#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vfl s PRO 2 N 0.00 3.51 0.43 -2.82 0.02 -1.26 -4.91 135.00 129.97 1vfl s PRO 2 Ca 0.00 2.12 0.16 0.00 0.02 0.00 0.00 61.00 63.31 1vfl s PRO 2 Cb 0.00 -2.43 0.98 0.00 0.02 0.00 0.00 34.50 33.07 1vfl s PRO 2 CO 0.00 -0.86 1.94 0.00 -0.33 0.00 0.00 177.00 177.75 1vfl h ALA 3 N 1.93 1.50 -2.36 -1.55 0.00 -1.90 -3.31 119.26 113.57 1vfl h ALA 3 Ca -0.50 -0.22 -0.59 0.00 0.00 0.00 0.00 54.91 53.60 1vfl h ALA 3 Cb 1.27 -0.04 -0.38 0.00 0.00 0.00 0.00 17.79 18.65 1vfl h ALA 3 CO 0.59 0.30 -0.97 0.12 0.00 0.00 0.00 179.25 179.29 1vfl s PHE 4 N -4.39 1.04 -1.29 0.00 5.36 -1.26 -5.01 117.98 112.44 1vfl s PHE 4 Ca -0.03 -2.28 -0.09 0.00 -0.96 0.00 0.00 56.93 53.56 1vfl s PHE 4 Cb 0.15 -0.90 -0.07 0.00 -0.34 0.00 0.00 43.02 41.86 1vfl s PHE 4 CO 0.69 -0.83 2.51 -3.47 -1.46 0.00 0.00 175.22 172.66 1vfl n ASP 5 N 2.90 6.52 -4.16 6.13 4.64 -1.25 -4.80 116.55 126.53 1vfl n ASP 5 Ca 0.29 -2.50 -0.10 0.00 -1.38 0.00 0.00 54.79 51.09 1vfl n ASP 5 Cb 0.47 -1.36 -0.10 0.00 -1.04 0.00 0.00 41.12 39.09 1vfl n ASP 5 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1vfl s LYS 6 N 2.90 0.99 0.43 -0.67 -0.14 -1.26 -5.10 119.74 116.89 1vfl s LYS 6 Ca 0.55 -1.48 -0.26 0.00 -1.36 0.00 0.00 55.97 53.43 1vfl s LYS 6 Cb 0.14 0.22 -0.09 0.00 -1.68 0.00 0.00 37.83 36.42 1vfl s LYS 6 CO -0.04 -0.28 1.36 -2.30 -0.76 0.00 0.00 175.35 173.34 1vfl n PRO 7 N -0.13 2.15 -4.34 -1.68 -0.02 -1.26 -4.83 135.00 124.88 1vfl n PRO 7 Ca -0.04 0.76 -0.18 0.00 -2.02 0.00 0.00 63.50 62.02 1vfl n PRO 7 Cb 0.64 -2.52 -0.10 0.00 -0.02 0.00 0.00 33.50 31.50 1vfl n PRO 7 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1vfl s LYS 8 N -2.29 1.33 -0.07 -0.52 1.02 -0.17 -4.92 119.74 114.12 1vfl s LYS 8 Ca 0.60 -1.63 0.05 0.00 0.02 0.00 0.00 55.97 55.01 1vfl s LYS 8 Cb -0.48 -0.88 -0.00 0.00 -0.52 0.00 0.00 37.83 35.94 1vfl s LYS 8 CO 0.58 0.05 -0.22 0.08 -0.92 0.00 0.00 175.35 174.93 1vfl s VAL 9 N -3.18 1.83 -0.08 3.17 1.01 -1.26 -0.81 120.40 121.07 1vfl s VAL 9 Ca 0.24 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.33 1vfl s VAL 9 Cb 0.03 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 34.85 1vfl s VAL 9 CO 0.07 0.51 -0.12 -0.70 0.00 0.00 0.00 175.10 174.86 1vfl s GLU 10 N 0.14 1.81 -0.00 2.72 2.12 -0.73 -4.71 118.70 120.05 1vfl s GLU 10 Ca -0.10 -0.43 0.08 0.00 0.36 0.00 0.00 54.97 54.88 1vfl s GLU 10 Cb -0.15 -1.55 -0.10 0.00 0.26 0.00 0.00 34.13 32.59 1vfl s GLU 10 CO 0.05 -0.03 0.31 1.28 -0.54 0.00 0.00 175.26 176.33 1vfl n LEU 11 N 4.04 0.29 -3.65 2.70 4.77 -1.26 -1.22 117.00 122.68 1vfl n LEU 11 Ca -0.21 -0.38 -0.29 0.00 -0.03 0.00 0.00 56.01 55.10 1vfl n LEU 11 Cb 0.51 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.46 1vfl n LEU 11 CO 0.24 0.07 -0.31 -2.28 -1.33 0.00 0.00 177.39 173.78 1vfl s HIS 12 N -1.96 1.37 -0.22 -1.77 2.46 -1.26 -4.67 115.29 109.24 1vfl s HIS 12 Ca 0.02 -1.74 -0.13 0.00 0.47 0.00 0.00 55.06 53.67 1vfl s HIS 12 Cb 0.06 -1.48 0.07 0.00 -0.13 0.00 0.00 32.58 31.09 1vfl s HIS 12 CO 0.34 -0.84 0.55 0.54 -2.47 0.00 0.00 174.74 172.86 1vfl s VAL 13 N 1.30 -0.01 -0.21 0.89 0.11 -1.26 -1.89 120.40 119.33 1vfl s VAL 13 Ca 0.13 0.04 -0.18 0.00 -2.93 0.00 0.00 61.98 59.04 1vfl s VAL 13 Cb -0.20 -0.80 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 1vfl s VAL 13 CO -0.16 0.02 0.49 -1.00 -3.33 0.00 0.00 175.10 171.11 1vfl s HIS 14 N 1.38 3.36 0.26 1.54 3.76 0.52 -1.65 115.29 124.46 1vfl s HIS 14 Ca -0.09 0.72 -0.03 0.00 -0.15 0.00 0.00 55.06 55.52 1vfl s HIS 14 Cb -0.06 -2.64 0.42 0.00 1.11 0.00 0.00 32.58 31.41 1vfl s HIS 14 CO -0.14 -0.10 1.85 1.25 -0.85 0.00 0.00 174.74 176.74 1vfl h LEU 15 N 7.96 0.88 0.00 0.89 5.85 -1.08 0.16 115.31 129.97 1vfl h LEU 15 Ca -0.34 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1vfl h LEU 15 Cb 1.15 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.03 1vfl h LEU 15 CO 0.73 0.52 0.00 -0.90 -0.34 0.00 0.00 178.44 178.45 1vfl n ASP 16 N -4.62 0.00 -0.05 1.25 3.85 -1.26 -1.86 116.55 113.87 1vfl n ASP 16 Ca 0.15 -0.85 0.05 0.00 -0.71 0.00 0.00 54.79 53.43 1vfl n ASP 16 Cb 0.25 0.00 0.06 0.00 -1.35 0.00 0.00 41.12 40.08 1vfl n ASP 16 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1vfl n GLY 17 N 0.49 3.63 2.24 6.12 0.00 0.49 -4.77 105.19 113.40 1vfl n GLY 17 Ca 0.16 -0.52 -0.19 0.00 0.00 0.00 0.00 46.02 45.47 1vfl n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vfl n ALA 18 N -0.90 1.83 -2.39 4.61 0.00 -0.78 -1.04 120.51 121.85 1vfl n ALA 18 Ca 0.07 -3.21 -0.30 0.00 0.00 0.00 0.00 53.44 50.01 1vfl n ALA 18 Cb 0.45 -0.92 -0.13 0.00 0.00 0.00 0.00 19.45 18.84 1vfl n ALA 18 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1vfl s ILE 19 N -1.79 2.31 0.12 0.00 1.01 -1.26 -4.73 121.20 116.86 1vfl s ILE 19 Ca 0.37 -1.54 -0.30 0.00 0.00 0.00 0.00 60.65 59.18 1vfl s ILE 19 Cb 0.29 -1.97 -0.06 0.00 0.01 0.00 0.00 42.46 40.72 1vfl s ILE 19 CO -0.09 0.23 1.11 -0.54 0.00 0.00 0.00 174.94 175.64 1vfl s LYS 20 N -1.68 4.55 0.51 2.79 1.02 -1.26 -4.80 119.74 120.87 1vfl s LYS 20 Ca 0.13 1.68 0.16 0.00 0.02 0.00 0.00 55.97 57.97 1vfl s LYS 20 Cb -0.10 -3.32 1.24 0.00 -0.52 0.00 0.00 37.83 35.13 1vfl s LYS 20 CO 0.05 -0.02 2.12 -1.00 -0.92 0.00 0.00 175.35 175.58 1vfl h PRO 21 N 5.78 0.00 -0.67 -1.68 0.13 -1.99 -1.52 132.00 132.05 1vfl h PRO 21 Ca -0.43 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.64 1vfl h PRO 21 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 1vfl h PRO 21 CO 0.75 0.04 0.18 0.93 -0.23 0.00 0.00 178.00 179.67 1vfl h GLU 22 N 0.00 1.06 -0.25 0.86 3.07 -1.91 0.33 114.58 117.74 1vfl h GLU 22 Ca -0.00 -0.24 -0.11 0.00 -0.50 0.00 0.00 59.36 58.51 1vfl h GLU 22 Cb 0.07 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.82 1vfl h GLU 22 CO 0.00 0.94 -0.30 1.15 -1.40 0.00 0.00 179.01 179.40 1vfl h THR 23 N 0.99 1.28 -0.49 1.13 2.02 -1.70 0.24 112.91 116.37 1vfl h THR 23 Ca 0.21 -1.38 -0.08 0.00 0.77 0.00 0.00 66.41 65.93 1vfl h THR 23 Cb 0.34 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1vfl h THR 23 CO -0.00 0.44 -0.01 0.40 0.37 0.00 0.00 175.52 176.71 1vfl h ILE 24 N 0.44 1.26 -0.57 3.11 2.04 -0.93 -2.13 117.51 120.73 1vfl h ILE 24 Ca 0.06 -1.09 -0.08 0.00 1.00 0.00 0.00 64.86 64.74 1vfl h ILE 24 Cb 0.75 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1vfl h ILE 24 CO 0.06 0.38 0.05 0.25 0.00 0.00 0.00 178.15 178.89 1vfl h LEU 25 N 0.73 0.95 -0.26 1.44 5.85 -0.47 -0.69 115.31 122.87 1vfl h LEU 25 Ca 0.14 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.58 1vfl h LEU 25 Cb 0.53 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1vfl h LEU 25 CO 0.03 1.00 0.16 0.22 -0.34 0.00 0.00 178.44 179.51 1vfl h TYR 26 N 0.87 0.31 0.00 1.25 5.03 -0.32 -2.45 116.97 121.65 1vfl h TYR 26 Ca 0.17 0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.38 1vfl h TYR 26 Cb 0.48 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.64 1vfl h TYR 26 CO 0.04 0.19 -0.52 1.88 -1.32 0.00 0.00 178.16 178.43 1vfl h TYR 27 N 0.33 0.00 0.00 -3.82 0.05 -1.34 -2.00 116.97 110.19 1vfl h TYR 27 Ca 0.10 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.88 1vfl h TYR 27 Cb -0.03 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.71 1vfl h TYR 27 CO -0.07 0.52 -0.00 0.78 -1.05 0.00 0.00 178.16 178.34 1vfl h GLY 28 N 2.99 -0.00 1.84 3.88 0.00 -0.89 -2.95 103.07 107.94 1vfl h GLY 28 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.15 1vfl h GLY 28 CO 0.07 -0.00 -0.78 0.07 0.00 0.00 0.00 176.54 175.90 1vfl h LYS 29 N -0.15 0.15 -0.97 4.80 2.10 -1.50 0.78 116.57 121.77 1vfl h LYS 29 Ca -0.00 -0.14 0.13 0.00 -2.00 0.00 0.00 60.65 58.64 1vfl h LYS 29 Cb 0.15 0.04 -0.08 0.00 -0.90 0.00 0.00 32.23 31.44 1vfl h LYS 29 CO 0.00 0.85 0.62 0.00 -2.00 0.00 0.00 179.45 178.92 1vfl h ARG 30 N 0.09 0.87 0.00 0.07 2.47 -1.27 -2.87 114.38 113.74 1vfl h ARG 30 Ca -0.02 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.63 1vfl h ARG 30 Cb 1.36 -0.20 -0.03 0.00 -1.65 0.00 0.00 29.97 29.46 1vfl h ARG 30 CO 0.11 0.58 -0.43 2.89 0.56 0.00 0.00 179.97 183.68 1vfl n ARG 31 N -4.61 1.36 -3.58 0.04 1.85 -1.12 -5.01 116.66 105.59 1vfl n ARG 31 Ca 0.19 -2.99 -0.21 0.00 -1.00 0.00 0.00 57.85 53.84 1vfl n ARG 31 Cb 0.40 -1.45 0.07 0.00 -1.05 0.00 0.00 32.46 30.43 1vfl n ARG 31 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1vfl n GLY 32 N -1.04 -0.39 3.78 2.89 0.00 -0.95 -5.00 105.19 104.49 1vfl n GLY 32 Ca 0.17 0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.97 1vfl n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vfl s ILE 33 N -3.43 5.34 -0.01 -0.61 -1.09 0.27 -5.01 121.20 116.65 1vfl s ILE 33 Ca 0.17 0.42 -0.30 0.00 -2.23 0.00 0.00 60.65 58.71 1vfl s ILE 33 Cb -0.08 -3.55 -0.04 0.00 -1.58 0.00 0.00 42.46 37.21 1vfl s ILE 33 CO 0.76 0.49 1.16 0.00 -1.23 0.00 0.00 174.94 176.12 1vfl s ALA 34 N -0.17 3.41 0.09 9.38 0.00 -1.26 -4.49 121.76 128.70 1vfl s ALA 34 Ca 0.15 0.67 0.09 0.00 0.00 0.00 0.00 51.96 52.88 1vfl s ALA 34 Cb -0.13 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 1vfl s ALA 34 CO 0.04 -0.57 -0.25 -0.51 0.00 0.00 0.00 175.76 174.47 1vfl s LEU 35 N 1.65 2.25 0.32 0.00 1.02 -1.26 -4.98 118.68 117.67 1vfl s LEU 35 Ca 0.56 -0.65 0.03 0.00 0.02 0.00 0.00 54.13 54.09 1vfl s LEU 35 Cb -0.25 -1.13 0.62 0.00 0.02 0.00 0.00 46.19 45.45 1vfl s LEU 35 CO 0.25 0.17 1.90 1.55 0.02 0.00 0.00 176.35 180.25 1vfl h PRO 36 N 4.35 0.89 -5.10 1.29 0.13 -1.96 -3.44 132.00 128.17 1vfl h PRO 36 Ca -0.47 -0.05 -0.37 0.00 -0.87 0.00 0.00 66.00 64.24 1vfl h PRO 36 Cb 1.16 -0.20 -0.14 0.00 0.13 0.00 0.00 31.00 31.95 1vfl h PRO 36 CO 0.41 0.59 -0.68 0.00 -0.23 0.00 0.00 178.00 178.10 1vfl s ALA 37 N -5.83 1.72 -1.04 -0.56 0.00 -1.26 -5.06 121.76 109.72 1vfl s ALA 37 Ca -0.11 -1.68 0.10 0.00 0.00 0.00 0.00 51.96 50.26 1vfl s ALA 37 Cb 0.20 0.34 0.18 0.00 0.00 0.00 0.00 23.12 23.84 1vfl s ALA 37 CO 0.79 -0.19 1.02 -0.25 0.00 0.00 0.00 175.76 177.13 1vfl n ASP 38 N -0.35 2.33 -4.30 0.00 8.00 -1.26 -4.90 116.55 116.06 1vfl n ASP 38 Ca -0.07 -1.71 -0.27 0.00 0.71 0.00 0.00 54.79 53.46 1vfl n ASP 38 Cb 0.63 -0.10 -0.14 0.00 -0.02 0.00 0.00 41.12 41.49 1vfl n ASP 38 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1vfl s THR 39 N -0.91 1.88 0.12 -3.53 -1.32 -1.26 -5.06 115.64 105.56 1vfl s THR 39 Ca 0.16 -1.36 -0.25 0.00 -1.21 0.00 0.00 61.69 59.03 1vfl s THR 39 Cb 0.10 -1.64 -0.05 0.00 -1.51 0.00 0.00 72.50 69.39 1vfl s THR 39 CO 0.13 0.21 1.65 -0.65 -2.21 0.00 0.00 174.62 173.75 1vfl h PRO 40 N 4.63 -0.33 -0.28 7.08 0.11 -1.94 0.15 132.00 141.41 1vfl h PRO 40 Ca -0.45 0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.72 1vfl h PRO 40 Cb 1.16 0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1vfl h PRO 40 CO 0.43 -0.22 0.08 1.49 -0.21 0.00 0.00 178.00 179.57 1vfl h GLU 41 N -0.35 0.19 0.00 1.05 4.81 -1.97 -0.99 114.58 117.32 1vfl h GLU 41 Ca 0.06 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 1vfl h GLU 41 Cb 0.43 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1vfl h GLU 41 CO -0.20 0.13 -0.33 1.49 -0.73 0.00 0.00 179.01 179.37 1vfl h GLU 42 N 0.20 0.00 -0.19 1.92 4.57 -1.97 -1.78 114.58 117.33 1vfl h GLU 42 Ca 0.13 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.25 1vfl h GLU 42 Cb 0.11 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1vfl h GLU 42 CO -0.15 0.33 -0.12 1.25 -1.18 0.00 0.00 179.01 179.14 1vfl h LEU 43 N 0.00 0.44 -0.95 1.64 5.85 -0.20 -0.43 115.31 121.66 1vfl h LEU 43 Ca -0.00 -0.44 -0.08 0.00 0.84 0.00 0.00 57.88 58.20 1vfl h LEU 43 Cb 0.86 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 1vfl h LEU 43 CO 0.04 0.78 -0.39 -0.61 -0.34 0.00 0.00 178.44 177.93 1vfl h GLN 44 N 0.11 0.00 -0.35 1.25 4.15 -1.13 0.14 115.11 119.27 1vfl h GLN 44 Ca 0.04 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.34 1vfl h GLN 44 Cb 0.63 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.31 1vfl h GLN 44 CO 0.03 0.39 -0.27 -0.91 -1.93 0.00 0.00 178.83 176.14 1vfl h ASN 45 N 0.00 0.75 0.01 -0.69 -0.26 -1.09 0.64 115.58 114.94 1vfl h ASN 45 Ca -0.00 -0.29 -0.10 0.00 -0.56 