#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 0.30 2.12 2.47 -2.04 -2.59 114.38 114.64 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 -0.14 0.00 0.56 0.00 0.00 179.97 180.39 2flf h ALA 3 N 0.03 -1.04 0.00 0.04 0.00 -2.06 -3.06 119.26 113.17 2flf h ALA 3 Ca 0.00 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 2flf h ALA 3 Cb 1.51 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 2flf h ALA 3 CO 0.00 -1.01 -0.79 0.00 0.00 0.00 0.00 179.25 177.45 2flf h ARG 4 N -0.42 0.00 0.64 0.00 -0.00 -1.91 -3.29 114.38 109.40 2flf h ARG 4 Ca -0.04 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.41 2flf h ARG 4 Cb 0.31 0.00 0.01 0.00 0.00 0.00 0.00 29.97 30.28 2flf h ARG 4 CO 0.07 0.79 -0.31 1.25 0.00 0.00 0.00 179.97 181.77 2flf h LEU 5 N 0.00 -0.73 -1.69 3.04 5.85 -1.68 -2.11 115.31 117.99 2flf h LEU 5 Ca -0.01 0.03 0.23 0.00 0.84 0.00 0.00 57.88 58.97 2flf h LEU 5 Cb 1.49 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 42.65 2flf h LEU 5 CO 0.10 -0.44 0.62 0.22 -0.34 0.00 0.00 178.44 178.60 2flf h TYR 6 N -1.02 0.33 -0.54 1.25 3.20 -1.70 0.49 116.97 118.98 2flf h TYR 6 Ca -0.09 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.72 2flf h TYR 6 Cb 0.66 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.81 2flf h TYR 6 CO 0.04 0.08 0.06 0.00 -1.64 0.00 0.00 178.16 176.70 2flf h ALA 7 N 1.59 1.09 -0.15 1.82 0.00 -1.60 -1.00 119.26 121.02 2flf h ALA 7 Ca 0.46 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 2flf h ALA 7 Cb 1.41 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2flf h ALA 7 CO -0.12 0.59 -0.29 0.00 0.00 0.00 0.00 179.25 179.42 2flf h ALA 8 N 1.24 0.24 0.03 0.00 0.00 0.62 -1.40 119.26 120.00 2flf h ALA 8 Ca 0.17 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2flf h ALA 8 Cb 0.40 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2flf h ALA 8 CO 0.01 0.25 -0.02 0.74 0.00 0.00 0.00 179.25 180.24 2flf h PHE 9 N 0.08 -0.04 0.02 0.00 -1.00 -1.06 0.58 116.94 115.52 2flf h PHE 9 Ca 0.01 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.81 2flf h PHE 9 Cb 0.88 0.01 -0.04 0.00 3.61 0.00 0.00 35.95 40.42 2flf h PHE 9 CO 0.10 0.12 -0.22 -0.09 -1.61 0.00 0.00 178.31 176.61 2flf h ARG 10 N -0.20 -0.34 0.09 1.51 2.43 -1.25 -2.13 114.38 114.48 2flf h ARG 10 Ca -0.00 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2flf h ARG 10 Cb 0.18 0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.76 2flf h ARG 10 CO 0.01 -0.23 -0.48 0.37 -1.51 0.00 0.00 179.97 178.13 2flf h GLN 11 N -0.36 -0.66 -0.93 0.20 4.15 -1.11 -1.42 115.11 114.98 2flf h GLN 11 Ca 0.05 0.05 0.23 0.00 0.77 0.00 0.00 58.65 59.75 2flf h GLN 11 Cb 0.43 0.15 -0.12 0.00 0.21 0.00 0.00 27.48 28.14 2flf h GLN 11 CO -0.19 -0.44 0.46 0.28 -1.93 0.00 0.00 178.83 177.02 2flf h VAL 12 N -0.69 0.51 -0.35 2.39 2.07 -0.67 -0.28 116.25 119.23 2flf h VAL 12 Ca 0.02 -0.16 -0.15 0.00 0.82 0.00 0.00 66.70 67.22 2flf h VAL 12 Cb 0.72 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2flf h VAL 12 CO -0.29 0.09 -0.38 1.23 0.02 0.00 0.00 177.57 178.24 2flf h GLY 13 N 0.47 0.94 0.75 2.17 0.00 -0.80 -0.21 103.07 106.40 2flf h GLY 13 Ca 0.58 -0.99 0.03 0.00 0.00 0.00 0.00 47.33 46.96 2flf h GLY 13 CO -0.50 0.89 0.03 0.83 0.00 0.00 0.00 176.54 177.79 2flf h GLU 14 N 0.66 0.10 0.32 4.80 5.08 -0.03 -2.42 114.58 123.10 2flf h GLU 14 Ca 0.05 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 2flf h GLU 14 Cb 0.97 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.20 2flf h GLU 14 CO 0.09 0.07 -0.15 -0.44 -1.00 0.00 0.00 179.01 177.58 2flf h ASP 15 N 0.10 -0.36 -1.02 1.42 3.45 -1.21 -0.70 116.42 118.11 2flf h ASP 15 Ca 0.09 -0.17 0.25 0.00 0.43 0.00 0.00 57.03 57.63 2flf h ASP 15 Cb 0.10 0.09 -0.12 0.00 -0.56 0.00 0.00 39.33 38.84 2flf h ASP 15 CO -0.13 0.01 0.62 -0.07 -1.57 0.00 0.00 179.24 178.09 2flf h LEU 16 N -0.79 0.62 0.30 1.55 3.38 -1.02 0.16 115.31 119.51 2flf h LEU 16 Ca -0.04 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2flf h LEU 16 Cb 0.51 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2flf h LEU 16 CO 0.07 0.10 -0.14 0.15 0.09 0.00 0.00 178.44 178.71 2flf h PHE 17 N 0.53 -0.37 -0.57 1.13 3.57 -1.36 0.13 116.94 120.00 2flf h PHE 17 Ca 0.64 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 62.25 2flf h PHE 17 Cb 1.30 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 40.13 2flf h PHE 17 CO -0.01 -0.02 0.39 0.00 -2.23 0.00 0.00 178.31 176.45 2flf h ALA 18 N -0.50 2.23 -0.00 2.41 0.00 -0.12 -0.66 119.26 122.62 2flf h ALA 18 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2flf h ALA 18 Cb 0.51 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2flf h ALA 18 CO 0.07 -0.37 -0.21 1.04 0.00 0.00 0.00 179.25 179.78 2flf n GLN 19 N -4.44 0.07 -1.34 0.00 1.13 0.48 -4.93 117.38 108.34 2flf n GLN 19 Ca 0.10 -0.02 -0.00 0.00 -1.94 0.00 0.00 57.00 55.14 2flf n GLN 19 Cb 0.48 -1.50 -0.00 0.00 0.11 0.00 0.00 30.24 29.33 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 1.48 0.39 0.07 1.08 0.00 -0.25 -4.94 105.19 103.01 2flf n GLY 20 Ca 0.07 -1.02 0.12 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.04 0.71 -3.85 0.99 4.77 0.42 -4.44 117.00 115.56 2flf n LEU 21 Ca -0.00 0.27 -0.11 0.00 -0.03 0.00 0.00 56.01 56.14 2flf n LEU 21 Cb 0.17 -0.20 -0.09 0.00 -2.33 0.00 0.00 43.42 40.98 2flf n LEU 21 CO 0.00 -0.07 -0.10 0.27 -1.33 0.00 0.00 177.39 176.16 2flf s ILE 22 N -3.15 0.10 0.00 -0.08 -5.25 -1.16 0.96 121.20 112.62 2flf s ILE 22 Ca 0.07 -0.85 0.00 0.00 -0.99 0.00 0.00 60.65 58.88 2flf s ILE 22 Cb 0.13 -0.84 0.00 0.00 2.95 0.00 0.00 42.46 44.71 2flf s ILE 22 CO 0.70 -0.47 0.00 -1.54 -1.79 0.00 0.00 174.94 171.84 2flf n SER 23 N 0.81 0.00 -0.13 4.36 3.41 -1.26 -4.61 113.62 116.20 2flf n SER 23 Ca -0.19 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.15 2flf n SER 23 Cb 0.58 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.43 2flf n SER 23 