#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2flf h ARG 2 N 0.00 0.00 0.00 0.03 2.47 -2.05 0.89 114.38 115.72 2flf h ARG 2 Ca 0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 2flf h ARG 2 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 2flf h ARG 2 CO 0.00 0.00 -0.03 0.00 0.56 0.00 0.00 179.97 180.50 2flf h ALA 3 N 0.51 0.00 0.50 0.04 0.00 -2.06 -3.23 119.26 115.01 2flf h ALA 3 Ca 0.34 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2flf h ALA 3 Cb 2.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.29 2flf h ALA 3 CO -0.00 -0.05 -0.24 0.00 0.00 0.00 0.00 179.25 178.96 2flf h ARG 4 N -0.82 -0.64 0.00 0.00 3.08 -1.28 -2.38 114.38 112.35 2flf h ARG 4 Ca -0.00 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2flf h ARG 4 Cb 0.88 0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.08 2flf h ARG 4 CO 0.01 -0.37 0.00 1.28 -1.07 0.00 0.00 179.97 179.82 2flf n LEU 5 N -5.32 0.00 -0.07 3.04 4.77 -1.11 -1.94 117.00 116.38 2flf n LEU 5 Ca -0.11 0.31 -0.05 0.00 -0.03 0.00 0.00 56.01 56.13 2flf n LEU 5 Cb 0.30 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 2flf n LEU 5 CO 0.34 -0.28 -0.18 0.22 -1.33 0.00 0.00 177.39 176.17 2flf h TYR 6 N 0.00 0.00 -0.89 -1.77 3.20 -1.48 -3.21 116.97 112.82 2flf h TYR 6 Ca 0.00 0.00 0.21 0.00 3.14 0.00 0.00 58.73 62.08 2flf h TYR 6 Cb 0.04 0.00 -0.16 0.00 1.54 0.00 0.00 36.73 38.14 2flf h TYR 6 CO 0.00 0.20 -0.05 0.00 -1.64 0.00 0.00 178.16 176.68 2flf h ALA 7 N -0.88 0.88 -1.17 1.82 0.00 -0.90 -1.27 119.26 117.74 2flf h ALA 7 Ca -0.03 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2flf h ALA 7 Cb 0.42 0.56 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2flf h ALA 7 CO -0.02 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.76 2flf n ALA 8 N -3.16 -0.08 -0.04 0.00 0.00 -0.96 -0.26 120.51 116.01 2flf n ALA 8 Ca 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.57 2flf n ALA 8 Cb 0.58 0.29 -0.03 0.00 0.00 0.00 0.00 19.45 20.29 2flf n ALA 8 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2flf h PHE 9 N 0.00 -0.51 -0.58 0.00 -1.00 -1.32 -0.65 116.94 112.88 2flf h PHE 9 Ca 0.00 0.02 0.07 0.00 2.81 0.00 0.00 57.97 60.87 2flf h PHE 9 Cb 0.00 0.24 -0.08 0.00 3.61 0.00 0.00 35.95 39.72 2flf h PHE 9 CO -0.38 -0.15 -0.29 -2.13 -1.61 0.00 0.00 178.31 173.75 2flf n ARG 10 N -3.51 -0.20 0.32 1.51 3.00 -0.57 0.28 116.66 117.50 2flf n ARG 10 Ca -0.01 0.88 -0.18 0.00 -0.00 0.00 0.00 57.85 58.54 2flf n ARG 10 Cb 0.10 -1.30 -0.10 0.00 0.00 0.00 0.00 32.46 31.17 2flf n ARG 10 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 2flf h GLN 11 N 0.00 -0.99 -0.85 -0.14 4.15 0.01 -0.81 115.11 116.48 2flf h GLN 11 Ca 0.14 0.07 0.20 0.00 0.77 0.00 0.00 58.65 59.83 2flf h GLN 11 Cb 0.29 0.22 -0.06 0.00 0.21 0.00 0.00 27.48 28.14 2flf h GLN 11 CO -0.56 -0.66 0.57 0.28 -1.93 0.00 0.00 178.83 176.54 2flf h VAL 12 N -1.03 0.69 0.06 2.39 2.07 0.14 -0.54 116.25 120.03 2flf h VAL 12 Ca -0.07 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 2flf h VAL 12 Cb 0.87 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2flf h VAL 12 CO -0.02 0.06 -0.03 1.23 0.02 0.00 0.00 177.57 178.83 2flf h GLY 13 N 0.33 -0.08 0.79 2.17 0.00 0.26 -1.35 103.07 105.19 2flf h GLY 13 Ca 0.43 0.03 0.02 0.00 0.00 0.00 0.00 47.33 47.81 2flf h GLY 13 CO -0.13 -0.03 -0.08 0.83 0.00 0.00 0.00 176.54 177.13 2flf h GLU 14 N -0.51 -0.13 -0.56 4.80 5.08 0.28 -1.72 114.58 121.81 2flf h GLU 14 Ca -0.01 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2flf h GLU 14 Cb 0.45 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 2flf h GLU 14 CO 0.01 -0.09 0.05 -0.44 -1.00 0.00 0.00 179.01 177.54 2flf h ASP 15 N -0.14 0.89 -0.43 1.42 3.45 -1.28 -0.79 116.42 119.55 2flf h ASP 15 Ca 0.03 -0.22 -0.02 0.00 0.43 0.00 0.00 57.03 57.26 2flf h ASP 15 Cb 0.18 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 38.69 2flf h ASP 15 CO -0.09 0.93 0.20 0.25 -1.57 0.00 0.00 179.24 178.96 2flf h LEU 16 N 0.87 0.57 -0.62 1.55 5.85 -1.07 -0.57 115.31 121.88 2flf h LEU 16 Ca 0.17 -0.14 -0.12 0.00 0.84 0.00 0.00 57.88 58.63 2flf h LEU 16 Cb 0.45 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2flf h LEU 16 CO 0.02 0.55 -0.25 0.15 -0.34 0.00 0.00 178.44 178.57 2flf h PHE 17 N 0.55 0.95 0.73 1.25 3.57 -1.18 -1.57 116.94 121.23 2flf h PHE 17 Ca 0.14 -0.23 -0.03 0.00 3.53 0.00 0.00 57.97 61.38 2flf h PHE 17 Cb 0.14 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.66 2flf h PHE 17 CO -0.01 0.98 -0.42 0.00 -2.23 0.00 0.00 178.31 176.64 2flf h ALA 18 N 1.01 -1.25 0.00 2.41 0.00 -0.61 -2.37 119.26 118.45 2flf h ALA 18 Ca 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2flf h ALA 18 Cb 0.78 0.51 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2flf h ALA 18 CO 0.06 -1.20 0.00 1.04 0.00 0.00 0.00 179.25 179.16 2flf n GLN 19 N -5.06 0.18 -3.16 0.00 1.13 -0.27 -4.78 117.38 105.41 2flf n GLN 19 Ca -0.13 0.00 -0.23 0.00 -1.94 0.00 0.00 57.00 54.70 2flf n GLN 19 Cb 0.43 -1.01 0.03 0.00 0.11 0.00 0.00 30.24 29.81 2flf n GLN 19 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2flf n GLY 20 N -0.28 -0.52 0.10 1.08 0.00 -0.89 -4.89 105.19 99.78 2flf n GLY 20 Ca 0.00 0.13 0.09 0.00 0.00 0.00 0.00 46.02 46.24 2flf n GLY 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2flf n LEU 21 N -4.07 0.75 -3.89 0.99 4.77 -0.60 -4.71 117.00 110.25 2flf n LEU 21 Ca -0.08 0.30 -0.11 0.00 -0.03 0.00 0.00 56.01 56.09 2flf n LEU 21 Cb 0.60 -0.02 -0.12 0.00 -2.33 0.00 0.00 43.42 41.55 2flf n LEU 21 CO 0.50 -0.09 -0.28 0.27 -1.33 0.00 0.00 177.39 176.47 2flf s ILE 22 N -3.28 0.05 0.00 -0.08 -4.36 -1.21 -0.53 121.20 111.79 2flf s ILE 22 Ca -0.02 -0.40 0.00 0.00 -0.26 0.00 0.00 60.65 59.97 2flf s ILE 22 Cb 0.10 -0.22 0.00 0.00 1.25 0.00 0.00 42.46 43.58 2flf s ILE 22 CO 0.81 -0.22 0.00 -1.20 0.24 0.00 0.00 174.94 174.57 2flf n SER 23 N 2.30 -1.32 0.21 4.36 7.64 -1.26 -4.54 113.62 121.01 2flf n SER 23 Ca -0.18 -0.19 0.07 0.00 1.01 0.00 0.00 58.87 59.58 2flf n SER 23 Cb 0.57 0.00 0.48 0.00 -1.01 0.00 0.00 64.21 64.25 2flf n SER 23 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2flf h ALA 24 N -2.00 1.23 0.00 -0.43 0.00 -1.97 -3.37 119.26 112.71 2flf h ALA 24 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2flf h ALA 24 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2flf h ALA 24 CO 0.00 0.35 -0.38 0.25 0.00 0.00 0.00 179.25 179.47 2flf n THR 25 N -3.76 0.00 -0.70 0.00 -2.24 -1.26 -2.38 114.28 103.94 2flf n THR 25 Ca -0.01 