0.00 0.00 56.30 55.35 1vfl h ASN 45 Cb 0.89 -0.21 0.01 0.00 -1.06 0.00 0.00 38.32 37.95 1vfl h ASN 45 CO 0.05 0.98 -0.41 0.40 -1.06 0.00 0.00 177.43 177.40 1vfl h ILE 46 N 0.63 1.52 -0.28 2.81 2.04 -0.65 -3.34 117.51 120.24 1vfl h ILE 46 Ca 0.08 -2.07 -0.16 0.00 1.00 0.00 0.00 64.86 63.70 1vfl h ILE 46 Cb 0.78 2.79 -0.00 0.00 -0.74 0.00 0.00 36.82 39.65 1vfl h ILE 46 CO 0.06 0.58 -0.48 0.40 0.00 0.00 0.00 178.15 178.71 1vfl h ILE 47 N -0.39 1.29 -4.08 -0.67 2.04 -0.71 -3.46 117.51 111.54 1vfl h ILE 47 Ca -0.05 -1.67 -0.46 0.00 1.00 0.00 0.00 64.86 63.67 1vfl h ILE 47 Cb 1.17 1.58 0.14 0.00 -0.74 0.00 0.00 36.82 38.97 1vfl h ILE 47 CO 0.08 0.54 0.25 -0.83 0.00 0.00 0.00 178.15 178.19 1vfl s GLY 48 N -3.98 1.58 0.01 5.37 0.00 0.22 -4.73 107.32 105.80 1vfl s GLY 48 Ca -0.09 -0.39 0.02 0.00 0.00 0.00 0.00 44.72 44.25 1vfl s GLY 48 CO 0.87 0.17 -0.06 -3.16 0.00 0.00 0.00 173.10 170.92 1vfl s MET 49 N -5.11 0.46 0.00 2.90 0.23 -0.44 -4.90 119.30 112.44 1vfl s MET 49 Ca 0.64 -0.41 0.03 0.00 -1.03 0.00 0.00 55.69 54.93 1vfl s MET 49 Cb -0.17 -0.35 -0.01 0.00 -1.53 0.00 0.00 34.83 32.77 1vfl s MET 49 CO 0.55 0.09 0.33 -0.40 -2.03 0.00 0.00 175.02 173.56 1vfl n ASP 50 N 2.37 0.62 -3.79 -1.18 3.85 -1.26 -4.79 116.55 112.37 1vfl n ASP 50 Ca -0.17 -0.81 -0.11 0.00 -0.71 0.00 0.00 54.79 52.99 1vfl n ASP 50 Cb 0.57 0.59 -0.08 0.00 -1.35 0.00 0.00 41.12 40.85 1vfl n ASP 50 CO 0.00 0.00 0.00 -0.75 -1.01 0.00 0.00 177.20 175.44 1vfl s LYS 51 N -0.90 0.73 0.18 0.11 2.20 -1.26 -4.98 119.74 115.82 1vfl s LYS 51 Ca 0.02 -0.48 -0.33 0.00 -0.36 0.00 0.00 55.97 54.82 1vfl s LYS 51 Cb 0.03 0.31 -0.14 0.00 -1.51 0.00 0.00 37.83 36.52 1vfl s LYS 51 CO 0.10 -0.22 1.46 -2.30 -0.36 0.00 0.00 175.35 174.03 1vfl n PRO 52 N 0.78 1.94 -4.47 4.03 -0.02 -0.73 -4.86 135.00 131.67 1vfl n PRO 52 Ca -0.19 0.70 -0.24 0.00 -2.02 0.00 0.00 63.50 61.74 1vfl n PRO 52 Cb 0.58 -2.39 -0.10 0.00 -0.02 0.00 0.00 33.50 31.57 1vfl n PRO 52 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1vfl s LEU 53 N 0.53 2.60 0.85 2.45 1.02 -1.26 -5.03 118.68 119.84 1vfl s LEU 53 Ca 0.75 -1.04 -0.10 0.00 0.02 0.00 0.00 54.13 53.75 1vfl s LEU 53 Cb -0.71 -1.07 0.10 0.00 0.02 0.00 0.00 46.19 44.53 1vfl s LEU 53 CO 0.44 0.01 1.12 0.42 0.02 0.00 0.00 176.35 178.36 1vfl s THR 54 N -2.54 2.66 0.14 5.49 -4.23 -1.26 -4.74 115.64 111.15 1vfl s THR 54 Ca 0.30 0.21 -0.18 0.00 -1.18 0.00 0.00 61.69 60.84 1vfl s THR 54 Cb -0.04 -2.46 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 1vfl s THR 54 CO 0.15 -0.28 1.74 0.25 -0.54 0.00 0.00 174.62 175.94 1vfl h LEU 55 N -1.51 0.04 -0.55 4.79 5.85 -1.99 -0.69 115.31 121.25 1vfl h LEU 55 Ca -0.43 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.42 1vfl h LEU 55 Cb 1.25 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 42.26 1vfl h LEU 55 CO 0.46 0.05 0.15 -0.65 -0.34 0.00 0.00 178.44 178.12 1vfl h PRO 56 N 0.17 0.30 -0.67 5.25 0.11 -1.99 0.14 132.00 135.30 1vfl h PRO 56 Ca 0.12 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.22 1vfl h PRO 56 Cb 0.12 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.13 1vfl h PRO 56 CO -0.15 0.20 0.45 -0.44 -0.21 0.00 0.00 178.00 177.84 1vfl h ASP 57 N 0.31 0.78 0.35 -2.05 5.19 -1.80 -0.46 116.42 118.73 1vfl h ASP 57 Ca 0.28 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.65 1vfl h ASP 57 Cb 0.36 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.68 1vfl h ASP 57 CO -0.32 0.56 -0.17 0.15 -3.12 0.00 0.00 179.24 176.34 1vfl h PHE 58 N 0.92 -0.44 -0.63 4.55 3.57 0.17 -2.93 116.94 122.15 1vfl h PHE 58 Ca 0.25 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1vfl h PHE 58 Cb -0.10 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 1vfl h PHE 58 CO -0.03 -0.25 0.40 1.25 -2.23 0.00 0.00 178.31 177.45 1vfl h LEU 59 N -0.50 0.74 -2.49 0.59 5.85 -0.62 -2.03 115.31 116.86 1vfl h LEU 59 Ca -0.05 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1vfl h LEU 59 Cb 0.38 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 1vfl h LEU 59 CO 0.08 0.56 -0.01 0.00 -0.34 0.00 0.00 178.44 178.73 1vfl h ALA 60 N 1.57 1.46 -0.93 1.25 0.00 -0.90 -1.69 119.26 120.02 1vfl h ALA 60 Ca 0.23 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.22 1vfl h ALA 60 Cb -0.06 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 1vfl h ALA 60 CO -0.05 0.01 0.58 0.87 0.00 0.00 0.00 179.25 180.66 1vfl h LYS 61 N 0.00 0.96 -0.64 0.00 1.79 -1.26 -1.30 116.57 116.11 1vfl h LYS 61 Ca -0.00 -0.06 -0.09 0.00 -2.18 0.00 0.00 60.65 58.33 1vfl h LYS 61 Cb 0.02 -0.22 -0.02 0.00 -1.58 0.00 0.00 32.23 30.43 1vfl h LYS 61 CO 0.00 0.63 0.06 0.74 -1.08 0.00 0.00 179.45 179.81 1vfl h PHE 62 N 0.99 1.16 -0.38 -1.35 -1.00 -1.46 -2.55 116.94 112.34 1vfl h PHE 62 Ca 0.43 -0.17 0.11 0.00 2.81 0.00 0.00 57.97 61.15 1vfl h PHE 62 Cb 0.31 -0.31 -0.02 0.00 3.61 0.00 0.00 35.95 39.55 1vfl h PHE 62 CO -0.02 0.99 0.33 -0.44 -1.61 0.00 0.00 178.31 177.55 1vfl h ASP 63 N 1.00 0.00 -0.13 2.17 3.32 -1.29 -0.56 116.42 120.93 1vfl h ASP 63 Ca 0.19 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.11 1vfl h ASP 63 Cb 0.48 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1vfl h ASP 63 CO 0.02 0.00 -0.35 1.88 -1.72 0.00 0.00 179.24 179.07 1vfl h TYR 64 N 0.00 0.75 0.00 4.55 0.99 -1.26 -3.40 116.97 118.60 1vfl h TYR 64 Ca 0.18 -0.20 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1vfl h TYR 64 Cb 0.83 -0.17 0.00 0.00 1.00 0.00 0.00 36.73 38.39 1vfl h TYR 64 CO 0.00 0.91 -0.91 2.48 -0.00 0.00 0.00 178.16 180.64 1vfl n TYR 65 N -4.06 0.00 -0.03 4.88 0.18 -0.72 -4.66 117.16 112.76 1vfl n TYR 65 Ca -0.01 0.00 0.10 0.00 1.88 0.00 0.00 57.90 59.87 1vfl n TYR 65 Cb 0.49 0.00 0.51 0.00 -0.38 0.00 0.00 39.34 39.96 1vfl n TYR 65 CO 0.00 0.00 0.00 0.52 -2.08 0.00 0.00 176.86 175.30 1vfl h MET 66 N 0.00 0.37 0.00 -3.48 2.86 -1.35 -1.55 114.93 111.78 1vfl h MET 66 Ca 0.00 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1vfl h MET 66 Cb 0.19 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.76 1vfl h MET 66 CO 0.00 0.25 -0.01 -1.35 1.06 0.00 0.00 176.91 176.85 1vfl h PRO 67 N 0.38 0.00 0.00 -0.22 0.11 -1.80 -0.03 132.00 130.44 1vfl h PRO 67 Ca 0.23 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.33 1vfl h PRO 67 Cb 0.40 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 1vfl h PRO 67 CO -0.06 0.01 -0.05 0.00 -0.21 0.00 0.00 178.00 177.69 1vfl h ALA 68 N 1.99 0.97 0.00 -0.75 0.00 -1.61 -3.37 119.26 116.49 1vfl h ALA 68 Ca -0.00 -0.05 -0.33 0.00 0.00 0.00 0.00 54.91 54.53 1vfl h ALA 68 Cb 0.04 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1vfl h ALA 68 CO 0.00 0.07 -2.09 -0.89 0.00 0.00 0.00 179.25 176.34 1vfl n ILE 69 N -3.12 1.19 -1.59 0.00 2.08 -0.60 -4.53 119.36 112.78 1vfl n ILE 69 Ca 0.03 -0.26 -0.43 0.00 0.56 0.00 0.00 62.75 62.65 1vfl n ILE 69 Cb 0.49 -1.82 -0.00 0.00 -0.75 0.00 0.00 39.64 37.56 1vfl n ILE 69 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1vfl n ALA 70 N -3.98 -0.15 -0.03 -1.39 0.00 -0.12 -2.19 120.51 112.64 1vfl n ALA 70 Ca -0.40 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1vfl n ALA 70 Cb 0.77 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1vfl n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vfl n GLY 71 N 1.25 2.77 3.27 0.00 0.00 -0.16 -4.91 105.19 107.40 1vfl n GLY 71 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1vfl n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vfl h ARG 73 N 8.17 -0.10 -0.60 0.00 3.08 -1.94 -1.69 114.38 121.30 1vfl h ARG 73 Ca -0.27 0.01 0.09 0.00 0.07 0.00 0.00 59.98 59.87 1vfl h ARG 73 Cb 1.10 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 31.10 1vfl h ARG 73 CO 0.59 -0.07 0.23 0.22 -1.07 0.00 0.00 179.97 179.88 1vfl h ASP 74 N -0.10 0.25 -0.54 7.04 3.58 -1.95 -2.07 116.42 122.62 1vfl h ASP 74 Ca 0.13 0.07 -0.08 0.00 0.42 0.00 0.00 57.03 57.57 1vfl h ASP 74 Cb 0.30 0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 1vfl h ASP 74 CO -0.31 0.15 0.02 0.00 -2.88 0.00 0.00 179.24 176.22 1vfl h ALA 75 N 1.40 0.73 -0.22 -0.78 0.00 -1.76 -0.97 119.26 117.66 1vfl h ALA 75 Ca 0.30 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1vfl h ALA 75 Cb 0.34 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1vfl h ALA 75 CO -0.28 0.54 0.13 0.82 0.00 0.00 0.00 179.25 180.45 1vfl h ILE 76 N 0.83 1.08 -0.64 0.00 1.08 -0.89 -0.71 117.51 118.26 1vfl h ILE 76 Ca 0.16 -0.20 -0.07 0.00 -0.39 0.00 0.00 64.86 64.35 1vfl h ILE 76 Cb 0.51 0.83 -0.03 0.00 -3.07 0.00 0.00 36.82 35.06 1vfl h ILE 76 CO 0.02 0.08 0.11 0.50 -0.69 0.00 0.00 178.15 178.17 1vfl h LYS 77 N 0.26 1.05 -0.44 2.37 3.64 -1.34 -2.93 116.57 119.19 1vfl h LYS 77 Ca 0.08 -0.28 -0.06 0.00 -1.27 0.00 0.00 60.65 59.12 1vfl h LYS 77 Cb 0.02 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 1vfl h LYS 77 CO -0.01 0.97 0.05 -0.09 -2.27 0.00 0.00 179.45 178.10 1vfl h ARG 78 N 0.97 0.74 -0.11 1.90 2.43 -0.82 -1.88 114.38 117.61 1vfl h ARG 78 Ca 0.19 -0.21 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 1vfl h ARG 78 Cb 0.43 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1vfl h ARG 78 CO 0.01 0.78 -0.25 -0.84 -1.51 0.00 0.00 179.97 178.15 1vfl h ILE 79 N 0.59 1.23 -0.37 1.20 3.07 -1.13 0.98 117.51 123.09 1vfl h ILE 79 Ca 0.13 -1.08 -0.07 0.00 1.55 0.00 0.00 64.86 65.40 1vfl h ILE 79 Cb 0.41 1.43 -0.01 0.00 -0.27 0.00 0.00 36.82 38.38 1vfl h ILE 79 CO 0.01 0.32 -0.02 0.00 -1.05 0.00 0.00 178.15 177.41 1vfl h ALA 80 N 1.57 0.50 -0.08 0.16 0.00 -1.32 0.24 119.26 120.33 1vfl h ALA 80 Ca 0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1vfl h ALA 80 Cb 0.55 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1vfl h ALA 80 CO 0.04 0.30 0.04 -0.92 0.00 0.00 0.00 179.25 178.70 1vfl h TYR 81 N 0.48 0.12 0.00 0.00 3.20 -0.77 -2.71 116.97 117.30 1vfl h TYR 81 Ca 0.10 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 1vfl h TYR 81 Cb 0.50 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1vfl h TYR 81 CO 0.04 0.22 -0.22 0.93 -1.64 0.00 0.00 178.16 177.49 1vfl h GLU 82 N -0.01 0.00 -0.41 1.82 5.08 -0.75 -2.67 114.58 117.64 1vfl h GLU 82 Ca 0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1vfl h GLU 82 Cb 0.14 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1vfl h GLU 82 CO -0.00 0.22 0.17 0.35 -1.00 0.00 0.00 179.01 178.74 1vfl h PHE 83 N 0.00 0.61 -0.77 4.33 3.04 -0.63 -1.47 116.94 122.06 1vfl h PHE 83 Ca -0.00 -0.04 -0.01 0.00 3.98 0.00 0.00 57.97 61.89 1vfl h PHE 83 Cb 0.51 -0.18 -0.04 0.00 2.56 0.00 0.00 35.95 38.80 1vfl h PHE 83 CO 0.00 0.53 0.43 0.28 -2.02 0.00 0.00 178.31 177.54 1vfl h VAL 84 N 0.51 1.22 -0.61 1.41 2.07 -1.30 -2.11 116.25 117.45 1vfl h VAL 84 Ca 0.14 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 1vfl h VAL 84 Cb 0.17 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 1vfl h VAL 84 CO -0.01 0.24 0.32 -0.08 0.02 0.00 0.00 177.57 178.06 1vfl h GLU 85 N 1.06 0.87 -0.37 1.57 4.81 -1.34 -1.15 114.58 120.03 1vfl h GLU 85 Ca 0.27 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1vfl h GLU 85 Cb 0.00 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.18 1vfl h GLU 85 CO -0.05 0.67 0.17 0.52 -0.73 0.00 0.00 179.01 179.60 1vfl h MET 86 N 0.84 0.34 -0.61 1.92 2.86 -0.65 -1.98 114.93 117.65 1vfl h MET 86 Ca 0.21 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.80 1vfl h MET 86 Cb 0.07 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1vfl h MET 86 CO -0.03 0.23 0.24 0.87 1.06 0.00 0.00 176.91 179.27 1vfl h LYS 87 N 0.36 0.89 -0.85 1.72 1.79 -1.11 -2.22 116.57 117.14 1vfl h LYS 87 Ca 0.16 -0.14 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 1vfl h LYS 87 Cb 0.09 -0.15 -0.04 0.00 -1.58 0.00 0.00 32.23 30.54 1vfl h LYS 87 CO -0.12 0.73 0.49 0.00 -1.08 0.00 0.00 179.45 179.47 1vfl h ALA 88 N 1.39 1.09 0.00 3.86 0.00 -0.60 -0.84 119.26 124.16 1vfl h ALA 88 Ca 0.21 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1vfl h ALA 88 Cb 0.18 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1vfl h ALA 88 CO -0.02 0.57 -0.08 0.87 0.00 0.00 0.00 179.25 180.60 1vfl h LYS 89 N 1.18 0.00 -0.00 0.00 1.79 -0.80 -1.89 116.57 116.84 1vfl h LYS 89 Ca 0.30 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.77 1vfl h LYS 89 Cb -0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 1vfl h LYS 89 CO -0.05 0.08 -0.17 -0.25 -1.08 0.00 0.00 179.45 177.97 1vfl n ASP 90 N -3.28 0.40 0.00 0.86 10.43 -0.40 -4.91 116.55 119.64 1vfl n ASP 90 Ca -0.01 -0.29 0.00 0.00 2.57 0.00 0.00 54.79 57.07 1vfl n ASP 90 Cb 0.29 -0.09 0.00 0.00 1.84 0.00 0.00 41.12 43.16 1vfl n ASP 90 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1vfl n GLY 91 N 1.38 0.39 3.72 0.44 0.00 -0.71 -4.86 105.19 105.55 1vfl n GLY 91 Ca 0.11 -1.02 -0.40 0.00 0.00 0.00 0.00 46.02 44.71 1vfl n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vfl s VAL 92 N -2.00 5.03 -0.11 1.61 1.01 -0.73 -1.00 120.40 124.21 1vfl s VAL 92 Ca 0.00 1.46 0.20 0.00 0.00 0.00 0.00 61.98 63.64 1vfl s VAL 92 Cb 0.00 -4.05 -0.29 0.00 0.00 0.00 0.00 36.38 32.04 1vfl s VAL 92 CO 0.00 0.26 0.28 1.33 0.00 0.00 0.00 175.10 176.97 1vfl n VAL 93 N 3.71 0.65 -3.76 2.92 0.24 0.01 -4.51 118.33 117.59 1vfl n VAL 93 Ca -0.01 -0.66 -0.14 0.00 -2.04 0.00 0.00 64.34 61.49 1vfl n VAL 93 Cb 0.51 -0.22 -0.15 0.00 -1.47 0.00 0.00 33.84 32.52 1vfl n VAL 93 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1vfl s TYR 94 N -3.02 -0.09 -0.01 6.34 5.04 -1.21 -0.34 117.35 124.05 1vfl s TYR 94 Ca -0.09 0.35 -0.01 0.00 -2.44 0.00 0.00 57.07 54.88 1vfl s TYR 94 Cb 0.10 -0.14 0.00 0.00 0.35 0.00 0.00 41.96 42.27 1vfl s TYR 94 CO 0.86 -0.14 0.03 0.54 -1.34 0.00 0.00 175.55 175.50 1vfl s VAL 95 N 1.12 0.00 -0.27 3.14 0.11 -0.49 -1.78 120.40 122.23 1vfl s VAL 95 Ca -0.09 -0.04 -0.06 0.00 -2.93 0.00 0.00 61.98 58.86 1vfl s VAL 95 Cb -0.12 -0.06 0.01 0.00 -1.53 0.00 0.00 36.38 34.68 1vfl s VAL 95 CO -0.05 -0.02 0.04 -1.61 -3.33 0.00 0.00 175.10 170.13 1vfl s GLU 96 N -0.05 3.15 -0.10 1.54 2.02 -0.35 -1.67 118.70 123.23 1vfl s GLU 96 Ca -0.01 -0.81 -0.02 0.00 0.02 0.00 0.00 54.97 54.15 1vfl s GLU 96 Cb -0.01 -3.27 -0.03 0.00 0.10 0.00 0.00 34.13 30.92 1vfl s GLU 96 CO 0.00 -0.38 0.00 0.54 0.02 0.00 0.00 175.26 175.44 1vfl s VAL 97 N 1.48 4.31 0.25 2.63 0.11 -0.16 -4.19 120.40 124.83 1vfl s VAL 97 Ca 0.03 -0.24 0.11 0.00 -2.93 0.00 0.00 61.98 58.95 1vfl s VAL 97 Cb -0.17 -2.83 -0.05 0.00 -1.53 0.00 0.00 36.38 31.81 1vfl s VAL 97 CO 0.01 0.58 -0.18 0.00 -3.33 0.00 0.00 175.10 172.18 1vfl s ARG 98 N -0.66 1.56 -0.19 1.54 1.70 -0.66 -0.23 118.95 122.02 1vfl s ARG 98 Ca 0.11 -1.70 -0.35 0.00 -0.47 0.00 0.00 55.73 53.31 1vfl s ARG 98 Cb -0.12 -1.57 0.14 0.00 -0.57 0.00 0.00 34.95 32.84 1vfl s ARG 98 CO 0.02 0.29 1.29 1.52 -1.08 0.00 0.00 175.30 177.33 1vfl s TYR 99 N -2.62 -0.07 -0.32 5.89 -0.85 -0.85 -0.43 117.35 118.10 1vfl s TYR 99 Ca 0.27 0.03 -0.17 0.00 -0.52 0.00 0.00 57.07 56.69 1vfl s TYR 99 Cb -0.04 0.51 -0.02 0.00 0.38 0.00 0.00 41.96 42.80 1vfl s TYR 99 CO 0.12 -0.15 0.46 0.45 -1.52 0.00 0.00 175.55 174.91 1vfl s SER 100 N -2.28 6.30 0.37 -0.18 0.15 -1.26 -0.70 113.70 116.09 1vfl s SER 100 Ca 0.11 0.09 0.05 0.00 0.70 0.00 0.00 55.95 56.90 1vfl s SER 100 Cb 0.00 -2.24 0.73 0.00 -1.71 0.00 0.00 66.02 62.80 1vfl s SER 100 CO -0.04 -0.36 1.99 -0.65 1.20 0.00 0.00 173.24 175.38 1vfl h PRO 101 N 8.33 0.59 -0.69 5.44 0.11 -1.90 -2.69 132.00 141.19 1vfl h PRO 101 Ca -0.29 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.71 1vfl h PRO 101 Cb 1.14 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 1vfl h PRO 101 CO 0.72 0.46 0.26 0.45 -0.21 0.00 0.00 178.00 179.68 1vfl h HIS 102 N 0.59 1.04 0.00 0.65 3.86 -1.91 -2.60 115.15 116.79 1vfl h HIS 102 Ca 0.15 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1vfl h HIS 102 Cb 0.07 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.22 1vfl h HIS 102 CO 0.00 0.80 0.00 1.28 0.86 0.00 0.00 177.93 180.88 1vfl n LEU 103 N -4.29 0.00 -0.20 2.43 4.77 -1.01 -2.14 117.00 116.56 1vfl n LEU 103 Ca 0.06 0.06 0.03 0.00 -0.03 0.00 0.00 56.01 56.13 1vfl n LEU 103 Cb 0.19 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1vfl n LEU 103 CO 0.40 -0.02 0.31 0.18 -1.33 0.00 0.00 177.39 176.92 1vfl n LEU 104 N -1.06 1.34 -4.96 2.23 4.77 -0.99 -4.77 117.00 113.57 1vfl n LEU 104 Ca 0.13 -0.96 -0.19 0.00 -0.03 0.00 0.00 56.01 54.96 1vfl n LEU 104 Cb 0.08 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 1vfl n LEU 104 CO 0.12 0.28 0.03 0.00 -1.33 0.00 0.00 177.39 176.49 1vfl s ALA 105 N -0.53 4.16 0.00 -1.18 0.00 -0.91 -0.99 121.76 122.31 1vfl s ALA 105 Ca 0.06 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.51 1vfl s ALA 105 Cb 0.04 -1.57 0.00 0.00 0.00 0.00 0.00 23.12 21.59 1vfl s ALA 105 CO 0.08 -0.03 0.20 0.27 0.00 0.00 0.00 175.76 176.28 1vfl n ASN 106 N -1.59 0.07 -4.25 0.00 0.23 0.08 -4.60 115.26 105.21 1vfl n ASN 106 Ca -0.00 -1.02 -0.29 0.00 -0.53 0.00 0.00 54.58 52.74 1vfl n ASN 106 Cb 0.58 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 38.13 1vfl n ASN 106 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1vfl s SER 107 N -0.02 2.64 0.24 0.53 0.15 0.61 0.05 113.70 117.90 1vfl s SER 107 Ca 0.00 -0.41 0.00 0.00 0.70 0.00 0.00 55.95 56.24 1vfl s SER 107 Cb 0.00 -0.33 0.00 0.00 -1.71 0.00 0.00 66.02 63.98 1vfl s SER 107 CO 0.00 0.27 0.00 1.17 1.20 0.00 0.00 173.24 175.88 1vfl n LYS 108 N 2.57 0.00 -2.84 5.44 4.81 -1.26 -4.02 118.16 122.85 1vfl n LYS 108 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 1vfl n LYS 108 Cb 0.52 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.57 1vfl n LYS 108 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1vfl n VAL 109 N 0.00 -1.70 -0.04 3.15 0.31 -1.26 -4.79 118.33 114.00 1vfl n VAL 109 Ca 0.00 0.42 -0.10 0.00 -0.01 0.00 0.00 64.34 64.65 1vfl n VAL 109 Cb 0.00 -2.60 -0.07 0.00 -0.91 0.00 0.00 33.84 30.26 1vfl n VAL 109 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1vfl h GLU 110 N 3.33 -0.34 -5.67 5.55 4.57 -2.00 -2.95 114.58 117.07 1vfl h GLU 110 Ca 0.00 0.02 -0.46 0.00 -1.18 0.00 0.00 59.36 57.74 1vfl h GLU 110 Cb 0.83 0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 29.44 1vfl h GLU 110 CO 0.00 -0.23 1.43 -2.14 -1.18 0.00 0.00 179.01 176.89 1vfl s PRO 111 N -4.81 3.06 -0.25 0.92 0.02 -1.26 -4.89 135.00 127.79 1vfl s PRO 111 Ca -0.10 -1.33 -0.35 0.00 0.02 0.00 0.00 61.00 59.24 1vfl s PRO 111 Cb 0.05 -5.33 -0.11 0.00 0.02 0.00 0.00 34.50 29.13 1vfl s PRO 111 CO 0.41 -3.23 2.06 -0.89 -0.33 0.00 0.00 177.00 175.02 1vfl n ILE 112 N 7.29 0.34 -1.67 2.83 5.41 -1.11 -4.90 119.36 127.55 1vfl n ILE 112 Ca 0.45 -0.22 -0.33 0.00 1.00 0.00 0.00 62.75 63.65 1vfl n ILE 112 Cb 0.47 -1.78 0.06 0.00 -0.71 0.00 0.00 39.64 37.68 1vfl n ILE 112 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1vfl s PRO 113 N 5.32 2.65 -1.92 0.38 0.04 -1.26 -3.87 135.00 136.34 1vfl s PRO 113 Ca 1.02 1.44 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1vfl s PRO 113 Cb -0.77 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 31.84 1vfl s PRO 113 CO 0.50 -1.38 0.00 0.91 0.04 0.00 0.00 177.00 177.07 1vfl n TRP 114 N -2.55 -0.66 -2.00 0.56 5.03 -1.26 -2.55 117.44 114.02 1vfl n TRP 114 Ca 0.11 0.00 -0.11 0.00 3.03 0.00 0.00 57.50 60.52 1vfl n TRP 114 Cb 0.52 -3.77 -0.02 0.00 -1.03 0.00 0.00 31.31 27.00 1vfl n TRP 114 CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 1vfl n ASN 115 N -1.77 -3.38 -4.84 -0.99 4.13 -1.25 -4.88 115.26 102.27 1vfl n ASN 115 Ca -0.23 0.24 -0.32 0.00 1.68 0.00 0.00 54.58 55.96 1vfl n ASN 115 Cb 0.68 -3.01 -0.01 0.00 -1.54 0.00 0.00 39.78 35.90 1vfl n ASN 115 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1vfl s GLN 116 N -4.19 3.69 0.42 3.52 -2.07 -1.06 -5.03 119.66 114.95 1vfl s GLN 116 Ca 0.00 0.92 -0.23 0.00 -1.82 0.00 0.00 55.36 54.23 1vfl s GLN 116 Cb 0.00 -2.10 -0.09 0.00 -1.09 0.00 0.00 33.01 29.74 1vfl s GLN 116 CO 0.00 -0.49 1.04 0.00 -1.32 0.00 0.00 175.29 174.52 1vfl s ALA 117 N -2.81 3.02 -0.09 2.60 0.00 -1.26 -4.88 121.76 118.34 1vfl s ALA 117 Ca 0.58 0.66 -0.37 0.00 0.00 0.00 0.00 51.96 52.83 1vfl s ALA 117 Cb -0.11 -3.26 -0.15 0.00 0.00 0.00 0.00 23.12 19.60 1vfl s ALA 117 CO 0.41 -0.22 1.63 -1.91 0.00 0.00 0.00 175.76 175.67 1vfl n GLU 118 N -0.35 1.46 0.00 0.00 0.00 -1.26 -4.93 120.64 115.56 1vfl n GLU 118 Ca 0.06 0.53 0.00 0.00 0.00 0.00 0.00 57.16 57.76 1vfl n GLU 118 Cb 0.51 -2.24 0.00 0.00 0.00 0.00 0.00 31.44 29.70 1vfl n GLU 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1vfl n GLY 119 N 3.66 4.83 0.11 8.31 0.00 0.11 -5.00 105.19 117.21 1vfl n GLY 119 Ca 0.22 -1.71 0.02 0.00 0.00 0.00 0.00 46.02 44.55 1vfl n GLY 119 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vfl n ASP 120 N 0.00 1.02 -4.40 1.61 4.64 -1.26 -4.42 116.55 113.73 1vfl n ASP 120 Ca 0.00 -1.86 -0.42 0.00 -1.38 0.00 0.00 54.79 51.14 1vfl n ASP 120 Cb 0.00 -0.11 -0.11 0.00 -1.04 0.00 0.00 41.12 39.86 1vfl n ASP 120 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 1vfl s LEU 121 N -0.81 4.91 0.46 -2.67 0.20 -1.26 -4.84 118.68 114.67 1vfl s LEU 121 Ca 0.06 -1.00 -0.03 0.00 0.69 0.00 0.00 54.13 53.85 1vfl s LEU 121 Cb 0.05 -2.08 -0.03 0.00 -0.43 0.00 0.00 46.19 43.71 1vfl s LEU 121 CO 0.01 -0.42 0.73 0.42 -0.29 0.00 0.00 176.35 176.79 1vfl s THR 122 N 1.60 4.72 0.30 3.68 -4.23 -1.26 -0.29 115.64 120.16 1vfl s THR 122 Ca 0.03 -0.07 0.01 0.00 -1.18 0.00 0.00 61.69 60.48 1vfl s THR 122 Cb -0.19 -3.78 0.28 0.00 1.34 0.00 0.00 72.50 70.15 1vfl s THR 122 CO 0.08 -0.68 1.91 -0.65 -0.54 0.00 0.00 174.62 174.74 1vfl h PRO 123 N 0.33 1.00 -0.06 3.99 0.11 -1.82 -1.63 132.00 133.92 1vfl h PRO 123 Ca -0.47 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.59 1vfl h PRO 123 Cb 1.22 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1vfl h PRO 123 CO 0.61 0.66 -0.02 0.22 -0.21 0.00 0.00 178.00 179.26 1vfl h ASP 124 N 1.03 -0.06 -0.12 -2.05 1.82 -1.94 -2.10 116.42 113.01 1vfl h ASP 124 Ca 0.40 0.02 -0.07 0.00 -0.39 0.00 0.00 57.03 56.99 1vfl h ASP 124 Cb 0.22 0.04 -0.02 0.00 0.68 0.00 0.00 39.33 40.26 1vfl h ASP 124 CO -0.15 -0.02 -0.13 -0.08 -1.61 0.00 0.00 179.24 177.25 1vfl h GLU 125 N 0.00 0.46 -0.24 0.28 4.81 -1.84 -2.61 114.58 115.44 1vfl h GLU 125 Ca 0.03 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1vfl h GLU 125 Cb 0.05 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 1vfl h GLU 125 CO -0.07 0.59 -0.02 0.28 -0.73 0.00 0.00 179.01 179.06 1vfl h VAL 126 N 0.43 0.80 -0.65 0.32 2.07 -0.82 -0.90 116.25 117.50 1vfl h VAL 126 Ca 0.08 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.66 1vfl h VAL 126 Cb 0.48 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 1vfl h VAL 126 CO 0.03 0.01 0.34 0.58 0.02 0.00 0.00 177.57 178.54 1vfl h VAL 127 N 0.05 0.91 -0.71 2.57 2.07 -1.03 -0.22 116.25 119.89 1vfl h VAL 127 Ca 0.12 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 1vfl h VAL 127 Cb 0.16 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 1vfl h VAL 127 CO -0.21 0.11 0.24 0.77 0.02 0.00 0.00 177.57 178.50 1vfl h SER 128 N 0.61 1.00 -0.45 0.57 4.64 -1.11 -0.21 113.55 118.60 1vfl h SER 128 Ca 0.31 -0.17 -0.11 0.00 -0.47 0.00 0.00 61.79 61.35 1vfl h SER 128 Cb 0.25 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 1vfl h SER 128 CO -0.22 0.91 -0.12 -0.07 -0.87 0.00 0.00 176.83 176.47 1vfl h LEU 129 N 1.04 0.92 -0.29 5.97 -0.00 -0.35 -1.71 115.31 120.90 1vfl h LEU 129 Ca 0.23 -0.30 -0.05 0.00 -0.00 0.00 0.00 57.88 57.77 1vfl h LEU 129 Cb 0.26 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 40.66 1vfl h LEU 129 CO -0.01 1.05 0.00 0.58 -0.00 0.00 0.00 178.44 180.05 1vfl h VAL 130 N 0.83 1.26 -0.42 1.22 2.07 -0.70 -1.99 116.25 118.52 1vfl h VAL 130 Ca 0.13 -0.93 0.08 0.00 0.82 0.00 0.00 66.70 66.81 1vfl h VAL 130 Cb 0.65 1.30 -0.08 0.00 -1.52 0.00 0.00 31.29 31.64 1vfl h VAL 130 CO 0.05 0.30 -0.11 0.78 0.02 0.00 0.00 177.57 178.61 1vfl h ASN 131 N 0.30 -0.39 -0.30 0.57 -0.26 -0.86 0.50 115.58 115.13 1vfl h ASN 131 Ca 0.08 0.13 0.02 0.00 -0.56 0.00 0.00 56.30 55.97 1vfl h ASN 131 Cb 0.43 0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.92 1vfl h ASN 131 CO 0.01 -0.14 0.15 1.56 -1.06 0.00 0.00 177.43 177.95 1vfl h GLN 132 N -0.00 0.30 -0.57 