9 h TRP 401 Cb 0.13 -0.19 0.00 0.00 -0.51 0.00 0.00 29.16 28.60 1fk9 h TRP 401 CO -0.04 0.99 0.00 1.87 -1.03 0.00 0.00 178.44 180.23 1fk9 n TRP 402 N -4.05 0.00 -0.32 2.65 -0.00 0.13 -1.41 117.44 114.44 1fk9 n TRP 402 Ca -0.01 0.00 0.18 0.00 -0.00 0.00 0.00 57.50 57.67 1fk9 n TRP 402 Cb 0.51 0.00 0.38 0.00 -0.00 0.00 0.00 31.31 32.20 1fk9 n TRP 402 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 177.69 179.48 1fk9 h THR 403 N 0.00 0.29 0.48 5.87 1.35 -1.61 -2.55 112.91 116.74 1fk9 h THR 403 Ca 0.00 -0.09 -0.01 0.00 -0.55 0.00 0.00 66.41 65.76 1fk9 h THR 403 Cb 0.00 0.02 -0.01 0.00 -1.73 0.00 0.00 68.15 66.42 1fk9 h THR 403 CO 0.00 0.05 -0.38 -0.33 -0.25 0.00 0.00 175.52 174.60 1fk9 h GLU 404 N 0.25 -0.83 -6.50 4.72 5.08 -1.46 -3.43 114.58 112.41 1fk9 h GLU 404 Ca 0.64 0.06 -0.56 0.00 -1.00 0.00 0.00 59.36 58.50 1fk9 h GLU 404 Cb 1.38 0.19 0.05 0.00 0.50 0.00 0.00 28.75 30.87 1fk9 h GLU 404 CO -0.65 -0.55 1.00 0.98 -1.00 0.00 0.00 179.01 178.79 1fk9 n TYR 405 N -5.50 2.50 0.20 4.33 9.36 -0.50 -4.87 117.16 122.69 1fk9 n TYR 405 Ca -0.11 0.03 0.05 0.00 3.32 0.00 0.00 57.90 61.19 1fk9 n TYR 405 Cb 0.39 -2.66 0.25 0.00 -0.63 0.00 0.00 39.34 36.70 1fk9 n TYR 405 CO 0.00 0.00 0.00 -2.67 0.22 0.00 0.00 176.86 174.41 1fk9 n TRP 406 N 4.83 0.24 -4.18 2.98 4.27 -1.26 -4.67 117.44 119.65 1fk9 n TRP 406 Ca 0.18 0.11 -0.35 0.00 -3.89 0.00 0.00 57.50 53.55 1fk9 n TRP 406 Cb 0.33 -0.68 -0.09 0.00 -1.36 0.00 0.00 31.31 29.51 1fk9 n TRP 406 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 1fk9 s GLN 407 N -3.14 3.42 0.40 -2.67 0.74 -1.26 -5.10 119.66 112.05 1fk9 s GLN 407 Ca 0.02 -0.35 -0.24 0.00 0.05 0.00 0.00 55.36 54.84 1fk9 s GLN 407 Cb 0.05 -3.00 -0.09 0.00 1.10 0.00 0.00 33.01 31.07 1fk9 s GLN 407 CO 0.15 0.55 1.05 0.00 -0.55 0.00 0.00 175.29 176.50 1fk9 s ALA 408 N -0.44 3.08 -0.03 1.58 0.00 -1.26 -5.05 121.76 119.64 1fk9 s ALA 408 Ca 0.09 0.71 -0.29 0.00 0.00 0.00 0.00 51.96 52.47 1fk9 s ALA 408 Cb -0.12 -3.28 0.08 0.00 0.00 0.00 0.00 23.12 19.81 1fk9 s ALA 408 CO 0.02 -0.23 0.74 -0.08 0.00 0.00 0.00 175.76 176.21 1fk9 s THR 409 N -1.66 0.00 -0.00 0.00 -1.32 -1.26 -5.18 115.64 106.22 1fk9 s THR 409 Ca 0.58 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 61.05 1fk9 s THR 409 Cb -0.22 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 69.77 1fk9 s THR 409 CO 0.28 0.00 0.02 0.86 -2.21 0.00 0.00 174.62 173.57 1fk9 s TRP 410 N -1.79 0.01 -0.13 9.09 -0.00 -1.26 -5.14 118.94 119.73 1fk9 s TRP 410 Ca -0.06 -0.01 0.00 0.00 -0.00 0.00 0.00 56.10 56.03 1fk9 s TRP 410 Cb -0.00 -0.01 0.02 0.00 -0.00 0.00 0.00 33.47 33.48 1fk9 s TRP 410 CO 0.03 -0.04 -0.11 0.42 -0.00 0.00 0.00 176.95 177.25 1fk9 s ILE 411 N -0.17 1.29 1.17 5.86 -1.09 -1.26 -4.99 121.20 122.01 1fk9 s ILE 411 Ca -0.02 -0.46 -0.14 0.00 -2.23 0.00 0.00 60.65 57.80 1fk9 s ILE 411 Cb -0.01 -1.25 0.26 0.00 -1.58 0.00 0.00 42.46 39.88 1fk9 s ILE 411 CO -0.00 0.41 0.86 -0.81 -1.23 0.00 0.00 174.94 174.17 1fk9 n PRO 412 N 4.78 -2.31 -1.20 2.79 -0.04 -1.26 -4.79 135.00 132.98 1fk9 n PRO 412 Ca -0.15 -0.65 -0.47 0.00 -0.04 0.00 0.00 63.50 62.20 1fk9 n PRO 412 Cb 0.50 -2.10 -0.07 0.00 -0.04 0.00 0.00 33.50 31.80 1fk9 n PRO 412 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1fk9 n GLU 413 N -4.50 0.00 -3.65 0.54 2.13 -1.26 -4.79 120.64 109.11 1fk9 n GLU 413 Ca 0.03 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.72 1fk9 n GLU 413 Cb 0.55 -1.08 -0.06 0.00 0.27 0.00 0.00 31.44 31.12 1fk9 n GLU 413 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 1fk9 s TRP 414 N 1.40 -0.30 0.00 4.31 1.48 -1.26 -2.16 118.94 122.41 1fk9 s TRP 414 Ca 0.72 0.31 0.07 0.00 -1.06 0.00 0.00 56.10 56.14 1fk9 s TRP 414 Cb -1.02 0.24 -0.02 0.00 -1.16 0.00 0.00 33.47 31.50 1fk9 s TRP 414 CO 0.53 -0.57 -0.21 -1.83 -4.06 0.00 0.00 176.95 170.81 1fk9 s GLU 415 N -2.33 1.60 0.43 3.25 -1.05 0.19 -4.95 118.70 115.85 1fk9 s GLU 415 Ca -0.06 -0.80 -0.25 0.00 -0.15 0.00 0.00 54.97 53.70 1fk9 s GLU 415 Cb -0.01 -1.60 -0.08 0.00 -0.44 0.00 0.00 34.13 32.00 1fk9 s GLU 415 CO -0.01 0.43 1.33 0.12 0.95 0.00 0.00 175.26 178.08 1fk9 s PHE 416 N -0.58 2.68 -0.13 4.83 5.36 -1.26 -1.59 117.98 127.29 1fk9 s PHE 416 Ca 0.08 1.37 -0.01 0.00 -0.96 0.00 0.00 56.93 57.42 1fk9 s PHE 416 Cb -0.08 -3.73 0.03 0.00 -0.34 0.00 0.00 43.02 38.90 1fk9 s PHE 416 CO -0.00 -2.35 -0.05 0.08 -1.46 0.00 0.00 175.22 171.43 1fk9 s VAL 417 N -1.27 0.97 -1.27 3.12 1.01 0.10 -4.80 120.40 