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.45 2flf n THR 25 Cb 0.38 -0.33 0.16 0.00 -2.10 0.00 0.00 70.33 68.44 2flf n THR 25 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2flf n ALA 26 N -1.03 -3.32 -1.07 6.98 0.00 -1.26 -4.75 120.51 116.06 2flf n ALA 26 Ca 0.00 -0.99 0.04 0.00 0.00 0.00 0.00 53.44 52.48 2flf n ALA 26 Cb 0.17 -1.70 -0.02 0.00 0.00 0.00 0.00 19.45 17.91 2flf n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2flf n GLY 27 N 1.66 -3.53 3.25 0.00 0.00 -1.26 -4.30 105.19 101.01 2flf n GLY 27 Ca 0.04 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 2flf n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2flf s ASN 28 N -5.16 -0.03 0.09 1.61 2.20 0.12 -5.01 114.94 108.77 2flf s ASN 28 Ca 0.00 -0.48 -0.11 0.00 -0.94 0.00 0.00 52.86 51.33 2flf s ASN 28 Cb 0.00 0.38 0.01 0.00 -2.00 0.00 0.00 41.25 39.64 2flf s ASN 28 CO 0.00 -0.75 0.26 0.72 -2.94 0.00 0.00 177.10 174.39 2flf s PHE 29 N -3.63 0.03 0.23 1.54 -0.12 -1.26 -0.02 117.98 114.75 2flf s PHE 29 Ca 0.03 -0.40 -0.22 0.00 -0.05 0.00 0.00 56.93 56.28 2flf s PHE 29 Cb 0.03 0.04 0.05 0.00 -0.63 0.00 0.00 43.02 42.51 2flf s PHE 29 CO -0.10 -0.58 0.87 -1.54 -0.05 0.00 0.00 175.22 173.82 2flf s SER 30 N -2.76 -0.16 0.06 1.98 1.04 0.16 -1.95 113.70 112.07 2flf s SER 30 Ca 0.03 -0.61 0.01 0.00 0.48 0.00 0.00 55.95 55.87 2flf s SER 30 Cb 0.03 0.62 -0.03 0.00 0.10 0.00 0.00 66.02 66.74 2flf s SER 30 CO -0.11 -1.17 -0.06 0.68 0.98 0.00 0.00 173.24 173.56 2flf s VAL 31 N -3.22 0.51 0.70 5.02 -7.23 0.39 -0.08 120.40 116.49 2flf s VAL 31 Ca 0.13 -1.43 -0.11 0.00 -1.81 0.00 0.00 61.98 58.76 2flf s VAL 31 Cb -0.04 -1.04 0.01 0.00 0.56 0.00 0.00 36.38 35.88 2flf s VAL 31 CO 0.05 -0.63 1.06 -0.60 -0.31 0.00 0.00 175.10 174.68 2flf s ARG 32 N -2.59 2.90 0.00 4.82 3.52 -0.68 -0.04 118.95 126.88 2flf s ARG 32 Ca -0.01 0.80 0.00 0.00 -0.13 0.00 0.00 55.73 56.39 2flf s ARG 32 Cb -0.03 -2.00 0.00 0.00 -1.56 0.00 0.00 34.95 31.36 2flf s ARG 32 CO -0.03 -1.09 0.00 0.25 -0.81 0.00 0.00 175.30 173.63 2flf n THR 33 N -3.10 0.00 -2.10 4.11 -2.24 0.09 -4.61 114.28 106.44 2flf n THR 33 Ca 0.07 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.51 2flf n THR 33 Cb 0.54 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.74 2flf n THR 33 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2flf s LYS 34 N 0.41 2.68 0.00 -0.78 1.02 -1.26 -3.41 119.74 118.40 2flf s LYS 34 Ca 0.00 0.08 0.00 0.00 0.02 0.00 0.00 55.97 56.07 2flf s LYS 34 Cb 0.00 -4.72 0.00 0.00 -0.52 0.00 0.00 37.83 32.59 2flf s LYS 34 CO 0.00 -2.95 0.00 0.41 -0.92 0.00 0.00 175.35 171.89 2flf n GLY 35 N 6.25 2.28 0.00 -3.33 0.00 -1.26 -4.87 105.19 104.25 2flf n GLY 35 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2flf n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2flf n GLY 36 N -2.00 5.60 3.64 -0.02 0.00 -1.22 -3.58 105.19 107.61 2flf n GLY 36 Ca 0.00 -1.04 -0.05 0.00 0.00 0.00 0.00 46.02 44.94 2flf n GLY 36 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2flf s PHE 37 N 2.36 -0.26 -0.04 1.61 -0.12 -0.24 -0.73 117.98 120.56 2flf s PHE 37 Ca 0.00 0.60 -0.17 0.00 -0.05 0.00 0.00 56.93 57.32 2flf s PHE 37 Cb 0.00 0.38 -0.05 0.00 -0.63 0.00 0.00 43.02 42.72 2flf s PHE 37 CO 0.00 -0.13 0.46 -1.17 -0.05 0.00 0.00 175.22 174.33 2flf s LEU 38 N 0.34 4.41 0.19 -1.99 2.96 0.94 -2.23 118.68 123.30 2flf s LEU 38 Ca 0.03 0.95 -0.00 0.00 -0.22 0.00 0.00 54.13 54.88 2flf s LEU 38 Cb -0.05 -2.67 -0.04 0.00 0.50 0.00 0.00 46.19 43.93 2flf s LEU 38 CO -0.12 0.19 0.09 -0.51 -1.32 0.00 0.00 176.35 174.68 2flf s ILE 39 N -0.42 0.25 0.08 6.68 2.07 -1.19 -0.46 121.20 128.21 2flf s ILE 39 Ca 0.25 -1.98 -0.30 0.00 -1.41 0.00 0.00 60.65 57.22 2flf s ILE 39 Cb -0.16 -2.37 -0.05 0.00 0.13 0.00 0.00 42.46 40.00 2flf s ILE 39 CO 0.13 -0.18 0.98 0.42 -1.91 0.00 0.00 174.94 174.38 2flf s THR 40 N -3.96 4.57 1.11 4.00 -4.23 -0.82 -2.60 115.64 113.70 2flf s THR 40 Ca 0.33 2.04 -0.19 0.00 -1.18 0.00 0.00 61.69 62.70 2flf s THR 40 Cb 0.07 -4.31 0.11 0.00 1.34 0.00 0.00 72.50 69.71 2flf s THR 40 CO 0.09 0.27 -0.03 0.29 -0.54 0.00 0.00 174.62 174.70 2flf n LYS 41 N 3.09 -1.73 -3.81 3.99 5.02 0.14 -3.35 118.16 121.51 2flf n LYS 41 Ca 0.03 -0.49 -0.35 0.00 -2.02 0.00 0.00 58.31 55.48 2flf n LYS 41 Cb 0.49 -1.62 -0.10 0.00 -0.02 0.00 0.00 35.03 33.79 2flf n LYS 41 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2flf s SER 42 N -1.83 5.87 -0.21 4.39 0.15 0.14 -4.19 113.70 118.02 2flf s SER 42 Ca 0.52 0.10 -0.07 0.00 0.70 0.00 0.00 55.95 57.19 2flf s SER 42 Cb -0.09 -2.04 0.01 0.00 -1.71 0.00 0.00 66.02 62.19 2flf s SER 42 CO 0.60 0.12 0.27 0.61 1.20 0.00 0.00 173.24 176.04 2flf n GLY 43 N 3.92 -1.17 3.53 9.45 0.00 -1.26 -4.90 105.19 114.77 2flf n GLY 43 Ca -0.16 0.53 -0.10 0.00 0.00 0.00 0.00 46.02 46.29 2flf n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2flf s VAL 44 N -1.72 0.00 -0.72 1.61 0.11 -1.26 -5.09 120.40 113.33 2flf s VAL 44 Ca 0.11 -0.22 -0.26 0.00 -2.93 0.00 0.00 61.98 58.68 2flf s VAL 44 Cb -0.03 -1.24 0.01 0.00 -1.53 0.00 0.00 36.38 33.59 2flf s VAL 44 CO 0.38 0.00 1.52 -1.10 -3.33 0.00 0.00 175.10 172.57 2flf s GLN 45 N -3.63 2.99 0.15 1.54 -1.52 -1.26 -4.31 119.66 113.62 2flf s GLN 45 Ca 0.04 0.00 0.23 0.00 -1.95 0.00 0.00 55.36 53.69 2flf s GLN 45 Cb -0.02 -4.36 0.90 0.00 -0.22 0.00 0.00 33.01 29.31 2flf s GLN 45 CO -0.08 -2.41 1.71 1.63 -0.25 0.00 0.00 175.29 175.89 2flf n LYS 46 N 9.26 0.14 -0.04 2.91 5.02 -1.00 -2.75 118.16 131.70 2flf n LYS 46 Ca 0.13 0.26 -0.16 0.00 -2.02 0.00 0.00 58.31 56.52 2flf n LYS 46 Cb 0.50 -1.72 -0.08 0.00 -0.02 0.00 0.00 35.03 33.72 2flf n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2flf h ALA 47 N 2.50 0.24 -2.08 7.82 0.00 -1.79 -3.36 119.26 122.59 2flf h ALA 47 Ca 0.00 -0.49 -0.69 0.00 0.00 0.00 0.00 54.91 53.73 2flf h ALA 47 Cb 0.46 -0.02 -0.36 0.00 0.00 0.00 0.00 17.79 17.87 2flf h ALA 47 CO 0.00 0.40 0.03 0.54 0.00 0.00 0.00 179.25 180.22 2flf n ARG 48 N -4.23 3.41 -3.10 0.00 1.74 -1.11 -3.80 116.66 109.57 2flf n ARG 48 Ca -0.07 -4.62 -0.40 0.00 -0.77 0.00 0.00 57.85 51.98 2flf n ARG 48 Cb 0.58 -2.37 -0.06 0.00 -1.02 0.00 0.00 32.46 29.59 2flf n ARG 48 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2flf s LEU 49 N -2.62 4.15 0.22 0.55 1.43 -1.22 -4.82 118.68 116.38 2flf s LEU 49 Ca 0.36 0.86 0.05 0.00 -1.03 0.00 0.00 54.13 54.37 2flf s LEU 49 Cb 0.10 -2.92 -0.03 0.00 0.03 0.00 0.00 46.19 43.38 2flf s LEU 49 CO 0.04 -0.28 0.33 0.42 0.23 0.00 0.00 176.35 177.10 