#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fl1 n GLN 3 N 0.00 0.56 -2.47 0.00 6.02 -1.26 -4.96 117.38 115.27 1fl1 n GLN 3 Ca 0.00 0.45 -0.31 0.00 -0.01 0.00 0.00 57.00 57.13 1fl1 n GLN 3 Cb 0.00 -1.64 -0.02 0.00 1.02 0.00 0.00 30.24 29.60 1fl1 n GLN 3 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1fl1 s GLY 4 N -5.02 1.91 -0.22 1.08 0.00 -1.26 -5.06 107.32 98.75 1fl1 s GLY 4 Ca -0.31 -0.04 -0.02 0.00 0.00 0.00 0.00 44.72 44.35 1fl1 s GLY 4 CO 0.51 0.19 -0.08 -2.27 0.00 0.00 0.00 173.10 171.46 1fl1 s LEU 5 N -4.25 2.80 0.23 0.66 1.98 -1.26 -4.33 118.68 114.51 1fl1 s LEU 5 Ca 0.55 -0.58 0.09 0.00 -2.89 0.00 0.00 54.13 51.30 1fl1 s LEU 5 Cb -0.10 -1.66 -0.04 0.00 0.66 0.00 0.00 46.19 45.04 1fl1 s LEU 5 CO 0.36 -0.04 -0.02 -0.31 -1.89 0.00 0.00 176.35 174.45 1fl1 s TYR 6 N 1.40 2.72 0.01 5.38 2.02 0.22 -0.41 117.35 128.68 1fl1 s TYR 6 Ca 0.04 -0.20 -0.02 0.00 -0.37 0.00 0.00 57.07 56.53 1fl1 s TYR 6 Cb -0.15 -1.26 -0.01 0.00 -0.40 0.00 0.00 41.96 40.15 1fl1 s TYR 6 CO -0.06 0.57 0.02 0.54 -1.57 0.00 0.00 175.55 175.05 1fl1 s VAL 7 N -2.06 0.07 0.04 0.71 0.11 -0.40 -1.23 120.40 117.65 1fl1 s VAL 7 Ca 0.29 -0.54 -0.20 0.00 -2.93 0.00 0.00 61.98 58.60 1fl1 s VAL 7 Cb -0.08 -0.21 0.04 0.00 -1.53 0.00 0.00 36.38 34.61 1fl1 s VAL 7 CO 0.19 -0.30 0.46 -0.83 -3.33 0.00 0.00 175.10 171.29 1fl1 s GLY 8 N -0.91 -0.34 0.00 6.54 0.00 -0.69 -0.07 107.32 111.85 1fl1 s GLY 8 Ca -0.10 0.43 0.00 0.00 0.00 0.00 0.00 44.72 45.05 1fl1 s GLY 8 CO -0.00 0.16 0.00 0.61 0.00 0.00 0.00 173.10 173.86 1fl1 n GLY 9 N 0.46 1.47 3.82 0.20 0.00 -0.30 -1.06 105.19 109.78 1fl1 n GLY 9 Ca -0.18 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 1fl1 n GLY 9 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fl1 s PHE 10 N -1.98 3.56 -0.76 1.61 0.40 -1.26 -0.26 117.98 119.30 1fl1 s PHE 10 Ca 0.00 1.44 0.17 0.00 -0.60 0.00 0.00 56.93 57.94 1fl1 s PHE 10 Cb 0.00 -2.67 -0.19 0.00 0.51 0.00 0.00 43.02 40.67 1fl1 s PHE 10 CO 0.00 0.22 0.70 1.33 0.70 0.00 0.00 175.22 178.17 1fl1 n VAL 11 N 0.32 0.00 -3.61 -0.44 0.24 -0.72 -4.35 118.33 109.78 1fl1 n VAL 11 Ca 0.01 -0.12 -0.03 0.00 -2.04 0.00 0.00 64.34 62.16 1fl1 n VAL 11 Cb 0.52 0.95 -0.06 0.00 -1.47 0.00 0.00 33.84 33.77 1fl1 n VAL 11 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1fl1 s ASP 12 N -2.68 -0.72 -0.19 -1.34 2.15 -1.24 -4.60 116.67 108.05 1fl1 s ASP 12 Ca 0.06 1.10 -0.02 0.00 0.43 0.00 0.00 52.55 54.11 1fl1 s ASP 12 Cb 0.13 1.43 -0.01 0.00 -0.30 0.00 0.00 42.92 44.17 1fl1 s ASP 12 CO 0.70 -0.17 -0.09 -0.69 -0.17 0.00 0.00 175.17 174.75 1fl1 s VAL 13 N 1.73 3.14 0.22 1.11 1.01 -1.26 -1.37 120.40 124.99 1fl1 s VAL 13 Ca -0.08 -0.59 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 1fl1 s VAL 13 Cb -0.05 -2.39 -0.09 0.00 0.00 0.00 0.00 36.38 33.85 1fl1 s VAL 13 CO -0.17 0.47 1.22 0.54 0.00 0.00 0.00 175.10 177.15 1fl1 s VAL 14 N 1.13 3.37 0.00 2.92 0.11 -0.90 -4.97 120.40 122.06 1fl1 s VAL 14 Ca 0.01 1.21 0.00 0.00 -2.93 0.00 0.00 61.98 60.27 1fl1 s VAL 14 Cb -0.14 -3.77 0.00 0.00 -1.53 0.00 0.00 36.38 30.94 1fl1 s VAL 14 CO -0.02 0.22 0.00 -0.67 -3.33 0.00 0.00 175.10 171.30 1fl1 n ASP 28 N 2.11 0.00 -4.20 3.54 4.64 -1.26 -5.09 116.55 116.29 1fl1 n ASP 28 Ca 0.03 0.00 -0.17 0.00 -1.38 0.00 0.00 54.79 53.27 1fl1 n ASP 28 Cb 0.44 0.00 -0.11 0.00 -1.04 0.00 0.00 41.12 40.41 1fl1 n ASP 28 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1fl1 s GLN 29 N 0.00 0.90 0.00 -0.67 -2.07 -1.26 -5.03 119.66 111.52 1fl1 s GLN 29 Ca 0.00 -1.11 0.09 0.00 -1.82 0.00 0.00 55.36 52.52 1fl1 s GLN 29 Cb 0.00 -0.76 0.25 0.00 -1.09 0.00 0.00 33.01 31.41 1fl1 s GLN 29 CO 0.00 0.15 1.19 1.33 -1.32 0.00 0.00 175.29 176.64 1fl1 n VAL 30 N 0.80 0.94 -0.85 3.63 0.24 -1.26 -4.80 118.33 117.03 1fl1 n VAL 30 Ca -0.18 -0.97 -0.25 0.00 -2.04 0.00 0.00 64.34 60.90 1fl1 n VAL 30 Cb 0.56 0.54 -0.02 0.00 -1.47 0.00 0.00 33.84 33.45 1fl1 n VAL 30 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1fl1 n THR 31 N 0.37 2.79 -0.50 3.34 -2.24 -1.26 -2.41 114.28 114.38 1fl1 n THR 31 Ca 0.10 -1.67 0.00 0.00 -2.27 0.00 0.00 64.05 60.21 1fl1 n THR 31 Cb 0.39 -2.22 0.00 0.00 -2.10 0.00 0.00 70.33 66.40 1fl1 n THR 31 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1fl1 n ASP 32 N 4.11 0.00 -0.26 3.42 10.43 -1.26 -4.89 116.55 128.10 1fl1 n ASP 32 Ca 0.51 -0.16 0.02 0.00 2.57 0.00 0.00 54.79 57.73 1fl1 n ASP 32 Cb 0.15 0.00 0.05 0.00 1.84 0.00 0.00 41.12 43.16 1fl1 n ASP 32 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1fl1 n TYR 33 N 0.00 0.13 -3.85 1.24 4.02 -1.01 -4.98 117.16 112.71 1fl1 n TYR 33 Ca 0.00 -0.32 -0.26 0.00 -0.01 0.00 0.00 57.90 57.31 1fl1 n TYR 33 Cb 0.04 -0.03 -0.03 0.00 -0.02 0.00 0.00 39.34 39.31 1fl1 n TYR 33 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1fl1 s LEU 34 N -0.79 4.29 0.61 7.72 1.43 -1.25 -4.46 118.68 126.24 1fl1 s LEU 34 Ca 0.09 0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 53.40 1fl1 s LEU 34 Cb 0.05 -3.00 0.04 0.00 0.03 0.00 0.00 46.19 43.31 1fl1 s LEU 34 CO 0.07 0.00 0.88 -2.16 0.23 0.00 0.00 176.35 175.37 1fl1 s PRO 35 N -3.34 2.51 -0.30 1.29 0.04 -1.26 -5.00 135.00 128.94 1fl1 s PRO 35 Ca 0.36 -0.43 -0.02 0.00 0.04 0.00 0.00 61.00 60.96 1fl1 s PRO 35 Cb -0.11 -2.33 0.05 0.00 0.04 0.00 0.00 34.50 32.15 1fl1 s PRO 35 CO 0.29 -0.88 -0.01 0.08 0.04 0.00 0.00 177.00 176.52 1fl1 s VAL 36 N -2.97 2.95 -0.77 -0.36 1.01 -0.83 -4.93 120.40 114.50 1fl1 s VAL 36 Ca 0.57 -1.40 0.22 0.00 0.00 0.00 0.00 61.98 61.37 1fl1 s VAL 36 Cb -0.10 -2.70 -0.23 0.00 0.00 0.00 0.00 36.38 33.35 1fl1 s VAL 36 CO 0.42 -0.10 0.86 0.35 0.00 0.00 0.00 175.10 176.62 1fl1 n THR 37 N 4.61 0.02 -2.75 3.92 -2.24 -1.26 -1.26 114.28 115.32 1fl1 n THR 37 Ca -0.13 -0.12 -0.40 0.00 -2.27 0.00 0.00 64.05 61.12 1fl1 n THR 37 Cb 0.43 0.69 -0.05 0.00 -2.10 0.00 0.00 70.33 69.30 1fl1 n THR 37 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1fl1 s GLU 38 N -3.12 4.78 -0.05 -0.78 2.12 -1.26 -4.62 118.70 115.77 1fl1 s GLU 38 Ca 0.05 1.46 -0.33 0.00 0.36 0.00 0.00 54.97 56.51 1fl1 s GLU 38 Cb 0.16 -3.32 -0.11 0.00 0.26 0.00 0.00 34.13 31.11 1fl1 s GLU 38 CO 0.86 0.38 1.90 -2.30 -0.54 0.00 0.00 175.26 175.57 1fl1 n PRO 39 N 2.09 2.35 -4.14 4.30 -0.02 -1.26 -4.82 135.00 133.49 1fl1 n PRO 39 Ca -0.00 0.86 -0.31 0.00 -2.02 0.00 0.00 63.50 62.03 1fl1 n PRO 39 Cb 0.48 -2.74 -0.08 0.00 -0.02 0.00 0.00 33.50 31.15 1fl1 n PRO 39 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1fl1 s LEU 40 N 4.13 3.66 0.43 2.45 1.43 -1.26 -4.86 118.68 124.67 1fl1 s LEU 40 Ca 0.92 -0.02 -0.24 0.00 -1.03 0.00 0.00 54.13 53.76 1fl1 s LEU 40 Cb -0.63 -2.25 -0.08 0.00 0.03 0.00 0.00 46.19 43.27 1fl1 s LEU 40 CO 0.49 0.22 1.19 -2.84 0.23 0.00 0.00 176.35 175.65 1fl1 s PRO 41 N -2.01 3.88 -0.25 1.29 0.02 -1.26 -0.68 135.00 136.00 1fl1 s PRO 41 Ca 0.24 1.87 -0.07 0.00 0.02 0.00 0.00 61.00 63.07 1fl1 s PRO 41 Cb -0.12 -2.56 -0.03 0.00 0.02 0.00 0.00 34.50 31.82 1fl1 s PRO 41 CO 0.16 -0.47 0.07 0.42 -0.33 0.00 0.00 177.00 176.85 1fl1 s ILE 42 N -1.44 4.25 0.45 2.83 1.01 0.39 -1.71 121.20 126.98 