118.27 1fk9 s VAL 417 Ca 0.60 -0.39 -0.18 0.00 0.00 0.00 0.00 61.98 62.00 1fk9 s VAL 417 Cb -0.39 -1.09 0.01 0.00 0.00 0.00 0.00 36.38 34.92 1fk9 s VAL 417 CO 0.50 0.23 1.92 -3.20 0.00 0.00 0.00 175.10 174.55 1fk9 n ASN 418 N 4.94 4.12 -3.74 3.32 5.15 -1.26 -4.15 115.26 123.63 1fk9 n ASN 418 Ca -0.11 -2.84 -0.30 0.00 -0.60 0.00 0.00 54.58 50.73 1fk9 n ASN 418 Cb 0.49 -1.66 -0.15 0.00 -0.53 0.00 0.00 39.78 37.93 1fk9 n ASN 418 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1fk9 s THR 419 N 5.15 0.92 0.68 -0.44 2.01 -1.26 -5.10 115.64 117.60 1fk9 s THR 419 Ca 0.55 -1.43 -0.17 0.00 0.31 0.00 0.00 61.69 60.96 1fk9 s THR 419 Cb 0.07 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.84 1fk9 s THR 419 CO 0.05 -0.67 0.68 -2.65 -0.69 0.00 0.00 174.62 171.34 1fk9 n PRO 420 N 4.83 0.45 -2.88 4.92 -0.02 -1.26 -4.17 135.00 136.87 1fk9 n PRO 420 Ca -0.02 0.20 -0.41 0.00 -2.02 0.00 0.00 63.50 61.24 1fk9 n PRO 420 Cb 0.42 -1.94 -0.04 0.00 -0.02 0.00 0.00 33.50 31.92 1fk9 n PRO 420 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1fk9 s PRO 421 N -2.78 4.34 0.29 0.52 0.04 -1.26 -4.96 135.00 131.18 1fk9 s PRO 421 Ca 0.69 1.05 -0.29 0.00 0.04 0.00 0.00 61.00 62.49 1fk9 s PRO 421 Cb -0.37 -3.55 -0.10 0.00 0.04 0.00 0.00 34.50 30.52 1fk9 s PRO 421 CO 0.54 -0.26 1.24 -0.51 0.04 0.00 0.00 177.00 178.04 1fk9 s LEU 422 N 1.91 4.47 -0.04 -3.56 1.43 -1.26 -4.77 118.68 116.86 1fk9 s LEU 422 Ca 0.40 2.49 -0.29 0.00 -1.03 0.00 0.00 54.13 55.70 1fk9 s LEU 422 Cb -0.17 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.39 1fk9 s LEU 422 CO 0.14 -0.40 0.95 0.54 0.23 0.00 0.00 176.35 177.82 1fk9 s VAL 423 N -0.92 4.87 0.27 -1.59 0.11 0.12 -5.01 120.40 118.25 1fk9 s VAL 423 Ca 0.49 1.98 0.06 0.00 -2.93 0.00 0.00 61.98 61.58 1fk9 s VAL 423 Cb -0.36 -4.29 -0.02 0.00 -1.53 0.00 0.00 36.38 30.18 1fk9 s VAL 423 CO 0.46 0.13 0.21 2.29 -3.33 0.00 0.00 175.10 174.86 1fk9 n LYS 424 N 4.20 0.36 -3.80 1.54 2.85 -1.26 -4.54 118.16 117.51 1fk9 n LYS 424 Ca 0.06 -2.63 -0.37 0.00 -1.05 0.00 0.00 58.31 54.32 1fk9 n LYS 424 Cb 0.50 2.07 -0.13 0.00 -0.65 0.00 0.00 35.03 36.83 1fk9 n LYS 424 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1fk9 s LEU 425 N 0.00 4.35 0.60 -5.58 1.43 -1.26 -4.74 118.68 113.48 1fk9 s LEU 425 Ca 0.30 -1.31 0.37 0.00 -1.03 0.00 0.00 54.13 52.45 1fk9 s LEU 425 Cb 0.01 -1.82 1.88 0.00 0.03 0.00 0.00 46.19 46.30 1fk9 s LEU 425 CO 0.21 -0.34 2.19 -0.50 0.23 0.00 0.00 176.35 178.13 1fk9 h TRP 426 N 8.14 0.00 -2.82 0.29 4.06 -1.96 -3.45 115.95 120.22 1fk9 h TRP 426 Ca -0.21 0.00 0.03 0.00 2.06 0.00 0.00 58.89 60.77 1fk9 h TRP 426 Cb 1.07 0.00 -0.11 0.00 -1.00 0.00 0.00 29.16 29.12 1fk9 h TRP 426 CO 0.60 0.03 0.29 1.52 -3.56 0.00 0.00 178.44 177.31 1fk9 s TYR 427 N -4.03 -0.42 -0.09 0.49 1.13 -1.26 -4.65 117.35 108.52 1fk9 s TYR 427 Ca -0.03 0.18 -0.07 0.00 -1.41 0.00 0.00 57.07 55.74 1fk9 s TYR 427 Cb 0.12 0.58 0.03 0.00 -1.10 0.00 0.00 41.96 41.59 1fk9 s TYR 427 CO 0.49 -0.85 0.23 1.14 -2.51 0.00 0.00 175.55 174.05 1fk9 s GLN 428 N -3.62 0.25 0.01 -3.49 -2.07 -1.26 -5.03 119.66 104.44 1fk9 s GLN 428 Ca 0.04 0.37 -0.30 0.00 -1.82 0.00 0.00 55.36 53.65 1fk9 s GLN 428 Cb -0.02 0.07 -0.03 0.00 -1.09 0.00 0.00 33.01 31.94 1fk9 s GLN 428 CO -0.08 -0.06 1.00 -0.51 -1.32 0.00 0.00 175.29 174.32 1fk9 s LEU 429 N 0.39 4.37 0.40 2.60 1.43 -1.26 -4.64 118.68 121.97 1fk9 s LEU 429 Ca -0.02 1.70 -0.27 0.00 -1.03 0.00 0.00 54.13 54.51 1fk9 s LEU 429 Cb -0.04 -3.57 -0.10 0.00 0.03 0.00 0.00 46.19 42.51 1fk9 s LEU 429 CO -0.02 -0.27 1.36 -0.62 0.23 0.00 0.00 176.35 177.03 1fk9 n GLU 430 N 3.87 2.23 0.03 1.70 -0.58 -0.25 -4.85 120.64 122.78 1fk9 n GLU 430 Ca 0.06 0.79 0.13 0.00 -0.42 0.00 0.00 57.16 57.72 1fk9 n GLU 430 Cb 0.51 -2.50 0.49 0.00 -0.57 0.00 0.00 31.44 29.36 1fk9 n GLU 430 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1fk9 n LYS 431 N 0.19 0.08 -4.20 3.49 5.02 -1.26 -4.65 118.16 116.83 1fk9 n LYS 431 Ca 0.05 0.06 -0.17 0.00 -2.02 0.00 0.00 58.31 56.23 1fk9 n LYS 431 Cb 0.39 -1.59 -0.13 0.00 -0.02 0.00 0.00 35.03 33.68 1fk9 n LYS 431 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1fk9 s GLU 432 N -3.04 0.67 0.75 1.97 2.56 -1.26 -5.10 118.70 115.25 1fk9 s GLU 432 Ca 0.12 -0.63 -0.16 0.00 0.00 0.00 0.00 54.97 54.30 1fk9 s GLU 432 Cb 0.17 -0.59 -0.01 0.00 2.00 0.00 0.00 34.13 35.70 1fk9 s GLU 432 CO 0.58 0.14 0.69 -0.35 -0.56 0.00 0.00 175.26 175.76 1fk9 n PRO 433 N 1.97 0.28 -3.63 4.30 -0.04 -1.26 -4.88 135.00 131.74 1fk9 n PRO 433 Ca -0.19 0.15 -0.37 0.00 -0.04 0.00 0.00 63.50 63.05 1fk9 n PRO 433 Cb 0.55 -1.99 -0.10 0.00 -0.04 0.00 0.00 33.50 31.93 1fk9 n PRO 433 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1fk9 s ILE 434 N -1.95 5.34 0.01 0.52 1.01 -1.26 -5.05 121.20 119.82 1fk9 s ILE 434 Ca 0.67 0.21 -0.30 0.00 0.00 0.00 0.00 60.65 61.23 1fk9 s ILE 434 Cb -0.33 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.57 1fk9 s ILE 434 CO 0.56 0.32 1.33 -0.69 0.00 0.00 0.00 174.94 176.47 1fk9 s VAL 435 N 1.20 3.81 0.00 2.92 1.01 -1.26 -2.74 120.40 125.35 1fk9 s VAL 435 Ca 0.08 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.28 1fk9 s VAL 435 Cb -0.14 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.45 1fk9 s VAL 435 CO 0.06 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.79 1fk9 n GLY 436 N 3.51 2.15 3.71 4.51 0.00 -1.26 -5.03 105.19 112.77 1fk9 n GLY 436 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1fk9 n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fk9 s ALA 437 N -2.32 3.26 0.78 4.61 0.00 -1.11 -5.02 121.76 121.96 1fk9 s ALA 437 Ca 0.00 0.38 -0.16 0.00 0.00 0.00 0.00 51.96 52.19 1fk9 s ALA 437 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 1fk9 s ALA 437 CO 0.00 -0.28 0.39 -1.91 0.00 0.00 0.00 175.76 173.96 1fk9 n GLU 438 N 4.10 0.15 -4.21 0.00 2.13 -1.26 -4.58 120.64 116.96 1fk9 n GLU 438 Ca 0.04 0.09 -0.33 0.00 0.66 0.00 0.00 57.16 57.62 1fk9 n GLU 438 Cb 0.51 -1.75 -0.16 0.00 0.27 0.00 0.00 31.44 30.31 1fk9 n GLU 438 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1fk9 s THR 439 N -2.02 2.22 -0.27 6.31 2.01 -1.26 -2.11 115.64 120.51 1fk9 s THR 439 Ca 0.62 -0.90 -0.09 0.00 0.31 0.00 0.00 61.69 61.63 1fk9 s THR 439 Cb -0.32 -1.93 -0.03 0.00 0.01 0.00 0.00 72.50 70.24 1fk9 s THR 439 CO 0.62 0.53 0.12 -0.36 -0.69 0.00 0.00 174.62 174.84 1fk9 s PHE 440 N 1.20 3.14 -0.25 4.92 0.40 -0.50 -0.75 117.98 126.15 1fk9 s PHE 440 Ca 0.03 -0.33 -0.13 0.00 -0.60 0.00 0.00 56.93 55.90 1fk9 s PHE 440 Cb -0.14 -2.31 -0.05 0.00 0.51 0.00 0.00 43.02 41.04 1fk9 s PHE 440 CO -0.10 -0.34 0.26 0.71 0.70 0.00 0.00 175.22 176.46 1fk9 s TYR 441 N 1.65 3.28 -0.05 0.36 1.51 0.12 -0.85 117.35 123.37 1fk9 s TYR 441 Ca 0.06 0.31 0.05 0.00 -1.01 0.00 0.00 57.07 56.47 1fk9 s TYR 441 Cb -0.16 -2.42 -0.02 0.00 -0.11 0.00 0.00 41.96 39.26 1fk9 s TYR 441 CO 0.06 -0.08 -0.19 0.08 -1.11 0.00 0.00 175.55 174.31 1fk9 s VAL 442 N 1.53 2.62 0.18 0.71 1.01 -0.74 0.06 120.40 125.77 1fk9 s VAL 442 Ca 0.11 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.21 1fk9 s VAL 442 Cb -0.15 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.23 1fk9 s VAL 442 CO 0.08 0.58 0.00 0.47 0.00 0.00 0.00 175.10 176.23 1fk9 n ASP 443 N 2.61 -1.13 -4.13 3.32 9.92 -1.26 -4.35 116.55 121.53 1fk9 n ASP 443 Ca -0.17 0.32 -0.43 0.00 -0.53 0.00 0.00 54.79 53.98 1fk9 n ASP 443 Cb 0.52 1.26 0.00 0.00 -0.64 0.00 0.00 41.12 42.26 1fk9 n ASP 443 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1fk9 n ALA 455 N -2.92 4.73 -3.00 2.24 0.00 -1.26 -4.95 120.51 115.36 1fk9 n ALA 455 Ca 0.00 -4.40 0.00 0.00 0.00 0.00 0.00 53.44 49.04 1fk9 n ALA 455 Cb 0.00 -2.87 0.00 0.00 0.00 0.00 0.00 19.45 16.58 1fk9 n ALA 455 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fk9 n GLY 456 N 3.01 3.24 3.43 0.00 0.00 -1.26 -1.75 105.19 111.85 1fk9 n GLY 456 Ca 0.35 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 1fk9 n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fk9 s TYR 457 N -3.84 -0.18 -0.03 1.61 -0.85 -1.06 -4.64 117.35 108.35 1fk9 s TYR 457 Ca 0.00 -0.14 0.00 0.00 -0.52 0.00 0.00 57.07 56.41 1fk9 s TYR 457 Cb 0.00 0.35 0.03 0.00 0.38 0.00 0.00 41.96 42.71 1fk9 s TYR 457 CO 0.00 -0.82 0.00 0.08 -1.52 0.00 0.00 175.55 173.29 1fk9 s VAL 458 N -3.84 0.17 0.32 -3.49 1.01 0.11 -2.93 120.40 111.75 1fk9 s VAL 458 Ca 0.06 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.21 1fk9 s VAL 458 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 1fk9 s VAL 458 CO -0.07 0.15 0.33 0.42 0.00 0.00 0.00 175.10 175.93 1fk9 s THR 459 N 1.07 3.84 -0.67 3.92 -4.23 0.13 0.15 115.64 119.85 1fk9 s THR 459 Ca -0.09 -1.26 0.21 0.00 -1.18 0.00 0.00 61.69 59.37 1fk9 s THR 459 Cb -0.13 -3.30 0.21 0.00 1.34 0.00 0.00 72.50 70.62 1fk9 s THR 459 CO -0.02 -0.19 1.64 -0.46 -0.54 0.00 0.00 174.62 175.05 1fk9 n ASN 460 N -1.43 0.45 -1.73 3.99 6.94 0.07 -2.44 115.26 121.12 1fk9 n ASN 460 Ca -0.02 0.61 