2flf s THR 50 N 1.89 5.22 -0.08 5.49 -4.23 -1.26 -4.72 115.64 117.95 2flf s THR 50 Ca 0.29 -0.96 0.09 0.00 -1.18 0.00 0.00 61.69 59.93 2flf s THR 50 Cb -0.16 -3.81 0.09 0.00 1.34 0.00 0.00 72.50 69.96 2flf s THR 50 CO 0.11 -0.29 1.13 -2.65 -0.54 0.00 0.00 174.62 172.38 2flf n PRO 51 N -1.23 0.06 -0.94 3.99 -0.02 -1.26 -1.14 135.00 134.46 2flf n PRO 51 Ca -0.09 0.49 -0.19 0.00 -2.02 0.00 0.00 63.50 61.69 2flf n PRO 51 Cb 0.56 -2.03 0.11 0.00 -0.02 0.00 0.00 33.50 32.13 2flf n PRO 51 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2flf n GLU 52 N -1.85 1.98 0.00 -0.52 4.71 -1.26 -3.80 120.64 119.91 2flf n GLU 52 Ca -0.01 -2.22 0.00 0.00 -0.01 0.00 0.00 57.16 54.92 2flf n GLU 52 Cb 0.34 -1.87 0.00 0.00 -1.01 0.00 0.00 31.44 28.90 2flf n GLU 52 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2flf n ASP 53 N -0.57 0.16 -4.43 1.62 10.43 -0.29 -5.03 116.55 118.44 2flf n ASP 53 Ca 0.44 -0.49 -0.35 0.00 2.57 0.00 0.00 54.79 56.97 2flf n ASP 53 Cb 1.16 0.44 -0.13 0.00 1.84 0.00 0.00 41.12 44.44 2flf n ASP 53 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2flf s LEU 54 N -0.89 3.18 -0.00 0.64 1.43 -1.25 0.28 118.68 122.07 2flf s LEU 54 Ca 0.00 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 2flf s LEU 54 Cb 0.00 -1.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.41 2flf s LEU 54 CO 0.00 0.07 -0.12 -1.48 0.23 0.00 0.00 176.35 175.05 2flf s LEU 55 N 0.97 2.05 0.84 1.79 0.05 -1.07 -4.97 118.68 118.34 2flf s LEU 55 Ca 0.01 -0.25 -0.11 0.00 0.05 0.00 0.00 54.13 53.83 2flf s LEU 55 Cb -0.14 -0.57 0.10 0.00 -2.05 0.00 0.00 46.19 43.52 2flf s LEU 55 CO 0.01 0.11 1.11 -0.70 -0.55 0.00 0.00 176.35 176.33 2flf s GLU 56 N -0.43 1.72 -0.30 1.48 2.56 -1.26 -3.20 118.70 119.27 2flf s GLU 56 Ca 0.04 1.24 -0.12 0.00 0.00 0.00 0.00 54.97 56.12 2flf s GLU 56 Cb -0.05 -1.83 0.12 0.00 2.00 0.00 0.00 34.13 34.37 2flf s GLU 56 CO -0.00 -2.04 0.71 0.08 -0.56 0.00 0.00 175.26 173.44 2flf s VAL 57 N -2.82 -0.71 0.54 3.70 1.01 -0.95 -4.66 120.40 116.51 2flf s VAL 57 Ca 0.63 0.00 0.04 0.00 0.00 0.00 0.00 61.98 62.65 2flf s VAL 57 Cb -0.19 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.24 2flf s VAL 57 CO 0.57 0.00 0.75 -2.16 0.00 0.00 0.00 175.10 174.26 2flf s PRO 58 N 2.55 2.47 0.00 2.72 0.04 -1.26 -1.08 135.00 140.43 2flf s PRO 58 Ca -0.07 -1.04 0.28 0.00 0.04 0.00 0.00 61.00 60.22 2flf s PRO 58 Cb -0.10 -2.55 1.17 0.00 0.04 0.00 0.00 34.50 33.06 2flf s PRO 58 CO -0.19 -0.71 1.82 1.28 0.04 0.00 0.00 177.00 179.23 2flf n LEU 59 N -2.27 0.81 0.00 -3.56 4.77 -1.24 -4.42 117.00 111.09 2flf n LEU 59 Ca 0.10 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 2flf n LEU 59 Cb 0.60 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2flf n LEU 59 CO 0.43 0.14 0.11 -0.62 -1.33 0.00 0.00 177.39 176.12 2flf n GLU 60 N -0.59 0.00 0.18 3.23 1.02 -1.26 -5.04 120.64 118.18 2flf n GLU 60 Ca 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 2flf n GLU 60 Cb 0.29 -0.68 0.00 0.00 -0.02 0.00 0.00 31.44 31.03 2flf n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2flf n GLY 61 N 0.19 -1.62 3.56 0.62 0.00 -1.26 -5.09 105.19 101.58 2flf n GLY 61 Ca 0.00 0.38 -0.37 0.00 0.00 0.00 0.00 46.02 46.03 2flf n GLY 61 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2flf s PRO 62 N -2.00 2.30 -0.70 1.61 0.02 -1.26 -4.93 135.00 130.04 2flf s PRO 62 Ca 0.00 1.37 -0.24 0.00 0.02 0.00 0.00 61.00 62.15 2flf s PRO 62 Cb 0.00 -4.53 0.06 0.00 0.02 0.00 0.00 34.50 30.05 2flf s PRO 62 CO 0.00 -3.06 1.08 0.42 -0.33 0.00 0.00 177.00 175.12 2flf s ILE 63 N 11.28 4.12 0.09 2.83 1.01 -1.26 -4.68 121.20 134.59 2flf s ILE 63 Ca 0.93 -0.14 -0.36 0.00 0.00 0.00 0.00 60.65 61.08 2flf s ILE 63 Cb -0.18 -4.77 -0.16 0.00 0.01 0.00 0.00 42.46 37.36 2flf s ILE 63 CO 0.26 -1.60 1.41 -0.81 0.00 0.00 0.00 174.94 174.20 2flf n PRO 64 N 8.26 1.38 -1.77 2.79 -0.04 -1.26 -4.91 135.00 139.45 2flf n PRO 64 Ca -0.00 0.50 -0.40 0.00 -0.04 0.00 0.00 63.50 63.55 2flf n PRO 64 Cb 0.47 -2.17 0.01 0.00 -0.04 0.00 0.00 33.50 31.77 2flf n PRO 64 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2flf s GLU 65 N 0.74 3.83 0.00 0.54 -1.05 -1.26 -3.24 118.70 118.26 2flf s GLU 65 Ca 0.84 2.51 0.00 0.00 -0.15 0.00 0.00 54.97 58.17 2flf s GLU 65 Cb -0.90 -2.77 0.00 0.00 -0.44 0.00 0.00 34.13 30.02 2flf s GLU 65 CO 0.46 -0.74 0.00 0.41 0.95 0.00 0.00 175.26 176.34 2flf n GLY 66 N 0.51 1.78 3.69 -3.83 0.00 -1.26 -5.08 105.19 101.01 2flf n GLY 66 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2flf n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2flf s ALA 67 N -2.13 3.58 -0.29 4.61 0.00 -1.20 0.26 121.76 126.58 2flf s ALA 67 Ca 0.00 0.89 -0.39 0.00 0.00 0.00 0.00 51.96 52.46 2flf s ALA 67 Cb 0.00 -3.59 -0.15 0.00 0.00 0.00 0.00 23.12 19.38 2flf s ALA 67 CO 0.00 -0.90 1.85 0.45 0.00 0.00 0.00 175.76 177.17 2flf n SER 68 N 5.30 2.35 -0.06 0.00 2.88 -1.21 -4.60 113.62 118.27 2flf n SER 68 Ca 0.13 0.94 0.05 0.00 -1.33 0.00 0.00 58.87 58.66 2flf n SER 68 Cb 0.44 -1.17 0.09 0.00 -0.75 0.00 0.00 64.21 62.82 2flf n SER 68 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2flf n VAL 69 N 5.19 -0.03 1.56 2.46 0.31 -1.26 0.07 118.33 126.62 2flf n VAL 69 Ca 0.30 0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.88 2flf n VAL 69 Cb 0.15 -0.40 0.00 0.00 -0.91 0.00 0.00 33.84 32.68 2flf n VAL 69 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2flf n GLU 70 N -2.90 0.93 0.27 5.55 1.02 -1.26 -3.78 120.64 120.47 2flf n GLU 70 Ca 0.05 0.00 0.18 0.00 -0.02 0.00 0.00 57.16 57.38 2flf n GLU 70 Cb 0.21 -1.15 0.96 0.00 -0.02 0.00 0.00 31.44 31.45 2flf n GLU 70 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 2flf h SER 71 N 0.02 0.00 -0.26 1.62 0.02 -0.66 0.31 113.55 114.59 2flf h SER 71 Ca 0.00 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.85 2flf h SER 71 Cb 0.15 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 2flf h SER 71 CO 0.00 0.00 -0.16 0.58 -1.14 0.00 0.00 176.83 176.11 2flf h VAL 72 N 0.00 1.26 0.18 2.27 2.07 -1.84 -2.10 116.25 118.09 2flf h VAL 72 Ca 0.00 -1.21 -0.30 0.00 0.82 0.00 0.00 66.70 66.00 2flf h VAL 72 Cb 0.01 1.15 0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2flf h VAL 72 CO 0.00 0.41 -1.34 0.58 0.02 0.00 0.00 177.57 177.23 2flf h VAL 73 N 0.63 1.38 0.27 2.57 2.07 -0.70 -2.92 116.25 119.53 2flf h VAL 73 Ca 0.10 -2.82 -0.01 0.00 0.82 0.00 0.00 66.70 64.79 2flf h VAL 73 Cb 0.63 2.95 0.00 0.00 -1.52 0.00 0.00 31.29 33.35 2flf h VAL 73 CO 0.04 0.84 -0.13 0.45 