0.81 4.20 -1.15 0.01 115.11 118.71 1vfl h GLN 132 Ca 0.20 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 1vfl h GLN 132 Cb 0.31 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 1vfl h GLN 132 CO -0.43 0.20 0.22 0.78 -0.67 0.00 0.00 178.83 178.93 1vfl h GLY 133 N 0.31 0.92 1.05 3.46 0.00 -0.70 -1.14 103.07 106.97 1vfl h GLY 133 Ca 0.13 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.87 1vfl h GLY 133 CO -0.09 0.47 0.07 1.41 0.00 0.00 0.00 176.54 178.41 1vfl h LEU 134 N 0.78 1.00 -0.44 3.11 3.38 -0.66 -0.81 115.31 121.67 1vfl h LEU 134 Ca 0.19 -0.27 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 1vfl h LEU 134 Cb 0.21 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1vfl h LEU 134 CO -0.01 1.03 -0.28 1.56 0.09 0.00 0.00 178.44 180.83 1vfl h GLN 135 N 0.95 0.97 -0.30 1.13 4.20 -0.83 0.29 115.11 121.51 1vfl h GLN 135 Ca 0.18 -0.45 -0.09 0.00 0.06 0.00 0.00 58.65 58.35 1vfl h GLN 135 Cb 0.47 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 1vfl h GLN 135 CO 0.02 1.12 -0.19 0.93 -0.67 0.00 0.00 178.83 180.04 1vfl h GLU 136 N 0.81 0.55 -0.43 1.46 5.08 -1.12 -1.93 114.58 119.00 1vfl h GLU 136 Ca 0.09 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 58.13 1vfl h GLU 136 Cb 0.86 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1vfl h GLU 136 CO 0.08 0.71 -0.25 0.78 -1.00 0.00 0.00 179.01 179.33 1vfl h GLY 137 N 0.98 0.96 1.01 -3.84 0.00 -0.86 -1.29 103.07 100.03 1vfl h GLY 137 Ca 0.08 -0.86 -0.01 0.00 0.00 0.00 0.00 47.33 46.54 1vfl h GLY 137 CO 0.04 0.78 0.39 -2.09 0.00 0.00 0.00 176.54 175.66 1vfl h GLU 138 N 0.76 0.99 -0.57 4.80 4.81 -0.60 0.74 114.58 125.52 1vfl h GLU 138 Ca 0.10 -0.12 -0.09 0.00 -0.13 0.00 0.00 59.36 59.12 1vfl h GLU 138 Cb 0.80 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 1vfl h GLU 138 CO 0.07 0.74 -0.00 0.00 -0.73 0.00 0.00 179.01 179.08 1vfl h ARG 139 N 0.98 0.99 0.00 1.92 3.08 -1.12 -2.59 114.38 117.63 1vfl h ARG 139 Ca 0.25 -0.30 -0.22 0.00 0.07 0.00 0.00 59.98 59.78 1vfl h ARG 139 Cb 0.04 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 1vfl h ARG 139 CO -0.04 0.97 -1.23 -0.44 -1.07 0.00 0.00 179.97 178.16 1vfl h ASP 140 N 0.90 0.00 -0.02 7.04 3.45 -0.87 -3.40 116.42 123.53 1vfl h ASP 140 Ca 0.16 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.62 1vfl h ASP 140 Cb 0.53 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.30 1vfl h ASP 140 CO 0.03 0.90 0.00 0.49 -1.57 0.00 0.00 179.24 179.09 1vfl n PHE 141 N -3.19 0.01 -2.99 4.55 3.01 0.22 -5.03 117.46 114.04 1vfl n PHE 141 Ca -0.07 -0.02 -0.14 0.00 1.01 0.00 0.00 57.45 58.24 1vfl n PHE 141 Cb 0.95 -0.00 0.04 0.00 -0.01 0.00 0.00 39.48 40.45 1vfl n PHE 141 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1vfl n GLY 142 N 0.37 0.04 3.09 1.37 0.00 -0.98 -4.85 105.19 104.23 1vfl n GLY 142 Ca 0.04 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 1vfl n GLY 142 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vfl s VAL 143 N -3.09 1.53 -0.02 1.61 1.01 -1.25 -4.87 120.40 115.32 1vfl s VAL 143 Ca 0.29 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 1vfl s VAL 143 Cb -0.13 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1vfl s VAL 143 CO 0.36 0.44 1.16 -0.75 0.00 0.00 0.00 175.10 176.31 1vfl s LYS 144 N 0.68 4.40 -0.05 2.72 2.20 0.54 -4.42 119.74 125.80 1vfl s LYS 144 Ca -0.13 1.65 0.02 0.00 -0.36 0.00 0.00 55.97 57.15 1vfl s LYS 144 Cb -0.16 -3.49 0.01 0.00 -1.51 0.00 0.00 37.83 32.68 1vfl s LYS 144 CO 0.03 -0.35 -0.12 0.08 -0.36 0.00 0.00 175.35 174.64 1vfl s VAL 145 N 1.78 1.05 0.13 4.02 1.01 -1.26 -1.40 120.40 125.73 1vfl s VAL 145 Ca 0.56 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 62.13 1vfl s VAL 145 Cb -0.25 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1vfl s VAL 145 CO 0.24 0.33 -0.11 -0.13 0.00 0.00 0.00 175.10 175.43 1vfl s ARG 146 N 0.50 1.00 0.35 2.72 1.81 -0.67 -4.74 118.95 119.92 1vfl s ARG 146 Ca -0.10 -1.32 0.09 0.00 -1.72 0.00 0.00 55.73 52.68 1vfl s ARG 146 Cb -0.14 -0.69 -0.06 0.00 -0.45 0.00 0.00 34.95 33.61 1vfl s ARG 146 CO 0.03 0.11 -0.08 -1.54 -0.68 0.00 0.00 175.30 173.13 1vfl s SER 147 N -2.78 3.78 -0.04 0.23 1.04 0.46 -0.99 113.70 115.39 1vfl s SER 147 Ca 0.12 -1.18 0.01 0.00 0.48 0.00 0.00 55.95 55.37 1vfl s SER 147 Cb -0.01 -0.37 0.02 0.00 0.10 0.00 0.00 66.02 65.77 1vfl s SER 147 CO 0.01 -0.21 -0.03 -0.63 0.98 0.00 0.00 173.24 173.36 1vfl s ILE 148 N -2.60 0.40 -0.12 -1.02 1.01 0.69 -0.70 121.20 118.86 1vfl s ILE 148 Ca 0.33 -0.04 -0.17 0.00 0.00 0.00 0.00 60.65 60.76 1vfl s ILE 148 Cb 0.02 -0.46 -0.04 0.00 0.01 0.00 0.00 42.46 41.99 1vfl s ILE 148 CO 0.17 0.20 0.45 -0.76 0.00 0.00 0.00 174.94 175.00 1vfl s LEU 149 N 0.99 4.28 -0.15 2.97 1.43 -0.96 -2.00 118.68 125.24 1vfl s LEU 149 Ca -0.10 0.79 -0.14 0.00 -1.03 0.00 0.00 54.13 53.64 1vfl s LEU 149 Cb -0.14 -2.65 -0.05 0.00 0.03 0.00 0.00 46.19 43.38 1vfl s LEU 149 CO -0.01 0.03 0.32 0.00 0.23 0.00 0.00 176.35 176.92 1vfl s MET 152 N -2.84 3.61 0.38 0.00 -1.94 -1.26 -0.77 119.30 116.48 1vfl s MET 152 Ca 0.50 -0.53 0.16 0.00 -1.71 0.00 0.00 55.69 54.11 1vfl s MET 152 Cb -0.11 -3.00 1.04 0.00 2.01 0.00 0.00 34.83 34.77 1vfl s MET 152 CO 0.19 0.09 1.76 0.00 -0.01 0.00 0.00 175.02 177.05 1vfl h ARG 153 N 7.23 0.44 -0.01 2.03 3.08 -0.64 0.40 114.38 126.91 1vfl h ARG 153 Ca -0.34 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.68 1vfl h ARG 153 Cb 1.18 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1vfl h ARG 153 CO 0.61 0.29 -0.03 -2.39 -1.07 0.00 0.00 179.97 177.38 1vfl n HIS 154 N -4.69 0.00 -3.15 3.04 1.44 -1.26 -4.29 115.22 106.31 1vfl n HIS 154 Ca 0.25 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.74 1vfl n HIS 154 Cb 0.83 -0.04 -0.05 0.00 0.12 0.00 0.00 29.99 30.86 1vfl n HIS 154 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1vfl n GLN 155 N -0.48 1.70 -0.07 -1.40 1.13 0.13 -4.92 117.38 113.46 1vfl n GLN 155 Ca 0.20 -3.89 0.24 0.00 -1.94 0.00 0.00 57.00 51.60 1vfl n GLN 155 Cb 0.25 -1.82 0.71 0.00 0.11 0.00 0.00 30.24 29.49 1vfl n GLN 155 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1vfl h PRO 156 N 3.32 0.00 0.00 -1.09 0.11 -1.75 -0.94 132.00 131.65 1vfl h PRO 156 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1vfl h PRO 156 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1vfl h PRO 156 CO 0.62 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.07 1vfl h SER 157 N 0.00 0.00 0.66 -2.05 4.64 -1.91 -1.97 113.55 112.91 1vfl h SER 157 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1vfl h SER 157 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1vfl h SER 157 CO -0.00 0.00 -1.22 0.79 -0.87 0.00 0.00 176.83 175.52 1vfl n TRP 158 N -2.81 0.61 -0.30 4.77 8.01 -0.36 -4.52 117.44 122.83 1vfl n TRP 158 Ca -0.02 0.18 0.13 0.00 -1.31 0.00 0.00 57.50 56.48 1vfl n TRP 158 Cb 0.09 -0.75 0.37 0.00 -2.01 0.00 0.00 31.31 29.02 1vfl n TRP 158 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 1vfl h SER 159 N 0.00 0.67 -0.25 -0.99 0.02 -1.46 -1.38 113.55 110.16 1vfl h SER 159 Ca 0.00 0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 60.88 1vfl h SER 159 Cb 0.94 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 1vfl h SER 159 CO 0.00 0.30 -0.30 0.28 -1.14 0.00 0.00 176.83 175.97 1vfl h SER 160 N 0.69 0.79 -0.30 3.07 0.02 -1.79 -2.22 113.55 113.80 1vfl h SER 160 Ca 0.50 -0.32 -0.07 0.00 -0.84 0.00 0.00 61.79 61.06 1vfl h SER 160 Cb 0.86 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 1vfl h SER 160 CO -0.26 1.03 -0.05 -0.33 -1.14 0.00 0.00 176.83 176.09 1vfl h GLU 161 N 0.65 0.68 -0.03 3.45 5.08 -1.57 -2.07 114.58 120.76 1vfl h GLU 161 Ca 0.07 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1vfl h GLU 161 Cb 0.83 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.00 1vfl h GLU 161 CO 0.07 0.73 0.02 0.28 -1.00 0.00 0.00 179.01 179.10 1vfl h VAL 162 N 0.63 1.10 -0.26 3.13 2.07 -0.94 -1.71 116.25 120.26 1vfl h VAL 162 Ca 0.12 -0.29 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 1vfl h VAL 162 Cb 0.47 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1vfl h VAL 162 CO 0.02 0.08 -0.08 1.62 0.02 0.00 0.00 177.57 179.23 1vfl h VAL 163 N -0.06 1.20 0.00 2.57 3.04 -1.24 -1.82 116.25 119.93 1vfl h VAL 163 Ca 0.01 -0.87 -0.11 0.00 -1.01 0.00 0.00 66.70 64.73 1vfl h VAL 163 Cb 0.11 1.10 -0.02 0.00 -2.01 0.00 0.00 31.29 30.48 1vfl h VAL 163 CO -0.00 0.28 -0.50 -0.33 -1.01 0.00 0.00 177.57 176.01 1vfl h GLU 164 N 0.40 0.00 -0.27 4.17 4.39 -1.19 -2.05 114.58 120.03 1vfl h GLU 164 Ca 0.08 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.60 1vfl h GLU 164 Cb 0.40 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1vfl h GLU 164 CO 0.02 0.50 -0.54 -0.07 -1.16 0.00 0.00 179.01 177.76 1vfl h LEU 165 N 0.00 0.88 -0.93 1.33 4.07 -0.61 -0.39 115.31 119.66 1vfl h LEU 165 Ca -0.01 -0.47 -0.01 0.00 0.08 0.00 0.00 57.88 57.48 1vfl h LEU 165 Cb 0.91 -0.25 -0.04 0.00 1.08 0.00 0.00 40.66 42.36 1vfl h LEU 165 CO 0.07 1.24 0.55 0.00 -1.08 0.00 0.00 178.44 179.22 1vfl h LYS 167 N 1.28 0.58 -0.81 0.00 1.57 -1.20 -1.92 116.57 116.08 1vfl h LYS 167 Ca 0.33 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1vfl h LYS 167 Cb -0.04 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.23 1vfl h LYS 167 CO -0.06 0.88 0.38 -0.22 -0.57 0.00 0.00 179.45 179.85 1vfl h LYS 168 N 0.30 1.16 -0.45 3.15 3.64 -0.65 -3.08 116.57 120.64 1vfl h LYS 168 Ca 0.05 -0.17 -0.14 0.00 -1.27 0.00 0.00 60.65 59.11 1vfl h LYS 168 Cb 0.74 -0.21 -0.09 0.00 -0.41 0.00 0.00 32.23 32.27 1vfl h LYS 168 CO 0.05 0.90 0.08 0.66 -2.27 0.00 0.00 179.45 178.87 1vfl n TYR 169 N -4.31 1.47 -1.69 1.91 4.01 -0.31 -5.01 117.16 113.24 1vfl n TYR 169 Ca 0.08 -1.26 -0.41 0.00 -0.16 0.00 0.00 57.90 56.15 1vfl n TYR 169 Cb 0.14 -0.50 0.01 0.00 -0.31 0.00 0.00 39.34 38.69 1vfl n TYR 169 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 1vfl n ARG 170 N -0.69 1.82 0.00 -0.72 1.85 -0.72 -1.82 116.66 116.38 1vfl n ARG 170 Ca 0.32 0.65 0.00 0.00 -1.00 0.00 0.00 57.85 57.82 1vfl n ARG 170 Cb 1.10 -2.34 0.00 0.00 -1.05 0.00 0.00 32.46 30.17 1vfl n ARG 170 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1vfl n GLU 171 N -0.01 0.00 -1.03 2.89 4.07 -0.94 -4.74 120.64 120.88 1vfl n GLU 171 Ca 0.07 0.00 -0.31 0.00 -0.06 0.00 0.00 57.16 56.86 1vfl n GLU 171 Cb 0.40 -0.12 -0.02 0.00 -0.06 0.00 0.00 31.44 31.63 1vfl n GLU 171 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 1vfl n GLN 172 N 0.00 2.77 0.00 5.31 7.27 -0.75 -4.49 117.38 127.49 1vfl n GLN 172 Ca 0.00 -1.83 0.00 0.00 0.07 0.00 0.00 57.00 55.24 1vfl n GLN 172 Cb 0.00 -2.65 0.00 0.00 2.41 0.00 0.00 30.24 30.00 1vfl n GLN 172 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1vfl n THR 173 N 4.06 0.00 -2.25 1.69 -2.24 -1.26 -4.87 114.28 109.41 1vfl n THR 173 Ca 0.59 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.95 1vfl n THR 173 Cb 0.19 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.40 1vfl n THR 173 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1vfl s VAL 174 N 0.00 3.94 -0.02 2.28 1.01 -1.21 0.17 120.40 126.57 1vfl s VAL 174 Ca 0.00 1.10 0.01 0.00 0.00 0.00 0.00 61.98 63.08 1vfl s VAL 174 Cb 0.00 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 1vfl s VAL 174 CO 0.00 -0.25 0.02 1.33 0.00 0.00 0.00 175.10 176.20 1vfl n VAL 175 N 5.92 0.00 -3.86 2.92 0.24 0.12 -2.21 118.33 121.47 1vfl n VAL 175 Ca 0.16 -0.47 -0.09 0.00 -2.04 0.00 0.00 64.34 61.90 1vfl n VAL 175 Cb 0.45 0.99 -0.00 0.00 -1.47 0.00 0.00 33.84 33.81 1vfl n VAL 175 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vfl s ALA 176 N -1.08 -0.79 0.11 2.33 0.00 -1.23 -3.12 121.76 117.98 1vfl s ALA 176 Ca 0.00 -0.65 0.11 0.00 0.00 0.00 0.00 51.96 51.42 1vfl s ALA 176 Cb 0.00 0.79 -0.04 0.00 0.00 0.00 0.00 23.12 23.88 1vfl s ALA 176 CO 0.02 -0.99 -0.27 -1.50 0.00 0.00 0.00 175.76 173.03 1vfl s ILE 177 N -3.03 2.23 0.30 0.00 2.07 -0.41 -2.25 121.20 120.11 1vfl s ILE 177 Ca 0.15 -1.68 0.03 0.00 -1.41 0.00 0.00 60.65 57.74 1vfl s ILE 177 Cb -0.05 -1.96 -0.06 0.00 0.13 0.00 0.00 42.46 40.52 1vfl s ILE 177 CO 0.10 0.15 0.07 -0.62 -1.91 0.00 0.00 174.94 172.73 1vfl s ASP 178 N -1.89 1.88 -0.15 4.50 3.68 0.22 -1.73 116.67 123.18 1vfl s ASP 178 Ca 0.13 -1.38 -0.03 0.00 2.13 0.00 0.00 52.55 53.41 1vfl s ASP 178 Cb -0.10 0.02 0.05 0.00 -1.45 0.00 0.00 42.92 41.44 1vfl s ASP 178 CO 0.05 -0.66 0.04 -0.22 0.13 0.00 0.00 175.17 174.51 1vfl s LEU 179 N -3.41 0.80 0.41 -1.34 0.20 -1.22 -0.35 118.68 113.76 1vfl s LEU 179 Ca 0.37 -0.54 0.03 0.00 0.69 0.00 0.00 54.13 54.69 1vfl s LEU 179 Cb 0.08 -0.46 -0.03 0.00 -0.43 0.00 0.00 46.19 45.36 1vfl s LEU 179 CO 0.15 -0.28 0.10 0.00 -0.29 0.00 0.00 176.35 176.03 1vfl s ALA 180 N 1.96 3.01 0.00 5.97 0.00 0.05 -1.12 121.76 131.63 1vfl s ALA 180 Ca 0.02 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1vfl s ALA 180 Cb -0.15 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.61 1vfl s ALA 180 CO -0.07 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.81 1vfl n GLY 181 N -0.93 0.00 3.63 0.00 0.00 -1.26 0.14 105.19 106.77 1vfl n GLY 181 Ca -0.07 -2.23 -0.43 0.00 0.00 0.00 0.00 46.02 43.29 1vfl n GLY 181 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vfl s ASP 182 N -4.00 6.61 0.36 1.61 2.15 -1.26 -4.88 116.67 117.26 1vfl s ASP 182 Ca 0.00 1.44 0.22 0.00 0.43 0.00 0.00 52.55 54.64 1vfl s ASP 182 Cb 0.00 -2.54 0.23 0.00 -0.30 0.00 0.00 42.92 40.31 1vfl s ASP 182 CO 0.00 -1.09 1.44 -0.08 -0.17 0.00 0.00 175.17 175.27 1vfl h GLU 183 N 9.64 0.00 0.00 4.34 4.81 -1.94 -3.24 114.58 128.19 1vfl h GLU 183 Ca -0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1vfl h GLU 183 Cb 1.