1fl1 s ILE 42 Ca 0.60 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 61.04 1fl1 s ILE 42 Cb -0.31 -3.00 0.01 0.00 0.01 0.00 0.00 42.46 39.16 1fl1 s ILE 42 CO 0.39 0.32 0.04 0.35 0.00 0.00 0.00 174.94 176.04 1fl1 n THR 43 N 4.92 0.00 -4.33 2.92 -2.24 0.35 -0.11 114.28 115.78 1fl1 n THR 43 Ca -0.16 -2.06 -0.33 0.00 -2.27 0.00 0.00 64.05 59.22 1fl1 n THR 43 Cb 0.51 0.36 -0.15 0.00 -2.10 0.00 0.00 70.33 68.95 1fl1 n THR 43 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1fl1 s ILE 44 N -2.57 2.59 -1.52 2.28 1.01 -1.18 -0.00 121.20 121.82 1fl1 s ILE 44 Ca 0.03 -0.78 -0.15 0.00 0.00 0.00 0.00 60.65 59.75 1fl1 s ILE 44 Cb -0.00 -2.11 0.13 0.00 0.01 0.00 0.00 42.46 40.49 1fl1 s ILE 44 CO 0.02 0.51 0.67 -0.62 0.00 0.00 0.00 174.94 175.52 1fl1 n GLU 45 N 4.33 -3.16 -1.54 2.79 -0.58 -0.23 -0.59 120.64 121.66 1fl1 n GLU 45 Ca -0.19 0.38 -0.15 0.00 -0.42 0.00 0.00 57.16 56.77 1fl1 n GLU 45 Cb 0.51 -5.10 -0.06 0.00 -0.57 0.00 0.00 31.44 26.23 1fl1 n GLU 45 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1fl1 n HIS 46 N -4.16 -0.38 -3.07 -0.32 8.25 -1.26 -4.94 115.22 109.33 1fl1 n HIS 46 Ca 0.05 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.16 1fl1 n HIS 46 Cb 0.50 -2.85 -0.06 0.00 1.12 0.00 0.00 29.99 28.70 1fl1 n HIS 46 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1fl1 s LEU 47 N -4.19 4.30 0.59 2.41 1.43 0.24 -5.06 118.68 118.41 1fl1 s LEU 47 Ca 0.00 1.44 -0.15 0.00 -1.03 0.00 0.00 54.13 54.39 1fl1 s LEU 47 Cb 0.00 -3.71 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 1fl1 s LEU 47 CO 0.00 -0.02 1.05 -2.16 0.23 0.00 0.00 176.35 175.45 1fl1 s PRO 48 N -2.14 3.36 -1.59 1.29 0.04 -1.26 -3.68 135.00 131.02 1fl1 s PRO 48 Ca 0.45 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1fl1 s PRO 48 Cb -0.16 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.34 1fl1 s PRO 48 CO 0.21 -0.78 0.00 0.39 0.04 0.00 0.00 177.00 176.86 1fl1 n GLU 49 N -2.08 -1.36 -1.28 4.56 1.02 -1.26 -4.65 120.64 115.59 1fl1 n GLU 49 Ca 0.08 0.91 -0.05 0.00 -0.02 0.00 0.00 57.16 58.09 1fl1 n GLU 49 Cb 0.53 -5.33 0.12 0.00 -0.02 0.00 0.00 31.44 26.74 1fl1 n GLU 49 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1fl1 n THR 50 N -3.65 2.13 -2.29 2.62 -2.24 -1.16 -1.53 114.28 108.16 1fl1 n THR 50 Ca -0.20 -3.43 -0.42 0.00 -2.27 0.00 0.00 64.05 57.73 1fl1 n THR 50 Cb 0.64 -0.40 -0.03 0.00 -2.10 0.00 0.00 70.33 68.44 1fl1 n THR 50 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1fl1 s GLU 51 N -3.17 4.29 -0.00 -0.78 2.02 -0.73 -3.09 118.70 117.23 1fl1 s GLU 51 Ca 0.42 1.87 0.08 0.00 0.02 0.00 0.00 54.97 57.35 1fl1 s GLU 51 Cb 0.38 -3.62 -0.10 0.00 0.10 0.00 0.00 34.13 30.90 1fl1 s GLU 51 CO -0.04 -0.58 0.29 1.33 0.02 0.00 0.00 175.26 176.29 1fl1 n VAL 52 N 4.79 0.00 -2.94 2.63 0.24 0.84 -3.79 118.33 120.10 1fl1 n VAL 52 Ca 0.13 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 1fl1 n VAL 52 Cb 0.44 0.82 0.00 0.00 -1.47 0.00 0.00 33.84 33.63 1fl1 n VAL 52 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fl1 n GLY 53 N 1.41 -0.55 3.07 7.63 0.00 -1.22 -0.08 105.19 115.45 1fl1 n GLY 53 Ca 0.01 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 1fl1 n GLY 53 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1fl1 s TRP 54 N -3.14 0.69 0.44 1.61 0.52 -0.78 -0.46 118.94 117.82 1fl1 s TRP 54 Ca 0.00 -0.55 -0.22 0.00 0.02 0.00 0.00 56.10 55.35 1fl1 s TRP 54 Cb 0.00 -0.41 -0.09 0.00 -1.15 0.00 0.00 33.47 31.82 1fl1 s TRP 54 CO 0.00 -0.09 1.04 0.95 0.02 0.00 0.00 176.95 178.87 1fl1 s THR 55 N -1.63 3.75 -0.17 2.01 -4.23 0.15 -0.90 115.64 114.62 1fl1 s THR 55 Ca -0.08 1.22 0.17 0.00 -1.18 0.00 0.00 61.69 61.82 1fl1 s THR 55 Cb -0.08 -3.57 0.43 0.00 1.34 0.00 0.00 72.50 70.62 1fl1 s THR 55 CO -0.00 -0.11 1.31 0.18 -0.54 0.00 0.00 174.62 175.46 1fl1 n LEU 56 N -0.49 3.25 0.00 4.79 4.77 0.58 -4.03 117.00 125.87 1fl1 n LEU 56 Ca 0.07 -3.11 0.00 0.00 -0.03 0.00 0.00 56.01 52.94 1fl1 n LEU 56 Cb 0.51 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1fl1 n LEU 56 CO 0.42 0.74 0.00 0.61 -1.33 0.00 0.00 177.39 177.83 1fl1 n GLY 57 N -0.93 4.68 3.05 -0.72 0.00 -1.23 -4.38 105.19 105.65 1fl1 n GLY 57 Ca 0.20 -0.81 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 1fl1 n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fl1 s LEU 58 N 0.00 1.79 0.10 0.99 1.43 -0.39 -2.15 118.68 120.45 1fl1 s LEU 58 Ca 0.00 -0.51 0.06 0.00 -1.03 0.00 0.00 54.13 52.64 1fl1 s LEU 58 Cb 0.00 -1.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.95 1fl1 s LEU 58 CO 0.00 -0.03 -0.15 -0.36 0.23 0.00 0.00 176.35 176.04 1fl1 s PHE 59 N 1.36 1.37 -0.08 0.29 0.08 -0.00 -1.96 117.98 119.04 1fl1 s PHE 59 Ca 0.03 -0.52 -0.16 0.00 0.12 0.00 0.00 56.93 56.41 1fl1 s PHE 59 Cb -0.13 -0.73 -0.05 0.00 -0.57 0.00 0.00 43.02 41.54 1fl1 s PHE 59 CO -0.10 0.12 0.41 -1.14 -0.10 0.00 0.00 175.22 174.41 1fl1 s GLN 60 N -2.33 4.14 0.27 0.44 -0.44 -1.26 -0.24 119.66 120.25 1fl1 s GLN 60 Ca 0.05 0.37 0.04 0.00 -2.50 0.00 0.00 55.36 53.31 1fl1 s GLN 60 Cb -0.07 -3.34 -0.03 0.00 -1.64 0.00 0.00 33.01 27.93 1fl1 s GLN 60 CO 0.03 0.40 0.21 0.14 0.50 0.00 0.00 175.29 176.57 1fl1 s VAL 61 N -0.13 0.01 0.25 1.34 -7.23 0.08 -4.93 120.40 109.79 1fl1 s VAL 61 Ca 0.23 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.36 1fl1 s VAL 61 Cb -0.15 -2.50 0.26 0.00 0.56 0.00 0.00 36.38 34.55 1fl1 s VAL 61 CO 0.10 0.00 1.67 0.28 -0.31 0.00 0.00 175.10 176.84 1fl1 h SER 62 N 2.34 -0.06 -0.68 4.85 0.02 -1.97 -2.52 113.55 115.52 1fl1 h SER 62 Ca -0.30 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1fl1 h SER 62 Cb 1.24 0.24 0.00 0.00 0.14 0.00 0.00 62.40 64.02 1fl1 h SER 62 CO 0.44 -0.09 0.00 1.41 -1.14 0.00 0.00 176.83 177.45 1fl1 n HIS 63 N -5.21 0.91 -1.37 3.45 8.25 -1.26 -4.92 115.22 115.06 1fl1 n HIS 63 Ca 0.16 -0.45 0.00 0.00 -0.26 0.00 0.00 57.72 57.16 1fl1 n HIS 63 Cb 0.51 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.62 1fl1 n HIS 63 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fl1 n GLY 64 N 1.59 0.42 3.51 -1.41 0.00 -0.95 -2.11 105.19 106.23 1fl1 n GLY 64 Ca 0.23 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.21 1fl1 n GLY 64 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fl1 s ILE 65 N -2.88 5.26 -0.06 -0.61 1.01 -0.47 -0.74 121.20 122.71 1fl1 s ILE 65 Ca 0.00 -0.36 -0.07 0.00 0.00 0.00 0.00 60.65 60.22 1fl1 s ILE 65 Cb 0.00 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1fl1 s ILE 65 CO 0.00 -0.10 0.20 0.12 0.00 0.00 0.00 174.94 175.16 1fl1 s PHE 66 N 1.71 3.60 0.07 3.97 2.19 0.67 -1.75 117.98 128.43 1fl1 s PHE 66 Ca 0.06 0.55 0.08 0.00 0.33 0.00 0.00 56.93 57.95 1fl1 s PHE 66 Cb -0.18 -1.96 -0.03 0.00 -1.31 0.00 0.00 43.02 39.54 1fl1 s PHE 66 CO 0.10 0.68 -0.21 0.00 1.83 0.00 0.00 175.22 177.63 1fl1 s THR 68 N -0.96 0.56 0.30 0.00 2.01 -0.91 -1.15 115.64 115.47 1fl1 s THR 68 Ca 0.07 -0.91 -0.19 0.00 0.31 0.00 0.00 61.69 60.97 1fl1 s THR 68 Cb -0.09 -0.59 0.06 0.00 0.01 0.00 0.00 72.50 71.89 1fl1 s THR 68 CO 0.03 -0.26 0.85 -0.83 -0.69 0.00 0.00 174.62 173.73 1fl1 s GLY 69 N -1.26 0.17 -0.02 