0.07 0.00 -0.02 0.00 0.00 54.58 55.21 1fk9 n ASN 460 Cb 0.59 -0.70 0.37 0.00 -2.36 0.00 0.00 39.78 37.68 1fk9 n ASN 460 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1fk9 n ARG 461 N -1.99 4.36 0.00 -3.83 1.74 -1.26 -4.92 116.66 110.76 1fk9 n ARG 461 Ca 0.03 -2.87 0.00 0.00 -0.77 0.00 0.00 57.85 54.24 1fk9 n ARG 461 Cb 0.22 -2.13 0.00 0.00 -1.02 0.00 0.00 32.46 29.53 1fk9 n ARG 461 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fk9 n GLY 462 N 0.71 2.58 3.77 -0.13 0.00 -1.02 -5.03 105.19 106.08 1fk9 n GLY 462 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.91 1fk9 n GLY 462 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fk9 s ARG 463 N -0.26 3.85 0.13 1.61 0.52 -1.26 -4.79 118.95 118.75 1fk9 s ARG 463 Ca 0.00 1.70 -0.24 0.00 -0.52 0.00 0.00 55.73 56.67 1fk9 s ARG 463 Cb 0.00 -2.42 0.07 0.00 0.52 0.00 0.00 34.95 33.12 1fk9 s ARG 463 CO 0.00 -0.46 0.65 1.14 0.02 0.00 0.00 175.30 176.65 1fk9 s GLN 464 N -2.68 1.20 -0.30 3.54 -2.07 -1.26 0.21 119.66 118.30 1fk9 s GLN 464 Ca 0.62 -0.42 -0.02 0.00 -1.82 0.00 0.00 55.36 53.72 1fk9 s GLN 464 Cb -0.27 0.55 0.19 0.00 -1.09 0.00 0.00 33.01 32.40 1fk9 s GLN 464 CO 0.32 -0.52 0.69 0.21 -1.32 0.00 0.00 175.29 174.68 1fk9 s LYS 465 N -3.56 0.48 -0.44 9.60 2.20 -1.15 -5.01 119.74 121.87 1fk9 s LYS 465 Ca 0.01 0.77 -0.09 0.00 -0.36 0.00 0.00 55.97 56.30 1fk9 s LYS 465 Cb -0.01 0.42 0.09 0.00 -1.51 0.00 0.00 37.83 36.82 1fk9 s LYS 465 CO -0.12 -0.61 0.29 0.08 -0.36 0.00 0.00 175.35 174.63 1fk9 s VAL 466 N 2.87 4.21 0.01 4.02 1.01 -1.26 -2.58 120.40 128.69 1fk9 s VAL 466 Ca 0.16 -1.54 0.01 0.00 0.00 0.00 0.00 61.98 60.60 1fk9 s VAL 466 Cb -0.13 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1fk9 s VAL 466 CO -0.20 -0.60 0.04 -0.69 0.00 0.00 0.00 175.10 173.65 1fk9 s VAL 467 N 1.40 4.42 -0.22 2.92 1.01 -0.72 -4.95 120.40 124.27 1fk9 s VAL 467 Ca 0.04 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1fk9 s VAL 467 Cb -0.24 -3.02 0.05 0.00 0.00 0.00 0.00 36.38 33.16 1fk9 s VAL 467 CO 0.01 0.31 -0.10 0.42 0.00 0.00 0.00 175.10 175.74 1fk9 s THR 468 N -1.19 1.80 0.09 3.92 -4.23 -1.26 -4.14 115.64 110.64 1fk9 s THR 468 Ca 0.23 -1.22 -0.03 0.00 -1.18 0.00 0.00 61.69 59.49 1fk9 s THR 468 Cb -0.12 -1.90 -0.05 0.00 1.34 0.00 0.00 72.50 71.77 1fk9 s THR 468 CO 0.14 0.09 0.29 -0.22 -0.54 0.00 0.00 174.62 174.38 1fk9 s LEU 469 N 1.30 4.32 0.04 4.79 2.96 -1.26 -5.09 118.68 125.74 1fk9 s LEU 469 Ca -0.04 0.44 -0.21 0.00 -0.22 0.00 0.00 54.13 54.11 1fk9 s LEU 469 Cb -0.18 -3.09 -0.06 0.00 0.50 0.00 0.00 46.19 43.37 1fk9 s LEU 469 CO -0.07 0.13 0.61 0.42 -1.32 0.00 0.00 176.35 176.12 1fk9 s THR 470 N -1.56 4.80 -0.34 3.68 -4.23 -1.26 -4.61 115.64 112.12 1fk9 s THR 470 Ca 0.37 1.30 -0.08 0.00 -1.18 0.00 0.00 61.69 62.10 1fk9 s THR 470 Cb -0.13 -3.95 0.01 0.00 1.34 0.00 0.00 72.50 69.77 1fk9 s THR 470 CO 0.25 0.47 0.29 0.47 -0.54 0.00 0.00 174.62 175.56 1fk9 n ASP 471 N 2.31 -7.41 -3.64 3.99 8.00 -1.26 -5.08 116.55 113.46 1fk9 n ASP 471 Ca -0.08 0.86 -0.07 0.00 0.71 0.00 0.00 54.79 56.22 1fk9 n ASP 471 Cb 0.51 -4.95 -0.07 0.00 -0.02 0.00 0.00 41.12 36.58 1fk9 n ASP 471 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1fk9 s THR 472 N -2.00 -0.01 0.72 -3.53 -1.32 -1.26 -5.13 115.64 103.11 1fk9 s THR 472 Ca 0.12 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 60.47 1fk9 s THR 472 Cb -0.03 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.99 1fk9 s THR 472 CO 0.70 0.00 1.12 -0.89 -2.21 0.00 0.00 174.62 173.34 1fk9 s THR 473 N 1.64 3.10 0.11 5.08 2.01 -1.26 -4.78 115.64 121.54 1fk9 s THR 473 Ca -0.10 0.45 -0.23 0.00 0.31 0.00 0.00 61.69 62.11 1fk9 s THR 473 Cb -0.05 -2.93 -0.08 0.00 0.01 0.00 0.00 72.50 69.45 1fk9 s THR 473 CO -0.20 -0.38 1.69 0.78 -0.69 0.00 0.00 174.62 175.82 1fk9 h ASN 474 N -0.53 -0.34 -0.91 3.53 2.35 -2.02 0.23 115.58 117.90 1fk9 h ASN 474 Ca -0.45 0.05 0.12 0.00 -0.55 0.00 0.00 56.30 55.47 1fk9 h ASN 474 Cb 1.25 0.15 -0.08 0.00 0.05 0.00 0.00 38.32 39.68 1fk9 h ASN 474 CO 0.52 -0.17 0.53 1.56 -1.65 0.00 0.00 177.43 178.22 1fk9 h GLN 475 N -0.19 0.79 0.00 0.81 4.20 -2.02 -1.22 115.11 117.48 1fk9 h GLN 475 Ca 0.04 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 1fk9 h GLN 475 Cb 0.25 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 1fk9 h GLN 475 CO -0.12 0.52 -0.53 -0.22 -0.67 0.00 0.00 178.83 177.81 1fk9 h LYS 476 N 0.82 0.00 -0.10 1.46 3.64 -1.67 -3.08 116.57 117.64 1fk9 h LYS 476 Ca 0.46 