0.02 0.00 0.00 177.57 178.79 2flf h HIS 74 N 0.13 -0.33 -0.68 1.57 3.86 -1.46 -2.52 115.15 115.72 2flf h HIS 74 Ca -0.19 -0.01 0.14 0.00 -1.16 0.00 0.00 60.37 59.14 2flf h HIS 74 Cb 2.04 0.11 -0.10 0.00 1.06 0.00 0.00 27.41 30.53 2flf h HIS 74 CO 0.10 0.02 0.17 -0.09 0.86 0.00 0.00 177.93 178.98 2flf h ARG 75 N -0.75 0.28 -0.67 2.45 2.43 -1.51 0.33 114.38 116.92 2flf h ARG 75 Ca -0.04 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2flf h ARG 75 Cb 0.50 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.95 2flf h ARG 75 CO 0.06 0.19 0.45 1.49 -1.51 0.00 0.00 179.97 180.64 2flf h GLU 76 N 0.29 0.83 0.58 0.20 4.57 -1.50 -0.91 114.58 118.64 2flf h GLU 76 Ca 0.37 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.47 2flf h GLU 76 Cb 0.58 -0.19 0.01 0.00 -0.16 0.00 0.00 28.75 28.99 2flf h GLU 76 CO -0.45 0.55 -0.28 0.28 -1.18 0.00 0.00 179.01 177.94 2flf h VAL 77 N 0.86 0.00 -0.33 0.32 2.07 0.07 -0.33 116.25 118.91 2flf h VAL 77 Ca 0.26 -0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.87 2flf h VAL 77 Cb -0.01 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.74 2flf h VAL 77 CO -0.07 0.00 0.29 1.88 0.02 0.00 0.00 177.57 179.70 2flf h TYR 78 N -0.77 0.00 0.55 1.57 -1.99 -1.28 0.79 116.97 115.83 2flf h TYR 78 Ca -0.08 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.62 2flf h TYR 78 Cb 0.59 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.33 2flf h TYR 78 CO 0.10 0.00 -0.27 -0.09 -0.00 0.00 0.00 178.16 177.90 2flf h ARG 79 N 0.00 -0.72 -0.64 4.88 2.43 -0.77 -3.32 114.38 116.25 2flf h ARG 79 Ca 0.16 0.05 -0.33 0.00 -0.81 0.00 0.00 59.98 59.05 2flf h ARG 79 Cb 0.74 0.16 -0.19 0.00 -0.42 0.00 0.00 29.97 30.26 2flf h ARG 79 CO -0.00 -0.41 0.25 0.54 -1.51 0.00 0.00 179.97 178.84 2flf n ARG 80 N -5.31 2.09 -3.92 0.20 1.74 -0.17 -4.98 116.66 106.30 2flf n ARG 80 Ca -0.11 -3.11 -0.09 0.00 -0.77 0.00 0.00 57.85 53.77 2flf n ARG 80 Cb 0.33 -1.99 -0.06 0.00 -1.02 0.00 0.00 32.46 29.73 2flf n ARG 80 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2flf s THR 81 N -3.26 0.03 -0.33 0.55 2.01 0.21 -4.75 115.64 110.11 2flf s THR 81 Ca 0.50 -1.25 0.22 0.00 0.31 0.00 0.00 61.69 61.48 2flf s THR 81 Cb 0.44 -1.90 0.17 0.00 0.01 0.00 0.00 72.50 71.22 2flf s THR 81 CO 0.05 -0.15 1.34 1.23 -0.69 0.00 0.00 174.62 176.40 2flf h GLY 82 N 2.36 0.00 -2.96 4.40 0.00 -1.85 -3.42 103.07 101.60 2flf h GLY 82 Ca -0.29 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 46.65 2flf h GLY 82 CO 0.41 0.00 -0.10 0.00 0.00 0.00 0.00 176.54 176.85 2flf n ALA 83 N -2.15 -2.10 0.04 3.60 0.00 -1.26 -4.87 120.51 113.76 2flf n ALA 83 Ca 0.02 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2flf n ALA 83 Cb 0.56 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 19.11 2flf n ALA 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2flf n ARG 84 N 0.68 0.27 -3.66 0.00 1.74 -1.01 -4.74 116.66 109.95 2flf n ARG 84 Ca 0.10 -0.47 -0.11 0.00 -0.77 0.00 0.00 57.85 56.59 2flf n ARG 84 Cb 0.08 -0.95 -0.08 0.00 -1.02 0.00 0.00 32.46 30.49 2flf n ARG 84 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2flf s ALA 85 N -0.23 -1.57 -0.04 7.54 0.00 -1.24 -1.69 121.76 124.53 2flf s ALA 85 Ca 0.01 1.91 0.01 0.00 0.00 0.00 0.00 51.96 53.89 2flf s ALA 85 Cb 0.01 -1.12 0.02 0.00 0.00 0.00 0.00 23.12 22.03 2flf s ALA 85 CO 0.02 -0.31 -0.05 -1.17 0.00 0.00 0.00 175.76 174.25 2flf s LEU 86 N 0.82 1.36 -0.11 0.00 2.96 0.88 0.70 118.68 125.28 2flf s LEU 86 Ca -0.04 -0.13 0.03 0.00 -0.22 0.00 0.00 54.13 53.77 2flf s LEU 86 Cb -0.05 -0.45 0.01 0.00 0.50 0.00 0.00 46.19 46.20 2flf s LEU 86 CO -0.06 -0.05 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.01 2flf s VAL 87 N 0.87 1.93 -0.35 1.68 1.01 -0.23 -0.66 120.40 124.65 2flf s VAL 87 Ca -0.12 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 60.97 2flf s VAL 87 Cb -0.14 -1.70 0.10 0.00 0.00 0.00 0.00 36.38 34.64 2flf s VAL 87 CO 0.00 0.53 0.07 -2.28 0.00 0.00 0.00 175.10 173.42 2flf s HIS 88 N 0.63 3.74 0.24 5.22 2.46 0.97 -1.07 115.29 127.48 2flf s HIS 88 Ca -0.12 -2.91 0.01 0.00 0.47 0.00 0.00 55.06 52.50 2flf s HIS 88 Cb -0.16 -2.95 0.01 0.00 -0.13 0.00 0.00 32.58 29.34 2flf s HIS 88 CO 0.03 -0.95 0.08 0.00 -2.47 0.00 0.00 174.74 171.42 2flf n ALA 89 N 4.30 0.27 -3.08 1.58 0.00 -0.99 -0.70 120.51 121.90 2flf n ALA 89 Ca 0.03 -1.03 -0.23 0.00 0.00 0.00 0.00 53.44 52.20 2flf n ALA 89 Cb 0.42 0.51 -0.04 0.00 0.00 0.00 0.00 19.45 20.34 2flf n ALA 89 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2flf n HIS 90 N -0.79 2.24 -1.65 0.00 8.25 0.31 -1.49 115.22 122.08 2flf n HIS 90 Ca -0.06 -3.91 -0.41 0.00 -0.26 0.00 0.00 57.72 53.08 2flf n HIS 90 Cb 0.29 -0.46 -0.03 0.00 1.12 0.00 0.00 29.99 30.91 2flf n HIS 90 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2flf s PRO 91 N -2.88 2.81 0.00 -0.41 0.04 -1.23 -4.69 135.00 128.63 2flf s PRO 91 Ca 0.44 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.20 2flf s PRO 91 Cb 0.30 -4.42 0.00 0.00 0.04 0.00 0.00 34.50 30.41 2flf s PRO 91 CO -0.11 -2.47 0.82 0.54 0.04 0.00 0.00 177.00 175.82 2flf n ARG 92 N 8.83 0.00 -0.32 4.56 1.74 -1.26 -0.58 116.66 129.63 2flf n ARG 92 Ca 0.31 0.72 0.13 0.00 -0.77 0.00 0.00 57.85 58.24 2flf n ARG 92 Cb 0.48 -1.32 0.32 0.00 -1.02 0.00 0.00 32.46 30.92 2flf n ARG 92 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2flf h VAL 93 N 0.00 0.57 0.22 1.55 2.07 -1.94 -1.45 116.25 117.26 2flf h VAL 93 Ca 0.00 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.35 2flf h VAL 93 Cb 0.00 -0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 29.72 2flf h VAL 93 CO 0.00 0.10 -0.45 0.00 0.02 0.00 0.00 177.57 177.23 2flf h ALA 94 N 1.68 -0.88 -0.54 1.67 0.00 -1.65 -2.45 119.26 117.09 2flf h ALA 94 Ca 0.57 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.47 2flf h ALA 94 Cb 1.01 0.73 -0.08 0.00 0.00 0.00 0.00 17.79 19.45 2flf h ALA 94 CO -0.47 -1.05 0.06 0.28 0.00 0.00 0.00 179.25 178.07 2flf h VAL 95 N -0.76 0.62 0.05 0.00 2.07 0.20 -2.89 116.25 115.54 2flf h VAL 95 Ca -0.01 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.48 2flf h VAL 95 Cb 0.74 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 30.88 2flf h VAL 95 CO -0.20 0.03 -0.48 0.00 0.02 0.00 0.00 177.57 176.95 2flf h ALA 96 N 1.46 -0.83 -0.12 1.67 0.00 -0.98 -1.64 119.26 118.82 2flf h ALA 96 Ca 0.28 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.15 2flf h ALA 96 Cb 0.42 0.83 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2flf h ALA 96 CO -0.41 -1.04 0.14 -0.07 0.00 0.00 0.00 179.25 177.87 2flf h LEU 97 N -0.66 0.00 -0.25 0.00 3.38 -1.28 -2.69 115.31 113.81 2flf h LEU 97 Ca 0.02 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.02 2flf h LEU 97 Cb 0.71 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 2flf h LEU 97 CO -0.31 0.00 0.07 0.28 0.09 0.00 0.00 178.44 178.57 2flf h SER 98 N 0.00 0.07 -0.58 -0.43 0.02 -1.10 -2.75 113.55 108.78 2flf h SER 98 Ca 0.06 0.03 0.17 0.00 -0.84 0.00 0.00 61.79 61.20 2flf h SER 98 Cb 0.34 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 2flf h SER 98 CO -0.00 0.07 1.00 -0.26 -1.14 0.00 0.00 176.83 176.50 2flf h PHE 99 N 0.18 0.00 0.00 3.45 -1.00 -1.50 -3.09 116.94 114.98 2flf h PHE 99 Ca 0.11 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.89 2flf h PHE 99 Cb 0.09 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.65 2flf h PHE 99 CO -0.14 0.00 -0.09 0.72 -1.61 0.00 0.00 178.31 177.19 2flf n HIS 100 N -3.05 0.00 -1.00 -0.55 8.25 -1.06 -5.04 115.22 112.78 2flf n HIS 100 Ca 0.13 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.24 2flf n HIS 100 Cb 1.18 -0.05 0.10 0.00 1.12 0.00 0.00 29.99 32.34 2flf n HIS 100 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2flf n LEU 101 N -2.73 0.12 -0.01 2.41 4.77 -1.12 -4.91 117.00 115.52 2flf n LEU 101 Ca -0.01 0.44 0.10 0.00 -0.03 0.00 0.00 56.01 56.50 2flf n LEU 101 Cb 0.05 -1.20 -0.15 0.00 -2.33 0.00 0.00 43.42 39.79 2flf n LEU 101 CO 0.02 -3.46 -0.64 -1.54 -1.33 0.00 0.00 177.39 170.44 2flf n SER 102 N -0.79 0.51 -3.76 -1.43 3.41 -1.26 -4.81 113.62 105.49 2flf n SER 102 Ca 0.08 -0.14 -0.10 0.00 -0.26 0.00 0.00 58.87 58.45 2flf n SER 102 Cb 0.52 1.78 -0.06 0.00 -0.26 0.00 0.00 64.21 66.19 2flf n SER 102 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2flf s ARG 103 N -3.31 0.91 -0.34 4.33 3.00 -1.26 -1.18 118.95 121.10 2flf s ARG 103 Ca -0.05 -0.77 -0.00 0.00 0.00 0.00 0.00 55.73 54.90 2flf s ARG 103 Cb 0.13 0.39 0.08 0.00 0.00 0.00 0.00 34.95 35.55 2flf s ARG 103 CO 0.82 -0.32 0.07 -1.17 0.00 0.00 0.00 175.30 174.71 2flf s LEU 104 N -2.66 4.52 -0.54 2.53 2.96 0.60 -4.91 118.68 121.18 2flf s LEU 104 Ca 0.02 -1.74 -0.18 0.00 -0.22 0.00 0.00 54.13 52.01 2flf s LEU 104 Cb 0.03 -1.72 0.10 0.00 0.50 0.00 0.00 46.19 45.09 2flf s LEU 104 CO -0.10 -0.38 0.58 -0.13 -1.32 0.00 0.00 176.35 175.00 2flf s ARG 105 N 1.12 3.03 0.54 1.98 0.52 -1.26 -2.39 118.95 122.49 2flf s ARG 105 Ca 0.03 -1.34 -0.21 0.00 -0.52 0.00 0.00 55.73 53.68 2flf s ARG 105 Cb -0.21 -4.22 -0.05 0.00 0.52 0.00 0.00 34.95 31.00 2flf s ARG 105 CO -0.04 -1.33 1.29 -2.14 0.02 0.00 0.00 175.30 173.10 2flf s PRO 106 N 2.20 3.21 -0.21 3.54 0.02 -1.26 -4.95 135.00 137.54 2flf s PRO 106 Ca 0.09 2.07 0.12 0.00 0.02 0.00 0.00 61.00 63.29 2flf s PRO 106 Cb -0.25 -2.22 -0.22 0.00 0.02 0.00 0.00 34.50 31.83 2flf s PRO 106 CO 0.07 -1.08 0.00 1.28 -0.33 0.00 0.00 177.00 176.94 2flf n LEU 107 N -1.05 1.10 -4.76 -5.54 4.77 -1.26 -4.59 117.00 105.67 2flf n LEU 107 Ca 0.11 -0.02 -0.41 0.00 -0.03 0.00 0.00 56.01 55.65 2flf n LEU 107 Cb 0.46 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.51 2flf n LEU 107 CO 0.50 0.65 1.12 1.51 -1.33 0.00 0.00 177.39 179.85 2flf s ASP 108 N -5.90 6.51 0.24 -1.43 3.84 -1.26 -4.87 116.67 113.81 2flf s ASP 108 Ca -0.18 2.86 -0.06 0.00 -0.00 0.00 0.00 52.55 55.16 2flf s ASP 108 Cb 0.07 -2.64 0.45 0.00 -1.38 0.00 0.00 42.92 39.41 2flf s ASP 108 CO 0.75 -0.77 1.65 0.25 -0.00 0.00 0.00 175.17 177.05 2flf h LEU 109 N 4.06 -0.21 0.03 2.11 5.85 -1.98 -2.12 115.31 123.04 2flf h LEU 109 Ca -0.48 0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.44 2flf h LEU 109 Cb 1.23 0.29 -0.05 0.00 0.37 0.00 0.00 40.66 42.49 2flf h LEU 109 CO 0.72 -0.13 -0.38 -0.08 -0.34 0.00 0.00 178.44 178.23 2flf h GLU 110 N 0.16 -0.53 -0.72 1.25 4.81 -1.99 0.20 114.58 117.76 2flf h GLU 110 Ca 0.41 0.04 0.13 0.00 -0.13 0.00 0.00 59.36 59.80 2flf h GLU 110 Cb 0.72 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.18 2flf h GLU 110 CO -0.60 -0.35 0.48 0.78 -0.73 0.00 0.00 179.01 178.59 2flf h GLY 111 N -0.55 0.75 2.00 1.92 0.00 -1.74 -1.47 103.07 103.98 2flf h GLY 111 Ca 0.05 -0.20 -0.14 0.00 0.00 0.00 0.00 47.33 47.03 2flf h GLY 111 CO -0.28 0.09 -0.68 1.46 0.00 0.00 0.00 176.54 177.13 2flf h GLN 112 N 0.48 0.00 -0.03 4.80 4.20 -0.41 1.00 115.11 125.15 2flf h GLN 112 Ca 0.35 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.90 2flf h GLN 112 Cb 0.69 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 2flf h GLN 112 CO -0.11 0.68 -0.71 1.25 -0.67 0.00 0.00 178.83 179.26 2flf h HIS 113 N 0.00 0.22 0.00 2.96 2.76 0.41 -3.24 115.15 118.26 2flf h HIS 113 Ca -0.01 -0.10 -0.13 0.00 -2.20 0.00 0.00 60.37 57.93 2flf h HIS 113 Cb 1.27 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 30.18 2flf h HIS 113 CO 0.00 0.82 -1.49 0.66 -1.30 0.00 0.00 177.93 176.62 2flf n TYR 114 N -3.76 0.00 -1.90 5.26 4.01 -1.10 -4.71 117.16 114.96 2flf n TYR 114 Ca -0.02 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.40 2flf n TYR 114 Cb 0.69 -0.33 0.04 0.00 -0.31 0.00 0.00 39.34 39.43 2flf n TYR 114 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2flf n LEU 115 N -2.80 6.30 0.00 7.72 4.77 0.34 -4.77 117.00 128.55 2flf n LEU 115 Ca -0.15 -4.74 0.00 0.00 -0.03 0.00 0.00 56.01 51.08 2flf n LEU 115 Cb 0.66 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2flf n LEU 115 CO 0.08 1.87 0.00 0.29 -1.33 0.00 0.00 177.39 178.30 2flf n LYS 116 N -0.68 0.00 -4.18 3.23 5.02 -1.17 -3.97 118.16 116.41 2flf n LYS 116 Ca 0.51 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.61 2flf n LYS 116 Cb 0.64 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 35.49 2flf n LYS 116 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2flf s GLU 117 N -3.52 0.65 -0.37 1.97 2.12 -1.26 -4.44 118.70 113.86 2flf s GLU 117 Ca 0.00 -0.15 -0.01 0.00 0.36 0.00 0.00 54.97 55.18 2flf s GLU 117 Cb 0.00 -0.66 0.10 0.00 0.26 0.00 0.00 34.13 33.83 2flf s GLU 117 CO 0.00 0.01 0.12 0.08 -0.54 0.00 0.00 175.26 174.94 2flf s VAL 118 N 0.45 2.96 0.38 3.70 1.01 -1.01 -4.78 120.40 123.12 2flf s VAL 118 Ca -0.06 -2.00 -0.26 0.00 0.00 0.00 0.00 61.98 59.66 2flf s VAL 118 Cb -0.09 -3.00 -0.09 0.00 0.00 0.00 0.00 36.38 33.20 2flf s VAL 118 CO -0.00 -0.55 1.25 -2.16 0.00 0.00 0.00 175.10 173.64 2flf s PRO 119 N 1.10 4.09 -0.17 2.72 0.04 -1.25 -0.29 135.00 141.23 2flf s PRO 119 Ca 0.06 2.04 -0.07 0.00 0.04 0.00 0.00 61.00 63.08 2flf s PRO 119 Cb -0.21 -2.80 -0.04 0.00 0.04 0.00 