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1vfl h GLU 183 CO 1.01 0.03 0.00 0.25 -0.73 0.00 0.00 179.01 179.57 1vfl n THR 184 N -2.99 0.37 -2.00 0.32 -2.24 -1.26 -4.70 114.28 101.77 1vfl n THR 184 Ca 0.03 0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.47 1vfl n THR 184 Cb 0.55 -0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 1vfl n THR 184 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1vfl s ILE 185 N -2.53 3.56 0.19 2.28 1.01 -1.23 -4.91 121.20 119.57 1vfl s ILE 185 Ca 0.20 0.66 -0.32 0.00 0.00 0.00 0.00 60.65 61.18 1vfl s ILE 185 Cb 0.13 -3.49 -0.12 0.00 0.01 0.00 0.00 42.46 39.00 1vfl s ILE 185 CO 0.30 -0.13 1.74 1.21 0.00 0.00 0.00 174.94 178.06 1vfl n GLU 186 N 7.41 2.77 -1.04 2.79 2.13 -1.26 -2.15 120.64 131.29 1vfl n GLU 186 Ca 0.19 1.00 -0.01 0.00 0.66 0.00 0.00 57.16 58.99 1vfl n GLU 186 Cb 0.44 -2.86 -0.01 0.00 0.27 0.00 0.00 31.44 29.28 1vfl n GLU 186 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1vfl n GLY 187 N 4.01 0.22 0.36 8.31 0.00 -1.26 -4.86 105.19 111.97 1vfl n GLY 187 Ca 0.16 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.20 1vfl n GLY 187 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vfl h SER 188 N 0.00 0.84 0.09 1.61 4.64 -1.78 0.04 113.55 118.98 1vfl h SER 188 Ca -0.03 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 1vfl h SER 188 Cb 0.82 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 1vfl h SER 188 CO 0.04 0.56 -0.14 0.28 -0.87 0.00 0.00 176.83 176.70 1vfl h SER 189 N 0.97 0.11 0.22 4.97 0.02 -1.89 -2.28 113.55 115.68 1vfl h SER 189 Ca 0.34 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 1vfl h SER 189 Cb 0.11 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1vfl h SER 189 CO -0.11 0.27 -0.14 0.18 -1.14 0.00 0.00 176.83 175.89 1vfl n LEU 190 N -4.31 0.86 -4.67 5.07 7.99 -0.07 -4.45 117.00 117.42 1vfl n LEU 190 Ca -0.02 -0.20 -0.47 0.00 -0.01 0.00 0.00 56.01 55.32 1vfl n LEU 190 Cb 0.25 -0.12 -0.05 0.00 -0.11 0.00 0.00 43.42 43.39 1vfl n LEU 190 CO 0.37 0.16 1.33 0.49 -1.51 0.00 0.00 177.39 178.22 1vfl n PHE 191 N -0.63 2.28 -0.33 -1.77 3.72 -0.79 -4.76 117.46 115.19 1vfl n PHE 191 Ca 0.15 0.15 0.24 0.00 -0.05 0.00 0.00 57.45 57.93 1vfl n PHE 191 Cb 0.31 -2.59 0.46 0.00 -0.94 0.00 0.00 39.48 36.72 1vfl n PHE 191 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1vfl h PRO 192 N 7.45 0.20 -0.86 -1.08 0.11 -1.91 0.93 132.00 136.85 1vfl h PRO 192 Ca -0.47 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1vfl h PRO 192 Cb 1.27 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 1vfl h PRO 192 CO 0.91 0.13 0.49 0.78 -0.21 0.00 0.00 178.00 180.11 1vfl h GLY 193 N 0.21 1.26 0.57 -0.55 0.00 -1.88 -0.64 103.07 102.04 1vfl h GLY 193 Ca 0.73 -0.55 -0.07 0.00 0.00 0.00 0.00 47.33 47.43 1vfl h GLY 193 CO -0.68 0.53 -0.25 0.45 0.00 0.00 0.00 176.54 176.60 1vfl h HIS 194 N 1.19 0.32 -1.00 5.60 3.86 -1.08 -2.87 115.15 121.16 1vfl h HIS 194 Ca 0.30 -0.15 0.03 0.00 -1.16 0.00 0.00 60.37 59.40 1vfl h HIS 194 Cb -0.00 -0.05 -0.06 0.00 1.06 0.00 0.00 27.41 28.36 1vfl h HIS 194 CO 0.00 0.89 0.65 -0.24 0.86 0.00 0.00 177.93 180.09 1vfl h VAL 195 N -0.33 1.18 -0.06 2.45 3.04 -1.13 -2.27 116.25 119.13 1vfl h VAL 195 Ca -0.02 -0.44 -0.14 0.00 -1.01 0.00 0.00 66.70 65.09 1vfl h VAL 195 Cb 0.93 -0.20 -0.01 0.00 -2.01 0.00 0.00 31.29 29.99 1vfl h VAL 195 CO 0.05 0.23 -0.61 -0.61 -1.01 0.00 0.00 177.57 175.62 1vfl h GLN 196 N 1.27 0.20 -0.37 4.17 4.15 -1.19 -1.45 115.11 121.89 1vfl h GLN 196 Ca 0.39 -0.14 -0.12 0.00 0.77 0.00 0.00 58.65 59.56 1vfl h GLN 196 Cb -0.02 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1vfl h GLN 196 CO -0.12 0.75 -0.24 0.00 -1.93 0.00 0.00 178.83 177.29 1vfl h ALA 197 N 1.22 0.88 -0.01 3.38 0.00 -1.21 -1.63 119.26 121.89 1vfl h ALA 197 Ca -0.01 -0.38 -0.21 0.00 0.00 0.00 0.00 54.91 54.31 1vfl h ALA 197 Cb 1.11 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1vfl h ALA 197 CO 0.09 0.63 -0.90 1.88 0.00 0.00 0.00 179.25 180.95 1vfl h TYR 198 N 0.65 0.51 -0.66 0.00 -1.99 -1.32 -1.58 116.97 112.58 1vfl h TYR 198 Ca 0.09 -0.27 -0.03 0.00 2.00 0.00 0.00 58.73 60.52 1vfl h TYR 198 Cb 0.75 -0.06 -0.03 0.00 2.00 0.00 0.00 36.73 39.38 1vfl h TYR 198 CO 0.04 1.08 0.30 0.00 -0.00 0.00 0.00 178.16 179.58 1vfl h ALA 199 N 0.83 1.28 -0.11 3.88 0.00 -1.12 -1.43 119.26 122.59 1vfl h ALA 199 Ca -0.06 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 1vfl h ALA 199 Cb 1.52 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1vfl h ALA 199 CO 0.15 0.55 -0.51 1.49 0.00 0.00 0.00 179.25 180.93 1vfl h GLU 200 N 0.94 0.30 -0.65 0.00 4.57 -1.13 -2.31 114.58 116.30 1vfl h GLU 200 Ca 0.23 -0.18 -0.04 0.00 -1.18 0.00 0.00 59.36 58.20 1vfl h GLU 200 Cb 0.13 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.70 1vfl h GLU 200 CO -0.03 0.74 0.27 0.00 -1.18 0.00 0.00 179.01 178.82 1vfl h ALA 201 N 1.23 0.85 -0.62 2.92 0.00 -0.32 0.17 119.26 123.49 1vfl h ALA 201 Ca 0.01 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1vfl h ALA 201 Cb 0.98 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1vfl h ALA 201 CO 0.08 0.46 0.25 0.28 0.00 0.00 0.00 179.25 180.32 1vfl h VAL 202 N 0.92 1.23 0.00 0.00 2.07 -1.15 0.23 116.25 119.55 1vfl h VAL 202 Ca 0.22 -0.73 -0.08 0.00 0.82 0.00 0.00 66.70 66.93 1vfl h VAL 202 Cb 0.19 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1vfl h VAL 202 CO -0.02 0.29 -0.38 0.50 0.02 0.00 0.00 177.57 177.98 1vfl h LYS 203 N 0.87 0.00 -0.43 1.57 3.64 -0.98 -3.08 116.57 118.17 1vfl h LYS 203 Ca 0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1vfl h LYS 203 Cb 0.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1vfl h LYS 203 CO -0.02 0.38 0.00 0.43 -2.27 0.00 0.00 179.45 177.97 1vfl n SER 204 N -3.90 3.33 -1.22 4.20 7.64 0.01 -4.97 113.62 118.71 1vfl n SER 204 Ca -0.01 -1.94 -0.11 0.00 1.01 0.00 0.00 58.87 57.81 1vfl n SER 204 Cb 0.43 -0.28 -0.01 0.00 -1.01 0.00 0.00 64.21 63.35 1vfl n SER 204 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vfl n GLY 205 N 1.25 0.03 3.67 0.23 0.00 -0.10 -5.00 105.19 105.27 1vfl n GLY 205 Ca 0.18 -0.43 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 1vfl n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vfl s VAL 206 N -2.54 5.15 0.87 1.61 1.01 0.61 -5.03 120.40 122.08 1vfl s VAL 206 Ca 0.00 0.84 -0.11 0.00 0.00 0.00 0.00 61.98 62.71 1vfl s VAL 206 Cb 0.00 -3.79 0.12 0.00 0.00 0.00 0.00 36.38 32.71 1vfl s VAL 206 CO 0.00 0.21 1.15 -1.00 0.00 0.00 0.00 175.10 175.46 1vfl s HIS 207 N 1.47 1.80 -0.02 5.22 3.76 -1.18 -4.40 115.29 121.95 1vfl s HIS 207 Ca 0.22 1.74 0.02 0.00 -0.15 0.00 0.00 55.06 56.89 1vfl s HIS 207 Cb -0.15 -3.32 0.00 0.00 1.11 0.00 0.00 32.58 30.22 1vfl s HIS 207 CO 0.09 -2.65 -0.07 1.03 -0.85 0.00 0.00 174.74 172.29 1vfl s ARG 208 N -4.60 0.70 0.04 1.40 0.52 -1.26 -1.29 118.95 114.46 1vfl s ARG 208 Ca 0.67 -0.24 -0.00 0.00 -0.52 0.00 0.00 55.73 55.63 1vfl s ARG 208 Cb -0.23 -0.68 -0.03 0.00 0.52 0.00 0.00 34.95 34.53 1vfl s ARG 208 CO 0.56 0.11 -0.03 -0.08 0.02 0.00 0.00 175.30 175.88 1vfl s THR 209 N 0.07 0.20 -0.10 0.02 -1.32 -0.71 -0.97 115.64 112.85 1vfl s THR 209 Ca -0.01 -1.33 -0.07 0.00 -1.21 0.00 0.00 61.69 59.08 1vfl s THR 209 Cb -0.06 -0.85 0.03 0.00 -1.51 0.00 0.00 72.50 70.12 1vfl s THR 209 CO -0.00 -0.71 0.24 -0.69 -2.21 0.00 0.00 174.62 171.25 1vfl s VAL 210 N -2.54 -0.02 -0.24 5.08 1.01 -1.11 -3.44 120.40 119.13 1vfl s VAL 210 Ca -0.05 0.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.70 1vfl s VAL 210 Cb -0.02 -0.36 -0.01 0.00 0.00 0.00 0.00 36.38 36.00 1vfl s VAL 210 CO -0.05 0.03 1.29 -1.00 0.00 0.00 0.00 175.10 175.37 1vfl s HIS 211 N 0.62 2.75 -0.24 5.22 3.76 -0.28 -0.28 115.29 126.84 1vfl s HIS 211 Ca -0.04 0.93 -0.18 0.00 -0.15 0.00 0.00 55.06 55.62 1vfl s HIS 211 Cb -0.05 -3.74 0.07 0.00 1.11 0.00 0.00 32.58 29.97 1vfl s HIS 211 CO -0.04 -1.71 0.62 0.00 -0.85 0.00 0.00 174.74 172.76 1vfl s ALA 212 N 4.03 -1.58 0.00 -1.40 0.00 -0.96 -4.89 121.76 116.96 1vfl s ALA 212 Ca 0.56 1.94 0.00 0.00 0.00 0.00 0.00 51.96 54.46 1vfl s ALA 212 Cb -0.19 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1vfl s ALA 212 CO 0.19 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.05 1vfl n GLY 213 N 3.46 0.66 0.11 0.00 0.00 -1.26 -1.01 105.19 107.16 1vfl n GLY 213 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 1vfl n GLY 213 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1vfl h GLU 214 N 1.99 -0.16 0.00 1.61 4.81 -1.91 0.29 114.58 121.22 1vfl h GLU 214 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1vfl h GLU 214 Cb 0.00 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1vfl h GLU 214 CO 0.00 0.32 -0.63 1.55 -0.73 0.00 0.00 179.01 179.52 1vfl n VAL 215 N -4.87 0.00 -1.82 0.32 3.14 -1.26 -4.75 118.33 109.09 1vfl n VAL 215 Ca -0.08 -0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.01 1vfl n VAL 215 Cb 0.27 0.32 0.08 0.00 -1.06 0.00 0.00 33.84 33.46 1vfl n VAL 215 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1vfl s GLY 216 N -1.26 1.60 0.94 7.55 0.00 -1.26 -4.96 107.32 109.92 1vfl s GLY 216 Ca 0.00 -0.50 -0.13 0.00 0.00 0.00 0.00 44.72 44.09 1vfl s GLY 216 CO 0.00 -0.04 1.17 -1.35 0.00 0.00 0.00 173.10 172.88 1vfl s SER 217 N -4.38 3.31 0.65 1.64 1.04 -1.26 -4.25 113.70 110.45 1vfl s SER 217 Ca 0.61 0.81 0.39 0.00 0.48 0.00 0.00 55.95 58.23 1vfl s SER 217 Cb -0.12 -1.26 2.10 0.00 0.10 0.00 0.00 66.02 66.85 1vfl s SER 217 CO 0.51 -2.66 2.18 0.00 0.98 0.00 0.00 173.24 174.25 1vfl h ALA 218 N -1.58 1.12 -0.10 5.32 0.00 -1.93 -1.33 119.26 120.76 1vfl h ALA 218 Ca -0.48 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 1vfl h ALA 218 Cb 1.31 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1vfl h ALA 218 CO 0.56 -0.12 -0.36 -0.97 0.00 0.00 0.00 179.25 178.36 1vfl h ASN 219 N 0.00 0.21 0.63 0.00 -0.73 -1.90 -1.58 115.58 112.21 1vfl h ASN 219 Ca 0.00 -0.08 -0.13 0.00 1.87 0.00 0.00 56.30 57.96 1vfl h ASN 219 Cb 0.24 -0.06 -0.02 0.00 0.27 0.00 0.00 38.32 38.75 1vfl h ASN 219 CO 0.00 0.56 -0.62 0.58 -0.37 0.00 0.00 177.43 177.58 1vfl h VAL 220 N 0.18 1.44 -0.04 2.57 2.07 -1.58 -1.57 116.25 119.32 1vfl h VAL 220 Ca 0.02 -2.14 -0.01 0.00 0.82 0.00 0.00 66.70 65.40 1vfl h VAL 220 Cb 0.73 2.15 -0.00 0.00 -1.52 0.00 0.00 31.29 32.65 1vfl h VAL 220 CO 0.05 0.61 -0.00 0.58 0.02 0.00 0.00 177.57 178.83 1vfl h VAL 221 N 0.00 1.26 -0.98 2.57 2.07 -1.52 -1.07 116.25 118.57 1vfl h VAL 221 Ca -0.01 -0.78 0.07 0.00 0.82 0.00 0.00 66.70 66.81 1vfl h VAL 221 