4.40 0.00 0.89 -0.31 107.32 111.19 1fl1 s GLY 69 Ca -0.07 -0.49 0.05 0.00 0.00 0.00 0.00 44.72 44.21 1fl1 s GLY 69 CO 0.00 0.39 -0.15 0.00 0.00 0.00 0.00 173.10 173.34 1fl1 s ALA 70 N -2.65 1.31 -0.44 3.20 0.00 -0.07 -1.27 121.76 121.84 1fl1 s ALA 70 Ca 0.16 -0.66 -0.17 0.00 0.00 0.00 0.00 51.96 51.29 1fl1 s ALA 70 Cb -0.04 -0.36 0.03 0.00 0.00 0.00 0.00 23.12 22.75 1fl1 s ALA 70 CO 0.08 0.30 0.44 0.42 0.00 0.00 0.00 175.76 177.00 1fl1 s ILE 71 N -0.28 5.10 -0.01 0.00 -1.09 0.46 -1.87 121.20 123.51 1fl1 s ILE 71 Ca 0.04 -0.50 0.05 0.00 -2.23 0.00 0.00 60.65 58.02 1fl1 s ILE 71 Cb -0.07 -4.07 -0.08 0.00 -1.58 0.00 0.00 42.46 36.66 1fl1 s ILE 71 CO -0.00 -0.48 0.11 0.35 -1.23 0.00 0.00 174.94 173.69 1fl1 n THR 72 N 5.40 0.05 -1.49 2.92 -2.24 -0.30 -4.24 114.28 114.39 1fl1 n THR 72 Ca -0.08 -0.14 -0.53 0.00 -2.27 0.00 0.00 64.05 61.03 1fl1 n THR 72 Cb 0.47 0.20 -0.07 0.00 -2.10 0.00 0.00 70.33 68.82 1fl1 n THR 72 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1fl1 n SER 73 N -1.76 2.11 -0.25 3.42 2.88 0.89 -4.83 113.62 116.07 1fl1 n SER 73 Ca -0.02 0.59 -0.06 0.00 -1.33 0.00 0.00 58.87 58.05 1fl1 n SER 73 Cb 0.22 -1.21 0.05 0.00 -0.75 0.00 0.00 64.21 62.52 1fl1 n SER 73 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1fl1 h PRO 74 N 10.90 1.01 -0.79 -1.46 0.11 -1.95 0.12 132.00 139.96 1fl1 h PRO 74 Ca -0.30 -0.16 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 1fl1 h PRO 74 Cb 1.33 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 1fl1 h PRO 74 CO 1.01 0.81 0.36 0.00 -0.21 0.00 0.00 178.00 179.97 1fl1 h ALA 75 N 1.15 1.02 -0.19 -0.75 0.00 -1.93 -0.45 119.26 118.11 1fl1 h ALA 75 Ca 0.24 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1fl1 h ALA 75 Cb 0.15 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1fl1 h ALA 75 CO -0.03 0.60 -0.35 0.35 0.00 0.00 0.00 179.25 179.82 1fl1 h PHE 76 N 1.12 0.71 -0.16 0.00 3.04 -1.82 -1.36 116.94 118.47 1fl1 h PHE 76 Ca 0.27 -0.26 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 1fl1 h PHE 76 Cb 0.15 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.52 1fl1 h PHE 76 CO 0.01 0.99 0.06 -0.07 -2.02 0.00 0.00 178.31 177.29 1fl1 h LEU 77 N 0.23 0.19 -0.11 0.59 3.38 -0.52 0.50 115.31 119.57 1fl1 h LEU 77 Ca 0.01 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1fl1 h LEU 77 Cb 0.95 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1fl1 h LEU 77 CO 0.08 0.18 -0.16 -0.33 0.09 0.00 0.00 178.44 178.30 1fl1 h GLU 78 N 0.22 0.30 0.60 1.13 5.08 -0.92 -0.63 114.58 120.36 1fl1 h GLU 78 Ca 0.06 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1fl1 h GLU 78 Cb 0.05 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1fl1 h GLU 78 CO -0.01 0.75 -0.38 1.25 -1.00 0.00 0.00 179.01 179.62 1fl1 h LEU 79 N -0.13 -0.96 -1.26 1.33 6.46 -0.15 0.11 115.31 120.71 1fl1 h LEU 79 Ca 0.01 0.06 0.13 0.00 -0.12 0.00 0.00 57.88 57.96 1fl1 h LEU 79 Cb 0.72 0.29 -0.07 0.00 -0.73 0.00 0.00 40.66 40.87 1fl1 h LEU 79 CO 0.04 -0.59 0.57 0.00 -0.62 0.00 0.00 178.44 177.84 1fl1 h ALA 80 N -0.63 1.78 -0.33 1.25 0.00 -0.08 0.26 119.26 121.52 1fl1 h ALA 80 Ca -0.07 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1fl1 h ALA 80 Cb 0.76 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1fl1 h ALA 80 CO 0.07 -0.00 -0.03 1.03 0.00 0.00 0.00 179.25 180.31 1fl1 h SER 81 N 0.74 0.59 -0.50 0.00 0.87 -0.52 -1.69 113.55 113.04 1fl1 h SER 81 Ca 0.44 -0.33 -0.06 0.00 -1.23 0.00 0.00 61.79 60.61 1fl1 h SER 81 Cb 0.63 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1fl1 h SER 81 CO -0.20 0.78 0.11 0.03 -0.53 0.00 0.00 176.83 177.03 1fl1 h ARG 82 N 0.39 0.87 0.02 2.24 3.08 0.58 -2.45 114.38 119.12 1fl1 h ARG 82 Ca 0.09 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 1fl1 h ARG 82 Cb 0.50 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1fl1 h ARG 82 CO 0.02 0.80 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.64 1fl1 h LEU 83 N 0.83 -0.03 -1.87 3.04 4.07 -0.80 -2.80 115.31 117.76 1fl1 h LEU 83 Ca 0.18 -0.03 -0.00 0.00 0.08 0.00 0.00 57.88 58.11 1fl1 h LEU 83 Cb 0.34 0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.08 1fl1 h LEU 83 CO 0.00 0.01 0.07 0.00 -1.08 0.00 0.00 178.44 177.44 1fl1 h ALA 84 N 0.91 1.90 -0.93 1.53 0.00 -1.10 -0.66 119.26 120.92 1fl1 h ALA 84 Ca -0.00 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1fl1 h ALA 84 Cb 0.06 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1fl1 h ALA 84 CO 0.01 0.09 0.61 -0.44 0.00 0.00 0.00 179.25 179.52 1fl1 h ASP 85 N 0.16 1.05 0.00 0.00 3.45 -1.16 -3.15 116.42 116.77 1fl1 h ASP 85 Ca 0.04 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.48 1fl1 h ASP 85 Cb -0.00 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 38.51 1fl1 h ASP 85 CO -0.01 0.75 -1.93 0.35 -1.57 0.00 0.00 179.24 176.83 1fl1 n THR 86 N -4.41 0.00 -0.94 0.35 -2.24 -1.01 -4.83 114.28 101.21 1fl1 n THR 86 Ca 0.11 -0.47 -0.33 0.00 -2.27 0.00 0.00 64.05 61.10 1fl1 n THR 86 Cb 0.04 0.04 0.14 0.00 -2.10 0.00 0.00 70.33 68.45 1fl1 n THR 86 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1fl1 n SER 87 N -2.21 0.53 0.26 3.42 2.88 -0.29 -4.87 113.62 113.34 1fl1 n SER 87 Ca -0.04 0.51 0.15 0.00 -1.33 0.00 0.00 58.87 58.17 1fl1 n SER 87 Cb 0.54 -1.47 0.85 0.00 -0.75 0.00 0.00 64.21 63.38 1fl1 n SER 87 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 1fl1 h HIS 88 N -1.27 0.00 0.00 0.66 -0.00 -1.90 -1.67 115.15 110.97 1fl1 h HIS 88 Ca -0.45 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 59.92 1fl1 h HIS 88 Cb 1.29 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.70 1fl1 h HIS 88 CO 0.47 0.00 -0.00 -0.39 -0.00 0.00 0.00 177.93 178.00 1fl1 h VAL 89 N 0.00 0.03 -0.21 5.26 -1.51 -1.89 -1.95 116.25 115.98 1fl1 h VAL 89 Ca 0.03 -0.19 -0.07 0.00 -1.23 0.00 0.00 66.70 65.24 1fl1 h VAL 89 Cb 0.15 1.18 -0.01 0.00 -2.13 0.00 0.00 31.29 30.48 1fl1 h VAL 89 CO -0.00 0.00 -0.18 0.00 -1.23 0.00 0.00 177.57 176.16 1fl1 h ALA 90 N 2.00 1.31 -0.01 5.19 0.00 -1.41 -3.11 119.26 123.22 1fl1 h ALA 90 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1fl1 h ALA 90 Cb 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1fl1 h ALA 90 CO 0.00 0.46 -0.03 2.89 0.00 0.00 0.00 179.25 182.58 1fl1 n ARG 91 N -4.19 0.84 -1.76 0.00 0.00 -0.88 -5.00 116.66 105.66 1fl1 n ARG 91 Ca -0.00 -1.16 -0.42 0.00 -0.00 0.00 0.00 57.85 56.27 1fl1 n ARG 91 Cb 0.33 -1.22 -0.03 0.00 -0.00 0.00 0.00 32.46 31.55 1fl1 n ARG 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1fl1 s ALA 92 N -1.07 3.86 0.53 2.89 0.00 -0.79 -4.93 121.76 122.26 1fl1 s ALA 92 Ca 0.14 1.56 -0.22 0.00 0.00 0.00 0.00 51.96 53.44 1fl1 s ALA 92 Cb 0.10 -3.67 -0.06 0.00 0.00 0.00 0.00 23.12 19.49 1fl1 s ALA 92 CO 0.17 -0.93 1.25 -2.30 0.00 0.00 0.00 175.76 173.95 1fl1 n PRO 93 N 3.37 1.57 -2.18 0.00 -0.02 -1.26 -4.95 135.00 131.54 1fl1 n PRO 93 Ca 0.13 0.58 -0.41 0.00 -2.02 0.00 0.00 63.50 61.78 1fl1 n PRO 93 Cb 0.36 -2.44 -0.03 0.00 -0.02 0.00 0.00 33.50 31.38 1fl1 n PRO 93 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1fl1 s VAL 94 N -1.31 2.98 0.00 -1.45 