0.00 34.50 31.48 2flf s PRO 119 CO -0.05 -0.35 0.05 0.08 0.04 0.00 0.00 177.00 176.77 2flf s VAL 120 N -1.28 4.68 0.16 -0.36 1.01 -0.33 -0.75 120.40 123.53 2flf s VAL 120 Ca 0.55 -0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.53 2flf s VAL 120 Cb -0.36 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 2flf s VAL 120 CO 0.46 0.48 -0.04 -0.76 0.00 0.00 0.00 175.10 175.24 2flf s LEU 121 N 0.25 3.19 -0.03 3.92 1.43 0.38 -4.83 118.68 123.00 2flf s LEU 121 Ca 0.03 -0.43 0.08 0.00 -1.03 0.00 0.00 54.13 52.77 2flf s LEU 121 Cb -0.12 -1.88 -0.02 0.00 0.03 0.00 0.00 46.19 44.20 2flf s LEU 121 CO 0.01 0.11 -0.26 0.00 0.23 0.00 0.00 176.35 176.44 2flf s ALA 122 N -1.63 2.14 1.25 4.21 0.00 -1.26 -0.58 121.76 125.89 2flf s ALA 122 Ca 0.26 -1.10 -0.14 0.00 0.00 0.00 0.00 51.96 50.98 2flf s ALA 122 Cb -0.10 -0.57 0.22 0.00 0.00 0.00 0.00 23.12 22.67 2flf s ALA 122 CO 0.17 0.50 0.58 -0.35 0.00 0.00 0.00 175.76 176.66 2flf n PRO 123 N 2.55 -3.30 -2.52 0.00 -0.04 -1.26 -5.02 135.00 125.41 2flf n PRO 123 Ca -0.16 -0.96 -0.40 0.00 -0.04 0.00 0.00 63.50 61.94 2flf n PRO 123 Cb 0.51 -1.11 -0.03 0.00 -0.04 0.00 0.00 33.50 32.83 2flf n PRO 123 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2flf s ALA 128 N -2.39 2.65 0.14 0.55 0.00 -1.26 -5.12 121.76 116.33 2flf s ALA 128 Ca 0.42 -1.99 0.06 0.00 0.00 0.00 0.00 51.96 50.44 2flf s ALA 128 Cb -0.06 -4.47 -0.04 0.00 0.00 0.00 0.00 23.12 18.55 2flf s ALA 128 CO 0.34 -3.62 -0.13 0.95 0.00 0.00 0.00 175.76 173.31 2flf s THR 129 N 5.49 1.30 -1.27 0.00 -4.23 -1.26 -5.00 115.64 110.67 2flf s THR 129 Ca 0.45 -1.85 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 2flf s THR 129 Cb -0.02 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.16 2flf s THR 129 CO -0.03 -0.53 0.59 -0.62 -0.54 0.00 0.00 174.62 173.48 2flf n GLU 130 N 0.25 0.00 -0.07 3.99 -0.58 -1.26 -1.68 120.64 121.29 2flf n GLU 130 Ca -0.13 0.15 -0.06 0.00 -0.42 0.00 0.00 57.16 56.70 2flf n GLU 130 Cb 0.58 -1.54 -0.03 0.00 -0.57 0.00 0.00 31.44 29.88 2flf n GLU 130 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 2flf h GLU 131 N 0.00 0.00 -0.85 3.49 4.39 -2.00 -3.35 114.58 116.26 2flf h GLU 131 Ca 0.00 0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.81 2flf h GLU 131 Cb 0.08 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.67 2flf h GLU 131 CO 0.00 0.16 0.55 0.00 -1.16 0.00 0.00 179.01 178.56 2flf h ALA 132 N -0.89 1.77 0.08 3.43 0.00 -1.73 -2.72 119.26 119.21 2flf h ALA 132 Ca -0.04 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2flf h ALA 132 Cb 0.47 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 2flf h ALA 132 CO -0.02 0.04 -0.36 0.00 0.00 0.00 0.00 179.25 178.90 2flf h ALA 133 N 1.59 -0.60 -0.93 0.00 0.00 -1.67 0.04 119.26 117.70 2flf h ALA 133 Ca 0.40 -0.05 0.21 0.00 0.00 0.00 0.00 54.91 55.47 2flf h ALA 133 Cb 0.54 0.61 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 2flf h ALA 133 CO -0.17 -0.90 0.61 -0.07 0.00 0.00 0.00 179.25 178.71 2flf h LEU 134 N -0.57 0.44 0.00 0.00 3.38 -1.62 0.12 115.31 117.07 2flf h LEU 134 Ca 0.04 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2flf h LEU 134 Cb 0.61 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2flf h LEU 134 CO -0.24 0.17 0.00 -1.20 0.09 0.00 0.00 178.44 177.26 2flf n SER 135 N -4.54 0.00 -0.21 -0.43 7.64 -0.11 -2.19 113.62 113.78 2flf n SER 135 Ca 0.20 0.50 0.15 0.00 1.01 0.00 0.00 58.87 60.73 2flf n SER 135 Cb 0.71 -0.05 0.28 0.00 -1.01 0.00 0.00 64.21 64.14 2flf n SER 135 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2flf n VAL 136 N -0.64 -0.27 0.00 0.44 0.31 -0.53 -1.58 118.33 116.06 2flf n VAL 136 Ca 0.00 1.34 0.00 0.00 -0.01 0.00 0.00 64.34 65.67 2flf n VAL 136 Cb 0.00 -2.06 0.00 0.00 -0.91 0.00 0.00 33.84 30.87 2flf n VAL 136 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2flf n ALA 137 N -2.94 0.00 -0.29 3.52 0.00 0.40 -1.46 120.51 119.73 2flf n ALA 137 Ca 0.19 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.74 2flf n ALA 137 Cb 0.65 0.05 0.21 0.00 0.00 0.00 0.00 19.45 20.36 2flf n ALA 137 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2flf n GLU 138 N -0.32 -0.07 -0.12 0.00 1.02 -0.62 0.12 120.64 120.65 2flf n GLU 138 Ca 0.00 1.25 -0.05 0.00 -0.02 0.00 0.00 57.16 58.35 2flf n GLU 138 Cb 0.00 -1.96 0.03 0.00 -0.02 0.00 0.00 31.44 29.49 2flf n GLU 138 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2flf h ALA 139 N 1.65 0.35 0.00 0.62 0.00 -1.44 0.33 119.26 120.78 2flf h ALA 139 Ca 0.47 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.50 2flf h ALA 139 Cb 0.92 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2flf h ALA 139 CO -0.80 -0.40 0.00 1.28 0.00 0.00 0.00 179.25 179.33 2flf n LEU 140 N -5.21 0.04 -0.08 0.00 4.77 0.32 -2.03 117.00 114.80 2flf n LEU 140 Ca 0.03 -0.02 -0.18 0.00 -0.03 0.00 0.00 56.01 55.81 2flf n LEU 140 Cb 0.21 -0.02 -0.12 0.00 -2.33 0.00 0.00 43.42 41.16 2flf n LEU 140 CO 0.19 0.01 -0.01 -0.09 -1.33 0.00 0.00 177.39 176.15 2flf h ARG 141 N 0.05 0.00 -0.01 3.23 2.43 -0.20 -3.38 114.38 116.50 2flf h ARG 141 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2flf h ARG 141 Cb 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2flf h ARG 141 CO 0.00 1.00 -0.73 0.39 -1.51 0.00 0.00 179.97 179.12 2flf n GLU 142 N -4.52 0.59 -4.51 0.20 -0.58 -1.16 -4.90 120.64 105.76 2flf n GLU 142 Ca -0.20 -0.49 -0.25 0.00 -0.42 0.00 0.00 57.16 55.81 2flf n GLU 142 Cb 0.57 -1.49 -0.10 0.00 -0.57 0.00 0.00 31.44 29.85 2flf n GLU 142 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2flf s HIS 143 N -2.74 2.30 -0.57 -0.32 3.76 -0.86 -5.05 115.29 111.81 2flf s HIS 143 Ca 0.13 -0.49 0.14 0.00 -0.15 0.00 0.00 55.06 54.69 2flf s HIS 143 Cb 0.17 -1.25 -0.16 0.00 1.11 0.00 0.00 32.58 32.46 2flf s HIS 143 CO 0.72 0.57 0.55 0.54 -0.85 0.00 0.00 174.74 176.26 2flf n ARG 144 N -0.72 2.25 -3.69 1.40 1.74 -1.26 -4.43 116.66 111.96 2flf n ARG 144 Ca -0.05 -0.02 -0.14 0.00 -0.77 0.00 0.00 57.85 56.88 2flf n ARG 144 Cb 0.63 -1.17 -0.09 0.00 -1.02 0.00 0.00 32.46 30.81 2flf n ARG 144 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2flf s ALA 145 N -2.37 -1.35 0.19 7.54 0.00 -1.26 -0.64 121.76 123.87 2flf s ALA 145 Ca 0.04 1.52 -0.03 0.00 0.00 0.00 0.00 51.96 53.49 2flf s ALA 145 Cb 0.10 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.32 2flf s ALA 145 CO 0.56 -0.26 0.16 0.00 0.00 0.00 0.00 175.76 176.22 2flf s LEU 147 N -3.12 1.62 -0.83 0.00 1.43 0.07 -0.38 118.68 117.48 2flf s LEU 147 Ca 