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2flf n ALA 24 N -3.00 1.24 -0.03 7.33 0.00 -1.26 -4.64 120.51 120.15 2flf n ALA 24 Ca 0.00 -1.07 -0.16 0.00 0.00 0.00 0.00 53.44 52.21 2flf n ALA 24 Cb 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 19.45 19.34 2flf n ALA 24 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2flf n THR 25 N -3.98 1.66 -0.75 0.00 -2.24 -1.26 -2.75 114.28 104.96 2flf n THR 25 Ca -0.51 -0.71 -0.33 0.00 -2.27 0.00 0.00 64.05 60.23 2flf n THR 25 Cb 0.91 -1.35 0.14 0.00 -2.10 0.00 0.00 70.33 67.93 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 -2.86 -2.89 0.00 6.98 0.00 -1.26 -4.72 120.51 115.77 2flf n ALA 26 Ca -0.29 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.37 2flf n ALA 26 Cb 1.05 -1.76 0.00 0.00 0.00 0.00 0.00 19.45 18.74 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 1.54 -2.40 0.00 0.00 0.00 -1.26 -4.53 105.19 98.54 2flf n GLY 27 Ca 0.05 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2flf n GLY 27 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2flf n ASN 28 N -0.04 0.00 -3.90 1.61 0.23 -0.89 -5.03 115.26 107.24 2flf n ASN 28 Ca 0.00 0.00 -0.09 0.00 -0.53 0.00 0.00 54.58 53.96 2flf n ASN 28 Cb 0.00 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.66 2flf n ASN 28 CO 0.00 0.00 0.00 0.72 -0.93 0.00 0.00 177.26 177.05 2flf s PHE 29 N -2.00 0.13 0.33 -2.53 -0.12 -1.26 -0.37 117.98 112.16 2flf s PHE 29 Ca 0.00 -0.51 -0.13 0.00 -0.05 0.00 0.00 56.93 56.24 2flf s PHE 29 Cb 0.00 0.34 0.05 0.00 -0.63 0.00 0.00 43.02 42.78 2flf s PHE 29 CO 0.00 -1.01 0.71 -1.13 -0.05 0.00 0.00 175.22 173.74 2flf n SER 30 N -0.38 -1.99 -3.78 1.98 3.41 0.19 -3.18 113.62 109.88 2flf n SER 30 Ca -0.04 -2.35 -0.11 0.00 -0.26 0.00 0.00 58.87 56.11 2flf n SER 30 Cb 0.61 3.30 -0.07 0.00 -0.26 0.00 0.00 64.21 67.79 2flf n SER 30 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2flf s VAL 31 N -2.20 0.10 0.52 -3.33 -7.23 -1.23 -2.03 120.40 105.00 2flf s VAL 31 Ca 0.14 -0.82 -0.10 0.00 -1.81 0.00 0.00 61.98 59.39 2flf s VAL 31 Cb -0.04 -1.05 -0.05 0.00 0.56 0.00 0.00 36.38 35.79 2flf s VAL 31 CO 0.10 -0.45 0.91 -0.60 -0.31 0.00 0.00 175.10 174.75 2flf s ARG 32 N -3.00 3.68 -0.04 4.82 3.52 -0.76 -1.35 118.95 125.82 2flf s ARG 32 Ca -0.02 0.59 -0.08 0.00 -0.13 0.00 0.00 55.73 56.10 2flf s ARG 32 Cb 0.01 -2.23 0.01 0.00 -1.56 0.00 0.00 34.95 31.18 2flf s ARG 32 CO -0.06 -0.32 0.19 0.95 -0.81 0.00 0.00 175.30 175.25 2flf s THR 33 N -2.81 0.04 0.10 4.11 -4.23 -0.35 -4.77 115.64 107.73 2flf s THR 33 Ca 0.53 -0.32 -0.04 0.00 -1.18 0.00 0.00 61.69 60.68 2flf s THR 33 Cb -0.10 -0.38 0.14 0.00 1.34 0.00 0.00 72.50 73.50 2flf s THR 33 CO 0.43 -0.17 0.59 0.29 -0.54 0.00 0.00 174.62 175.22 2flf n LYS 34 N 2.21 -0.06 0.20 3.99 5.02 -1.26 0.61 118.16 128.87 2flf n LYS 34 Ca -0.17 0.59 -0.08 0.00 -2.02 0.00 0.00 58.31 56.62 2flf n LYS 34 Cb 0.57 -0.88 -0.04 0.00 -0.02 0.00 0.00 35.03 34.67 2flf n LYS 34 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2flf h GLY 35 N 0.00 -0.55 0.00 0.72 0.00 -1.96 -3.49 103.07 97.79 2flf h GLY 35 Ca 0.16 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.70 2flf h GLY 35 CO -0.38 -0.20 0.00 0.61 0.00 0.00 0.00 176.54 176.56 2flf n GLY 36 N -0.16 -1.37 3.60 4.60 0.00 0.20 -4.49 105.19 107.57 2flf n GLY 36 Ca -0.07 0.46 -0.11 0.00 0.00 0.00 0.00 46.02 46.31 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 0.00 -0.46 -0.61 1.61 -0.12 -1.10 -1.21 117.98 116.10 2flf s PHE 37 Ca 0.00 0.99 -0.17 0.00 -0.05 0.00 0.00 56.93 57.69 2flf s PHE 37 Cb 0.00 0.40 0.13 0.00 -0.63 0.00 0.00 43.02 42.91 2flf s PHE 37 CO 0.00 -0.31 0.64 -1.17 -0.05 0.00 0.00 175.22 174.33 2flf s LEU 38 N -0.39 5.87 0.00 -1.99 2.96 -0.46 -2.82 118.68 121.85 2flf s LEU 38 Ca 0.00 -1.74 -0.07 0.00 -0.22 0.00 0.00 54.13 52.10 2flf s LEU 38 Cb -0.03 -2.26 0.18 0.00 0.50 0.00 0.00 46.19 44.58 2flf s LEU 38 CO -0.02 -0.95 1.13 0.00 -1.32 0.00 0.00 176.35 175.20 2flf n ILE 39 N 5.26 0.00 -3.99 6.68 0.13 -0.32 -3.53 119.36 123.58 2flf n ILE 39 Ca -0.08 -1.29 -0.28 0.00 -1.10 0.00 0.00 62.75 60.00 2flf n ILE 39 Cb 0.42 -1.18 -0.05 0.00 -0.84 0.00 0.00 39.64 38.00 2flf n ILE 39 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2flf s THR 40 N -3.42 4.98 1.17 9.51 -4.23 -1.19 -0.97 115.64 121.50 2flf s THR 40 Ca 0.69 -0.72 -0.19 0.00 -1.18 0.00 0.00 61.69 60.30 2flf s THR 40 Cb -0.03 -3.50 0.28 0.00 1.34 0.00 0.00 72.50 70.59 2flf s THR 40 CO 0.47 0.01 1.12 -0.54 -0.54 0.00 0.00 174.62 175.14 2flf s LYS 41 N -2.85 -1.01 0.33 3.99 1.02 0.43 -1.85 119.74 119.80 2flf s LYS 41 Ca 0.33 -0.07 0.07 0.00 0.02 0.00 0.00 55.97 56.32 2flf s LYS 41 Cb -0.12 -1.62 -0.02 0.00 -0.52 0.00 0.00 37.83 35.55 2flf s LYS 41 CO 0.26 -3.57 0.32 -1.54 -0.92 0.00 0.00 175.35 169.90 2flf s SER 42 N -3.95 5.42 -0.12 2.83 1.04 0.04 -4.24 113.70 114.73 2flf s SER 42 Ca 0.71 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.71 2flf s SER 42 Cb -0.10 -1.05 0.00 0.00 0.10 0.00 0.00 66.02 64.97 2flf s SER 42 CO 0.56 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 175.04 2flf n GLY 43 N -1.40 0.10 3.93 7.32 0.00 -1.26 -4.94 105.19 108.94 2flf n GLY 43 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.78 5.31 -0.42 1.61 0.11 -1.26 -5.02 120.40 119.94 2flf s VAL 44 Ca 0.00 -0.42 -0.29 0.00 -2.93 0.00 0.00 61.98 58.35 2flf s VAL 44 Cb 0.00 -3.68 0.01 0.00 -1.53 0.00 0.00 36.38 31.18 2flf s VAL 44 CO 0.00 -0.00 1.41 -1.10 -3.33 0.00 0.00 175.10 172.07 2flf s GLN 45 N -2.90 3.57 0.31 1.54 -1.52 -1.26 -4.57 119.66 114.82 2flf s GLN 45 Ca 0.36 0.92 0.25 0.00 -1.95 0.00 0.00 55.36 54.94 2flf s GLN 45 Cb -0.12 -4.03 1.06 0.00 -0.22 0.00 0.00 33.01 29.71 2flf s GLN 45 CO 0.28 -1.58 1.76 0.87 -0.25 0.00 0.00 175.29 176.37 2flf h LYS 46 N 10.70 0.00 -0.25 2.91 1.57 -1.82 -1.54 116.57 128.14 2flf h LYS 46 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2flf h LYS 