1.01 -1.26 -4.99 120.40 115.38 1fl1 s VAL 94 Ca 0.70 0.89 0.00 0.00 0.00 0.00 0.00 61.98 63.56 1fl1 s VAL 94 Cb -0.44 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.37 1fl1 s VAL 94 CO 0.51 0.17 0.00 2.29 0.00 0.00 0.00 175.10 178.07 1fl1 n LYS 95 N 1.75 0.00 -0.00 2.72 0.00 -1.26 -4.97 118.16 116.39 1fl1 n LYS 95 Ca 0.03 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.37 1fl1 n LYS 95 Cb 0.42 0.00 -0.05 0.00 -0.00 0.00 0.00 35.03 35.41 1fl1 n LYS 95 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1fl1 n ASN 96 N -0.09 2.81 -4.44 -5.58 3.02 -1.26 -5.05 115.26 104.68 1fl1 n ASN 96 Ca 0.00 -0.15 -0.26 0.00 -0.03 0.00 0.00 54.58 54.14 1fl1 n ASN 96 Cb 0.00 1.22 -0.11 0.00 -0.61 0.00 0.00 39.78 40.28 1fl1 n ASN 96 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1fl1 s LEU 97 N -3.17 2.48 0.87 3.41 1.43 -1.26 -5.05 118.68 117.39 1fl1 s LEU 97 Ca -0.01 -0.90 -0.10 0.00 -1.03 0.00 0.00 54.13 52.09 1fl1 s LEU 97 Cb 0.04 -1.16 0.12 0.00 0.03 0.00 0.00 46.19 45.22 1fl1 s LEU 97 CO 0.26 0.10 1.12 -2.16 0.23 0.00 0.00 176.35 175.90 1fl1 s PRO 98 N -2.86 1.38 0.00 1.29 0.04 -1.26 -4.89 135.00 128.70 1fl1 s PRO 98 Ca 0.23 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.33 1fl1 s PRO 98 Cb -0.07 -1.78 -0.06 0.00 0.04 0.00 0.00 34.50 32.62 1fl1 s PRO 98 CO 0.11 -2.32 1.51 0.15 0.04 0.00 0.00 177.00 176.49 1fl1 s LYS 99 N -4.74 4.24 -0.49 4.56 -0.14 -1.26 -4.97 119.74 116.93 1fl1 s LYS 99 Ca 0.65 2.10 0.04 0.00 -1.36 0.00 0.00 55.97 57.40 1fl1 s LYS 99 Cb -0.21 -3.65 0.17 0.00 -1.68 0.00 0.00 37.83 32.46 1fl1 s LYS 99 CO 0.57 -0.67 0.39 0.39 -0.76 0.00 0.00 175.35 175.28 1fl1 n GLU 100 N 5.77 0.68 -0.29 1.68 -0.58 -1.26 -5.01 120.64 121.63 1fl1 n GLU 100 Ca 0.15 -3.55 0.12 0.00 -0.42 0.00 0.00 57.16 53.46 1fl1 n GLU 100 Cb 0.43 -1.83 0.28 0.00 -0.57 0.00 0.00 31.44 29.74 1fl1 n GLU 100 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1fl1 h PRO 101 N 5.50 0.23 0.47 3.49 0.11 -1.93 0.54 132.00 140.41 1fl1 h PRO 101 Ca 0.23 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.31 1fl1 h PRO 101 Cb 0.86 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 1fl1 h PRO 101 CO 0.47 0.15 -0.31 1.25 -0.21 0.00 0.00 178.00 179.36 1fl1 h LEU 102 N 0.24 -0.78 -0.70 2.35 6.46 -1.94 0.34 115.31 121.28 1fl1 h LEU 102 Ca 0.54 0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 58.33 1fl1 h LEU 102 Cb 1.06 0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 41.19 1fl1 h LEU 102 CO -0.62 -0.48 0.38 -0.07 -0.62 0.00 0.00 178.44 177.03 1fl1 h LEU 103 N -0.75 0.87 -0.66 2.25 3.38 -1.77 -1.84 115.31 116.80 1fl1 h LEU 103 Ca -0.05 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 1fl1 h LEU 103 Cb 0.62 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1fl1 h LEU 103 CO 0.04 0.72 -0.12 -0.33 0.09 0.00 0.00 178.44 178.84 1fl1 h GLU 104 N 0.96 0.92 -0.41 1.13 5.08 -0.69 -1.36 114.58 120.21 1fl1 h GLU 104 Ca 0.25 -0.33 -0.10 0.00 -1.00 0.00 0.00 59.36 58.17 1fl1 h GLU 104 Cb 0.04 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1fl1 h GLU 104 CO -0.04 0.99 -0.17 0.97 -1.00 0.00 0.00 179.01 179.76 1fl1 h ILE 105 N 0.82 1.26 -0.81 3.13 6.09 -0.14 -2.14 117.51 125.73 1fl1 h ILE 105 Ca 0.13 -1.25 -0.03 0.00 -1.37 0.00 0.00 64.86 62.33 1fl1 h ILE 105 Cb 0.65 1.13 -0.04 0.00 0.47 0.00 0.00 36.82 39.03 1fl1 h ILE 105 CO 0.05 0.42 0.37 -0.07 -3.07 0.00 0.00 178.15 175.85 1fl1 h LEU 106 N 0.69 1.07 -0.38 2.19 3.38 -1.01 0.79 115.31 122.05 1fl1 h LEU 106 Ca 0.11 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1fl1 h LEU 106 Cb 0.66 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1fl1 h LEU 106 CO 0.05 0.92 0.00 1.41 0.09 0.00 0.00 178.44 180.91 1fl1 n HIS 107 N -4.30 0.63 -0.04 1.13 8.25 -0.54 -0.53 115.22 119.82 1fl1 n HIS 107 Ca 0.08 0.23 -0.20 0.00 -0.26 0.00 0.00 57.72 57.57 1fl1 n HIS 107 Cb 0.15 -0.87 -0.13 0.00 1.12 0.00 0.00 29.99 30.26 1fl1 n HIS 107 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1fl1 n THR 108 N -2.05 1.68 -0.06 1.59 -1.04 -0.65 -4.32 114.28 109.43 1fl1 n THR 108 Ca 0.03 -0.64 -0.04 0.00 -2.04 0.00 0.00 64.05 61.37 1fl1 n THR 108 Cb 0.27 -1.59 -0.02 0.00 -1.82 0.00 0.00 70.33 67.16 1fl1 n THR 108 CO 0.00 0.00 0.00 -0.25 -0.64 0.00 0.00 175.07 174.18 1fl1 h TRP 109 N 0.05 0.00 -2.14 -1.42 7.01 -0.81 -3.43 115.95 115.21 1fl1 h TRP 109 Ca -0.47 0.00 -0.58 0.00 2.11 0.00 0.00 58.89 59.95 1fl1 h TRP 109 Cb 2.00 0.00 -0.41 0.00 -2.10 0.00 0.00 29.16 28.65 1fl1 h TRP 109 CO 0.06 0.18 -0.76 1.28 -2.79 0.00 0.00 178.44 176.41 1fl1 n LEU 110 N -4.70 2.75 0.00 0.65 4.77 0.31 -4.20 117.00 116.58 1fl1 n LEU 110 Ca -0.05 -5.25 0.11 0.00 -0.03 0.00 0.00 56.01 50.79 1fl1 n LEU 110 Cb 0.16 -0.25 0.47 0.00 -2.33 0.00 0.00 43.42 41.47 1fl1 n LEU 110 CO 0.07 2.10 0.85 -0.81 -1.33 0.00 0.00 177.39 178.27 1fl1 n PRO 111 N 0.87 0.00 -4.06 3.23 -0.04 -1.02 -4.36 135.00 129.61 1fl1 n PRO 111 Ca 0.27 0.12 -0.22 0.00 -0.04 0.00 0.00 63.50 63.64 1fl1 n PRO 111 Cb 0.45 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.36 1fl1 n PRO 111 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1fl1 s GLY 112 N -3.00 1.71 -0.02 0.55 0.00 0.99 -0.35 107.32 107.20 1fl1 s GLY 112 Ca 0.11 -1.65 0.06 0.00 0.00 0.00 0.00 44.72 43.24 1fl1 s GLY 112 CO 0.40 -1.63 -0.20 1.08 0.00 0.00 0.00 173.10 172.76 1fl1 s LEU 113 N -3.85 2.03 -0.09 0.66 1.43 -0.24 -0.26 118.68 118.35 1fl1 s LEU 113 Ca 0.36 -0.36 -0.03 0.00 -1.03 0.00 0.00 54.13 53.07 1fl1 s LEU 113 Cb -0.05 -1.02 0.05 0.00 0.03 0.00 0.00 46.19 45.19 1fl1 s LEU 113 CO 0.24 0.23 0.17 -0.55 0.23 0.00 0.00 176.35 176.67 1fl1 s SER 114 N -0.40 0.63 0.04 2.29 0.15 0.32 -4.70 113.70 112.03 1fl1 s SER 114 Ca 0.06 0.35 -0.20 0.00 0.70 0.00 0.00 55.95 56.86 1fl1 s SER 114 Cb -0.08 0.30 -0.06 0.00 -1.71 0.00 0.00 66.02 64.47 1fl1 s SER 114 CO -0.00 -0.23 0.60 -0.22 1.20 0.00 0.00 173.24 174.58 1fl1 s LEU 115 N 2.19 4.47 -0.06 3.45 2.96 -1.26 0.88 118.68 131.30 1fl1 s LEU 115 Ca 0.02 1.23 0.02 0.00 -0.22 0.00 0.00 54.13 55.18 1fl1 s LEU 115 Cb -0.12 -2.94 -0.03 0.00 0.50 0.00 0.00 46.19 43.61 1fl1 s LEU 115 CO -0.06 0.18 -0.12 -0.94 -1.32 0.00 0.00 176.35 174.09 1fl1 s SER 116 N -0.61 4.24 0.21 3.68 1.04 -0.21 -4.97 113.70 117.08 1fl1 s SER 116 Ca 0.31 -0.15 -0.13 0.00 0.48 0.00 0.00 55.95 56.46 1fl1 s SER 116 Cb -0.19 -1.03 0.00 0.00 0.10 0.00 0.00 66.02 64.90 1fl1 s SER 116 CO 0.18 0.33 0.43 -0.94 0.98 0.00 0.00 173.24 174.23 1fl1 s SER 117 N -0.65 -0.10 0.30 7.02 1.04 -1.26 -2.10 113.70 117.95 1fl1 s SER 117 Ca 0.10 -0.78 -0.12 0.00 0.48 0.00 0.00 55.95 55.63 1fl1 s SER 117 Cb -0.11 0.54 -0.08 0.00 0.10 0.00 0.00 66.02 66.47 1fl1 s SER 117 CO 0.01 -1.04 0.67 -0.63 0.98 0.00 0.00 173.24 173.24 1fl1 s ILE 118 N -3.96 4.80 0.40 -1.02 1.01 -1.23 -4.99 121.20 116.20 1fl1 s ILE 118 Ca 0.17 0.69 -0.04 0.00 0.00 0.00 0.00 60.65 61.46 1fl1 s ILE 118 Cb 0.01 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 1fl1 s ILE 118 CO 0.03 -0.21 0.67 -1.38 0.00 0.00 0.00 174.94 174.05 1fl1 s HIS 119 N -1.99 3.52 -0.11 3.97 -0.00 -1.26 -5.04 115.29 114.37 