Cb 1.10 1.70 -0.07 0.00 -1.52 0.00 0.00 31.29 32.51 1vfl h VAL 221 CO 0.08 0.21 0.63 0.50 0.02 0.00 0.00 177.57 179.01 1vfl h LYS 222 N -0.23 1.10 -0.04 1.57 3.64 -1.14 0.09 116.57 121.55 1vfl h LYS 222 Ca 0.01 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 1vfl h LYS 222 Cb 0.34 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1vfl h LYS 222 CO 0.00 0.73 -0.44 0.93 -2.27 0.00 0.00 179.45 178.40 1vfl h GLU 223 N 1.13 0.10 -0.41 1.90 5.08 -1.11 -0.40 114.58 120.87 1vfl h GLU 223 Ca 0.43 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.59 1vfl h GLU 223 Cb 0.20 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1vfl h GLU 223 CO -0.18 0.52 -0.34 0.00 -1.00 0.00 0.00 179.01 178.01 1vfl h ALA 224 N 1.47 0.61 0.08 3.43 0.00 0.31 -2.29 119.26 122.88 1vfl h ALA 224 Ca 0.00 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.37 1vfl h ALA 224 Cb 0.81 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.48 1vfl h ALA 224 CO 0.06 0.68 -0.48 0.28 0.00 0.00 0.00 179.25 179.79 1vfl h VAL 225 N 0.79 1.63 0.09 0.00 2.07 -0.98 -1.28 116.25 118.57 1vfl h VAL 225 Ca 0.07 -2.46 -0.27 0.00 0.82 0.00 0.00 66.70 64.86 1vfl h VAL 225 Cb 0.93 3.28 -0.01 0.00 -1.52 0.00 0.00 31.29 33.97 1vfl h VAL 225 CO 0.09 0.67 -1.32 0.44 0.02 0.00 0.00 177.57 177.47 1vfl h ASP 226 N -0.64 0.31 0.00 0.57 3.32 -1.20 -2.99 116.42 115.79 1vfl h ASP 226 Ca -0.08 -0.38 -0.36 0.00 0.02 0.00 0.00 57.03 56.23 1vfl h ASP 226 Cb 1.37 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 40.76 1vfl h ASP 226 CO 0.08 1.30 -2.09 0.41 -1.72 0.00 0.00 179.24 177.23 1vfl n THR 227 N -3.45 1.53 0.83 0.35 -1.04 -0.91 -4.44 114.28 107.16 1vfl n THR 227 Ca -0.10 -0.25 0.13 0.00 -2.04 0.00 0.00 64.05 61.79 1vfl n THR 227 Cb 1.02 -1.97 0.53 0.00 -1.82 0.00 0.00 70.33 68.09 1vfl n THR 227 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1vfl n LEU 228 N -4.32 0.29 -3.84 -4.42 4.32 -0.92 -4.90 117.00 103.22 1vfl n LEU 228 Ca -0.45 0.53 -0.24 0.00 -0.02 0.00 0.00 56.01 55.83 1vfl n LEU 228 Cb 0.79 -0.44 0.01 0.00 -1.62 0.00 0.00 43.42 42.16 1vfl n LEU 228 CO 0.08 -0.09 -0.13 0.29 -1.22 0.00 0.00 177.39 176.33 1vfl n LYS 229 N -1.78 -4.20 -1.85 3.23 5.02 -0.73 -4.80 118.16 113.05 1vfl n LYS 229 Ca 0.06 0.52 -0.33 0.00 -2.02 0.00 0.00 58.31 56.54 1vfl n LYS 229 Cb 0.36 -4.92 0.04 0.00 -0.02 0.00 0.00 35.03 30.49 1vfl n LYS 229 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1vfl s THR 230 N -3.76 3.28 -0.08 -0.18 -1.32 -0.56 -4.88 115.64 108.13 1vfl s THR 230 Ca 0.08 0.62 0.20 0.00 -1.21 0.00 0.00 61.69 61.38 1vfl s THR 230 Cb -0.04 -3.15 -0.31 0.00 -1.51 0.00 0.00 72.50 67.49 1vfl s THR 230 CO 0.85 -0.34 0.35 -0.62 -2.21 0.00 0.00 174.62 172.65 1vfl n GLU 231 N -2.22 0.68 -4.01 7.08 1.02 -0.14 -4.82 120.64 118.23 1vfl n GLU 231 Ca 0.10 -0.14 -0.08 0.00 -0.02 0.00 0.00 57.16 57.03 1vfl n GLU 231 Cb 0.52 -1.51 -0.09 0.00 -0.02 0.00 0.00 31.44 30.34 1vfl n GLU 231 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1vfl s ARG 232 N -3.18 0.72 -0.08 3.49 0.52 -1.05 -4.13 118.95 115.23 1vfl s ARG 232 Ca -0.08 -1.14 0.04 0.00 -0.52 0.00 0.00 55.73 54.03 1vfl s ARG 232 Cb 0.11 0.26 -0.01 0.00 0.52 0.00 0.00 34.95 35.84 1vfl s ARG 232 CO 0.87 -0.18 -0.22 -0.51 0.02 0.00 0.00 175.30 175.28 1vfl s LEU 233 N -2.91 2.20 -0.24 2.53 1.43 -0.32 -2.76 118.68 118.62 1vfl s LEU 233 Ca 0.07 -0.49 -0.27 0.00 -1.03 0.00 0.00 54.13 52.41 1vfl s LEU 233 Cb 0.07 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.86 1vfl s LEU 233 CO -0.10 0.21 0.95 -0.83 0.23 0.00 0.00 176.35 176.81 1vfl s GLY 234 N 0.08 1.72 0.00 -3.19 0.00 0.62 -0.10 107.32 106.44 1vfl s GLY 234 Ca -0.10 0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.64 1vfl s GLY 234 CO 0.06 2.02 0.00 1.42 0.00 0.00 0.00 173.10 176.60 1vfl n HIS 235 N 6.21 0.00 -1.47 1.90 8.25 0.66 -2.27 115.22 128.51 1vfl n HIS 235 Ca 0.09 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.39 1vfl n HIS 235 Cb 0.47 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.51 1vfl n HIS 235 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1vfl n GLY 236 N 0.00 1.61 0.37 -1.41 0.00 -0.18 -4.43 105.19 101.15 1vfl n GLY 236 Ca 0.00 -0.23 0.05 0.00 0.00 0.00 0.00 46.02 45.84 1vfl n GLY 236 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1vfl h TYR 237 N 0.00 1.05 0.00 1.61 0.05 -1.58 -2.37 116.97 115.73 1vfl h TYR 237 Ca -0.33 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.48 1vfl h TYR 237 Cb 1.07 -0.34 0.00 0.00 1.01 0.00 0.00 36.73 38.47 1vfl h TYR 237 CO 0.47 0.52 0.00 0.72 -1.05 0.00 0.00 178.16 178.82 1vfl n HIS 238 N -4.51 0.00 0.19 4.88 8.25 0.02 -2.95 115.22 121.11 1vfl n HIS 238 Ca 0.15 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.67 1vfl n HIS 238 Cb 0.23 -0.01 0.31 0.00 1.12 0.00 0.00 29.99 31.64 1vfl n HIS 238 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1vfl h THR 239 N 0.00 0.78 0.00 1.59 2.02 -1.70 -2.77 112.91 112.83 1vfl h THR 239 Ca 0.00 -1.55 0.00 0.00 0.77 0.00 0.00 66.41 65.63 1vfl h THR 239 Cb 0.04 1.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 1vfl h THR 239 CO 0.00 0.35 0.00 0.18 0.37 0.00 0.00 175.52 176.42 1vfl n LEU 240 N -3.43 0.00 0.12 2.58 4.77 -1.15 -1.93 117.00 117.96 1vfl n LEU 240 Ca 0.00 0.29 0.12 0.00 -0.03 0.00 0.00 56.01 56.39 1vfl n LEU 240 Cb 0.53 -0.29 0.06 0.00 -2.33 0.00 0.00 43.42 41.39 1vfl n LEU 240 CO 0.37 -0.18 0.24 -0.33 -1.33 0.00 0.00 177.39 176.15 1vfl h GLU 241 N 0.00 0.00 -3.93 3.23 5.08 -1.76 -3.40 114.58 113.79 1vfl h GLU 241 Ca 0.00 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.70 1vfl h GLU 241 Cb 0.10 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 28.97 1vfl h GLU 241 CO 0.00 0.00 -0.59 0.34 -1.00 0.00 0.00 179.01 177.76 1vfl s ASP 242 N -5.40 4.74 0.21 1.42 -1.08 -0.81 -4.99 116.67 110.76 1vfl s ASP 242 Ca 0.02 -2.62 -0.09 0.00 -0.52 0.00 0.00 52.55 49.34 1vfl s ASP 242 Cb 0.09 -1.70 0.25 0.00 -1.46 0.00 0.00 42.92 40.10 1vfl s ASP 242 CO 0.75 -0.34 1.80 0.71 0.52 0.00 0.00 175.17 178.61 1vfl h THR 243 N 5.88 0.94 -0.61 1.71 1.35 -1.78 0.40 112.91 120.80 1vfl h THR 243 Ca -0.06 -0.22 -0.08 0.00 -0.55 0.00 0.00 66.41 65.50 1vfl h THR 243 Cb 0.96 0.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.59 1vfl h THR 243 CO 0.65 0.12 0.08 0.74 -0.25 0.00 0.00 175.52 176.86 1vfl h THR 244 N 0.65 1.26 -0.33 6.82 2.02 -1.94 0.14 112.91 121.52 1vfl h THR 244 Ca 0.30 -1.01 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 1vfl h THR 244 Cb 0.22 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1vfl h THR 244 CO -0.20 0.37 0.09 0.25 0.37 0.00 0.00 175.52 176.40 1vfl h LEU 245 N 0.94 0.49 -0.31 2.58 5.85 -1.75 -0.55 115.31 122.55 1vfl h LEU 245 Ca 0.19 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.72 1vfl h LEU 245 Cb 0.43 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 1vfl h LEU 245 CO 0.01 0.58 0.11 0.22 -0.34 0.00 0.00 178.44 179.03 1vfl h TYR 246 N 0.37 0.21 -0.49 1.25 -0.00 -0.51 -0.27 116.97 117.52 1vfl h TYR 246 Ca 0.10 0.02 -0.07 0.00 -0.00 0.00 0.00 58.73 58.78 1vfl h TYR 246 Cb 0.28 -0.05 -0.02 0.00 -0.00 0.00 0.00 36.73 36.94 1vfl h TYR 246 CO 0.01 0.09 0.03 -0.91 -0.00 0.00 0.00 178.16 177.39 1vfl h ASN 247 N 0.25 0.76 -0.49 -2.11 2.35 -0.57 -0.82 115.58 114.96 1vfl h ASN 247 Ca 0.14 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.63 1vfl h ASN 247 Cb 0.10 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1vfl h ASN 247 CO -0.14 0.81 -0.04 -0.09 -1.65 0.00 0.00 177.43 176.32 1vfl h ARG 248 N 0.75 0.89 -0.16 0.81 2.43 -0.66 -0.86 114.38 117.59 1vfl h ARG 248 Ca 0.15 -0.30 -0.06 0.00 -0.81 0.00 0.00 59.98 58.96 1vfl h ARG 248 Cb 0.41 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1vfl h ARG 248 CO 0.01 0.94 -0.17 -0.07 -1.51 0.00 0.00 179.97 179.17 1vfl h LEU 249 N 0.75 0.25 -0.28 3.80 4.07 -0.73 0.03 115.31 123.19 1vfl h LEU 249 Ca 0.13 -0.06 -0.19 0.00 0.08 0.00 0.00 57.88 57.84 1vfl h LEU 249 Cb 0.56 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.24 1vfl h LEU 249 CO 0.03 0.45 -0.62 0.03 -1.08 0.00 0.00 178.44 177.25 1vfl h ARG 250 N 0.24 0.82 -0.81 1.13 3.08 -0.83 -1.09 114.38 116.93 1vfl h ARG 250 Ca 0.05 -0.56 -0.03 0.00 0.07 0.00 0.00 59.98 59.50 1vfl h ARG 250 Cb 0.46 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 1vfl h ARG 250 CO 0.03 1.19 0.38 0.37 -1.07 0.00 0.00 179.97 180.86 1vfl h GLN 251 N 0.61 1.17 0.00 0.04 5.75 -0.62 -1.90 115.11 120.17 1vfl h GLN 251 Ca -0.01 -0.18 0.00 0.00 -0.15 0.00 0.00 58.65 58.31 1vfl h GLN 251 Cb 1.23 -0.21 0.00 0.00 1.07 0.00 0.00 27.48 29.57 1vfl h GLN 251 CO 0.13 0.91 0.00 0.39 -2.65 0.00 0.00 178.83 177.62 1vfl n GLU 252 N -4.33 0.50 -2.53 1.69 1.02 -0.05 -4.90 120.64 112.04 1vfl n GLU 252 Ca 0.08 0.02 -0.18 0.00 -0.02 0.00 0.00 57.16 57.05 1vfl n GLU 252 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 1vfl n GLU 252 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1vfl n ASN 253 N -1.23 -5.30 -4.75 1.62 5.15 -0.71 -4.93 115.26 105.10 1vfl n ASN 253 Ca 0.15 -0.09 -0.41 0.00 -0.60 0.00 0.00 54.58 53.63 1vfl n ASN 253 Cb 0.19 -4.30 0.01 0.00 -0.53 0.00 0.00 39.78 35.15 1vfl n ASN 253 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 1vfl n MET 254 N -2.99 2.38 -3.48 1.20 0.00 -0.47 -4.86 117.12 108.89 1vfl n MET 254 Ca -0.17 0.84 -0.37 0.00 -0.00 0.00 0.00 57.70 57.99 1vfl n MET 254 Cb 0.64 -2.59 -0.06 0.00 0.00 0.00 0.00 33.22 31.21 1vfl n MET 254 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 1vfl s HIS 255 N -1.15 3.53 -0.20 1.12 2.46 -1.26 -4.27 115.29 115.51 1vfl s HIS 255 Ca 0.57 0.75 -0.06 0.00 0.47 0.00 0.00 55.06 56.79 1vfl s HIS 255 Cb -0.48 -2.38 -0.03 0.00 -0.13 0.00 0.00 32.58 29.56 1vfl s HIS 255 CO 0.61 0.31 0.03 -0.06 -2.47 0.00 0.00 174.74 173.16 1vfl s PHE 256 N 0.17 3.10 -0.78 3.88 0.40 -0.12 -1.17 117.98 123.48 1vfl s PHE 256 Ca 0.20 -0.28 -0.19 0.00 -0.60 0.00 0.00 56.93 56.07 1vfl s PHE 256 Cb -0.14 -2.11 0.12 0.00 0.51 0.00 0.00 43.02 41.40 1vfl s PHE 256 CO 0.07 -0.14 0.94 -1.21 0.70 0.00 0.00 175.22 175.59 1vfl s GLU 257 N 0.92 3.37 0.09 0.44 2.02 0.85 -1.77 118.70 124.61 1vfl s GLU 257 Ca 0.02 -1.57 -0.20 0.00 0.02 0.00 0.00 54.97 53.24 1vfl s GLU 257 Cb -0.14 -4.56 -0.07 0.00 0.10 0.00 0.00 34.13 29.46 1vfl s GLU 257 CO 0.02 -1.66 0.60 0.42 0.02 0.00 0.00 175.26 174.66 1vfl s ILE 258 N 2.61 4.69 -0.47 -1.63 1.01 -0.76 -0.24 121.20 126.41 1vfl s ILE 258 Ca 0.23 1.28 0.03 0.00 0.00 0.00 0.00 60.65 62.19 1vfl s ILE 258 Cb -0.13 -3.93 0.15 0.00 0.01 0.00 0.00 42.46 38.57 1vfl s ILE 258 CO -0.02 0.54 0.32 0.00 0.00 0.00 0.00 174.94 175.78 1vfl h PRO 260 N 6.14 -0.84 -0.56 0.00 0.11 -1.93 -0.31 132.00 134.60 1vfl h PRO 260 Ca 0.13 0.06 0.04 0.00 0.11 0.00 0.00 66.00 66.33 1vfl h PRO 260 Cb 0.89 0.19 -0.04 0.00 0.11 0.00 0.00 31.00 32.15 1vfl h PRO 260 CO 0.46 -0.56 0.31 2.35 -0.21 0.00 0.00 178.00 180.35 1vfl h TRP 261 N -0.87 0.58 0.10 0.65 2.91 -1.90 -2.22 115.95 115.20 1vfl h TRP 261 Ca -0.04 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.02 1vfl h TRP 261 Cb 0.77 -0.18 -0.03 0.00 -0.51 0.00 0.00 29.16 29.22 1vfl h TRP 261 CO -0.23 0.30 -0.18 1.03 -1.03 0.00 0.00 178.44 178.32 1vfl h SER 262 N 0.60 -0.51 -0.80 2.65 0.87 -1.81 -2.08 113.55 112.47 1vfl h SER 262 Ca 0.24 0.06 0.17 0.00 -1.23 0.00 0.00 61.79 61.03 1vfl h SER 262 Cb 0.11 0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 62.21 1vfl h SER 262 CO -0.14 -0.26 0.53 0.77 -0.53 0.00 0.00 176.83 177.20 1vfl h SER 263 N -0.35 0.37 0.28 6.23 4.64 -0.59 -0.29 113.55 123.84 1vfl h SER 263 Ca 0.03 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1vfl h SER 263 Cb 0.37 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1vfl h SER 263 CO -0.11 0.18 -0.13 0.22 -0.87 0.00 0.00 176.83 176.12 1vfl h TYR 264 N 0.39 -0.35 -0.97 4.77 5.03 -0.95 -1.17 116.97 123.73 1vfl h TYR 264 Ca 0.40 -0.01 0.10 0.00 2.58 0.00 0.00 58.73 61.80 1vfl h TYR 264 Cb 0.98 0.12 -0.07 0.00 1.55 0.00 0.00 36.73 39.30 1vfl h TYR 264 CO -0.00 -0.05 0.62 -0.07 -1.32 0.00 0.00 178.16 177.34 1vfl h LEU 265 N -1.00 0.92 -0.49 2.82 3.38 -0.94 -1.47 115.31 118.53 1vfl h LEU 265 Ca -0.04 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1vfl h LEU 265 Cb 0.45 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1vfl h LEU 265 CO 0.06 0.54 -0.23 0.71 0.09 0.00 0.00 178.44 179.61 1vfl h THR 266 N 1.01 0.45 0.00 0.22 1.35 -1.17 -1.93 112.91 112.84 1vfl h THR 266 Ca 0.45 -1.38 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 1vfl h THR 266 Cb 0.36 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 1vfl h THR 266 CO -0.20 0.22 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 1vfl n GLY 267 N 0.74 0.73 0.46 5.82 0.00 -0.55 -4.46 105.19 107.94 1vfl n GLY 267 Ca 0.02 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.32 1vfl n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vfl h ALA 268 N 0.00 2.80 -3.73 4.61 0.00 -1.56 -3.37 119.26 118.01 1vfl h ALA 268 Ca 0.00 -0.03 -0.68 0.00 0.00 0.00 0.00 54.91 54.20 1vfl h ALA 268 Cb 0.00 0.07 -0.29 0.00 0.00 0.00 0.00 17.79 17.56 1vfl h ALA 268 CO 0.00 -1.10 -0.83 -0.46 0.00 0.00 0.00 179.25 176.86 1vfl s TRP 269 N -4.93 2.60 -0.35 0.00 -0.00 -0.54 -4.89 118.94 110.83 1vfl s TRP 269 Ca -0.05 -0.66 -0.18 0.00 -0.00 0.00 0.00 56.10 55.22 1vfl s TRP 269 Cb 0.21 -1.68 -0.00 0.00 -0.00 0.00 0.00 33.47 31.99 1vfl s TRP 269 CO 0.75 -0.18 0.51 -1.59 -0.00 0.00 0.00 176.95 176.44 1vfl s LYS 270 N -0.05 3.62 0.64 5.86 -2.85 -1.26 -4.67 119.74 121.03 1vfl s LYS 270 Ca -0.05 -0.17 0.14 0.00 -1.00 0.00 0.00 55.97 54.89 1vfl s LYS 270 Cb -0.14 -3.81 0.76 0.00 -2.06 0.00 0.00 37.83 32.58 1vfl s LYS 270 CO 0.04 -0.64 1.42 -1.35 0.10 0.00 0.00 175.35 174.93 1vfl h PRO 271 N 8.45 0.00 -0.00 1.78 0.11 -1.95 0.82 132.00 141.21 1vfl h PRO 271 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1vfl h PRO 271 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1vfl h PRO 271 CO 0.77 0.00 -0.06 -0.25 -0.21 0.00 0.00 178.00 178.25 1vfl n ASP 272 N -2.63 0.09 -4.54 -2.05 8.00 -1.26 -4.87 116.55 109.29 1vfl n ASP 272 Ca -0.01 0.17 -0.24 0.00 0.71 0.00 0.00 54.79 55.42 1vfl n ASP 272 Cb 0.68 -0.33 -0.09 0.00 -0.02 0.00 0.00 41.12 41.36 1vfl n ASP 272 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1vfl s THR 273 N -2.85 2.58 0.20 -3.53 -4.23 0.28 -5.09 115.64 103.00 1vfl s THR 273 Ca 0.19 -2.21 -0.32 0.00 -1.18 0.00 0.00 61.69 58.17 1vfl s THR 273 Cb 0.19 -2.55 -0.11 0.00 1.34 0.00 0.00 72.50 71.37 1vfl s THR 273 CO 0.53 -0.31 1.66 -0.70 -0.54 0.00 0.00 174.62 175.25 1vfl s GLU 274 N -3.60 4.16 0.27 3.99 2.12 -1.26 -4.89 118.70 119.49 1vfl s GLU 274 Ca 0.32 2.51 -0.29 0.00 0.36 0.00 0.00 54.97 57.87 1vfl s GLU 274 Cb -0.02 -3.10 -0.10 0.00 0.26 0.00 0.00 34.13 31.17 1vfl s GLU 274 CO 0.17 -0.69 1.30 -1.58 -0.54 0.00 0.00 175.26 173.92 1vfl s HIS 275 N 1.07 3.18 0.35 5.30 5.65 -1.26 -4.90 115.29 124.68 1vfl s HIS 275 Ca 0.72 1.33 0.12 0.00 0.25 0.00 0.00 55.06 57.48 1vfl s HIS 275 Cb -0.47 -3.62 0.91 0.00 -1.18 0.00 0.00 32.58 28.21 1vfl s HIS 275 CO 0.33 -1.81 1.78 0.00 -0.65 0.00 0.00 174.74 174.38 1vfl h ALA 276 N 4.34 1.92 0.00 1.58 0.00 -1.95 0.24 119.26 125.40 1vfl h ALA 276 Ca -0.47 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 1vfl h ALA 276 Cb 1.22 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1vfl h ALA 276 CO 0.71 -0.31 -0.13 -0.24 0.00 0.00 0.00 179.25 179.29 1vfl h VAL 277 N 0.58 0.73 -0.18 0.00 3.04 -1.98 0.30 116.25 118.73 1vfl h VAL 277 Ca 0.58 -0.51 -0.09 0.00 -1.01 0.00 0.00 66.70 65.66 1vfl h VAL 277 Cb 1.16 1.31 -0.00 0.00 -2.01 0.00 0.00 31.29 31.74 1vfl h VAL 277 CO -0.34 0.13 -0.25 0.40 -1.01 0.00 0.00 177.57 176.49 1vfl h ILE 278 N 0.00 1.34 -0.04 3.17 2.04 -0.88 -1.65 117.51 121.50 1vfl h ILE 278 Ca -0.00 -1.46 -0.16 0.00 1.00 0.00 0.00 64.86 64.23 1vfl h ILE 278 Cb 0.30 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1vfl h ILE 278 CO 0.02 0.44 -0.71 -0.09 0.00 0.00 0.00 178.15 177.81 1vfl h ARG 279 N 0.14 0.20 -0.63 2.37 2.43 -1.30 -0.26 114.38 117.33 1vfl h ARG 279 Ca 0.02 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1vfl h ARG 279 Cb 0.82 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.38 1vfl h ARG 279 CO 0.06 0.83 0.39 0.74 -1.51 0.00 0.00 179.97 180.48 1vfl h PHE 280 N 0.14 0.82 -0.09 2.20 0.04 -0.93 1.08 116.94 120.20 1vfl h PHE 280 Ca -0.02 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.73 1vfl h PHE 280 Cb 1.27 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 39.14 1vfl h PHE 280 CO 0.02 0.54 -0.03 -0.22 -0.60 0.00 0.00 178.31 178.02 1vfl h LYS 281 N 0.87 0.18 -0.32 1.51 3.64 -0.89 0.38 116.57 121.94 1vfl h LYS 281 Ca 0.23 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.49 1vfl h LYS 281 Cb -0.05 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 1vfl h LYS 281 CO -0.04 0.52 -0.00 -0.91 -2.27 0.00 0.00 179.45 176.74 1vfl h ASN 282 N -0.17 0.47 -0.08 4.20 2.35 -0.04 -2.03 115.58 120.28 1vfl h ASN 282 Ca 0.02 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1vfl h ASN 282 Cb 0.46 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1vfl h ASN 282 CO 0.01 0.54 0.00 0.47 -1.65 0.00 0.00 177.43 176.80 1vfl n ASP 283 N -4.29 1.34 -3.77 5.81 10.43 0.37 -4.93 116.55 121.51 1vfl n ASP 283 Ca 0.01 -1.54 -0.27 0.00 2.57 0.00 0.00 54.79 55.57 1vfl n ASP 283 Cb 0.24 -0.04 0.05 0.00 1.84 0.00 0.00 41.12 43.20 1vfl n ASP 283 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1vfl n GLN 284 N 0.07 -6.30 -1.29 -1.24 6.02 -0.17 -4.96 117.38 109.51 1vfl n GLN 284 Ca 0.18 0.69 -0.31 0.00 -0.01 0.00 0.00 57.00 57.54 1vfl n GLN 284 Cb 0.30 -5.60 0.09 0.00 1.02 0.00 0.00 30.24 26.05 1vfl n GLN 284 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1vfl s VAL 285 N -3.35 3.39 -0.54 5.09 1.01 0.12 -4.98 120.40 121.13 1vfl s VAL 285 Ca 0.53 0.45 -0.21 0.00 0.00 0.00 0.00 61.98 62.75 1vfl s VAL 285 Cb -0.25 -2.97 0.05 0.00 0.00 0.00 0.00 36.38 33.21 1vfl s VAL 285 CO 0.79 -0.59 0.79 0.21 0.00 0.00 0.00 175.10 176.30 1vfl s ASN 286 N -3.44 6.26 0.17 3.32 2.47 -1.26 -4.88 114.94 117.58 1vfl s ASN 286 Ca 0.61 -0.73 -0.10 0.00 0.42 0.00 0.00 52.86 53.06 1vfl s ASN 286 Cb -0.17 -2.36 -0.00 0.00 -1.45 0.00 0.00 41.25 37.27 1vfl s ASN 286 CO 0.56 -1.09 0.31 -0.72 -3.72 0.00 0.00 177.10 172.44 1vfl s TYR 287 N 3.29 0.34 0.26 0.43 1.13 -1.26 -0.94 117.35 120.60 1vfl s TYR 287 Ca 0.22 -0.70 0.07 0.00 -1.41 0.00 0.00 57.07 55.24 1vfl s TYR 287 Cb -0.17 -0.01 -0.06 0.00 -1.10 0.00 0.00 41.96 40.63 1vfl s TYR 287 CO 0.14 -0.74 -0.07 -1.54 -2.51 0.00 0.00 175.55 170.83 1vfl s SER 288 N -2.96 2.68 -0.15 -0.18 1.04 -0.73 -4.51 113.70 108.89 1vfl s SER 288 Ca 0.16 -1.16 -0.05 0.00 0.48 0.00 0.00 55.95 55.38 1vfl s SER 288 Cb 0.03 -0.15 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 1vfl s SER 288 CO -0.00 -0.32 0.01 -0.76 0.98 0.00 0.00 173.24 173.15 1vfl s LEU 289 N -3.41 3.53 0.02 2.42 1.02 -1.26 -1.84 118.68 119.16 1vfl s LEU 289 Ca 0.28 0.00 -0.05 0.00 0.02 0.00 0.00 54.13 54.38 1vfl s LEU 289 Cb 0.03 -1.86 -0.01 0.00 0.02 0.00 0.00 46.19 44.37 1vfl s LEU 289 CO 0.11 0.21 0.09 0.20 0.02 0.00 0.00 176.35 176.98 1vfl s ASN 290 N 0.14 0.11 0.10 2.29 0.01 0.77 -4.68 114.94 113.69 1vfl s ASN 290 Ca 0.02 -0.36 0.07 0.00 -0.71 0.00 0.00 52.86 51.88 1vfl s ASN 290 Cb -0.13 0.19 -0.21 0.00 0.41 0.00 0.00 41.25 41.51 1vfl s ASN 290 CO 0.02 -0.40 1.21 0.71 -1.51 0.00 0.00 177.10 177.13 1vfl h THR 291 N 4.15 1.63 0.00 1.60 1.35 -1.86 -3.38 112.91 116.40 1vfl h THR 291 Ca -0.32 -3.35 0.00 0.00 -0.55 0.00 0.00 66.41 62.20 1vfl h THR 291 Cb 1.19 2.81 0.00 0.00 -1.73 0.00 0.00 68.15 70.42 1vfl h THR 291 CO 0.44 0.93 0.00 -0.67 -0.25 0.00 0.00 175.52 175.96 1vfl n ASP 292 N -3.32 0.00 -3.29 5.36 2.03 -0.79 -4.07 116.55 112.46 1vfl n ASP 292 Ca -0.02 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.04 1vfl n ASP 292 Cb 0.95 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 41.27 1vfl n ASP 292 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1vfl n ASP 293 N 3.49 0.32 -0.32 1.67 8.00 -1.26 -0.36 116.55 128.10 1vfl n ASP 293 Ca 0.00 -2.66 0.17 0.00 0.71 0.00 0.00 54.79 53.01 1vfl n ASP 293 Cb 0.00 -0.62 0.35 0.00 -0.02 0.00 0.00 41.12 40.83 1vfl n ASP 293 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1vfl h PRO 294 N 4.56 0.11 0.01 -0.24 0.11 -1.60 -0.26 132.00 134.69 1vfl h PRO 294 Ca 0.14 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 1vfl h PRO 294 Cb 0.87 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1vfl h PRO 294 CO 0.47 0.07 -0.00 1.25 -0.21 0.00 0.00 178.00 179.58 1vfl h LEU 295 N 0.12 -0.01 -0.67 2.35 5.85 -1.36 0.27 115.31 121.87 1vfl h LEU 295 Ca 0.63 -0.05 -0.14 0.00 0.84 0.00 0.00 57.88 59.16 1vfl h LEU 295 Cb 1.38 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 1vfl h LEU 295 CO -0.76 0.04 -0.51 0.40 -0.34 0.00 0.00 178.44 177.28 1vfl h ILE 296 N -0.06 1.33 -0.13 4.05 1.08 -1.36 -3.06 117.51 119.37 1vfl h ILE 296 Ca -0.00 -1.74 0.00 0.00 -0.39 0.00 0.00 64.86 62.73 1vfl h ILE 296 Cb 0.06 1.77 0.00 0.00 -3.07 0.00 0.00 36.82 35.57 1vfl h ILE 296 CO 0.00 0.53 0.00 0.49 -0.69 0.00 0.00 178.15 178.48 1vfl n PHE 297 N -3.96 0.15 -3.85 1.37 3.72 -0.24 -1.33 117.46 113.31 1vfl n PHE 297 Ca -0.02 -0.07 -0.24 0.00 -0.05 0.00 0.00 57.45 57.06 1vfl n PHE 297 Cb 0.56 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.10 1vfl n PHE 297 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1vfl n LYS 298 N 0.55 -3.86 -4.36 -1.08 5.02 0.84 -4.86 118.16 110.40 1vfl n LYS 298 Ca 0.17 0.49 -0.21 0.00 -2.02 0.00 0.00 58.31 56.74 1vfl n LYS 298 Cb 0.41 -4.77 -0.08 0.00 -0.02 0.00 0.00 35.03 30.57 1vfl n LYS 298 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1vfl s SER 299 N -4.35 1.96 0.31 4.39 1.04 -0.42 -5.04 113.70 111.58 1vfl s SER 299 Ca 0.01 -1.69 0.03 0.00 0.48 0.00 0.00 55.95 54.78 1vfl s SER 299 Cb -0.00 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.59 1vfl s SER 299 CO 0.86 -0.99 0.13 0.42 0.98 0.00 0.00 173.24 174.64 1vfl s THR 300 N -3.42 0.53 0.43 2.02 -4.23 -1.26 -4.68 115.64 105.02 1vfl s THR 300 Ca 0.34 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.95 1vfl s THR 300 Cb 0.03 -2.56 0.23 0.00 1.34 0.00 0.00 72.50 71.54 1vfl s THR 300 CO 0.21 0.00 2.03 0.25 -0.54 0.00 0.00 174.62 176.57 1vfl h LEU 301 N 2.19 0.27 -2.08 4.79 5.85 -1.96 -1.49 115.31 122.87 1vfl h LEU 301 Ca -0.36 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.33 1vfl h LEU 301 Cb 1.25 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 1vfl h LEU 301 CO 0.57 0.28 -0.02 -0.78 -0.34 0.00 0.00 178.44 178.15 1vfl h ASP 302 N 0.30 0.00 -0.55 1.25 3.58 -1.96 -1.91 116.42 117.13 1vfl h ASP 302 Ca 0.07 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.58 1vfl h ASP 302 Cb 0.12 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.12 1vfl h ASP 302 CO -0.00 0.02 0.26 0.74 -2.88 0.00 0.00 179.24 177.37 1vfl h THR 303 N 0.00 0.91 -0.09 2.25 2.02 -1.66 0.46 112.91 116.80 1vfl h THR 303 Ca -0.00 -0.17 -0.13 0.00 0.77 0.00 0.00 66.41 66.88 1vfl h THR 303 Cb 0.03 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1vfl h THR 303 CO 0.00 0.09 -0.54 0.44 0.37 0.00 0.00 175.52 175.89 1vfl h ASP 304 N 0.49 0.28 0.23 4.18 5.19 -1.47 -1.93 116.42 123.40 1vfl h ASP 304 Ca 0.25 -0.15 -0.24 0.00 -0.62 0.00 0.00 57.03 56.27 1vfl h ASP 304 Cb 0.20 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 39.64 1vfl h ASP 304 CO -0.20 0.77 -0.97 1.88 -3.12 0.00 0.00 179.24 177.60 1vfl h TYR 305 N 0.20 0.75 -0.82 4.55 -1.99 -1.18 -2.62 116.97 115.86 1vfl h TYR 305 Ca 0.00 -0.41 -0.04 0.00 2.00 0.00 0.00 58.73 60.28 1vfl h TYR 305 Cb 1.01 -0.09 -0.04 0.00 2.00 0.00 0.00 36.73 39.62 1vfl h TYR 305 CO 0.02 1.24 0.36 1.96 -0.00 0.00 0.00 178.16 181.74 1vfl h GLN 306 N 0.29 1.20 -0.17 4.88 1.08 -0.02 -0.40 115.11 121.97 1vfl h GLN 306 Ca -0.10 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 56.89 1vfl h GLN 306 Cb 1.62 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 28.83 1vfl h GLN 306 CO 0.18 0.95 0.05 1.98 -0.95 0.00 0.00 178.83 181.04 1vfl h MET 307 N 1.18 0.26 -0.03 1.46 4.05 -1.34 -0.32 114.93 120.20 