46 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 2flf h LYS 46 CO 1.09 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.97 2flf n ALA 47 N -1.83 2.47 -2.71 3.86 0.00 -1.26 -3.99 120.51 117.07 2flf n ALA 47 Ca 0.02 -0.74 -0.07 0.00 0.00 0.00 0.00 53.44 52.65 2flf n ALA 47 Cb 0.23 -0.97 0.04 0.00 0.00 0.00 0.00 19.45 18.75 2flf n ALA 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2flf n ARG 48 N 0.92 1.29 -1.88 0.00 1.74 -0.59 -4.64 116.66 113.49 2flf n ARG 48 Ca 0.17 -3.19 -0.32 0.00 -0.77 0.00 0.00 57.85 53.74 2flf n ARG 48 Cb 0.48 -1.23 0.02 0.00 -1.02 0.00 0.00 32.46 30.71 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 -3.31 3.36 0.05 0.55 1.43 -1.13 -4.79 118.68 114.84 2flf s LEU 49 Ca 0.26 1.73 -0.04 0.00 -1.03 0.00 0.00 54.13 55.06 2flf s LEU 49 Cb 0.42 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 42.10 2flf s LEU 49 CO 0.01 -1.25 0.05 0.42 0.23 0.00 0.00 176.35 175.81 2flf s THR 50 N -2.69 0.17 0.17 5.49 -4.23 -1.26 -4.90 115.64 108.38 2flf s THR 50 Ca 0.61 -1.37 -0.20 0.00 -1.18 0.00 0.00 61.69 59.55 2flf s THR 50 Cb -0.15 -1.13 0.08 0.00 1.34 0.00 0.00 72.50 72.64 2flf s THR 50 CO 0.44 -0.76 1.32 -2.65 -0.54 0.00 0.00 174.62 172.43 2flf n PRO 51 N 0.48 -0.28 0.00 3.99 -0.02 -1.26 0.18 135.00 138.09 2flf n PRO 51 Ca -0.17 1.30 0.01 0.00 -2.02 0.00 0.00 63.50 62.61 2flf n PRO 51 Cb 0.60 -1.92 0.04 0.00 -0.02 0.00 0.00 33.50 32.20 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 -5.16 0.07 0.01 -0.52 4.71 -1.26 -0.86 120.64 117.62 2flf n GLU 52 Ca 0.05 0.00 0.11 0.00 -0.01 0.00 0.00 57.16 57.31 2flf n GLU 52 Cb 0.28 -1.30 -0.06 0.00 -1.01 0.00 0.00 31.44 29.35 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 -0.80 0.67 -4.91 1.62 10.43 0.48 -4.90 116.55 119.14 2flf n ASP 53 Ca 0.01 -0.55 -0.31 0.00 2.57 0.00 0.00 54.79 56.51 2flf n ASP 53 Cb 0.00 1.08 -0.04 0.00 1.84 0.00 0.00 41.12 44.00 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 -3.53 4.33 0.05 0.64 1.43 -0.04 -0.43 118.68 121.14 2flf s LEU 54 Ca 0.04 0.27 -0.01 0.00 -1.03 0.00 0.00 54.13 53.39 2flf s LEU 54 Cb 0.15 -2.89 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 2flf s LEU 54 CO 0.85 0.18 -0.01 -0.22 0.23 0.00 0.00 176.35 177.37 2flf s LEU 55 N -2.43 2.37 0.09 1.79 2.96 -0.15 -4.87 118.68 118.45 2flf s LEU 55 Ca 0.34 -0.89 -0.09 0.00 -0.22 0.00 0.00 54.13 53.27 2flf s LEU 55 Cb -0.13 0.24 -0.06 0.00 0.50 0.00 0.00 46.19 46.74 2flf s LEU 55 CO 0.26 -0.56 0.40 -1.61 -1.32 0.00 0.00 176.35 173.53 2flf s GLU 56 N -3.48 3.74 -0.12 1.98 0.41 -1.26 -1.18 118.70 118.79 2flf s GLU 56 Ca 0.03 0.14 -0.15 0.00 -0.41 0.00 0.00 54.97 54.57 2flf s GLU 56 Cb 0.05 -2.97 0.04 0.00 -1.78 0.00 0.00 34.13 29.47 2flf s GLU 56 CO -0.08 0.54 0.41 0.08 -0.49 0.00 0.00 175.26 175.72 2flf s VAL 57 N -1.44 0.01 0.14 2.63 1.01 -1.13 -4.63 120.40 116.99 2flf s VAL 57 Ca 0.34 -0.10 -0.02 0.00 0.00 0.00 0.00 61.98 62.20 2flf s VAL 57 Cb -0.14 -0.61 -0.05 0.00 0.00 0.00 0.00 36.38 35.58 2flf s VAL 57 CO 0.19 -0.05 0.34 -2.16 0.00 0.00 0.00 175.10 173.42 2flf s PRO 58 N -0.17 3.55 0.10 2.72 0.04 -1.26 -2.70 135.00 137.28 2flf s PRO 58 Ca -0.03 -0.25 0.24 0.00 0.04 0.00 0.00 61.00 60.99 2flf s PRO 58 Cb -0.03 -2.89 0.94 0.00 0.04 0.00 0.00 34.50 32.56 2flf s PRO 58 CO 0.02 0.48 1.74 1.28 0.04 0.00 0.00 177.00 180.56 2flf n LEU 59 N -0.10 0.34 0.00 -3.56 4.32 -1.26 -4.48 117.00 112.26 2flf n LEU 59 Ca -0.04 0.55 0.00 0.00 -0.02 0.00 0.00 56.01 56.50 2flf n LEU 59 Cb 0.52 -0.47 0.00 0.00 -1.62 0.00 0.00 43.42 41.86 2flf n LEU 59 CO 0.49 -0.21 0.00 -0.62 -1.22 0.00 0.00 177.39 175.83 2flf n GLU 60 N -1.84 0.00 0.04 3.23 1.02 -1.26 -5.02 120.64 116.81 2flf n GLU 60 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2flf n GLU 60 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.72 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 0.52 -0.09 3.70 0.62 0.00 -1.26 -5.09 105.19 103.59 2flf n GLY 61 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2flf n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2flf s PRO 62 N -2.00 4.36 -0.32 1.61 0.04 -1.26 -5.04 135.00 132.39 2flf s PRO 62 Ca 0.00 1.80 -0.09 0.00 0.04 0.00 0.00 61.00 62.75 2flf s PRO 62 Cb 0.00 -3.47 0.01 0.00 0.04 0.00 0.00 34.50 31.08 2flf s PRO 62 CO 0.00 -0.41 0.13 0.42 0.04 0.00 0.00 177.00 177.19 2flf s ILE 63 N 1.78 4.31 0.64 0.56 1.09 -1.26 -4.40 121.20 123.92 2flf s ILE 63 Ca 0.59 -0.66 -0.17 0.00 -1.10 0.00 0.00 60.65 59.31 2flf s ILE 63 Cb -0.29 -3.27 -0.05 0.00 -1.06 0.00 0.00 42.46 37.80 2flf s ILE 63 CO 0.26 -0.01 0.72 -0.81 -0.10 0.00 0.00 174.94 175.00 2flf n PRO 64 N 4.93 0.57 -3.00 2.79 -0.04 -1.26 -4.92 135.00 134.07 2flf n PRO 64 Ca -0.14 0.23 -0.40 0.00 -0.04 0.00 0.00 63.50 63.16 2flf n PRO 64 Cb 0.48 -1.95 -0.04 0.00 -0.04 0.00 0.00 33.50 31.94 2flf n PRO 64 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2flf s GLU 65 N -2.64 4.45 0.00 0.54 2.12 -1.26 -3.85 118.70 118.07 2flf s GLU 65 Ca 0.71 0.95 0.00 0.00 0.36 0.00 0.00 54.97 56.99 2flf s GLU 65 Cb -0.40 -3.45 0.00 0.00 0.26 0.00 0.00 34.13 30.54 2flf s GLU 65 CO 0.52 0.05 0.00 0.41 -0.54 0.00 0.00 175.26 175.70 2flf n GLY 66 N 3.08 1.12 3.78 -1.50 0.00 -1.26 -5.10 105.19 105.31 2flf n GLY 66 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.28 2.63 0.18 4.61 0.00 -1.25 -0.78 121.76 125.86 2flf s ALA 67 Ca 0.00 0.60 -0.26 0.00 0.00 0.00 0.00 51.96 52.30 2flf s ALA 67 Cb 0.00 -3.31 -0.16 0.00 0.00 0.00 0.00 23.12 19.66 2flf s ALA 67 CO 0.00 -0.95 0.49 0.45 0.00 0.00 0.00 175.76 175.75 2flf n SER 68 N -1.89 -1.11 -0.05 0.00 2.88 -0.77 -4.45 113.62 108.23 2flf n SER 68 Ca 0.10 1.03 0.10 0.00 -1.33 0.00 0.00 58.87 58.78 2flf n SER 68 Cb 0.52 -0.87 0.49 0.00 -0.75 0.00 0.00 64.21 63.61 2flf n SER 68 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2flf h VAL 69 N 0.97 0.94 -0.53 2.46 2.07 -1.91 -0.12 116.25 120.12 2flf h VAL 69 Ca -0.26 -0.14 -0.28 0.00 0.82 0.00 0.00 66.70 66.83 2flf h VAL 69 Cb 1.31 0.48 -0.16 0.00 -1.52 0.00 0.00 31.29 31.40 2flf h VAL 69 CO 0.52 0.08 0.36 -0.62 0.02 0.00 0.00 177.57 177.93 2flf n GLU 70 N -4.47 1.69 0.23 1.57 1.02 -1.26 -4.23 120.64 115.18 2flf n GLU 70 Ca 0.08 -1.62 0.12 0.00 -0.02 0.00 0.00 57.16 55.72 2flf n GLU 70 Cb 0.31 -1.63 0.43 0.00 -0.02 0.00 0.00 31.44 30.53 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 0.62 0.00 0.43 1.62 0.02 -1.33 -3.18 113.55 111.74 2flf h SER 71 Ca 0.34 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.27 2flf h SER 71 Cb 1.