1fl1 s HIS 119 Ca 0.51 0.68 -0.30 0.00 -0.00 0.00 0.00 55.06 55.96 1fl1 s HIS 119 Cb -0.11 -2.17 -0.01 0.00 -0.00 0.00 0.00 32.58 30.29 1fl1 s HIS 119 CO 0.21 -0.06 1.08 -1.25 -0.00 0.00 0.00 174.74 174.73 1fl1 s PRO 120 N -4.27 4.37 0.00 -0.38 0.04 -1.26 -5.11 135.00 128.39 1fl1 s PRO 120 Ca 0.45 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.97 1fl1 s PRO 120 Cb -0.10 -3.57 0.00 0.00 0.04 0.00 0.00 34.50 30.87 1fl1 s PRO 120 CO 0.38 -0.42 0.00 -0.35 0.04 0.00 0.00 177.00 176.65 1fl1 n PRO 130 N 5.34 -0.99 0.08 0.56 -0.04 -1.26 -4.91 135.00 133.78 1fl1 n PRO 130 Ca 0.10 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.53 1fl1 n PRO 130 Cb 0.47 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.86 1fl1 n PRO 130 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1fl1 h VAL 131 N 0.00 1.31 -4.43 0.52 2.07 -1.98 -3.44 116.25 110.30 1fl1 h VAL 131 Ca 0.00 -2.89 -0.70 0.00 0.82 0.00 0.00 66.70 63.93 1fl1 h VAL 131 Cb 0.00 2.64 -0.28 0.00 -1.52 0.00 0.00 31.29 32.12 1fl1 h VAL 131 CO 0.00 0.75 -0.86 -0.36 0.02 0.00 0.00 177.57 177.12 1fl1 s PHE 132 N -2.80 2.43 -0.22 1.57 0.40 -1.26 -3.52 117.98 114.58 1fl1 s PHE 132 Ca 0.01 -0.39 -0.07 0.00 -0.60 0.00 0.00 56.93 55.89 1fl1 s PHE 132 Cb 0.09 -1.54 -0.19 0.00 0.51 0.00 0.00 43.02 41.89 1fl1 s PHE 132 CO 0.79 0.01 -0.03 1.04 0.70 0.00 0.00 175.22 177.73 1fl1 n GLN 133 N 2.44 0.66 -3.78 0.44 3.00 -0.89 -5.01 117.38 114.23 1fl1 n GLN 133 Ca -0.16 0.26 -0.02 0.00 -0.01 0.00 0.00 57.00 57.06 1fl1 n GLN 133 Cb 0.51 -1.60 -0.00 0.00 0.00 0.00 0.00 30.24 29.16 1fl1 n GLN 133 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.06 173.68 1fl1 s HIS 134 N -2.51 -0.05 -0.09 1.08 -3.43 -1.25 -4.08 115.29 104.96 1fl1 s HIS 134 Ca -0.32 -0.25 0.04 0.00 -0.80 0.00 0.00 55.06 53.73 1fl1 s HIS 134 Cb 0.09 0.64 -0.01 0.00 -1.43 0.00 0.00 32.58 31.88 1fl1 s HIS 134 CO 0.62 -0.77 -0.21 0.08 -2.00 0.00 0.00 174.74 172.47 1fl1 s VAL 135 N -2.80 2.39 -0.08 -5.38 1.01 -0.70 -1.05 120.40 113.80 1fl1 s VAL 135 Ca 0.16 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.23 1fl1 s VAL 135 Cb -0.01 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1fl1 s VAL 135 CO 0.02 0.56 -0.11 -0.44 0.00 0.00 0.00 175.10 175.13 1fl1 s SER 136 N 0.06 4.29 0.02 3.32 0.01 0.25 -0.50 113.70 121.16 1fl1 s SER 136 Ca -0.09 -0.15 -0.24 0.00 1.31 0.00 0.00 55.95 56.78 1fl1 s SER 136 Cb -0.15 -1.14 -0.05 0.00 0.21 0.00 0.00 66.02 64.89 1fl1 s SER 136 CO 0.06 0.31 0.73 -0.76 0.41 0.00 0.00 173.24 173.99 1fl1 s LEU 137 N -0.52 4.42 0.22 2.44 1.43 1.00 -0.52 118.68 127.16 1fl1 s LEU 137 Ca 0.07 1.37 -0.07 0.00 -1.03 0.00 0.00 54.13 54.47 1fl1 s LEU 137 Cb -0.12 -3.17 -0.02 0.00 0.03 0.00 0.00 46.19 42.91 1fl1 s LEU 137 CO 0.02 0.00 0.31 0.00 0.23 0.00 0.00 176.35 176.91 1fl1 h ALA 139 N 2.44 1.41 -1.93 0.00 0.00 -1.87 0.29 119.26 119.60 1fl1 h ALA 139 Ca -0.31 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.51 1fl1 h ALA 139 Cb 1.25 -0.22 -0.22 0.00 0.00 0.00 0.00 17.79 18.60 1fl1 h ALA 139 CO 0.44 0.46 0.08 -1.17 0.00 0.00 0.00 179.25 179.06 1fl1 s LEU 140 N -9.47 -0.88 0.40 0.00 2.96 -1.26 -4.41 118.68 106.01 1fl1 s LEU 140 Ca -0.09 1.41 -0.25 0.00 -0.22 0.00 0.00 54.13 54.98 1fl1 s LEU 140 Cb 0.16 2.30 -0.09 0.00 0.50 0.00 0.00 46.19 49.07 1fl1 s LEU 140 CO 0.78 -0.22 1.15 -0.83 -1.32 0.00 0.00 176.35 175.91 1fl1 s GLY 141 N 1.57 2.86 0.31 7.98 0.00 -1.26 -4.91 107.32 113.87 1fl1 s GLY 141 Ca -0.10 0.94 0.13 0.00 0.00 0.00 0.00 44.72 45.69 1fl1 s GLY 141 CO -0.19 1.45 1.64 -0.09 0.00 0.00 0.00 173.10 175.91 1fl1 h ARG 142 N 2.66 0.00 -5.84 2.90 2.43 -1.96 -3.43 114.38 111.14 1fl1 h ARG 142 Ca -0.49 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.05 1fl1 h ARG 142 Cb 1.23 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.72 1fl1 h ARG 142 CO 0.63 0.54 -0.38 1.03 -1.51 0.00 0.00 179.97 180.27 1fl1 s ARG 143 N -3.58 3.60 0.58 0.20 0.52 -1.26 -5.08 118.95 113.93 1fl1 s ARG 143 Ca -0.01 -0.00 -0.18 0.00 -0.52 0.00 0.00 55.73 55.02 1fl1 s ARG 143 Cb 0.12 -3.14 -0.04 0.00 0.52 0.00 0.00 34.95 32.41 1fl1 s ARG 143 CO 0.74 0.70 1.15 1.03 0.02 0.00 0.00 175.30 178.93 1fl1 s ARG 144 N -1.40 3.13 -0.52 3.54 1.81 -1.26 -3.41 118.95 120.82 1fl1 s ARG 144 Ca 0.23 1.62 0.00 0.00 -1.72 0.00 0.00 55.73 55.86 1fl1 s ARG 144 Cb -0.13 -1.97 0.00 0.00 -0.45 0.00 0.00 34.95 32.39 1fl1 s ARG 144 CO 0.12 -1.03 0.00 0.41 -0.68 0.00 0.00 175.30 174.12 1fl1 n GLY 145 N 0.12 0.70 2.19 -3.53 0.00 -1.26 -4.28 105.19 99.14 1fl1 n GLY 145 Ca 0.12 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 1fl1 n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fl1 n THR 146 N -2.62 3.36 -3.13 2.61 -2.24 -1.22 -4.46 114.28 106.57 1fl1 n THR 146 Ca -0.05 -2.51 -0.39 0.00 -2.27 0.00 0.00 64.05 58.84 1fl1 n THR 146 Cb 0.28 -1.19 -0.06 0.00 -2.10 0.00 0.00 70.33 67.26 1fl1 n THR 146 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1fl1 s VAL 147 N -4.01 4.58 0.47 2.28 0.11 -1.26 -1.08 120.40 121.49 1fl1 s VAL 147 Ca 0.54 1.45 -0.02 0.00 -2.93 0.00 0.00 61.98 61.02 1fl1 s VAL 147 Cb 0.43 -4.01 -0.01 0.00 -1.53 0.00 0.00 36.38 31.26 1fl1 s VAL 147 CO -0.00 0.53 0.72 0.00 -3.33 0.00 0.00 175.10 173.01 1fl1 s ALA 148 N -1.05 3.62 -0.10 1.54 0.00 0.53 -4.40 121.76 121.90 1fl1 s ALA 148 Ca 0.32 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1fl1 s ALA 148 Cb -0.21 -2.28 0.02 0.00 0.00 0.00 0.00 23.12 20.65 1fl1 s ALA 148 CO 0.22 -0.42 -0.10 0.08 0.00 0.00 0.00 175.76 175.55 1fl1 s VAL 149 N -2.64 1.11 -0.03 0.00 1.01 -0.22 -4.93 120.40 114.70 1fl1 s VAL 149 Ca 0.48 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 1fl1 s VAL 149 Cb -0.10 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 1fl1 s VAL 149 CO 0.40 0.37 0.04 -0.31 0.00 0.00 0.00 175.10 175.60 1fl1 s TYR 150 N 1.36 3.21 0.11 5.22 2.02 -1.26 -1.71 117.35 126.31 1fl1 s TYR 150 Ca -0.01 0.19 -0.26 0.00 -0.37 0.00 0.00 57.07 56.62 1fl1 s TYR 150 Cb -0.14 -1.75 0.08 0.00 -0.40 0.00 0.00 41.96 39.76 1fl1 s TYR 150 CO -0.05 0.52 1.06 0.20 -1.57 0.00 0.00 175.55 175.71 1fl1 s GLY 151 N -1.41 -0.25 0.01 0.71 0.00 -0.37 -4.85 107.32 101.16 1fl1 s GLY 151 Ca 0.19 0.23 0.22 0.00 0.00 0.00 0.00 44.72 45.36 1fl1 s GLY 151 CO 0.09 0.28 0.87 1.42 0.00 0.00 0.00 173.10 175.76 1fl1 n HIS 152 N -0.50 0.07 -3.94 1.90 8.25 -1.26 0.69 115.22 120.44 1fl1 n HIS 152 Ca -0.06 0.02 -0.34 0.00 -0.26 0.00 0.00 57.72 57.08 1fl1 n HIS 152 Cb 0.61 -0.24 -0.14 0.00 1.12 0.00 0.00 29.99 31.34 1fl1 n HIS 152 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1fl1 s ASP 153 N -3.58 4.84 0.21 0.41 3.68 -1.26 -4.49 116.67 116.48 1fl1 s ASP 153 Ca 0.04 -1.53 -0.09 0.00 2.13 0.00 0.00 52.55 53.10 1fl1 s ASP 153 Cb 0.15 -1.68 0.31 0.00 -1.45 0.00 0.00 42.92 40.24 1fl1 s ASP 153 CO 0.85 -0.30 1.73 0.00 0.13 0.00 0.00 175.17 177.57 1fl1 h ALA 154 N 7.91 0.79 -0.28 3.66 0.00 -1.96 0.18 119.26 129.55 1fl1 h ALA 154 Ca -0.17 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1fl1 h ALA 154 Cb 1.05 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1fl1 h ALA 