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.73 1fk9 h LYS 476 Cb 0.52 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1fk9 h LYS 476 CO -0.29 0.53 -0.44 1.79 -2.27 0.00 0.00 179.45 178.77 1fk9 h THR 477 N 0.00 1.32 0.51 1.00 1.35 0.65 -2.86 112.91 114.88 1fk9 h THR 477 Ca -0.01 -1.58 -0.02 0.00 -0.55 0.00 0.00 66.41 64.25 1fk9 h THR 477 Cb 0.98 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 1fk9 h THR 477 CO 0.07 0.47 -0.24 -0.33 -0.25 0.00 0.00 175.52 175.24 1fk9 h GLU 478 N 0.19 -0.66 -1.00 4.72 5.08 -1.39 -2.84 114.58 118.68 1fk9 h GLU 478 Ca 0.01 0.04 0.31 0.00 -1.00 0.00 0.00 59.36 58.73 1fk9 h GLU 478 Cb 0.85 0.15 -0.15 0.00 0.50 0.00 0.00 28.75 30.11 1fk9 h GLU 478 CO 0.07 -0.44 0.57 -0.07 -1.00 0.00 0.00 179.01 178.14 1fk9 h LEU 479 N -0.74 0.52 -0.35 1.33 -0.00 -1.61 0.16 115.31 114.63 1fk9 h LEU 479 Ca -0.07 0.19 0.06 0.00 -0.00 0.00 0.00 57.88 58.06 1fk9 h LEU 479 Cb 0.52 0.13 -0.05 0.00 -0.00 0.00 0.00 40.66 41.26 1fk9 h LEU 479 CO 0.11 -0.11 0.03 1.56 -0.00 0.00 0.00 178.44 180.03 1fk9 h GLN 480 N 0.35 0.14 0.00 1.13 4.20 -1.39 0.66 115.11 120.20 1fk9 h GLN 480 Ca 0.72 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 59.43 1fk9 h GLN 480 Cb 1.63 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.37 1fk9 h GLN 480 CO -0.60 0.09 -0.00 0.00 -0.67 0.00 0.00 178.83 177.65 1fk9 h ALA 481 N 1.29 -0.00 -0.96 3.87 0.00 -0.46 0.56 119.26 123.54 1fk9 h ALA 481 Ca 0.17 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1fk9 h ALA 481 Cb 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 1fk9 h ALA 481 CO -0.26 -0.49 0.61 0.82 0.00 0.00 0.00 179.25 179.93 1fk9 h ILE 482 N -0.03 1.02 0.68 0.00 2.04 -0.93 0.10 117.51 120.40 1fk9 h ILE 482 Ca -0.00 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 1fk9 h ILE 482 Cb 0.03 -0.13 0.00 0.00 -0.74 0.00 0.00 36.82 35.98 1fk9 h ILE 482 CO 0.00 0.19 -0.35 0.22 0.00 0.00 0.00 178.15 178.21 1fk9 h TYR 483 N 1.06 -0.92 -0.61 1.37 3.20 0.14 -1.37 116.97 119.84 1fk9 h TYR 483 Ca 0.44 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.35 1fk9 h TYR 483 Cb 0.27 0.31 -0.10 0.00 1.54 0.00 0.00 36.73 38.75 1fk9 h TYR 483 CO -0.01 -0.56 -0.57 -0.07 -1.64 0.00 0.00 178.16 175.31 1fk9 h LEU 484 N -0.95 -1.97 -0.86 2.82 3.38 0.12 -0.15 115.31 117.71 1fk9 h LEU 484 Ca -0.09 0.27 0.18 0.00 0.09 0.00 0.00 57.88 58.33 1fk9 h LEU 484 Cb 0.74 0.83 -0.16 0.00 0.09 0.00 0.00 40.66 42.16 1fk9 h LEU 484 CO 0.13 -0.34 -0.18 0.00 0.09 0.00 0.00 178.44 178.14 1fk9 h ALA 485 N 0.15 0.63 -0.79 1.53 0.00 -0.65 0.24 119.26 120.36 1fk9 h ALA 485 Ca 0.10 0.33 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 1fk9 h ALA 485 Cb 0.53 0.63 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 1fk9 h ALA 485 CO -0.72 -0.41 0.44 -0.07 0.00 0.00 0.00 179.25 178.49 1fk9 h LEU 486 N 0.01 0.97 -0.88 0.00 3.38 0.09 -1.36 115.31 117.52 1fk9 h LEU 486 Ca 0.43 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 1fk9 h LEU 486 Cb 0.68 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 1fk9 h LEU 486 CO -0.87 0.78 0.52 1.56 0.09 0.00 0.00 178.44 180.53 1fk9 h GLN 487 N 1.09 1.21 0.00 1.13 4.20 0.60 -2.95 115.11 120.39 1fk9 h GLN 487 Ca 0.28 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1fk9 h GLN 487 Cb 0.02 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.55 1fk9 h GLN 487 CO -0.05 0.86 -0.60 -0.25 -0.67 0.00 0.00 178.83 178.12 1fk9 n ASP 488 N -4.39 0.63 -4.85 1.46 10.43 -0.67 -4.94 116.55 114.23 1fk9 n ASP 488 Ca 0.09 0.04 -0.30 0.00 2.57 0.00 0.00 54.79 57.19 1fk9 n ASP 488 Cb 0.07 0.19 0.05 0.00 1.84 0.00 0.00 41.12 43.27 1fk9 n ASP 488 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1fk9 s SER 489 N -3.93 5.33 0.00 -2.24 1.04 -0.53 -5.08 113.70 108.29 1fk9 s SER 489 Ca 0.07 1.30 0.00 0.00 0.48 0.00 0.00 55.95 57.80 1fk9 s SER 489 Cb 0.14 -2.14 0.00 0.00 0.10 0.00 0.00 66.02 64.13 1fk9 s SER 489 CO 0.71 -1.44 0.00 0.61 0.98 0.00 0.00 173.24 174.11 1fk9 n GLY 490 N -2.57 -0.57 0.26 7.32 0.00 -1.26 -4.94 105.19 103.43 1fk9 n GLY 490 Ca 0.07 -1.65 0.14 0.00 0.00 0.00 0.00 46.02 44.58 1fk9 n GLY 490 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fk9 h LEU 491 N 0.00 0.00 -8.17 0.99 4.07 -1.96 -3.42 115.31 106.82 1fk9 h LEU 491 Ca 0.00 0.00 -0.56 0.00 0.08 0.00 0.00 57.88 57.40 1fk9 h LEU 491 Cb 0.00 0.00 -0.32 0.00 1.08 0.00 0.00 40.66 41.42 1fk9 h LEU 491 CO 0.00 0.12 -0.84 -1.61 -1.08 0.00 0.00 178.44 175.03 1fk9 s