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.45 2flf h SER 71 CO 0.61 0.14 -0.21 0.58 -1.14 0.00 0.00 176.83 176.82 2flf h VAL 72 N 0.00 0.55 -0.20 2.27 2.07 -1.82 -2.09 116.25 117.03 2flf h VAL 72 Ca -0.00 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.25 2flf h VAL 72 Cb 0.78 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 2flf h VAL 72 CO 0.02 0.06 -0.07 0.58 0.02 0.00 0.00 177.57 178.17 2flf h VAL 73 N -0.77 0.75 -0.85 2.57 2.07 -1.89 -0.94 116.25 117.19 2flf h VAL 73 Ca -0.06 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.64 2flf h VAL 73 Cb 0.54 0.75 -0.11 0.00 -1.52 0.00 0.00 31.29 30.94 2flf h VAL 73 CO 0.10 0.00 0.36 0.45 0.02 0.00 0.00 177.57 178.50 2flf h HIS 74 N -0.04 0.61 0.62 1.57 3.86 -1.52 -0.70 115.15 119.55 2flf h HIS 74 Ca 0.10 0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.32 2flf h HIS 74 Cb 0.19 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.52 2flf h HIS 74 CO -0.24 0.02 -0.34 -0.09 0.86 0.00 0.00 177.93 178.14 2flf h ARG 75 N 0.45 -0.86 -0.05 2.45 2.43 -0.55 -2.00 114.38 116.25 2flf h ARG 75 Ca 0.50 0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.75 2flf h ARG 75 Cb 0.86 0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 30.55 2flf h ARG 75 CO -0.47 -0.57 -0.52 1.49 -1.51 0.00 0.00 179.97 178.39 2flf h GLU 76 N -0.89 -0.60 -0.88 0.20 4.57 -0.13 0.64 114.58 117.49 2flf h GLU 76 Ca -0.08 0.04 0.24 0.00 -1.18 0.00 0.00 59.36 58.38 2flf h GLU 76 Cb 0.71 0.14 -0.14 0.00 -0.16 0.00 0.00 28.75 29.29 2flf h GLU 76 CO 0.11 -0.40 0.26 0.28 -1.18 0.00 0.00 179.01 178.08 2flf h VAL 77 N -0.62 0.33 0.00 0.32 2.07 -1.18 0.71 116.25 117.88 2flf h VAL 77 Ca 0.02 -0.08 -0.13 0.00 0.82 0.00 0.00 66.70 67.33 2flf h VAL 77 Cb 0.68 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2flf h VAL 77 CO -0.38 0.04 -0.61 1.88 0.02 0.00 0.00 177.57 178.53 2flf h TYR 78 N 0.23 0.00 -0.21 1.57 0.99 -0.28 -1.39 116.97 117.88 2flf h TYR 78 Ca 0.56 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 61.15 2flf h TYR 78 Cb 1.13 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.85 2flf h TYR 78 CO -0.24 0.61 -0.47 -0.09 -0.00 0.00 0.00 178.16 177.97 2flf h ARG 79 N 0.00 0.54 -0.14 4.88 2.43 0.60 -3.32 114.38 119.36 2flf h ARG 79 Ca -0.01 -0.30 -0.11 0.00 -0.81 0.00 0.00 59.98 58.75 2flf h ARG 79 Cb 1.09 0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 30.58 2flf h ARG 79 CO 0.08 0.90 -0.57 0.54 -1.51 0.00 0.00 179.97 179.41 2flf n ARG 80 N -4.00 1.97 -3.59 0.20 1.74 0.43 -5.06 116.66 108.36 2flf n ARG 80 Ca -0.02 -3.47 -0.13 0.00 -0.77 0.00 0.00 57.85 53.46 2flf n ARG 80 Cb 0.55 -1.74 -0.05 0.00 -1.02 0.00 0.00 32.46 30.20 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 -3.48 0.04 -1.64 0.55 2.01 -0.53 -4.90 115.64 107.68 2flf s THR 81 Ca 0.40 -0.30 0.03 0.00 0.31 0.00 0.00 61.69 62.13 2flf s THR 81 Cb 0.38 -0.98 0.11 0.00 0.01 0.00 0.00 72.50 72.01 2flf s THR 81 CO -0.05 -0.17 0.95 0.61 -0.69 0.00 0.00 174.62 175.28 2flf n GLY 82 N 0.35 0.23 3.71 4.40 0.00 -1.26 -4.74 105.19 107.88 2flf n GLY 82 Ca -0.18 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 2flf n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2flf s ALA 83 N -1.66 3.78 -1.86 4.61 0.00 -1.26 -4.87 121.76 120.50 2flf s ALA 83 Ca 0.08 1.37 0.18 0.00 0.00 0.00 0.00 51.96 53.58 2flf s ALA 83 Cb 0.05 -3.65 0.33 0.00 0.00 0.00 0.00 23.12 19.84 2flf s ALA 83 CO 0.04 -0.88 1.25 0.54 0.00 0.00 0.00 175.76 176.71 2flf n ARG 84 N 4.38 2.18 -3.61 0.00 5.12 -0.12 -4.83 116.66 119.77 2flf n ARG 84 Ca 0.15 -2.00 -0.06 0.00 -1.93 0.00 0.00 57.85 54.00 2flf n ARG 84 Cb 0.38 -1.39 -0.04 0.00 -1.16 0.00 0.00 32.46 30.25 2flf n ARG 84 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2flf s ALA 85 N -1.24 -2.03 -0.04 7.54 0.00 -0.88 -1.83 121.76 123.28 2flf s ALA 85 Ca 0.30 1.71 -0.02 0.00 0.00 0.00 0.00 51.96 53.94 2flf s ALA 85 Cb 0.17 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.35 2flf s ALA 85 CO 0.24 -0.32 0.09 -1.17 0.00 0.00 0.00 175.76 174.60 2flf s LEU 86 N -1.22 1.27 -0.10 0.00 2.96 -0.86 -2.24 118.68 118.49 2flf s LEU 86 Ca 0.04 0.19 0.00 0.00 -0.22 0.00 0.00 54.13 54.14 2flf s LEU 86 Cb -0.01 0.25 0.02 0.00 0.50 0.00 0.00 46.19 46.95 2flf s LEU 86 CO -0.03 -0.08 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.14 2flf s VAL 87 N 0.58 1.03 -0.38 1.68 1.01 -1.05 0.56 120.40 123.83 2flf s VAL 87 Ca -0.04 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 61.55 2flf s VAL 87 Cb -0.06 -1.03 0.07 0.00 0.00 0.00 0.00 36.38 35.36 2flf s VAL 87 CO -0.02 0.36 0.19 -2.28 0.00 0.00 0.00 175.10 173.34 2flf s HIS 88 N 1.50 3.35 0.32 5.22 2.46 0.51 -1.22 115.29 127.41 2flf s HIS 88 Ca 0.01 -1.66 0.00 0.00 0.47 0.00 0.00 55.06 53.88 2flf s HIS 88 Cb -0.13 -2.74 0.00 0.00 -0.13 0.00 0.00 32.58 29.58 2flf s HIS 88 CO -0.06 -0.83 0.00 0.00 -2.47 0.00 0.00 174.74 171.39 2flf n ALA 89 N 4.81 0.27 -3.30 1.58 0.00 -0.77 -2.08 120.51 121.02 2flf n ALA 89 Ca -0.10 -1.42 -0.25 0.00 0.00 0.00 0.00 53.44 51.67 2flf n ALA 89 Cb 0.43 0.77 -0.08 0.00 0.00 0.00 0.00 19.45 20.58 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 1.42 -1.56 0.00 8.25 0.27 -1.92 115.22 120.88 2flf n HIS 90 Ca -0.13 -3.83 -0.39 0.00 -0.26 0.00 0.00 57.72 53.12 2flf n HIS 90 Cb 0.40 -0.43 -0.03 