154 CO 0.54 -0.24 0.18 1.49 0.00 0.00 0.00 179.25 181.21 1fl1 h GLU 155 N 0.35 0.37 -0.38 0.00 4.81 -1.99 -0.11 114.58 117.64 1fl1 h GLU 155 Ca 0.32 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.55 1fl1 h GLU 155 Cb 0.44 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 1fl1 h GLU 155 CO -0.36 0.27 0.20 2.35 -0.73 0.00 0.00 179.01 180.75 1fl1 h TRP 156 N 0.36 0.37 -0.14 0.92 7.01 -1.80 0.13 115.95 122.81 1fl1 h TRP 156 Ca 0.10 0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.16 1fl1 h TRP 156 Cb -0.01 -0.11 -0.05 0.00 -2.10 0.00 0.00 29.16 26.89 1fl1 h TRP 156 CO -0.05 0.20 -0.15 0.28 -2.79 0.00 0.00 178.44 175.94 1fl1 h VAL 157 N 0.41 0.60 -0.16 2.65 2.07 -0.15 -2.20 116.25 119.47 1fl1 h VAL 157 Ca 0.16 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.53 1fl1 h VAL 157 Cb 0.05 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1fl1 h VAL 157 CO -0.10 0.00 -0.54 0.58 0.02 0.00 0.00 177.57 177.53 1fl1 h VAL 158 N -0.18 1.33 0.00 2.57 2.07 -0.76 -2.76 116.25 118.53 1fl1 h VAL 158 Ca 0.10 -1.80 0.00 0.00 0.82 0.00 0.00 66.70 65.82 1fl1 h VAL 158 Cb 0.32 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1fl1 h VAL 158 CO -0.24 0.55 0.00 0.77 0.02 0.00 0.00 177.57 178.67 1fl1 h SER 159 N 0.35 0.00 0.48 0.57 4.64 -0.35 -2.12 113.55 117.12 1fl1 h SER 159 Ca 0.01 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 1fl1 h SER 159 Cb 1.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1fl1 h SER 159 CO 0.10 0.00 -0.07 0.03 -0.87 0.00 0.00 176.83 176.01 1fl1 h ARG 160 N 0.00 0.00 -4.82 4.77 -0.00 -1.10 -3.39 114.38 109.85 1fl1 h ARG 160 Ca 0.00 0.00 -0.69 0.00 -0.50 0.00 0.00 59.98 58.79 1fl1 h ARG 160 Cb 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 29.97 29.93 1fl1 h ARG 160 CO 0.00 0.07 0.28 -0.06 0.00 0.00 0.00 179.97 180.26 1fl1 s PHE 161 N -4.03 2.99 -0.99 3.04 0.08 -0.80 0.14 117.98 118.41 1fl1 s PHE 161 Ca -0.02 -0.99 0.14 0.00 0.12 0.00 0.00 56.93 56.18 1fl1 s PHE 161 Cb 0.12 -4.09 0.61 0.00 -0.57 0.00 0.00 43.02 39.09 1fl1 s PHE 161 CO 0.54 -1.37 1.46 -1.13 -0.10 0.00 0.00 175.22 174.62 1fl1 n SER 162 N 6.49 0.02 -0.05 1.36 3.41 -0.72 -1.71 113.62 122.41 1fl1 n SER 162 Ca -0.03 0.50 0.13 0.00 -0.26 0.00 0.00 58.87 59.21 1fl1 n SER 162 Cb 0.44 -0.51 0.50 0.00 -0.26 0.00 0.00 64.21 64.39 1fl1 n SER 162 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1fl1 n SER 163 N -1.52 0.35 -4.42 4.04 3.41 -1.26 -4.66 113.62 109.57 1fl1 n SER 163 Ca 0.03 -0.17 -0.41 0.00 -0.26 0.00 0.00 58.87 58.07 1fl1 n SER 163 Cb 0.17 -0.10 -0.11 0.00 -0.26 0.00 0.00 64.21 63.91 1fl1 n SER 163 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1fl1 s VAL 164 N -2.78 4.82 0.96 -3.33 1.01 -0.69 -4.64 120.40 115.75 1fl1 s VAL 164 Ca 0.19 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.38 1fl1 s VAL 164 Cb 0.19 -3.63 0.12 0.00 0.00 0.00 0.00 36.38 33.06 1fl1 s VAL 164 CO 0.56 -0.18 0.84 -1.54 0.00 0.00 0.00 175.10 174.77 1fl1 n SER 165 N 5.05 -0.74 -0.13 3.32 3.41 -1.26 -4.66 113.62 118.60 1fl1 n SER 165 Ca -0.12 0.33 -0.05 0.00 -0.26 0.00 0.00 58.87 58.76 1fl1 n SER 165 Cb 0.47 -1.35 0.03 0.00 -0.26 0.00 0.00 64.21 63.10 1fl1 n SER 165 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1fl1 h LYS 166 N -1.85 0.35 -0.50 4.33 3.64 -1.96 0.16 116.57 120.74 1fl1 h LYS 166 Ca -0.45 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 58.88 1fl1 h LYS 166 Cb 1.28 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 1fl1 h LYS 166 CO 0.39 0.23 0.21 0.66 -2.27 0.00 0.00 179.45 178.67 1fl1 h SER 167 N 0.37 0.68 -0.43 4.20 4.64 -1.99 -0.62 113.55 120.39 1fl1 h SER 167 Ca 0.19 -0.16 0.03 0.00 -0.47 0.00 0.00 61.79 61.38 1fl1 h SER 167 Cb 0.14 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 1fl1 h SER 167 CO -0.16 0.65 0.23 -0.33 -0.87 0.00 0.00 176.83 176.35 1fl1 h GLU 168 N 0.66 0.45 0.01 4.77 5.08 -1.80 -1.26 114.58 122.49 1fl1 h GLU 168 Ca 0.17 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1fl1 h GLU 168 Cb 0.18 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1fl1 h GLU 168 CO -0.02 0.30 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.19 1fl1 h ARG 169 N 0.46 -0.01 -0.97 2.33 2.43 -0.62 -0.76 114.38 117.23 1fl1 h ARG 169 Ca 0.18 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.47 1fl1 h ARG 169 Cb 0.07 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.54 1fl1 h ARG 169 CO -0.11 0.07 0.62 0.00 -1.51 0.00 0.00 179.97 179.03 1fl1 h ALA 170 N 0.89 1.57 0.23 2.80 0.00 -0.92 0.10 119.26 123.93 1fl1 h ALA 170 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1fl1 h ALA 170 Cb 0.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1fl1 h ALA 170 CO 0.00 0.20 -0.11 1.25 0.00 0.00 0.00 179.25 180.59 1fl1 h HIS 171 N 0.95 -0.29 -0.37 0.00 -0.00 -0.85 -1.93 115.15 112.67 1fl1 h HIS 171 Ca 0.47 -0.01 0.07 0.00 -0.00 0.00 0.00 60.37 60.91 1fl1 h HIS 171 Cb 0.48 0.09 -0.06 0.00 -0.00 0.00 0.00 27.41 27.92 1fl1 h HIS 171 CO -0.00 0.03 -0.03 0.82 -0.00 0.00 0.00 177.93 178.74 1fl1 h ILE 172 N -0.61 0.69 -0.03 6.26 2.04 -0.47 -1.56 117.51 123.82 1fl1 h ILE 172 Ca -0.03 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 1fl1 h ILE 172 Cb 0.44 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1fl1 h ILE 172 CO 0.05 0.01 -0.14 -0.07 0.00 0.00 0.00 178.15 178.01 1fl1 h LEU 173 N 0.06 0.04 -0.91 1.44 3.38 -0.82 -1.73 115.31 116.78 1fl1 h LEU 173 Ca 0.18 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.15 1fl1 h LEU 173 Cb 0.26 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 1fl1 h LEU 173 CO -0.33 0.19 0.60 -0.61 0.09 0.00 0.00 178.44 178.38 1fl1 h GLN 174 N 0.05 1.19 -0.35 1.13 4.15 -0.45 -0.70 115.11 120.12 1fl1 h GLN 174 Ca 0.01 -0.07 -0.15 0.00 0.77 0.00 0.00 58.65 59.20 1fl1 h GLN 174 Cb 0.27 -0.27 -0.00 0.00 0.21 0.00 0.00 27.48 27.69 1fl1 h GLN 174 CO 0.02 0.79 -0.38 0.45 -1.93 0.00 0.00 178.83 177.78 1fl1 h HIS 175 N 1.22 1.06 -0.11 3.99 3.86 -1.15 -2.39 115.15 121.64 1fl1 h HIS 175 Ca 0.33 -0.32 0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1fl1 h HIS 175 Cb -0.13 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.11 1fl1 h HIS 175 CO -0.01 1.14 0.04 0.28 0.86 0.00 0.00 177.93 180.24 1fl1 h VAL 176 N 0.68 0.99 0.00 2.45 2.07 -0.84 -2.73 116.25 118.86 1fl1 h VAL 176 Ca 0.05 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1fl1 h VAL 176 Cb 0.97 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1fl1 h VAL 176 CO 0.09 0.02 -0.12 0.77 0.02 0.00 0.00 177.57 178.36 1fl1 h SER 177 N 0.10 0.00 0.00 0.57 4.64 -1.19 -2.89 113.55 114.78 1fl1 h SER 177 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1fl1 h SER 177 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1fl1 h SER 177 CO -0.04 0.12 0.00 -1.54 -0.87 0.00 0.00 176.83 174.50 1fl1 n SER 178 N -3.24 0.00 -4.19 4.97 3.41 -0.90 -4.68 113.62 108.99 1fl1 n SER 178 Ca 0.01 -0.78 -0.31 0.00 -0.26 0.00 0.00 58.87 57.53 1fl1 n SER 178 Cb 0.39 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.17 1fl1 n SER 178 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fl1 s