GLU 492 N -3.94 1.92 -0.13 1.13 2.02 -1.26 0.20 118.70 118.64 1fk9 s GLU 492 Ca -0.01 -0.59 -0.15 0.00 0.02 0.00 0.00 54.97 54.24 1fk9 s GLU 492 Cb 0.12 -1.60 0.04 0.00 0.10 0.00 0.00 34.13 32.78 1fk9 s GLU 492 CO 0.58 0.17 0.41 0.54 0.02 0.00 0.00 175.26 176.98 1fk9 s VAL 493 N 0.26 0.01 -0.14 2.63 0.11 0.23 -4.41 120.40 119.08 1fk9 s VAL 493 Ca -0.09 -0.08 -0.05 0.00 -2.93 0.00 0.00 61.98 58.83 1fk9 s VAL 493 Cb -0.14 -0.61 -0.04 0.00 -1.53 0.00 0.00 36.38 34.07 1fk9 s VAL 493 CO 0.04 -0.05 0.03 0.20 -3.33 0.00 0.00 175.10 171.99 1fk9 s ASN 494 N -0.11 5.37 -0.06 3.54 0.01 -0.89 -1.67 114.94 121.13 1fk9 s ASN 494 Ca -0.03 0.08 0.04 0.00 -0.71 0.00 0.00 52.86 52.24 1fk9 s ASN 494 Cb -0.03 -1.78 0.00 0.00 0.41 0.00 0.00 41.25 39.85 1fk9 s ASN 494 CO 0.02 0.25 -0.18 -0.63 -1.51 0.00 0.00 177.10 175.05 1fk9 s ILE 495 N -0.12 1.53 -0.25 0.60 -1.09 0.17 -1.41 121.20 120.64 1fk9 s ILE 495 Ca 0.05 -0.74 0.02 0.00 -2.23 0.00 0.00 60.65 57.75 1fk9 s ILE 495 Cb -0.12 -1.33 0.05 0.00 -1.58 0.00 0.00 42.46 39.47 1fk9 s ILE 495 CO 0.02 0.44 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.37 1fk9 s VAL 496 N 0.26 2.28 0.27 2.92 1.01 -0.03 0.13 120.40 127.24 1fk9 s VAL 496 Ca -0.10 -1.46 0.11 0.00 0.00 0.00 0.00 61.98 60.53 1fk9 s VAL 496 Cb -0.14 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 33.92 1fk9 s VAL 496 CO 0.04 0.07 -0.15 0.28 0.00 0.00 0.00 175.10 175.33 1fk9 s THR 497 N 1.16 2.72 -1.61 3.92 -1.32 0.09 -1.78 115.64 118.81 1fk9 s THR 497 Ca -0.06 -2.25 0.14 0.00 -1.21 0.00 0.00 61.69 58.31 1fk9 s THR 497 Cb -0.19 -2.42 0.07 0.00 -1.51 0.00 0.00 72.50 68.45 1fk9 s THR 497 CO -0.06 -0.37 0.89 -0.90 -2.21 0.00 0.00 174.62 171.97 1fk9 n ASP 498 N -0.62 1.93 -4.51 8.08 5.75 -1.25 -0.77 116.55 125.17 1fk9 n ASP 498 Ca -0.06 -1.47 -0.43 0.00 -0.01 0.00 0.00 54.79 52.83 1fk9 n ASP 498 Cb 0.59 0.18 -0.04 0.00 -1.03 0.00 0.00 41.12 40.82 1fk9 n ASP 498 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1fk9 s SER 499 N -1.40 6.28 0.50 -1.12 0.15 -1.26 -4.56 113.70 112.28 1fk9 s SER 499 Ca 0.15 -0.53 0.20 0.00 0.70 0.00 0.00 55.95 56.46 1fk9 s SER 499 Cb 0.12 -2.45 1.27 0.00 -1.71 0.00 0.00 66.02 63.25 1fk9 s SER 499 CO 0.25 -1.36 2.08 0.06 1.20 0.00 0.00 173.24 175.46 1fk9 h GLN 500 N 9.47 0.00 0.00 5.44 3.07 -1.95 -2.50 115.11 128.64 1fk9 h GLN 500 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.47 1fk9 h GLN 500 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.63 1fk9 h GLN 500 CO 1.14 0.11 0.00 0.98 0.09 0.00 0.00 178.83 181.15 1fk9 n TYR 501 N -4.14 0.00 -0.32 0.06 9.36 -1.26 -0.76 117.16 120.10 1fk9 n TYR 501 Ca -0.02 0.00 0.27 0.00 3.32 0.00 0.00 57.90 61.47 1fk9 n TYR 501 Cb 0.19 -0.16 0.60 0.00 -0.63 0.00 0.00 39.34 39.34 1fk9 n TYR 501 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1fk9 h ALA 502 N -1.99 2.56 0.22 2.98 0.00 -1.91 0.37 119.26 121.49 1fk9 h ALA 502 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1fk9 h ALA 502 Cb 0.00 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1fk9 h ALA 502 CO 0.00 -0.94 -0.12 1.25 0.00 0.00 0.00 179.25 179.43 1fk9 h LEU 503 N 0.24 -0.30 0.41 0.00 7.12 -1.37 -0.41 115.31 121.00 1fk9 h LEU 503 Ca 0.58 0.02 -0.02 0.00 0.13 0.00 0.00 57.88 58.59 1fk9 h LEU 503 Cb 1.79 0.09 0.00 0.00 -0.53 0.00 0.00 40.66 42.01 1fk9 h LEU 503 CO -0.19 -0.20 -0.22 1.23 -0.13 0.00 0.00 178.44 178.93 1fk9 h GLY 504 N -0.32 -0.61 -0.32 3.75 0.00 0.18 0.35 103.07 106.10 1fk9 h GLY 504 Ca -0.02 0.24 0.03 0.00 0.00 0.00 0.00 47.33 47.58 1fk9 h GLY 504 CO 0.03 -0.22 -0.31 -2.22 0.00 0.00 0.00 176.54 173.81 1fk9 h ILE 505 N -0.58 0.00 -0.40 2.60 2.04 -0.82 -0.03 117.51 120.32 1fk9 h ILE 505 Ca -0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 1fk9 h ILE 505 Cb 0.46 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1fk9 h ILE 505 CO 0.08 0.00 0.19 0.40 0.00 0.00 0.00 178.15 178.82 1fk9 h ILE 506 N -0.16 1.14 -0.29 -0.67 2.04 -1.04 -2.31 117.51 116.23 1fk9 h ILE 506 Ca 0.05 -0.40 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 1fk9 h ILE 506 Cb 0.30 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1fk9 h ILE 506 CO -0.38 0.16 0.04 -0.61 0.00 0.00 0.00 178.15 177.36 1fk9 h GLN 507 N 0.56 0.43 0.00 2.37 4.15 0.12 -0.60 115.11 122.13 1fk9 h GLN 507 Ca 0.14 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1fk9 h GLN 507 Cb 0.06 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.68 1fk9 h GLN 507 CO -0.02 0.43 0.00 