0.00 1.12 0.00 0.00 29.99 31.04 2flf n HIS 90 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2flf n PRO 91 N 1.20 1.33 -0.27 -0.41 -0.04 -1.23 -4.46 135.00 131.11 2flf n PRO 91 Ca 0.25 0.17 -0.07 0.00 -0.04 0.00 0.00 63.50 63.81 2flf n PRO 91 Cb 0.47 -3.35 -0.07 0.00 -0.04 0.00 0.00 33.50 30.51 2flf n PRO 91 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2flf n ARG 92 N 8.92 -0.29 -0.10 0.54 1.74 -1.26 -1.24 116.66 124.97 2flf n ARG 92 Ca 0.35 1.11 -0.14 0.00 -0.77 0.00 0.00 57.85 58.40 2flf n ARG 92 Cb 0.51 -1.63 -0.03 0.00 -1.02 0.00 0.00 32.46 30.28 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 1.28 -0.20 1.55 2.07 -1.93 -2.18 116.25 116.83 2flf h VAL 93 Ca 0.10 -1.55 0.06 0.00 0.82 0.00 0.00 66.70 66.13 2flf h VAL 93 Cb 0.27 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 2flf h VAL 93 CO -0.62 0.51 0.16 0.00 0.02 0.00 0.00 177.57 177.65 2flf h ALA 94 N 0.73 2.06 -0.01 1.67 0.00 -1.68 0.41 119.26 122.45 2flf h ALA 94 Ca 0.05 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 2flf h ALA 94 Cb 0.97 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.79 2flf h ALA 94 CO 0.09 -0.27 -0.92 0.28 0.00 0.00 0.00 179.25 178.44 2flf h VAL 95 N 0.00 1.32 -0.24 0.00 2.07 -0.86 -1.96 116.25 116.57 2flf h VAL 95 Ca 0.10 -2.19 0.04 0.00 0.82 0.00 0.00 66.70 65.47 2flf h VAL 95 Cb 0.42 2.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.58 2flf h VAL 95 CO -0.00 0.67 0.01 0.00 0.02 0.00 0.00 177.57 178.27 2flf h ALA 96 N 0.38 0.22 0.00 1.67 0.00 -0.33 -0.81 119.26 120.39 2flf h ALA 96 Ca -0.11 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2flf h ALA 96 Cb 1.59 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 2flf h ALA 96 CO 0.18 -0.41 -0.16 -0.07 0.00 0.00 0.00 179.25 178.79 2flf h LEU 97 N 0.09 0.00 -2.74 0.00 3.38 -1.28 -2.63 115.31 112.13 2flf h LEU 97 Ca 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2flf h LEU 97 Cb 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2flf h LEU 97 CO -0.18 0.16 -0.00 0.28 0.09 0.00 0.00 178.44 178.79 2flf h SER 98 N 0.00 0.00 -0.46 -0.43 0.02 -0.33 -2.72 113.55 109.63 2flf h SER 98 Ca -0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2flf h SER 98 Cb 0.44 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 2flf h SER 98 CO 0.02 0.00 -0.13 -0.26 -1.14 0.00 0.00 176.83 175.32 2flf h PHE 99 N 0.00 1.02 0.00 3.45 -1.00 -1.43 -3.41 116.94 115.57 2flf h PHE 99 Ca -0.00 -0.22 0.00 0.00 2.81 0.00 0.00 57.97 60.56 2flf h PHE 99 Cb 0.00 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 39.32 2flf h PHE 99 CO 0.00 1.00 0.00 0.72 -1.61 0.00 0.00 178.31 178.42 2flf n HIS 100 N -4.23 0.00 -1.06 -0.55 8.25 -1.04 -5.00 115.22 111.59 2flf n HIS 100 Ca -0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 2flf n HIS 100 Cb 0.40 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.49 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 -1.07 -1.60 -0.34 2.41 4.77 -1.12 -4.87 117.00 115.18 2flf n LEU 101 Ca 0.00 0.76 0.12 0.00 -0.03 0.00 0.00 56.01 56.86 2flf n LEU 101 Cb 0.00 -0.72 0.15 0.00 -2.33 0.00 0.00 43.42 40.52 2flf n LEU 101 CO 0.00 -2.81 0.42 -1.20 -1.33 0.00 0.00 177.39 172.48 2flf n SER 102 N 1.70 1.49 -3.58 -1.43 7.64 -1.26 -4.79 113.62 113.38 2flf n SER 102 Ca 0.11 -1.17 -0.11 0.00 1.01 0.00 0.00 58.87 58.71 2flf n SER 102 Cb 0.25 0.37 -0.05 0.00 -1.01 0.00 0.00 64.21 63.77 2flf n SER 102 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2flf s ARG 103 N -2.55 0.65 -0.21 1.43 0.52 -1.26 -2.30 118.95 115.22 2flf s ARG 103 Ca 0.20 0.22 -0.01 0.00 -0.52 0.00 0.00 55.73 55.62 2flf s ARG 103 Cb 0.18 0.31 0.01 0.00 0.52 0.00 0.00 34.95 35.97 2flf s ARG 103 CO 0.58 -0.19 -0.11 -1.17 0.02 0.00 0.00 175.30 174.43 2flf s LEU 104 N -0.95 2.66 -0.26 2.53 0.20 0.18 -4.92 118.68 118.13 2flf s LEU 104 Ca -0.02 -0.63 0.01 0.00 0.69 0.00 0.00 54.13 54.17 2flf s LEU 104 Cb -0.01 -1.61 0.05 0.00 -0.43 0.00 0.00 46.19 44.19 2flf s LEU 104 CO 0.02 -0.04 -0.09 -0.13 -0.29 0.00 0.00 176.35 175.82 2flf s ARG 105 N 1.36 2.49 1.22 1.98 0.52 -1.26 -0.87 118.95 124.39 2flf s ARG 105 Ca 0.04 -1.19 -0.14 0.00 -0.52 0.00 0.00 55.73 53.91 2flf s ARG 105 Cb -0.14 -2.93 0.30 0.00 0.52 0.00 0.00 34.95 32.69 2flf s ARG 105 CO -0.08 -0.50 0.92 -2.30 0.02 0.00 0.00 175.30 173.36 2flf n PRO 106 N 4.54 -2.80 0.00 3.54 -0.02 -1.26 -4.97 135.00 134.03 2flf n PRO 106 Ca -0.15 -0.80 0.00 0.00 -2.02 0.00 0.00 63.50 60.53 2flf n PRO 106 Cb 0.44 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 2flf n PRO 106 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2flf n LEU 107 N -4.87 0.00 -4.87 2.45 4.77 -1.26 -4.88 117.00 108.35 2flf n LEU 107 Ca 0.03 -0.14 -0.31 0.00 -0.03 0.00 0.00 56.01 55.56 2flf n LEU 107 Cb 0.55 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.61 2flf n LEU 107 CO 0.56 0.00 0.47 1.51 -1.33 0.00 0.00 177.39 178.60 2flf s ASP 108 N -1.07 6.55 0.07 -1.43 -4.77 -1.26 -4.99 116.67 109.77 2flf s ASP 108 Ca 0.00 1.19 -0.20 0.00 -3.30 0.00 0.00 52.55 50.24 2flf s ASP 108 Cb 0.00 -2.35 -0.11 0.00 -1.09 0.00 0.00 42.92 39.38 2flf s ASP 108 CO 0.00 -0.40 1.49 0.25 0.70 0.00 0.00 175.17 177.20 2flf h LEU 109 N 1.30 0.34 -0.79 2.11 5.85 -1.99 -2.48 115.31 119.65 2flf h LEU 109 Ca -0.47 -0.32 0.11 0.00 0.84 0.00 0.00 57.88 58.03 2flf h LEU 109 Cb 1.19 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 42.04 2flf h LEU 109 CO 0.64 0.58 0.42 -0.08 -0.34 0.00 0.00 178.44 179.66 2flf h GLU 110 N 0.09 0.66 0.00 1.25 4.81 -2.00 -1.00 114.58 118.39 2flf h GLU 110 Ca 0.05 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.14 2flf h GLU 110 Cb 0.42 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 2flf h GLU 110 CO 0.01 0.43 -0.51 0.78 -0.73 0.00 0.00 179.01 178.99 2flf h GLY 111 N 0.68 0.00 1.91 1.92 0.00 -1.88 -2.96 103.07 102.74 2flf h GLY 111 Ca 0.40 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.55 