ARG 180 N 0.36 3.20 0.60 0.00 1.81 -1.26 -4.90 118.95 118.77 1fl1 s ARG 180 Ca -0.18 -0.67 0.27 0.00 -1.72 0.00 0.00 55.73 53.44 1fl1 s ARG 180 Cb -0.17 -4.09 1.29 0.00 -0.45 0.00 0.00 34.95 31.53 1fl1 s ARG 180 CO 0.08 -1.35 1.70 -0.07 -0.68 0.00 0.00 175.30 174.98 1fl1 h LEU 181 N 10.25 0.00 -0.19 2.53 3.38 -1.97 0.29 115.31 129.60 1fl1 h LEU 181 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1fl1 h LEU 181 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1fl1 h LEU 181 CO 1.02 0.00 0.00 1.21 0.09 0.00 0.00 178.44 180.76 1fl1 n GLU 182 N -3.46 0.04 -0.02 1.13 4.07 -1.26 -2.13 120.64 119.00 1fl1 n GLU 182 Ca 0.11 0.37 0.07 0.00 -0.06 0.00 0.00 57.16 57.65 1fl1 n GLU 182 Cb 0.90 -1.58 0.07 0.00 -0.06 0.00 0.00 31.44 30.77 1fl1 n GLU 182 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1fl1 n ASP 183 N -1.65 2.31 -4.74 4.31 8.00 0.10 -4.97 116.55 119.91 1fl1 n ASP 183 Ca 0.02 -1.64 -0.41 0.00 0.71 0.00 0.00 54.79 53.47 1fl1 n ASP 183 Cb 0.12 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.14 1fl1 n ASP 183 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1fl1 s LEU 184 N -1.18 4.57 0.75 0.64 1.43 -0.91 -5.02 118.68 118.96 1fl1 s LEU 184 Ca 0.18 1.94 -0.14 0.00 -1.03 0.00 0.00 54.13 55.08 1fl1 s LEU 184 Cb 0.12 -3.60 0.05 0.00 0.03 0.00 0.00 46.19 42.79 1fl1 s LEU 184 CO 0.18 0.00 1.18 -0.94 0.23 0.00 0.00 176.35 177.00 1fl1 s SER 185 N -0.60 4.16 -0.03 2.29 1.04 -1.26 -4.93 113.70 114.37 1fl1 s SER 185 Ca 0.45 2.25 -0.30 0.00 0.48 0.00 0.00 55.95 58.82 1fl1 s SER 185 Cb -0.26 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.23 1fl1 s SER 185 CO 0.32 -2.28 1.50 -0.89 0.98 0.00 0.00 173.24 172.87 1fl1 s THR 186 N -2.19 3.66 0.52 2.02 2.01 -1.26 -4.98 115.64 115.42 1fl1 s THR 186 Ca 0.71 0.94 -0.22 0.00 0.31 0.00 0.00 61.69 63.43 1fl1 s THR 186 Cb -0.26 -3.61 -0.06 0.00 0.01 0.00 0.00 72.50 68.59 1fl1 s THR 186 CO 0.47 -0.04 1.35 -2.84 -0.69 0.00 0.00 174.62 172.87 1fl1 s PRO 187 N 3.15 3.28 -1.00 4.92 0.02 -1.26 -4.93 135.00 139.17 1fl1 s PRO 187 Ca 0.67 2.22 -0.20 0.00 0.02 0.00 0.00 61.00 63.71 1fl1 s PRO 187 Cb -0.32 -2.33 0.10 0.00 0.02 0.00 0.00 34.50 31.97 1fl1 s PRO 187 CO 0.27 -1.07 1.30 1.21 -0.33 0.00 0.00 177.00 178.37 1fl1 s ASN 188 N -0.92 6.61 -0.57 2.53 3.04 -1.26 -4.91 114.94 119.45 1fl1 s ASN 188 Ca 0.69 -1.87 0.03 0.00 0.04 0.00 0.00 52.86 51.76 1fl1 s ASN 188 Cb -0.40 -2.48 0.14 0.00 -1.54 0.00 0.00 41.25 36.98 1fl1 s ASN 188 CO 0.48 -1.23 0.33 0.12 -3.04 0.00 0.00 177.10 173.75 1fl1 s PHE 189 N 3.62 3.28 0.00 0.43 5.36 -1.25 -1.78 117.98 127.65 1fl1 s PHE 189 Ca 0.40 -3.17 0.00 0.00 -0.96 0.00 0.00 56.93 53.20 1fl1 s PHE 189 Cb -0.02 -2.84 0.00 0.00 -0.34 0.00 0.00 43.02 39.82 1fl1 s PHE 189 CO -0.08 -0.71 0.00 1.33 -1.46 0.00 0.00 175.22 174.29 1fl1 n VAL 190 N 2.91 0.00 -1.26 3.12 0.24 -0.58 -4.91 118.33 117.85 1fl1 n VAL 190 Ca 0.08 -0.20 -0.43 0.00 -2.04 0.00 0.00 64.34 61.76 1fl1 n VAL 190 Cb 0.33 0.80 -0.03 0.00 -1.47 0.00 0.00 33.84 33.48 1fl1 n VAL 190 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1fl1 n SER 191 N -0.61 -1.25 -4.76 -1.34 2.88 -0.84 -4.83 113.62 102.86 1fl1 n SER 191 Ca 0.00 1.00 -0.40 0.00 -1.33 0.00 0.00 58.87 58.14 1fl1 n SER 191 Cb 0.00 -0.86 0.02 0.00 -0.75 0.00 0.00 64.21 62.62 1fl1 n SER 191 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1fl1 n PRO 192 N 0.93 2.26 0.02 -1.46 -0.02 -1.26 -4.89 135.00 130.58 1fl1 n PRO 192 Ca 0.16 0.80 0.01 0.00 -2.02 0.00 0.00 63.50 62.45 1fl1 n PRO 192 Cb 0.24 -2.62 0.33 0.00 -0.02 0.00 0.00 33.50 31.43 1fl1 n PRO 192 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1fl1 h LEU 193 N 2.31 0.43 -0.74 2.45 5.85 -2.01 -2.77 115.31 120.83 1fl1 h LEU 193 Ca -0.51 -0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.24 1fl1 h LEU 193 Cb 1.27 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 42.11 1fl1 h LEU 193 CO 0.61 0.50 0.37 -0.33 -0.34 0.00 0.00 178.44 179.25 1fl1 h GLU 194 N 0.45 0.59 -0.94 1.25 3.07 -1.99 -0.05 114.58 116.96 1fl1 h GLU 194 Ca 0.10 -0.04 0.08 0.00 -0.50 0.00 0.00 59.36 59.00 1fl1 h GLU 194 Cb 0.29 -0.13 -0.07 0.00 -0.84 0.00 0.00 28.75 28.00 1fl1 h GLU 194 CO 0.01 0.39 0.61 1.15 -1.40 0.00 0.00 179.01 179.76 1fl1 h THR 195 N 0.60 1.03 -0.08 1.13 2.02 -1.87 0.11 112.91 115.85 1fl1 h THR 195 Ca 0.37 -0.35 -0.17 0.00 0.77 0.00 0.00 66.41 67.03 1fl1 h THR 195 Cb 0.43 -0.09 0.01 0.00 -1.74 0.00 0.00 68.15 66.76 1fl1 h THR 195 CO -0.29 0.19 -0.61 -0.07 0.37 0.00 0.00 175.52 175.11 1fl1 h LEU 196 N 1.03 0.68 -0.83 2.58 3.38 -1.34 -3.03 115.31 117.79 1fl1 h LEU 196 Ca 0.42 -0.67 0.04 0.00 0.09 0.00 0.00 57.88 57.76 1fl1 h LEU 196 Cb 0.27 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 1fl1 h LEU 196 CO -0.17 1.25 0.52 -0.03 0.09 0.00 0.00 178.44 180.10 1fl1 h MET 197 N 0.17 0.97 -0.77 1.13 4.05 -0.34 -0.39 114.93 119.76 1fl1 h MET 197 Ca -0.05 -0.06 0.02 0.00 -0.28 0.00 0.00 59.70 59.33 1fl1 h MET 197 Cb 1.26 -0.22 -0.04 0.00 -0.80 0.00 0.00 31.60 31.80 1fl1 h MET 197 CO 0.12 0.64 0.50 0.00 0.23 0.00 0.00 176.91 178.40 1fl1 h ALA 198 N 1.36 0.99 -0.77 0.39 0.00 -0.81 0.17 119.26 120.59 1fl1 h ALA 198 Ca 0.34 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1fl1 h ALA 198 Cb 0.06 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1fl1 h ALA 198 CO -0.13 0.33 0.29 0.87 0.00 0.00 0.00 179.25 180.61 1fl1 h LYS 199 N 0.99 1.17 -0.50 0.00 1.79 -1.22 0.29 116.57 119.09 1fl1 h LYS 199 Ca 0.30 -0.22 -0.03 0.00 -2.18 0.00 0.00 60.65 58.52 1fl1 h LYS 199 Cb -0.04 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 30.40 1fl1 h LYS 199 CO -0.09 0.96 0.19 0.00 -1.08 0.00 0.00 179.45 179.43 1fl1 h ALA 200 N 1.18 0.65 -0.07 3.86 0.00 -0.06 -0.98 119.26 123.84 1fl1 h ALA 200 Ca 0.26 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1fl1 h ALA 200 Cb 0.24 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1fl1 h ALA 200 CO -0.02 0.26 0.04 0.82 0.00 0.00 0.00 179.25 180.35 1fl1 h ILE 201 N 0.67 1.10 -0.36 0.00 2.04 -0.35 -2.68 117.51 117.93 1fl1 h ILE 201 Ca 0.17 -0.28 0.04 0.00 1.00 0.00 0.00 64.86 65.79 1fl1 h ILE 201 Cb 0.21 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1fl1 h ILE 201 CO -0.01 0.08 0.24 0.44 0.00 0.00 0.00 178.15 178.90 1fl1 h ASP 202 N 0.01 0.27 -0.84 1.72 3.32 -0.73 -2.74 116.42 117.42 1fl1 h ASP 202 Ca 0.02 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1fl1 h ASP 202 Cb 0.10 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 1fl1 h ASP 202 CO -0.00 0.18 0.49 0.00 -1.72 0.00 0.00 179.24 178.19 1fl1 h ALA 203 N 1.80 1.07 0.00 3.45 0.00 -0.82 -1.90 119.26 122.86 1fl1 h ALA 203 Ca 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1fl1 h ALA 203 Cb 0.22 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1fl1 h ALA 203 CO -0.03 0.55 0.00 0.41 0.00 0.00 0.00 179.25 180.18 1fl1 n GLY 204 N -1.17 -0.90 0.95 0.00 0.00 -1.03 -1.28 105.19 101.76 1fl1 n GLY 204 Ca 0.08 0.18 0.09 0.00 0.00 0.00 0.00 46.02 46.37 1fl1 n GLY 204 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1fl1 n PHE 205 N -2.23 0.59 -2.46 