0.00 -1.93 0.00 0.00 178.83 177.31 1fk9 n ALA 508 N -2.48 2.25 -3.89 3.38 0.00 -0.17 -4.90 120.51 114.69 1fk9 n ALA 508 Ca 0.01 -0.08 -0.35 0.00 0.00 0.00 0.00 53.44 53.02 1fk9 n ALA 508 Cb 0.19 -1.21 0.01 0.00 0.00 0.00 0.00 19.45 18.44 1fk9 n ALA 508 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1fk9 n GLN 509 N -0.80 -1.33 -1.22 0.00 6.02 -0.23 -4.87 117.38 114.95 1fk9 n GLN 509 Ca 0.10 0.31 -0.31 0.00 -0.01 0.00 0.00 57.00 57.09 1fk9 n GLN 509 Cb 0.05 -3.70 0.10 0.00 1.02 0.00 0.00 30.24 27.70 1fk9 n GLN 509 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1fk9 s PRO 510 N -6.62 2.08 0.00 -1.09 0.04 -1.26 -4.67 135.00 123.48 1fk9 s PRO 510 Ca 0.36 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.55 1fk9 s PRO 510 Cb -0.15 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.51 1fk9 s PRO 510 CO 0.91 -1.76 0.17 -0.40 0.04 0.00 0.00 177.00 175.95 1fk9 n ASP 511 N -3.60 0.33 -3.74 6.66 5.68 0.44 -4.93 116.55 117.40 1fk9 n ASP 511 Ca 0.09 -0.78 -0.13 0.00 -0.50 0.00 0.00 54.79 53.46 1fk9 n ASP 511 Cb 0.53 0.13 -0.10 0.00 -1.14 0.00 0.00 41.12 40.55 1fk9 n ASP 511 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fk9 s GLN 512 N -0.13 0.52 0.04 0.11 -2.07 -1.15 -5.03 119.66 111.95 1fk9 s GLN 512 Ca 0.00 0.36 -0.09 0.00 -1.82 0.00 0.00 55.36 53.81 1fk9 s GLN 512 Cb 0.00 0.25 0.00 0.00 -1.09 0.00 0.00 33.01 32.17 1fk9 s GLN 512 CO 0.00 -0.09 0.19 0.45 -1.32 0.00 0.00 175.29 174.52 1fk9 s SER 513 N -0.19 0.03 0.24 12.60 0.15 -1.26 -3.08 113.70 122.19 1fk9 s SER 513 Ca -0.03 -0.35 0.13 0.00 0.70 0.00 0.00 55.95 56.40 1fk9 s SER 513 Cb -0.03 0.28 -0.00 0.00 -1.71 0.00 0.00 66.02 64.56 1fk9 s SER 513 CO 0.02 -0.54 1.40 -0.33 1.20 0.00 0.00 173.24 174.98 1fk9 h GLU 514 N 3.53 0.00 -6.61 5.44 4.39 -1.97 -3.44 114.58 115.92 1fk9 h GLU 514 Ca -0.32 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 58.87 1fk9 h GLU 514 Cb 1.19 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.81 1fk9 h GLU 514 CO 0.47 0.61 0.17 0.45 -1.16 0.00 0.00 179.01 179.56 1fk9 s SER 515 N -6.51 7.22 0.01 1.42 0.15 -1.26 -4.99 113.70 109.75 1fk9 s SER 515 Ca 0.03 1.57 -0.19 0.00 0.70 0.00 0.00 55.95 58.06 1fk9 s SER 515 Cb 0.08 -2.47 -0.25 0.00 -1.71 0.00 0.00 66.02 61.67 1fk9 s SER 515 CO 0.76 0.08 1.08 -0.08 1.20 0.00 0.00 173.24 176.29 1fk9 h GLU 516 N 3.69 0.46 -0.29 5.44 4.81 -2.00 -3.10 114.58 123.60 1fk9 h GLU 516 Ca -0.47 -0.53 0.04 0.00 -0.13 0.00 0.00 59.36 58.27 1fk9 h GLU 516 Cb 1.20 0.16 -0.08 0.00 0.63 0.00 0.00 28.75 30.66 1fk9 h GLU 516 CO 0.65 1.18 -0.53 1.25 -0.73 0.00 0.00 179.01 180.83 1fk9 h LEU 517 N -0.03 -1.74 -0.46 1.64 6.46 -1.98 0.42 115.31 119.62 1fk9 h LEU 517 Ca -0.10 0.22 0.05 0.00 -0.12 0.00 0.00 57.88 57.93 1fk9 h LEU 517 Cb 1.47 0.70 -0.07 0.00 -0.73 0.00 0.00 40.66 42.03 1fk9 h LEU 517 CO 0.15 -0.44 -0.44 0.58 -0.62 0.00 0.00 178.44 177.67 1fk9 h VAL 518 N -0.47 0.00 -0.89 1.05 2.07 -1.97 0.42 116.25 116.46 1fk9 h VAL 518 Ca 0.06 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.81 1fk9 h VAL 518 Cb 0.63 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.27 1fk9 h VAL 518 CO -0.52 0.00 0.34 0.78 0.02 0.00 0.00 177.57 178.18 1fk9 h ASN 519 N -0.21 0.21 0.07 0.57 4.21 -1.13 0.66 115.58 119.96 1fk9 h ASN 519 Ca 0.08 0.17 -0.00 0.00 1.21 0.00 0.00 56.30 57.76 1fk9 h ASN 519 Cb 0.41 0.19 0.00 0.00 -1.12 0.00 0.00 38.32 37.80 1fk9 h ASN 519 CO -0.54 -0.07 -0.03 1.56 -1.29 0.00 0.00 177.43 177.05 1fk9 h GLN 520 N 0.31 -0.09 0.06 0.81 4.20 0.38 -0.45 115.11 120.33 1fk9 h GLN 520 Ca 0.56 0.01 0.02 0.00 0.06 0.00 0.00 58.65 59.30 1fk9 h GLN 520 Cb 1.11 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.88 1fk9 h GLN 520 CO -0.58 -0.06 -0.16 0.82 -0.67 0.00 0.00 178.83 178.18 1fk9 h ILE 521 N -0.10 0.61 -1.03 2.54 2.04 0.29 -1.00 117.51 120.86 1fk9 h ILE 521 Ca -0.01 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.11 1fk9 h ILE 521 Cb 0.07 0.61 -0.12 0.00 -0.74 0.00 0.00 36.82 36.65 1fk9 h ILE 521 CO 0.02 0.00 0.63 0.40 0.00 0.00 0.00 178.15 179.19 1fk9 h ILE 522 N -0.30 0.51 -0.61 -0.67 2.04 0.49 0.85 117.51 119.81 1fk9 h ILE 522 Ca 0.04 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.74 1fk9 h ILE 522 Cb 0.34 -0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.36 1fk9 h ILE 522 CO -0.12 0.09 0.39 -0.08 0.00 0.00 0.00 178.15 178.43 1fk9 h GLU 523 N 0.49 0.76 -0.32 2.37 4.57 0.26 -1.12 114.58 121.60 1fk9 h GLU 523 Ca 0.64 