2flf h GLY 111 CO -0.29 0.00 -0.83 1.46 0.00 0.00 0.00 176.54 176.88 2flf h GLN 112 N 0.00 0.08 -0.00 4.80 4.20 -0.84 0.98 115.11 124.33 2flf h GLN 112 Ca -0.01 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 2flf h GLN 112 Cb 1.04 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 2flf h GLN 112 CO 0.07 0.86 -0.00 1.25 -0.67 0.00 0.00 178.83 180.34 2flf h HIS 113 N 0.04 0.01 0.04 2.96 2.76 -1.11 -3.30 115.15 116.56 2flf h HIS 113 Ca -0.02 -0.00 -0.33 0.00 -2.20 0.00 0.00 60.37 57.81 2flf h HIS 113 Cb 1.45 -0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.37 2flf h HIS 113 CO 0.01 0.39 -1.87 0.66 -1.30 0.00 0.00 177.93 175.83 2flf n TYR 114 N -4.90 0.82 -3.25 5.26 4.01 -1.13 -4.63 117.16 113.34 2flf n TYR 114 Ca -0.08 0.26 -0.38 0.00 -0.16 0.00 0.00 57.90 57.54 2flf n TYR 114 Cb 0.21 -1.10 -0.03 0.00 -0.31 0.00 0.00 39.34 38.11 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 -3.93 5.26 -0.29 7.72 4.77 0.34 -4.76 117.00 126.12 2flf n LEU 115 Ca -0.37 -5.25 0.10 0.00 -0.03 0.00 0.00 56.01 50.46 2flf n LEU 115 Cb 0.88 -1.10 0.26 0.00 -2.33 0.00 0.00 43.42 41.13 2flf n LEU 115 CO 0.26 1.74 1.00 0.11 -1.33 0.00 0.00 177.39 179.17 2flf h LYS 116 N 5.28 0.34 -2.03 3.23 1.57 -1.65 -3.40 116.57 119.91 2flf h LYS 116 Ca 0.19 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 59.00 2flf h LYS 116 Cb 0.68 -0.08 -0.21 0.00 0.08 0.00 0.00 32.23 32.71 2flf h LYS 116 CO 1.09 0.22 -0.09 -2.00 -0.57 0.00 0.00 179.45 178.11 2flf s GLU 117 N -5.95 0.62 -0.42 3.15 2.12 -1.26 -4.63 118.70 112.33 2flf s GLU 117 Ca -0.12 1.35 -0.14 0.00 0.36 0.00 0.00 54.97 56.42 2flf s GLU 117 Cb 0.24 0.57 0.04 0.00 0.26 0.00 0.00 34.13 35.23 2flf s GLU 117 CO 0.77 -0.18 0.31 0.08 -0.54 0.00 0.00 175.26 175.69 2flf s VAL 118 N 2.39 5.05 0.35 3.70 1.01 -0.05 -4.87 120.40 127.98 2flf s VAL 118 Ca -0.07 -0.86 -0.27 0.00 0.00 0.00 0.00 61.98 60.77 2flf s VAL 118 Cb -0.09 -3.89 -0.09 0.00 0.00 0.00 0.00 36.38 32.31 2flf s VAL 118 CO -0.19 -0.38 1.20 -2.16 0.00 0.00 0.00 175.10 173.57 2flf s PRO 119 N 1.63 4.29 -0.16 2.72 0.04 -1.26 -0.64 135.00 141.61 2flf s PRO 119 Ca 0.04 1.97 -0.07 0.00 0.04 0.00 0.00 61.00 62.98 2flf s PRO 119 Cb -0.21 -2.93 -0.04 0.00 0.04 0.00 0.00 34.50 31.36 2flf s PRO 119 CO 0.08 -0.16 0.08 0.08 0.04 0.00 0.00 177.00 177.12 2flf s VAL 120 N -1.26 4.93 -0.10 -0.36 1.01 -0.97 -1.68 120.40 121.97 2flf s VAL 120 Ca 0.51 0.01 -0.03 0.00 0.00 0.00 0.00 61.98 62.48 2flf s VAL 120 Cb -0.34 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2flf s VAL 120 CO 0.44 0.50 0.02 -0.76 0.00 0.00 0.00 175.10 175.30 2flf s LEU 121 N -0.01 3.68 -0.47 3.92 1.43 0.25 -4.81 118.68 122.68 2flf s LEU 121 Ca 0.07 0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2flf s LEU 121 Cb -0.12 -1.86 0.16 0.00 0.03 0.00 0.00 46.19 44.40 2flf s LEU 121 CO 0.01 0.36 0.33 0.00 0.23 0.00 0.00 176.35 177.28 2flf s ALA 122 N -0.78 1.96 0.00 4.21 0.00 -1.26 -1.02 121.76 124.86 2flf s ALA 122 Ca 0.12 -2.66 0.00 0.00 0.00 0.00 0.00 51.96 49.42 2flf s ALA 122 Cb -0.12 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.23 2flf s ALA 122 CO 0.02 -2.04 0.00 -2.30 0.00 0.00 0.00 175.76 171.45 2flf n PRO 123 N 3.01 0.00 -1.18 0.00 -0.02 -1.26 -5.10 135.00 130.44 2flf n PRO 123 Ca 0.21 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 61.34 2flf n PRO 123 Cb 0.41 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.86 2flf n PRO 123 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2flf n ALA 128 N -3.00 6.46 -1.48 3.55 0.00 -1.26 -5.13 120.51 119.65 2flf n ALA 128 Ca 0.00 -3.12 -0.31 0.00 0.00 0.00 0.00 53.44 50.01 2flf n ALA 128 Cb 0.00 -3.29 0.06 0.00 0.00 0.00 0.00 19.45 16.22 2flf n ALA 128 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2flf s THR 129 N 2.70 3.80 0.61 0.00 -4.23 -1.26 -4.87 115.64 112.40 2flf s THR 129 Ca 0.59 0.60 0.32 0.00 -1.18 0.00 0.00 61.69 62.02 2flf s THR 129 Cb 0.15 -3.25 0.37 0.00 1.34 0.00 0.00 72.50 71.11 2flf s THR 129 CO -0.05 -0.75 2.14 -0.33 -0.54 0.00 0.00 174.62 175.09 2flf h GLU 130 N -0.78 0.00 0.21 3.99 4.39 -2.02 -2.69 114.58 117.69 2flf h GLU 130 Ca -0.44 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.25 2flf h GLU 130 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2flf h GLU 130 CO 0.55 0.00 -0.10 0.93 -1.16 0.00 0.00 179.01 179.23 2flf h GLU 131 N 0.00 -0.28 -1.04 2.33 3.07 -2.02 -3.31 114.58 113.34 2flf h GLU 131 Ca 0.05 0.02 0.28 0.00 -0.50 0.00 0.00 59.36 59.21 2flf h GLU 131 Cb 0.37 0.06 -0.12 0.00 -0.84 0.00 0.00 28.75 28.22 2flf h GLU 131 CO -0.00 -0.19 0.63 0.00 -1.40 0.00 0.00 179.01 178.05 2flf h ALA 132 N -1.67 2.03 -0.53 3.43 0.00 -1.88 -1.79 119.26 118.84 2flf h ALA 132 Ca -0.03 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2flf h ALA 132 Cb 0.22 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 2flf h ALA 132 CO 0.05 -0.53 0.23 0.00 0.00 0.00 0.00 179.25 179.00 2flf h ALA 133 N 1.72 0.68 0.00 0.00 0.00 -1.58 0.12 119.26 120.20 2flf h ALA 133 Ca 0.67 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.55 2flf h ALA 133 Cb 1.52 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2flf h ALA 133 CO -0.45 -0.15 -0.38 -0.07 0.00 0.00 0.00 179.25 178.20 2flf h LEU 134 N 0.44 0.00 0.39 0.00 3.38 -1.42 -2.74 115.31 115.36 2flf h LEU 134 Ca 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 2flf h LEU 134 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2flf h LEU 134 CO -0.22 0.38 -0.19 -1.28 0.09 0.00 0.00 178.44 177.22 2flf h SER 135 N 0.00 -0.44 -0.69 -0.43 0.87 -0.75 -1.14 113.55 110.97 2flf h SER 135 Ca -0.00 -0.12 0.03 0.00 -1.23 0.00 0.00 61.79 60.46 2flf h SER 135 Cb 0.85 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.88 2flf h SER 135 CO 0.05 -0.09 0.43 0.58 -0.53 0.00 0.00 176.83 177.27 2flf h VAL 136 N -0.84 1.09 -0.30 2.23 2.07 -0.87 -2.05 116.25 117.58 2flf h VAL 136 Ca -0.05 