1.61 3.72 -0.72 -4.89 117.46 113.08 1fl1 n PHE 205 Ca -0.01 -0.41 -0.43 0.00 -0.05 0.00 0.00 57.45 56.56 1fl1 n PHE 205 Cb 0.06 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.56 1fl1 n PHE 205 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1fl1 s ILE 206 N -1.09 4.34 0.28 4.37 1.01 -0.40 -4.95 121.20 124.75 1fl1 s ILE 206 Ca 0.33 1.62 -0.30 0.00 0.00 0.00 0.00 60.65 62.31 1fl1 s ILE 206 Cb 0.18 -4.05 -0.11 0.00 0.01 0.00 0.00 42.46 38.50 1fl1 s ILE 206 CO 0.24 -0.12 1.49 -0.13 0.00 0.00 0.00 174.94 176.42 1fl1 s ARG 207 N 3.24 4.21 -1.93 2.79 3.00 -1.26 -2.88 118.95 126.12 1fl1 s ARG 207 Ca 0.53 2.41 0.00 0.00 0.00 0.00 0.00 55.73 58.68 1fl1 s ARG 207 Cb -0.21 -3.07 0.00 0.00 0.00 0.00 0.00 34.95 31.67 1fl1 s ARG 207 CO 0.15 -0.49 0.00 -0.25 0.00 0.00 0.00 175.30 174.70 1fl1 n ASP 208 N 2.08 -5.02 -0.14 0.23 9.92 -1.26 -4.87 116.55 117.49 1fl1 n ASP 208 Ca 0.07 0.40 -0.03 0.00 -0.53 0.00 0.00 54.79 54.69 1fl1 n ASP 208 Cb 0.39 -4.43 0.05 0.00 -0.64 0.00 0.00 41.12 36.49 1fl1 n ASP 208 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 1fl1 h ARG 209 N 0.00 0.16 -0.52 -1.24 2.43 -1.90 0.43 114.38 113.74 1fl1 h ARG 209 Ca -0.39 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 58.70 1fl1 h ARG 209 Cb 1.24 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 1fl1 h ARG 209 CO 0.56 0.10 0.07 -0.07 -1.51 0.00 0.00 179.97 179.12 1fl1 h LEU 210 N 0.16 0.78 -0.01 3.80 3.38 -1.89 0.16 115.31 121.69 1fl1 h LEU 210 Ca 0.23 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1fl1 h LEU 210 Cb 0.32 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1fl1 h LEU 210 CO -0.34 0.81 -0.00 0.44 0.09 0.00 0.00 178.44 179.43 1fl1 h ASP 211 N 0.78 0.01 -0.89 -0.43 3.32 -1.71 -2.24 116.42 115.28 1fl1 h ASP 211 Ca 0.16 -0.46 0.08 0.00 0.02 0.00 0.00 57.03 56.83 1fl1 h ASP 211 Cb 0.37 -0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.85 1fl1 h ASP 211 CO 0.01 0.47 0.54 -0.07 -1.72 0.00 0.00 179.24 178.47 1fl1 h LEU 212 N -0.44 0.82 -1.07 1.55 3.38 -0.01 -0.84 115.31 118.70 1fl1 h LEU 212 Ca 0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1fl1 h LEU 212 Cb 0.47 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 1fl1 h LEU 212 CO 0.00 0.49 0.51 0.25 0.09 0.00 0.00 178.44 179.78 1fl1 h LEU 213 N 0.93 1.02 -0.45 1.67 5.85 -0.62 -0.46 115.31 123.25 1fl1 h LEU 213 Ca 0.41 -0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.98 1fl1 h LEU 213 Cb 0.29 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1fl1 h LEU 213 CO -0.21 0.78 -0.08 0.50 -0.34 0.00 0.00 178.44 179.08 1fl1 h LYS 214 N 1.17 0.86 -0.04 1.25 3.64 -0.56 -2.77 116.57 120.11 1fl1 h LYS 214 Ca 0.30 -0.32 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1fl1 h LYS 214 Cb -0.05 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1fl1 h LYS 214 CO -0.06 0.95 0.01 1.15 -2.27 0.00 0.00 179.45 179.24 1fl1 h THR 215 N 0.69 1.16 -0.85 1.00 2.02 -0.81 -2.90 112.91 113.23 1fl1 h THR 215 Ca 0.12 -0.46 0.21 0.00 0.77 0.00 0.00 66.41 67.05 1fl1 h THR 215 Cb 0.62 1.39 -0.13 0.00 -1.74 0.00 0.00 68.15 68.29 1fl1 h THR 215 CO 0.04 0.13 0.26 0.44 0.37 0.00 0.00 175.52 176.76 1fl1 h ASP 216 N -0.11 0.08 -0.62 4.18 3.45 -1.03 0.34 116.42 122.71 1fl1 h ASP 216 Ca 0.01 0.17 0.09 0.00 0.43 0.00 0.00 57.03 57.74 1fl1 h ASP 216 Cb 0.19 0.22 -0.07 0.00 -0.56 0.00 0.00 39.33 39.11 1fl1 h ASP 216 CO -0.00 -0.09 0.25 -0.09 -1.57 0.00 0.00 179.24 177.74 1fl1 h ARG 217 N 0.27 0.44 -0.15 3.56 2.43 -1.28 0.43 114.38 120.07 1fl1 h ARG 217 Ca 0.52 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.62 1fl1 h ARG 217 Cb 1.00 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1fl1 h ARG 217 CO -0.59 0.29 -0.08 0.78 -1.51 0.00 0.00 179.97 178.86 1fl1 h GLY 218 N 0.45 0.36 0.87 2.80 0.00 -0.38 -2.54 103.07 104.63 1fl1 h GLY 218 Ca 0.31 -0.33 0.10 0.00 0.00 0.00 0.00 47.33 47.41 1fl1 h GLY 218 CO -0.28 0.30 0.50 -2.08 0.00 0.00 0.00 176.54 174.97 1fl1 h VAL 219 N -0.00 0.94 -0.00 4.60 2.07 -0.51 0.10 116.25 123.44 1fl1 h VAL 219 Ca 0.03 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1fl1 h VAL 219 Cb 0.56 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1fl1 h VAL 219 CO 0.02 0.12 -0.03 0.00 0.02 0.00 0.00 177.57 177.70 1fl1 n ALA 220 N -2.46 2.46 -3.66 1.67 0.00 0.10 -4.93 120.51 113.68 1fl1 n ALA 220 Ca 0.13 -0.13 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 1fl1 n ALA 220 Cb 0.33 -1.45 0.07 0.00 0.00 0.00 0.00 19.45 18.40 1fl1 n ALA 220 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1fl1 n SER 221 N -1.42 -5.40 -4.73 0.00 7.64 0.36 -4.43 113.62 105.63 1fl1 n SER 221 Ca 0.09 -0.62 -0.41 0.00 1.01 0.00 0.00 58.87 58.94 1fl1 n SER 221 Cb 0.31 -4.73 -0.04 0.00 -1.01 0.00 0.00 64.21 58.74 1fl1 n SER 221 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1fl1 s ILE 222 N -3.33 4.00 0.02 0.44 1.01 -1.06 -1.76 121.20 120.51 1fl1 s ILE 222 Ca 0.53 1.68 -0.13 0.00 0.00 0.00 0.00 60.65 62.72 1fl1 s ILE 222 Cb -0.24 -4.07 -0.06 0.00 0.01 0.00 0.00 42.46 38.10 1fl1 s ILE 222 CO 0.76 0.27 0.40 -0.76 0.00 0.00 0.00 174.94 175.60 1fl1 s LEU 223 N -0.15 4.43 0.47 2.97 1.43 0.12 -4.93 118.68 123.03 1fl1 s LEU 223 Ca 0.50 0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 54.40 1fl1 s LEU 223 Cb -0.28 -2.69 -0.06 0.00 0.03 0.00 0.00 46.19 43.19 1fl1 s LEU 223 CO 0.33 0.28 0.85 -0.44 0.23 0.00 0.00 176.35 177.60 1fl1 s SER 224 N -1.28 6.44 0.34 2.29 0.01 -1.26 -4.37 113.70 115.87 1fl1 s SER 224 Ca 0.26 1.21 -0.12 0.00 1.31 0.00 0.00 55.95 58.61 1fl1 s SER 224 Cb -0.16 -2.36 -0.08 0.00 0.21 0.00 0.00 66.02 63.64 1fl1 s SER 224 CO 0.14 -0.54 0.71 -2.16 0.41 0.00 0.00 173.24 171.81 1fl1 s PRO 225 N -4.27 3.87 0.14 12.44 0.04 -1.26 -5.16 135.00 140.80 1fl1 s PRO 225 Ca 0.52 0.50 -0.07 0.00 0.04 0.00 0.00 61.00 62.00 1fl1 s PRO 225 Cb -0.10 -2.46 -0.02 0.00 0.04 0.00 0.00 34.50 31.96 1fl1 s PRO 225 CO 0.37 0.11 0.20 0.14 0.04 0.00 0.00 177.00 177.86 1fl1 s VAL 226 N -2.10 0.10 -2.00 -0.36 -7.23 -1.26 -5.03 120.40 102.50 1fl1 s VAL 226 Ca 0.52 -1.50 0.07 0.00 -1.81 0.00 0.00 61.98 59.25 1fl1 s VAL 226 Cb -0.10 -1.79 0.20 0.00 0.56 0.00 0.00 36.38 35.24 1fl1 s VAL 226 CO 0.24 -0.43 1.17 -1.22 -0.31 0.00 0.00 175.10 174.54 1fl1 n TYR 227 N -0.14 0.28 -1.70 2.82 4.01 -1.26 -4.89 117.16 116.28 1fl1 n TYR 227 Ca -0.09 -0.14 -0.40 0.00 -0.16 0.00 0.00 57.90 57.11 1fl1 n TYR 227 Cb 0.63 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.68 1fl1 n TYR 227 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1fl1 n LEU 228 N 0.12 4.26 -1.32 7.72 7.99 -1.26 -4.78 117.00 129.73 1fl1 n LEU 228 Ca 0.07 1.07 0.12 0.00 -0.01 0.00 0.00 56.01 57.26 1fl1 n LEU 228 Cb 0.18 -1.51 0.31 0.00 -0.11 0.00 0.00 43.42 42.30 1fl1 n LEU 228 CO 0.05 -0.70 0.77 0.29 -1.51 0.00 0.00 177.39 176.29 1fl1 n LYS 229 N -0.18 2.73 0.00 3.23 4.76 -1.26 -5.12 118.16 122.32 1fl1 n LYS 229 Ca 0.07 -2.63 0.00 0.00 -2.87 0.00 0.00 58.31 52.88 1fl1 n LYS 229 Cb 0.41 -1.56 0.00 0.00 -1.84 0.00 0.00 35.03 32.04 1fl1 n LYS 229 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03