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.75 1fk9 h GLU 523 Cb 1.38 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 1fk9 h GLU 523 CO -0.42 0.50 0.10 1.96 -1.18 0.00 0.00 179.01 179.98 1fk9 h GLN 524 N 0.79 0.49 -0.07 1.92 1.08 0.11 -2.49 115.11 116.93 1fk9 h GLN 524 Ca 0.24 -0.10 0.02 0.00 -1.45 0.00 0.00 58.65 57.36 1fk9 h GLN 524 Cb -0.04 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.30 1fk9 h GLN 524 CO -0.08 0.52 -0.08 -0.07 -0.95 0.00 0.00 178.83 178.18 1fk9 h LEU 525 N 0.36 -0.23 -1.53 1.46 3.38 -0.80 -0.52 115.31 117.42 1fk9 h LEU 525 Ca 0.10 0.05 0.12 0.00 0.09 0.00 0.00 57.88 58.24 1fk9 h LEU 525 Cb 0.23 0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 1fk9 h LEU 525 CO -0.00 -0.11 0.48 0.40 0.09 0.00 0.00 178.44 179.30 1fk9 h ILE 526 N -0.10 0.86 -0.17 1.22 2.04 -1.13 -2.24 117.51 117.99 1fk9 h ILE 526 Ca 0.06 -0.17 -0.20 0.00 1.00 0.00 0.00 64.86 65.54 1fk9 h ILE 526 Cb 0.18 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1fk9 h ILE 526 CO -0.13 0.09 -0.70 0.11 0.00 0.00 0.00 178.15 177.52 1fk9 h LYS 527 N 0.49 0.72 -7.27 2.37 1.79 -0.69 -3.46 116.57 110.52 1fk9 h LYS 527 Ca 0.35 -0.55 -0.52 0.00 -2.18 0.00 0.00 60.65 57.75 1fk9 h LYS 527 Cb 0.67 0.10 0.19 0.00 -1.58 0.00 0.00 32.23 31.62 1fk9 h LYS 527 CO -0.12 1.16 0.22 0.15 -1.08 0.00 0.00 179.45 179.79 1fk9 s LYS 528 N -3.83 1.01 -0.14 3.15 -0.14 -0.35 -4.95 119.74 114.48 1fk9 s LYS 528 Ca -0.09 1.51 0.06 0.00 -1.36 0.00 0.00 55.97 56.09 1fk9 s LYS 528 Cb 0.10 -1.73 -0.23 0.00 -1.68 0.00 0.00 37.83 34.28 1fk9 s LYS 528 CO 0.88 -2.62 0.26 0.39 -0.76 0.00 0.00 175.35 173.51 1fk9 n GLU 529 N -4.23 0.69 -3.66 1.68 -0.58 0.13 -4.93 120.64 109.74 1fk9 n GLU 529 Ca 0.11 0.19 -0.07 0.00 -0.42 0.00 0.00 57.16 56.98 1fk9 n GLU 529 Cb 0.52 -1.65 -0.08 0.00 -0.57 0.00 0.00 31.44 29.66 1fk9 n GLU 529 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1fk9 s LYS 530 N -2.55 0.47 -0.07 3.49 1.02 -1.03 -5.01 119.74 116.07 1fk9 s LYS 530 Ca -0.17 1.12 0.02 0.00 0.02 0.00 0.00 55.97 56.96 1fk9 s LYS 530 Cb 0.07 0.35 0.01 0.00 -0.52 0.00 0.00 37.83 37.74 1fk9 s LYS 530 CO 0.76 -0.20 -0.13 0.08 -0.92 0.00 0.00 175.35 174.94 1fk9 s VAL 531 N 2.22 1.21 -0.20 3.17 1.01 -1.26 -0.61 120.40 125.95 1fk9 s VAL 531 Ca -0.06 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.41 1fk9 s VAL 531 Cb -0.10 -1.10 0.03 0.00 0.00 0.00 0.00 36.38 35.21 1fk9 s VAL 531 CO -0.16 0.37 -0.18 -0.47 0.00 0.00 0.00 175.10 174.67 1fk9 s TYR 532 N 0.64 2.90 -0.15 5.22 5.04 -0.67 -1.09 117.35 129.24 1fk9 s TYR 532 Ca -0.15 -1.81 -0.07 0.00 -2.44 0.00 0.00 57.07 52.60 1fk9 s TYR 532 Cb -0.16 -1.92 -0.04 0.00 0.35 0.00 0.00 41.96 40.18 1fk9 s TYR 532 CO 0.04 -0.83 0.10 -1.17 -1.34 0.00 0.00 175.55 172.36 1fk9 s LEU 533 N 1.25 4.12 0.05 6.97 0.20 -1.26 0.46 118.68 130.47 1fk9 s LEU 533 Ca 0.02 0.29 0.02 0.00 0.69 0.00 0.00 54.13 55.15 1fk9 s LEU 533 Cb -0.15 -2.02 -0.03 0.00 -0.43 0.00 0.00 46.19 43.57 1fk9 s LEU 533 CO -0.11 0.30 -0.08 0.00 -0.29 0.00 0.00 176.35 176.17 1fk9 s ALA 534 N -0.38 0.64 0.14 5.97 0.00 0.12 -4.94 121.76 123.31 1fk9 s ALA 534 Ca 0.11 -0.85 0.09 0.00 0.00 0.00 0.00 51.96 51.31 1fk9 s ALA 534 Cb -0.12 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 1fk9 s ALA 534 CO 0.01 -0.04 -0.18 -0.46 0.00 0.00 0.00 175.76 175.09 1fk9 s TRP 535 N -1.67 2.50 -0.21 0.00 -0.00 -1.25 -0.73 118.94 117.58 1fk9 s TRP 535 Ca -0.07 -0.28 -0.12 0.00 -0.00 0.00 0.00 56.10 55.63 1fk9 s TRP 535 Cb -0.08 -1.30 0.07 0.00 -0.00 0.00 0.00 33.47 32.16 1fk9 s TRP 535 CO -0.00 0.42 0.51 0.14 -0.00 0.00 0.00 176.95 178.02 1fk9 s VAL 536 N -1.30 -0.02 0.42 5.86 -7.23 0.05 -4.90 120.40 113.28 1fk9 s VAL 536 Ca 0.19 0.06 -0.24 0.00 -1.81 0.00 0.00 61.98 60.18 1fk9 s VAL 536 Cb -0.10 -0.75 -0.10 0.00 0.56 0.00 0.00 36.38 35.99 1fk9 s VAL 536 CO 0.11 0.02 1.00 -0.81 -0.31 0.00 0.00 175.10 175.11 1fk9 n PRO 537 N 4.18 1.32 -1.86 4.82 -0.04 -1.26 -3.84 135.00 138.33 1fk9 n PRO 537 Ca -0.22 0.48 -0.30 0.00 -0.04 0.00 0.00 63.50 63.42 1fk9 n PRO 537 Cb 0.57 -2.03 0.06 0.00 -0.04 0.00 0.00 33.50 32.05 1fk9 n PRO 537 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fk9 s ALA 538 N -1.28 2.80 0.00 0.55 0.00 -1.26 -4.96 121.76 117.61 1fk9 s ALA 538 Ca 0.63 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1fk9 s ALA 538 Cb -0.55 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 19.54 1fk9 s ALA 538 CO 0.57 -1.26 0.00 1.58 0.00 0.00 0.00 175.76 176.64