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 2flf h VAL 136 Cb 0.54 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 2flf h VAL 136 CO 0.09 0.15 -0.04 0.00 0.02 0.00 0.00 177.57 177.79 2flf h ALA 137 N 1.30 1.37 -0.00 1.67 0.00 -1.47 -0.63 119.26 121.50 2flf h ALA 137 Ca 0.28 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 2flf h ALA 137 Cb 0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2flf h ALA 137 CO -0.11 0.43 -0.76 0.93 0.00 0.00 0.00 179.25 179.74 2flf h GLU 138 N 0.45 0.02 0.00 0.00 5.08 -0.77 -3.18 114.58 116.19 2flf h GLU 138 Ca 0.10 -0.02 -0.19 0.00 -1.00 0.00 0.00 59.36 58.25 2flf h GLU 138 Cb 0.36 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2flf h GLU 138 CO 0.02 0.77 -0.86 0.00 -1.00 0.00 0.00 179.01 177.93 2flf h ALA 139 N 1.22 0.54 0.00 3.43 0.00 -0.81 -3.15 119.26 120.49 2flf h ALA 139 Ca -0.01 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2flf h ALA 139 Cb 1.35 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2flf h ALA 139 CO 0.10 0.91 0.00 1.28 0.00 0.00 0.00 179.25 181.54 2flf n LEU 140 N -3.66 0.00 0.06 0.00 4.77 -0.29 -2.02 117.00 115.85 2flf n LEU 140 Ca -0.03 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.06 2flf n LEU 140 Cb 0.80 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.96 2flf n LEU 140 CO 0.47 0.00 0.12 0.54 -1.33 0.00 0.00 177.39 177.19 2flf n ARG 141 N -0.73 0.37 0.00 3.23 1.74 -1.19 -4.22 116.66 115.87 2flf n ARG 141 Ca 0.11 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 2flf n ARG 141 Cb 0.05 -1.68 0.00 0.00 -1.02 0.00 0.00 32.46 29.81 2flf n ARG 141 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2flf n GLU 142 N -2.19 0.76 -3.99 5.56 1.02 -1.06 -5.06 120.64 115.68 2flf n GLU 142 Ca 0.02 -0.24 -0.08 0.00 -0.02 0.00 0.00 57.16 56.84 2flf n GLU 142 Cb 0.47 -0.69 -0.10 0.00 -0.02 0.00 0.00 31.44 31.10 2flf n GLU 142 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2flf s HIS 143 N -0.18 0.32 -1.41 -0.32 3.76 -0.86 -5.05 115.29 111.56 2flf s HIS 143 Ca 0.00 -0.71 0.25 0.00 -0.15 0.00 0.00 55.06 54.46 2flf s HIS 143 Cb 0.00 -0.23 0.55 0.00 1.11 0.00 0.00 32.58 34.01 2flf s HIS 143 CO 0.00 -0.35 1.44 0.54 -0.85 0.00 0.00 174.74 175.52 2flf n ARG 144 N 0.66 0.46 -2.42 1.40 1.74 -1.26 -4.34 116.66 112.90 2flf n ARG 144 Ca -0.18 -0.28 -0.05 0.00 -0.77 0.00 0.00 57.85 56.56 2flf n ARG 144 Cb 0.59 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.53 2flf n ARG 144 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2flf n ALA 145 N -1.02 -0.22 0.00 7.54 0.00 -1.26 -0.57 120.51 124.98 2flf n ALA 145 Ca 0.09 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2flf n ALA 145 Cb 0.35 0.48 0.00 0.00 0.00 0.00 0.00 19.45 20.28 2flf n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2flf s LEU 147 N 0.00 2.24 -0.34 0.00 1.43 -0.68 -1.79 118.68 119.54 2flf s LEU 147 Ca 0.00 -0.64 0.02 0.00 -1.03 0.00 0.00 54.13 52.48 2flf s LEU 147 Cb 0.00 -1.14 0.09 0.00 0.03 0.00 0.00 46.19 45.18 2flf s LEU 147 CO 0.00 0.18 0.05 -0.76 0.23 0.00 0.00 176.35 176.05 2flf s LEU 148 N -1.59 4.64 0.06 1.79 1.43 0.86 0.85 118.68 126.71 2flf s LEU 148 Ca 0.11 -1.99 -0.38 0.00 -1.03 0.00 0.00 54.13 50.84 2flf s LEU 148 Cb -0.10 -1.66 -0.18 0.00 0.03 0.00 0.00 46.19 44.28 2flf s LEU 148 CO 0.04 -0.38 1.22 -1.14 0.23 0.00 0.00 176.35 176.32 2flf n ARG 149 N 4.35 0.70 0.00 1.70 0.63 -0.19 -1.67 116.66 122.18 2flf n ARG 149 Ca -0.00 0.25 0.00 0.00 -0.92 0.00 0.00 57.85 57.18 2flf n ARG 149 Cb 0.42 -1.83 0.00 0.00 0.45 0.00 0.00 32.46 31.50 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 2.11 1.92 0.00 5.14 0.00 -1.26 -4.91 105.19 108.19 2flf n GLY 150 Ca 0.19 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2flf n GLY 150 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2flf n HIS 151 N 0.00 0.00 0.00 1.61 8.25 -0.67 -5.08 115.22 119.33 2flf n HIS 151 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2flf n HIS 151 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2flf n HIS 151 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2flf n GLY 152 N 1.87 2.69 3.06 -1.41 0.00 -1.23 -4.74 105.19 105.43 2flf n GLY 152 Ca 0.00 -0.40 -0.17 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.07 0.77 -0.13 4.61 0.00 -0.81 -0.10 121.76 124.03 2flf s ALA 153 Ca 0.00 -0.60 -0.02 0.00 0.00 0.00 0.00 51.96 51.35 2flf s ALA 153 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 2flf s ALA 153 CO 0.00 0.12 -0.08 -0.06 0.00 0.00 0.00 175.76 175.74 2flf s PHE 154 N -0.72 2.92 0.19 0.00 0.40 -0.74 -1.85 117.98 118.18 2flf s PHE 154 Ca -0.01 -0.41 0.09 0.00 -0.60 0.00 0.00 56.93 56.00 2flf s PHE 154 Cb -0.06 -1.88 -0.04 0.00 0.51 0.00 0.00 43.02 41.55 2flf s PHE 154 CO 0.00 -0.07 -0.07 0.00 0.70 0.00 0.00 175.22 175.79 2flf s ALA 155 N 0.21 3.02 -0.07 5.36 0.00 -0.36 -2.23 121.76 127.69 2flf s ALA 155 Ca -0.05 -1.49 0.04 0.00 0.00 0.00 0.00 51.96 50.47 2flf s ALA 155 Cb -0.15 -0.78 -0.00 0.00 0.00 0.00 0.00 23.12 22.19 2flf s ALA 155 CO 0.04 0.44 -0.21 0.08 0.00 0.00 0.00 175.76 176.10 2flf s VAL 156 N -1.81 1.80 -0.19 0.00 1.01 0.27 -2.52 120.40 118.96 2flf s VAL 156 Ca 0.26 -0.90 -0.07 0.00 0.00 0.00 0.00 61.98 61.28 2flf s VAL 156 Cb -0.08 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 2flf s VAL 156 CO 0.16 0.50 0.04 -0.83 0.00 0.00 0.00 175.10 174.98 2flf s GLY 157 N 0.17 1.85 -0.00 4.51 0.00 -0.95 -4.40 107.32 108.50 2flf s GLY 157 Ca -0.11 -0.81 0.11 0.00 0.00 0.00 0.00 44.72 43.91 2flf s GLY 157 CO 0.05 0.10 0.47 1.04 0.00 0.00 0.00 173.10 174.76 2flf n LEU 158 N 3.72 0.51 -4.63 0.66 4.77 -1.26 -0.95 117.00 119.82 2flf n LEU 158 Ca -0.17 -0.48 -0.38 0.00 -0.03 0.00 0.00 56.01 54.95 2flf n LEU 158 Cb 0.52 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.66 2flf n LEU 158 CO 0.34 0.13 0.60 0.29 -1.33 0.00 0.00 177.39 177.42 2flf n LYS 159 N -1.28 0.97 -0.10 3.23 4.01 -1.26 -4.63 