1vfl h MET 307 Ca 0.28 -0.06 -0.14 0.00 -0.28 0.00 0.00 59.70 59.50 1vfl h MET 307 Cb 0.17 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.92 1vfl h MET 307 CO -0.03 0.38 -0.64 1.79 0.23 0.00 0.00 176.91 178.64 1vfl h THR 308 N 0.10 1.42 0.20 -0.77 1.35 -1.36 -0.11 112.91 113.74 1vfl h THR 308 Ca 0.05 -2.11 -0.01 0.00 -0.55 0.00 0.00 66.41 63.79 1vfl h THR 308 Cb 0.22 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 1vfl h THR 308 CO -0.00 0.61 -0.10 0.50 -0.25 0.00 0.00 175.52 176.29 1vfl h LYS 309 N 0.10 -0.26 0.03 4.72 1.63 -1.01 0.14 116.57 121.92 1vfl h LYS 309 Ca -0.01 0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 59.71 1vfl h LYS 309 Cb 1.15 0.06 0.01 0.00 -0.60 0.00 0.00 32.23 32.84 1vfl h LYS 309 CO 0.09 0.14 -0.39 0.87 -3.45 0.00 0.00 179.45 176.71 1vfl h LYS 310 N -0.87 0.20 0.00 1.90 1.79 -1.13 -2.59 116.57 115.87 1vfl h LYS 310 Ca -0.03 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 1vfl h LYS 310 Cb 0.51 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 1vfl h LYS 310 CO 0.04 1.04 -0.72 -0.25 -1.08 0.00 0.00 179.45 178.48 1vfl n ASP 311 N -4.39 0.62 0.00 0.86 8.00 -0.07 -4.34 116.55 117.24 1vfl n ASP 311 Ca -0.11 -0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.30 1vfl n ASP 311 Cb 0.60 0.39 0.00 0.00 -0.02 0.00 0.00 41.12 42.09 1vfl n ASP 311 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1vfl n MET 312 N -1.89 0.43 -2.20 -1.24 2.81 -1.03 -4.99 117.12 109.01 1vfl n MET 312 Ca 0.03 -0.63 -0.17 0.00 -1.81 0.00 0.00 57.70 55.12 1vfl n MET 312 Cb 0.41 -0.79 -0.02 0.00 -0.71 0.00 0.00 33.22 32.12 1vfl n MET 312 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1vfl n GLY 313 N -0.13 -0.02 3.76 3.03 0.00 -0.67 -4.91 105.19 106.25 1vfl n GLY 313 Ca 0.00 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1vfl n GLY 313 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vfl s PHE 314 N -2.82 2.95 0.41 1.61 0.40 0.40 -4.95 117.98 115.98 1vfl s PHE 314 Ca 0.00 1.19 0.04 0.00 -0.60 0.00 0.00 56.93 57.56 1vfl s PHE 314 Cb 0.00 -3.81 0.00 0.00 0.51 0.00 0.00 43.02 39.72 1vfl s PHE 314 CO 0.00 -2.44 0.59 0.95 0.70 0.00 0.00 175.22 175.02 1vfl s THR 315 N -0.60 3.72 0.39 0.64 -4.23 -1.26 -4.58 115.64 109.72 1vfl s THR 315 Ca 0.54 -0.78 0.23 0.00 -1.18 0.00 0.00 61.69 60.50 1vfl s THR 315 Cb -0.42 -3.33 0.24 0.00 1.34 0.00 0.00 72.50 70.33 1vfl s THR 315 CO 0.50 -0.18 2.00 -0.08 -0.54 0.00 0.00 174.62 176.33 1vfl h GLU 316 N 0.58 0.00 -0.60 3.99 4.81 -1.95 -1.88 114.58 119.52 1vfl h GLU 316 Ca -0.45 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.69 1vfl h GLU 316 Cb 1.26 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.62 1vfl h GLU 316 CO 0.53 0.18 0.01 1.49 -0.73 0.00 0.00 179.01 180.49 1vfl h GLU 317 N 0.00 1.05 -0.33 1.92 4.22 -1.99 -0.49 114.58 118.96 1vfl h GLU 317 Ca -0.00 -0.33 -0.16 0.00 0.08 0.00 0.00 59.36 58.95 1vfl h GLU 317 Cb 0.41 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1vfl h GLU 317 CO 0.02 1.02 -0.41 1.49 -2.18 0.00 0.00 179.01 178.96 1vfl h GLU 318 N 0.96 0.86 -0.94 1.92 4.57 -1.75 -0.50 114.58 119.71 1vfl h GLU 318 Ca 0.17 -0.48 -0.00 0.00 -1.18 0.00 0.00 59.36 57.87 1vfl h GLU 318 Cb 0.55 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.12 1vfl h GLU 318 CO 0.03 1.12 0.57 0.74 -1.18 0.00 0.00 179.01 180.30 1vfl h PHE 319 N 0.65 1.24 -0.28 0.92 0.05 -1.20 0.23 116.94 118.55 1vfl h PHE 319 Ca 0.04 0.00 -0.06 0.00 3.82 0.00 0.00 57.97 61.77 1vfl h PHE 319 Cb 1.00 -0.41 -0.01 0.00 2.00 0.00 0.00 35.95 38.54 1vfl h PHE 319 CO 0.07 0.82 -0.07 0.87 -0.18 0.00 0.00 178.31 179.81 1vfl h LYS 320 N 1.30 0.55 0.03 1.51 1.57 -0.97 -2.57 116.57 117.99 1vfl h LYS 320 Ca 0.34 -0.21 0.02 0.00 -1.87 0.00 0.00 60.65 58.93 1vfl h LYS 320 Cb -0.07 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1vfl h LYS 320 CO -0.06 0.75 -0.15 -0.09 -0.57 0.00 0.00 179.45 179.32 1vfl h ARG 321 N 0.30 -0.26 -0.33 3.15 1.12 -0.47 -1.72 114.38 116.17 1vfl h ARG 321 Ca 0.07 0.02 -0.08 0.00 -1.11 0.00 0.00 59.98 58.88 1vfl h ARG 321 Cb 0.55 0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 30.55 1vfl h ARG 321 CO 0.03 -0.17 -0.12 1.37 -3.11 0.00 0.00 179.97 177.96 1vfl h LEU 322 N -0.27 0.56 -0.67 3.80 8.10 -0.58 -1.96 115.31 124.30 1vfl h LEU 322 Ca 0.04 -0.15 -0.14 0.00 0.11 0.00 0.00 57.88 57.74 1vfl h LEU 322 Cb 0.32 -0.15 -0.02 0.00 -0.44 0.00 0.00 40.66 40.37 1vfl h LEU 322 CO -0.13 0.72 -0.64 0.78 -4.11 0.00 0.00 178.44 175.06 1vfl h ASN 323 N 0.53 0.12 -0.38 0.17 2.35 -1.30 0.11 115.58 117.18 1vfl h ASN 323 Ca 0.10 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.71 1vfl h ASN 323 Cb 0.53 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1vfl h ASN 323 CO 0.03 0.73 -0.01 0.40 -1.65 0.00 0.00 177.43 176.93 1vfl h ILE 324 N 0.07 1.26 -0.24 2.81 1.08 -1.04 -1.23 117.51 120.23 1vfl h ILE 324 Ca -0.01 -1.02 -0.08 0.00 -0.39 0.00 0.00 64.86 63.36 1vfl h ILE 324 Cb 1.15 1.17 -0.01 0.00 -3.07 0.00 0.00 36.82 36.05 1vfl h ILE 324 CO 0.09 0.34 -0.20 0.78 -0.69 0.00 0.00 178.15 178.47 1vfl h ASN 325 N 0.50 0.42 -0.52 1.72 2.35 -1.12 0.95 115.58 119.86 1vfl h ASN 325 Ca 0.11 -0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 55.69 1vfl h ASN 325 Cb 0.49 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.72 1vfl h ASN 325 CO 0.02 0.63 0.16 0.00 -1.65 0.00 0.00 177.43 176.60 1vfl h ALA 326 N 1.41 0.69 -0.52 -0.83 0.00 -0.47 0.49 119.26 120.02 1vfl h ALA 326 Ca 0.06 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1vfl h ALA 326 Cb 0.58 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1vfl h ALA 326 CO 0.04 0.34 -0.02 0.00 0.00 0.00 0.00 179.25 179.61 1vfl h ALA 327 N 1.03 0.70 -0.07 0.00 0.00 -0.69 -1.26 119.26 118.96 1vfl h ALA 327 Ca 0.17 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1vfl h ALA 327 Cb 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1vfl h ALA 327 CO -0.01 0.54 -0.14 0.87 0.00 0.00 0.00 179.25 180.51 1vfl h LYS 328 N 0.80 0.11 -0.24 0.00 1.57 -0.50 -2.28 116.57 116.04 1vfl h LYS 328 Ca 0.14 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1vfl h LYS 328 Cb 0.55 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1vfl h LYS 328 CO 0.03 0.27 0.00 0.43 -0.57 0.00 0.00 179.45 179.61 1vfl n SER 329 N -4.31 2.35 -4.63 0.86 7.64 0.14 -4.96 113.62 110.71 1vfl n SER 329 Ca -0.02 -1.82 -0.29 0.00 1.01 0.00 0.00 58.87 57.75 1vfl n SER 329 Cb 0.25 -0.15 0.19 0.00 -1.01 0.00 0.00 64.21 63.48 1vfl n SER 329 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1vfl s SER 330 N -1.56 2.43 -0.39 6.43 1.04 -0.51 -4.92 113.70 116.21 1vfl s SER 330 Ca 0.34 1.57 0.07 0.00 0.48 0.00 0.00 55.95 58.41 1vfl s SER 330 Cb 0.19 -2.23 0.69 0.00 0.10 0.00 0.00 66.02 64.77 1vfl s SER 330 CO 0.28 -3.31 1.84 0.49 0.98 0.00 0.00 173.24 173.52 1vfl n PHE 331 N -4.33 2.66 -2.69 5.02 3.72 -1.26 -4.97 117.46 115.61 1vfl n PHE 331 Ca 0.06 -1.57 -0.32 0.00 -0.05 0.00 0.00 57.45 55.57 1vfl n PHE 331 Cb 0.55 -0.81 -0.05 0.00 -0.94 0.00 0.00 39.48 38.23 1vfl n PHE 331 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1vfl s LEU 332 N -3.17 3.81 0.69 4.37 2.96 -1.26 -4.87 118.68 121.20 1vfl s LEU 332 Ca 0.55 1.50 -0.17 0.00 -0.22 0.00 0.00 54.13 55.79 1vfl s LEU 332 Cb 0.46 -4.38 0.01 0.00 0.50 0.00 0.00 46.19 42.78 1vfl s LEU 332 CO 0.11 -0.44 1.27 -2.84 -1.32 0.00 0.00 176.35 173.13 1vfl s PRO 333 N -3.63 2.32 0.33 0.98 0.02 -1.26 -4.63 135.00 129.14 1vfl s PRO 333 Ca 0.58 1.97 0.09 0.00 0.02 0.00 0.00 61.00 63.65 1vfl s PRO 333 Cb -0.10 -1.83 0.82 0.00 0.02 0.00 0.00 34.50 33.42 1vfl s PRO 333 CO 0.24 -1.75 1.80 0.93 -0.33 0.00 0.00 177.00 177.89 1vfl h GLU 334 N 0.16 0.66 0.47 5.54 4.39 -1.98 0.10 114.58 123.93 1vfl h GLU 334 Ca -0.50 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.15 1vfl h GLU 334 Cb 1.32 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.81 1vfl h GLU 334 CO 0.51 0.44 -0.34 0.22 -1.16 0.00 0.00 179.01 178.68 1vfl h ASP 335 N 0.68 -0.89 0.44 1.42 -0.00 -2.00 -1.37 116.42 114.70 1vfl h ASP 335 Ca 0.55 0.06 -0.11 0.00 -0.00 0.00 0.00 57.03 57.54 1vfl h ASP 335 Cb 0.97 0.28 -0.01 0.00 -0.00 0.00 0.00 39.33 40.56 1vfl h ASP 335 CO -0.32 -0.52 -0.48 -0.33 -0.00 0.00 0.00 179.24 177.59 1vfl h GLU 336 N -0.80 0.06 -0.55 0.28 5.08 -1.75 -2.83 114.58 114.07 1vfl h GLU 336 Ca -0.05 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1vfl h GLU 336 Cb 0.67 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 1vfl h GLU 336 CO 0.02 0.53 0.17 -0.22 -1.00 0.00 0.00 179.01 178.50 1vfl h LYS 337 N 0.05 0.86 -0.79 2.33 3.64 -0.62 -0.32 116.57 121.71 1vfl h LYS 337 Ca -0.00 -0.19 -0.04 0.00 -1.27 0.00 0.00 60.65 59.16 1vfl h LYS 337 Cb 0.87 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.53 1vfl h LYS 337 CO 0.07 0.78 0.36 0.87 -2.27 0.00 0.00 179.45 179.25 1vfl h LYS 338 N 0.77 1.16 -0.69 1.90 1.79 -1.09 -0.24 116.57 120.17 1vfl h LYS 338 Ca 0.18 -0.18 -0.04 0.00 -2.18 0.00 0.00 60.65 58.42 1vfl h LYS 338 Cb 0.28 -0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 30.70 1vfl h LYS 338 CO -0.01 0.91 0.27 0.93 -1.08 0.00 0.00 179.45 180.48 1vfl h GLU 339 N 1.13 1.03 -0.72 3.15 5.08 -1.23 0.12 114.58 123.14 1vfl h GLU 339 Ca 0.27 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1vfl h GLU 339 Cb 0.15 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1vfl h GLU 339 CO -0.03 0.86 0.32 1.25 -1.00 0.00 0.00 179.01 180.41 1vfl h LEU 340 N 0.98 0.97 -0.73 1.33 5.85 -0.53 -1.74 115.31 121.43 1vfl h LEU 340 Ca 0.23 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 1vfl h LEU 340 Cb 0.21 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 1vfl h LEU 340 CO -0.02 0.85 0.31 -0.07 -0.34 0.00 0.00 178.44 179.17 1vfl h LEU 341 N 1.02 1.00 -1.06 2.25 3.38 -0.35 -1.35 115.31 120.19 1vfl h LEU 341 Ca 0.24 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1vfl h LEU 341 Cb 0.16 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1vfl h LEU 341 CO -0.03 0.88 0.42 0.44 0.09 0.00 0.00 178.44 180.25 1vfl h ASP 342 N 1.04 0.96 -0.12 -0.43 3.32 -0.37 0.29 116.42 121.12 1vfl h ASP 342 Ca 0.25 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1vfl h ASP 342 Cb 0.19 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1vfl h ASP 342 CO -0.02 0.78 0.04 0.25 -1.72 0.00 0.00 179.24 178.56 1vfl h LEU 343 N 1.09 0.18 -0.31 1.55 5.85 -0.86 -1.39 115.31 121.41 1vfl h LEU 343 Ca 0.27 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1vfl h LEU 343 Cb 0.03 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1vfl h LEU 343 CO -0.04 0.33 0.14 -0.07 -0.34 0.00 0.00 178.44 178.46 1vfl h LEU 344 N 0.01 0.41 -0.16 2.25 3.38 -0.71 0.09 115.31 120.57 1vfl h LEU 344 Ca 0.04 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 57.90 1vfl h LEU 344 Cb 0.22 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1vfl h LEU 344 CO -0.00 0.44 -0.03 1.88 0.09 0.00 0.00 178.44 180.82 1vfl h TYR 345 N 0.36 -0.07 -0.42 1.13 0.05 -0.38 0.66 116.97 118.29 1vfl h TYR 345 Ca 0.11 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.86 1vfl h TYR 345 Cb 0.14 0.05 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 1vfl h TYR 345 CO -0.01 -0.06 0.10 1.57 -1.05 0.00 0.00 178.16 178.71 1vfl h LYS 346 N 0.01 0.63 0.00 4.88 2.10 -1.13 0.38 116.57 123.45 1vfl h LYS 346 Ca 0.08 -0.11 -0.16 0.00 -2.00 0.00 0.00 60.65 58.46 1vfl h LYS 346 Cb 0.11 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 31.32 1vfl h LYS 346 CO -0.16 0.58 -0.75 0.00 -2.00 0.00 0.00 179.45 177.12 1vfl h ALA 347 N 1.50 0.64 -0.02 0.07 0.00 -0.18 -3.13 119.26 118.14 1vfl h ALA 347 Ca 0.14 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1vfl h ALA 347 Cb 0.24 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1vfl h ALA 347 CO -0.00 0.94 -0.16 0.66 0.00 0.00 0.00 179.25 180.69 1vfl n TYR 348 N -3.47 0.00 -1.38 0.00 0.53 0.22 -4.97 117.16 108.09 1vfl n TYR 348 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 1vfl n TYR 348 Cb 0.77 -0.02 0.00 0.00 -1.03 0.00 0.00 39.34 39.07 1vfl n TYR 348 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38