0.33 -0.34 -0.15 0.00 -1.03 0.00 0.00 54.13 52.95 2flf s LEU 147 Cb 0.06 -0.90 0.20 0.00 0.03 0.00 0.00 46.19 45.58 2flf s LEU 147 CO 0.09 0.02 0.80 -0.22 0.23 0.00 0.00 176.35 177.27 2flf s LEU 148 N 0.84 6.53 -0.44 1.79 2.96 -0.88 0.14 118.68 129.62 2flf s LEU 148 Ca -0.11 -2.57 -0.26 0.00 -0.22 0.00 0.00 54.13 50.97 2flf s LEU 148 Cb -0.15 -2.23 -0.13 0.00 0.50 0.00 0.00 46.19 44.17 2flf s LEU 148 CO 0.02 -0.65 1.53 -1.14 -1.32 0.00 0.00 176.35 174.79 2flf n ARG 149 N 4.34 0.00 0.00 1.98 0.63 0.25 -1.96 116.66 121.90 2flf n ARG 149 Ca 0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 2flf n ARG 149 Cb 0.47 -0.99 0.00 0.00 0.45 0.00 0.00 32.46 32.39 2flf n ARG 149 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2flf n GLY 150 N 4.72 2.38 3.32 5.14 0.00 -1.26 -4.67 105.19 114.82 2flf n GLY 150 Ca 0.39 -0.76 -0.44 0.00 0.00 0.00 0.00 46.02 45.21 2flf n GLY 150 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2flf n HIS 151 N 0.00 5.18 -0.70 1.61 1.44 -0.83 -5.03 115.22 116.89 2flf n HIS 151 Ca 0.00 -3.91 0.09 0.00 -2.01 0.00 0.00 57.72 51.89 2flf n HIS 151 Cb 0.00 -1.66 -0.02 0.00 0.12 0.00 0.00 29.99 28.42 2flf n HIS 151 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2flf n GLY 152 N 2.62 -1.63 3.47 -1.39 0.00 -1.26 -4.73 105.19 102.26 2flf n GLY 152 Ca 0.24 -1.35 -0.24 0.00 0.00 0.00 0.00 46.02 44.67 2flf n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2flf s ALA 153 N -1.68 2.69 -0.10 4.61 0.00 -0.56 -2.07 121.76 124.66 2flf s ALA 153 Ca 0.00 -1.88 0.04 0.00 0.00 0.00 0.00 51.96 50.11 2flf s ALA 153 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.91 2flf s ALA 153 CO 0.00 0.23 -0.22 -0.06 0.00 0.00 0.00 175.76 175.71 2flf s PHE 154 N -2.58 2.36 0.09 0.00 0.40 0.48 -2.34 117.98 116.39 2flf s PHE 154 Ca 0.30 -0.97 0.09 0.00 -0.60 0.00 0.00 56.93 55.75 2flf s PHE 154 Cb -0.04 -1.60 -0.04 0.00 0.51 0.00 0.00 43.02 41.86 2flf s PHE 154 CO 0.14 -0.40 -0.24 0.00 0.70 0.00 0.00 175.22 175.42 2flf s ALA 155 N 0.42 2.42 0.03 5.36 0.00 -0.23 -1.23 121.76 128.54 2flf s ALA 155 Ca -0.18 -1.34 0.09 0.00 0.00 0.00 0.00 51.96 50.53 2flf s ALA 155 Cb -0.17 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 2flf s ALA 155 CO 0.08 0.55 -0.25 0.08 0.00 0.00 0.00 175.76 176.21 2flf s VAL 156 N -0.97 2.21 0.20 0.00 1.01 0.18 -1.06 120.40 121.97 2flf s VAL 156 Ca 0.14 -1.31 0.05 0.00 0.00 0.00 0.00 61.98 60.85 2flf s VAL 156 Cb -0.10 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2flf s VAL 156 CO 0.05 0.40 0.26 -0.83 0.00 0.00 0.00 175.10 174.99 2flf s GLY 157 N -1.15 1.51 0.00 4.51 0.00 0.22 -4.23 107.32 108.18 2flf s GLY 157 Ca 0.12 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 43.64 2flf s GLY 157 CO 0.02 -1.21 0.00 1.04 0.00 0.00 0.00 173.10 172.95 2flf n LEU 158 N -0.87 0.00 -4.57 0.66 4.77 -1.26 -2.40 117.00 113.33 2flf n LEU 158 Ca -0.08 -0.03 -0.40 0.00 -0.03 0.00 0.00 56.01 55.46 2flf n LEU 158 Cb 0.56 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.67 2flf n LEU 158 CO 0.45 0.00 0.43 0.29 -1.33 0.00 0.00 177.39 177.24 2flf n LYS 159 N -0.12 1.04 -0.08 3.23 4.01 -1.26 -4.82 118.16 120.16 2flf n LYS 159 Ca 0.00 0.38 -0.07 0.00 -0.51 0.00 0.00 58.31 58.11 2flf n LYS 159 Cb 0.00 -1.93 -0.00 0.00 -0.51 0.00 0.00 35.03 32.59 2flf n LYS 159 CO 0.00 0.00 0.00 1.49 -1.11 0.00 0.00 177.40 177.78 2flf h GLU 160 N 1.09 0.17 -7.02 1.97 4.22 -2.00 -3.39 114.58 109.62 2flf h GLU 160 Ca -0.44 -0.01 -0.48 0.00 0.08 0.00 0.00 59.36 58.51 2flf h GLU 160 Cb 1.36 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 30.60 2flf h GLU 160 CO 0.54 0.11 0.40 0.00 -2.18 0.00 0.00 179.01 177.88 2flf s ALA 161 N -6.17 2.97 0.00 2.92 0.00 -1.26 -4.97 121.76 115.25 2flf s ALA 161 Ca -0.13 0.67 -0.16 0.00 0.00 0.00 0.00 51.96 52.34 2flf s ALA 161 Cb 0.11 -3.27 -0.09 0.00 0.00 0.00 0.00 23.12 19.87 2flf s ALA 161 CO 0.70 -0.29 0.90 -1.00 0.00 0.00 0.00 175.76 176.07 2flf h PRO 162 N 2.00 -0.55 -1.04 0.00 0.13 -1.90 -2.47 132.00 128.17 2flf h PRO 162 Ca -0.49 0.04 0.31 0.00 -0.87 0.00 0.00 66.00 64.99 2flf h PRO 162 Cb 1.22 0.13 -0.14 0.00 0.13 0.00 0.00 31.00 32.34 2flf h PRO 162 CO 0.60 -0.37 0.61 1.05 -0.23 0.00 0.00 178.00 179.67 2flf h GLU 163 N -0.79 0.34 0.00 0.86 9.09 -1.91 -1.58 114.58 120.59 2flf h GLU 163 Ca -0.06 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.33 2flf h GLU 163 Cb 0.44 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 27.46 2flf h GLU 163 CO 0.10 0.23 0.00 0.39 0.05 0.00 0.00 179.01 179.77 2flf n GLU 164 N -4.94 0.00 -0.09 1.06 -0.58 -1.21 -2.90 120.64 111.97 2flf n GLU 164 Ca 0.31 0.11 0.09 0.00 -0.42 0.00 0.00 57.16 57.25 2flf n GLU 164 Cb 0.98 -1.03 0.17 0.00 -0.57 0.00 0.00 31.44 30.99 2flf n GLU 164 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2flf n ALA 165 N -0.83 0.30 0.00 0.62 0.00 -0.88 0.19 120.51 119.92 2flf n ALA 165 Ca 0.00 0.30 -0.12 0.00 0.00 0.00 0.00 53.44 53.61 2flf n ALA 165 Cb 0.00 -0.30 -0.08 0.00 0.00 0.00 0.00 19.45 19.07 2flf n ALA 165 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2flf h LEU 166 N 0.00 0.03 -0.75 0.00 5.85 -1.25 -1.19 115.31 118.00 2flf h LEU 166 Ca 0.25 -0.27 -0.12 0.00 0.84 0.00 0.00 57.88 58.58 2flf h LEU 166 Cb 0.66 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 2flf h LEU 166 CO -0.22 0.29 -0.38 -0.07 -0.34 0.00 0.00 178.44 177.72 2flf h LEU 167 N -0.23 0.54 -0.08 2.25 3.38 0.22 0.79 115.31 122.19 2flf h LEU 167 Ca 0.01 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.76 2flf h LEU 167 Cb 0.27 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2flf h LEU 167 CO 0.00 0.86 -0.00 -0.08 0.09 0.00 0.00 178.44 179.31 2flf h GLU 168 N 0.43 0.02 -0.41 1.13 4.81 -1.35 0.22 114.58 119.42 2flf h GLU 168 Ca 0.04 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 2flf h GLU 168 Cb 0.85 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.21 2flf h GLU 168 CO 0.07 0.01 0.02 0.00 -0.73 0.00 0.00 179.01 178.39 2flf h ALA 169 N 1.07 1.27 -0.41 2.92 0.00 -0.99 -1.31 119.26 121.81 2flf h ALA 169 Ca 0.04 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 2flf h ALA 169 Cb 0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2flf h ALA 169 CO -0.06 0.49 -0.14 -0.92 0.00 0.00 0.00 179.25 178.61 2flf h TYR 170 N 0.62 0.83 -0.63 0.00 5.03 -0.14 -2.76 116.97 119.92 2flf h TYR 170 Ca 0.13 -0.16 -0.01 0.00 2.58 0.00 0.00 58.73 61.26 2flf h TYR 170 Cb 0.35 -0.21 -0.03 0.00 1.55 0.00 0.00 36.73 38.39 2flf h TYR 170 CO 0.02 0.85 0.33 0.78 -1.32 0.00 0.00 178.16 178.82 2flf h GLY 171 N 0.97 0.95 1.63 1.82 0.00 0.50 -1.66 103.07 107.29 2flf h GLY 171 Ca 0.11 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2flf h GLY 171 CO 0.04 0.42 0.23 1.41 0.00 0.00 0.00 176.54 178.65 2flf h LEU 172 N 0.86 0.43 -0.31 3.11 3.38 -1.08 0.48 115.31 122.17 2flf h LEU 172 Ca 0.22 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 2flf h LEU 172 Cb 0.06 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2flf h LEU 172 CO -0.03 0.32 -0.17 -0.03 0.09 0.00 0.00 178.44 178.62 2flf h MET 173 N 0.51 0.67 -0.71 1.13 4.05 -1.10 0.32 114.93 119.79 2flf h MET 173 Ca 0.14 -0.30 0.06 0.00 -0.28 0.00 0.00 59.70 59.32 2flf h MET 173 Cb -0.04 -0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 30.69 2flf h MET 173 CO -0.03 0.89 0.40 1.15 0.23 0.00 0.00 176.91 179.55 2flf h THR 174 N 0.42 0.97 0.00 -0.77 2.02 -0.20 -0.57 112.91 114.78 2flf h THR 174 Ca 0.07 -0.25 -0.10 0.00 0.77 0.00 0.00 66.41 66.89 2flf h THR 174 Cb 0.70 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2flf h THR 174 CO 0.05 0.13 -0.50 0.74 0.37 0.00 0.00 175.52 176.32 2flf h THR 175 N 0.73 1.09 0.55 3.16 2.02 0.22 -3.04 112.91 117.63 2flf h THR 175 Ca 0.32 -1.88 -0.03 0.00 0.77 0.00 0.00 66.41 65.60 2flf h THR 175 Cb 0.21 2.09 0.01 0.00 -1.74 0.00 0.00 68.15 68.72 2flf h THR 175 CO -0.19 0.49 -0.26 0.25 0.37 0.00 0.00 175.52 176.17 2flf h LEU 176 N 0.00 -0.62 0.16 2.58 5.85 0.13 -2.21 115.31 121.19 2flf h LEU 176 Ca -0.00 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2flf h LEU 176 Cb 1.06 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 2flf h LEU 176 CO 0.06 -0.45 -0.27 -0.33 -0.34 0.00 0.00 178.44 177.12 2flf h GLU 177 N -0.74 -0.43 -1.69 1.25 4.39 -1.49 -1.32 114.58 114.55 2flf h GLU 177 Ca -0.08 0.03 0.50 0.00 0.34 0.00 0.00 59.36 60.16 2flf h GLU 177 Cb 0.57 0.10 -0.09 0.00 -0.10 0.00 0.00 28.75 29.23 2flf h GLU 177 CO 0.12 -0.29 1.19 1.49 -1.16 0.00 0.00 179.01 180.36 2flf h GLU 178 N -0.45 0.02 0.00 2.33 4.81 -1.54 1.41 114.58 121.16 2flf h GLU 178 Ca -0.02 -0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.03 2flf h GLU 178 Cb 0.42 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 2flf h GLU 178 CO -0.09 0.01 -1.19 0.77 -0.73 0.00 0.00 179.01 177.78 2flf h SER 179 N 0.02 0.00 -0.03 1.04 0.02 -0.90 -2.81 113.55 110.89 2flf h SER 179 Ca 0.85 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.78 2flf h SER 179 Cb 3.23 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 65.77 2flf h SER 179 CO -0.11 0.70 -0.04 0.00 -1.14 0.00 0.00 176.83 176.24 2flf h ALA 180 N 1.30 0.05 -1.00 3.77 0.00 0.29 -1.81 119.26 121.86 2flf h ALA 180 Ca -0.12 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.53 2flf h ALA 180 Cb 1.64 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.37 2flf h ALA 180 CO 0.07 -0.16 0.66 1.96 0.00 0.00 0.00 179.25 181.78 2flf h GLN 181 N -0.39 1.29 -0.72 0.00 4.20 -0.95 0.66 115.11 119.20 2flf h GLN 181 Ca 0.00 -0.08 -0.06 0.00 0.06 0.00 0.00 58.65 58.58 2flf h GLN 181 Cb 0.55 -0.29 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 2flf h GLN 181 CO 0.01 0.85 0.22 0.82 -0.67 0.00 0.00 178.83 180.06 2flf h ILE 182 N 1.33 1.26 -0.24 2.54 2.04 -1.44 0.10 117.51 123.10 2flf h ILE 182 Ca 0.37 -0.90 -0.09 0.00 1.00 0.00 0.00 64.86 65.24 2flf h ILE 182 Cb -0.11 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 2flf h ILE 182 CO -0.09 0.35 -0.24 -0.07 0.00 0.00 0.00 178.15 178.10 2flf h LEU 183 N 1.07 0.45 0.00 1.44 3.38 -0.30 0.29 115.31 121.64 2flf h LEU 183 Ca 0.23 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2flf h LEU 183 Cb 0.31 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2flf h LEU 183 CO -0.01 0.69 0.00 -0.11 0.09 0.00 0.00 178.44 179.10 2flf n LEU 184 N -4.13 0.44 -0.31 1.67 7.94 0.22 -1.71 117.00 121.11 2flf n LEU 184 Ca -0.00 0.48 0.15 0.00 -1.11 0.00 0.00 56.01 55.53 2flf n LEU 184 Cb 0.39 -0.07 0.31 0.00 0.53 0.00 0.00 43.42 44.58 2flf n LEU 184 CO 0.41 -0.07 0.90 1.88 -1.11 0.00 0.00 177.39 179.40 2flf h TYR 185 N 0.00 0.23 -0.97 1.96 0.99 -0.89 0.78 116.97 119.07 2flf h TYR 185 Ca 0.00 0.06 0.10 0.00 2.00 0.00 0.00 58.73 60.88 2flf h TYR 185 Cb 0.00 0.05 -0.08 0.00 1.00 0.00 0.00 36.73 37.70 2flf h TYR 185 CO 0.03 -0.32 0.61 1.25 -0.00 0.00 0.00 178.16 179.72 2flf h HIS 186 N 0.11 1.11 0.00 4.88 2.76 -0.48 -2.75 115.15 120.78 2flf h HIS 186 Ca 0.59 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.79 2flf h HIS 186 Cb 1.24 -0.36 0.00 0.00 1.55 0.00 0.00 27.41 29.85 2flf h HIS 186 CO -0.33 0.49 0.00 -2.13 -1.30 0.00 0.00 177.93 174.66 2flf n ARG 187 N -4.60 0.00 0.00 5.26 3.00 0.27 -3.15 116.66 117.43 2flf n ARG 187 Ca 0.17 0.49 0.00 0.00 -0.00 0.00 0.00 57.85 58.51 2flf n ARG 187 Cb 0.28 -1.42 0.00 0.00 0.00 0.00 0.00 32.46 31.33 2flf n ARG 187 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2flf n LEU 188 N -1.98 0.00 0.00 6.15 4.77 -0.77 0.23 117.00 125.40 2flf n LEU 188 Ca 0.00 0.71 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 2flf n LEU 188 Cb 0.00 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 2flf n LEU 188 CO 0.00 -0.35 0.12 1.87 -1.33 0.00 0.00 177.39 177.69 2flf n TRP 189 N -2.70 0.00 -0.24 -1.77 -0.00 -1.05 0.96 117.44 112.63 2flf n TRP 189 Ca 0.00 0.00 0.32 0.00 -0.00 0.00 0.00 57.50 57.82 2flf n TRP 189 Cb 0.00 0.00 0.70 0.00 -0.00 0.00 0.00 31.31 32.01 2flf n TRP 189 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 177.69 178.06 2flf h GLN 190 N 0.00 0.00 0.00 5.87 4.15 -1.50 -2.39 115.11 121.24 2flf h GLN 190 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2flf h GLN 190 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2flf h GLN 190 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 178.83 177.31 2flf n GLY 191 N -1.71 -0.85 2.38 2.39 0.00 0.63 -3.99 105.19 104.05 2flf n GLY 191 Ca 0.23 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.16 2flf n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2flf n ALA 192 N -3.00 3.49 -1.54 4.61 0.00 0.27 -4.76 120.51 119.59 2flf n ALA 192 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.45 2flf n ALA 192 Cb 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.02 2flf n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2flf n GLY 193 N 3.04 1.24 0.00 0.00 0.00 -0.91 -4.88 105.19 103.68 2flf n GLY 193 Ca 0.23 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 45.09 2flf n GLY 193 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77