118.16 119.10 2flf n LYS 159 Ca 0.02 0.37 -0.10 0.00 -0.51 0.00 0.00 58.31 58.09 2flf n LYS 159 Cb 0.18 -2.21 -0.03 0.00 -0.51 0.00 0.00 35.03 32.46 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 0.57 0.47 -5.94 1.97 4.57 -1.96 -3.40 114.58 110.87 2flf h GLU 160 Ca -0.49 -0.11 -0.51 0.00 -1.18 0.00 0.00 59.36 57.07 2flf h GLU 160 Cb 1.36 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.87 2flf h GLU 160 CO 0.51 0.55 1.43 0.00 -1.18 0.00 0.00 179.01 180.33 2flf s ALA 161 N -5.28 2.21 0.43 2.92 0.00 -1.26 -4.85 121.76 115.93 2flf s ALA 161 Ca -0.13 -0.11 0.27 0.00 0.00 0.00 0.00 51.96 51.98 2flf s ALA 161 Cb 0.08 -4.23 1.34 0.00 0.00 0.00 0.00 23.12 20.31 2flf s ALA 161 CO 0.74 -3.68 1.66 -1.00 0.00 0.00 0.00 175.76 173.48 2flf h PRO 162 N 15.90 0.16 -0.50 0.00 0.13 -1.89 1.21 132.00 147.01 2flf h PRO 162 Ca -0.29 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.78 2flf h PRO 162 Cb 1.20 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 2flf h PRO 162 CO 1.14 0.10 0.11 0.93 -0.23 0.00 0.00 178.00 180.05 2flf h GLU 163 N 0.16 0.80 0.00 0.86 3.07 -1.92 -1.88 114.58 115.68 2flf h GLU 163 Ca 0.76 -0.20 -0.11 0.00 -0.50 0.00 0.00 59.36 59.31 2flf h GLU 163 Cb 2.29 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 30.08 2flf h GLU 163 CO -0.39 0.78 -0.53 0.93 -1.40 0.00 0.00 179.01 178.40 2flf h GLU 164 N 0.69 0.00 0.01 2.33 5.08 0.99 -2.20 114.58 121.48 2flf h GLU 164 Ca 0.16 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.30 2flf h GLU 164 Cb 0.34 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 2flf h GLU 164 CO 0.00 0.53 -0.94 0.00 -1.00 0.00 0.00 179.01 177.61 2flf h ALA 165 N 1.47 0.41 -0.34 3.43 0.00 -0.73 -1.30 119.26 122.20 2flf h ALA 165 Ca -0.01 -0.73 -0.16 0.00 0.00 0.00 0.00 54.91 54.01 2flf h ALA 165 Cb 0.96 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2flf h ALA 165 CO 0.07 0.88 -0.43 1.25 0.00 0.00 0.00 179.25 181.01 2flf h LEU 166 N 0.16 0.94 -0.82 0.00 5.85 -1.27 -0.97 115.31 119.20 2flf h LEU 166 Ca -0.07 -0.45 -0.02 0.00 0.84 0.00 0.00 57.88 58.18 2flf h LEU 166 Cb 1.58 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.34 2flf h LEU 166 CO 0.15 1.23 -0.09 -0.07 -0.34 0.00 0.00 178.44 179.32 2flf h LEU 167 N 0.70 0.00 -0.04 2.25 3.38 -1.35 -1.83 115.31 118.42 2flf h LEU 167 Ca 0.05 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 2flf h LEU 167 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2flf h LEU 167 CO 0.10 0.09 -0.26 -0.08 0.09 0.00 0.00 178.44 178.38 2flf h GLU 168 N 0.00 0.24 0.35 1.13 4.81 -0.71 -2.00 114.58 118.42 2flf h GLU 168 Ca -0.00 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.01 2flf h GLU 168 Cb 0.79 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 2flf h GLU 168 CO 0.01 0.88 -0.28 0.00 -0.73 0.00 0.00 179.01 178.89 2flf h ALA 169 N 0.37 -0.63 -0.76 2.92 0.00 -1.10 -0.68 119.26 119.38 2flf h ALA 169 Ca -0.02 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 54.91 2flf h ALA 169 Cb 0.94 0.38 -0.09 0.00 0.00 0.00 0.00 17.79 19.02 2flf h ALA 169 CO 0.05 -0.88 0.34 -0.92 0.00 0.00 0.00 179.25 177.84 2flf h TYR 170 N -0.64 0.59 -0.59 0.00 5.03 -1.40 0.21 116.97 120.17 2flf h TYR 170 Ca -0.03 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.31 2flf h TYR 170 Cb 0.55 -0.15 -0.03 0.00 1.55 0.00 0.00 36.73 38.66 2flf h TYR 170 CO -0.14 0.13 0.33 0.78 -1.32 0.00 0.00 178.16 177.93 2flf h GLY 171 N 0.52 0.88 1.01 1.82 0.00 -1.01 -2.03 103.07 104.25 2flf h GLY 171 Ca 0.41 -0.39 0.01 0.00 0.00 0.00 0.00 47.33 47.35 2flf h GLY 171 CO -0.36 0.38 0.37 1.41 0.00 0.00 0.00 176.54 178.34 2flf h LEU 172 N 0.80 0.64 -0.65 3.11 3.38 0.49 0.58 115.31 123.67 2flf h LEU 172 Ca 0.21 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.21 2flf h LEU 172 Cb 0.03 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 2flf h LEU 172 CO -0.03 0.47 0.37 -0.03 0.09 0.00 0.00 178.44 179.30 2flf h MET 173 N 0.76 0.68 -0.90 1.13 4.05 -0.86 0.20 114.93 119.99 2flf h MET 173 Ca 0.21 -0.04 0.01 0.00 -0.28 0.00 0.00 59.70 59.59 2flf h MET 173 Cb -0.09 -0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 30.51 2flf h MET 173 CO -0.04 0.45 0.59 1.15 0.23 0.00 0.00 176.91 179.29 2flf h THR 174 N 0.70 1.23 -0.50 -0.77 2.02 -0.56 -2.27 112.91 112.75 2flf h THR 174 Ca 0.28 -0.43 -0.12 0.00 0.77 0.00 0.00 66.41 66.92 2flf h THR 174 Cb 0.14 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.44 2flf h THR 174 CO -0.16 0.22 -0.15 0.74 0.37 0.00 0.00 175.52 176.55 2flf h THR 175 N 1.22 1.27 -0.79 3.16 2.02 0.39 -2.55 112.91 117.62 2flf h THR 175 Ca 0.33 -1.30 0.04 0.00 0.77 0.00 0.00 66.41 66.25 2flf h THR 175 Cb -0.14 1.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.28 2flf h THR 175 CO -0.07 0.45 0.50 0.25 0.37 0.00 0.00 175.52 177.02 2flf h LEU 176 N 0.84 0.80 -0.75 2.58 5.85 -0.17 -0.62 115.31 123.84 2flf h LEU 176 Ca 0.12 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 2flf h LEU 176 Cb 0.71 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 2flf h LEU 176 CO 0.05 0.54 -0.55 -0.08 -0.34 0.00 0.00 178.44 178.07 2flf h GLU 177 N 0.95 0.22 0.35 1.25 4.57 -1.34 -1.97 114.58 118.61 2flf h GLU 177 Ca 0.33 -0.14 -0.02 0.00 -1.18 0.00 0.00 59.36 58.35 2flf h GLU 177 Cb 0.07 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.68 2flf h GLU 177 CO -0.13 0.71 -0.17 1.49 -1.18 0.00 0.00 179.01 179.73 2flf h GLU 178 N 0.17 -0.46 -0.39 1.92 4.81 -0.95 -1.99 114.58 117.70 2flf h GLU 178 Ca 0.00 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.34 2flf h GLU 178 Cb 1.02 0.10 -0.08 0.00 0.63 0.00 0.00 28.75 30.43 2flf h GLU 178 CO 0.08 -0.15 -0.12 0.77 -0.73 0.00 0.00 179.01 178.87 2flf h SER 179 N -0.81 -0.42 -0.39 1.04 0.02 -1.10 -0.18 113.55 111.70 2flf h SER 179 Ca -0.05 0.12 0.03 0.00 -0.84 0.00 0.00 61.79 61.06 2flf h SER 179 Cb 0.53 0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.31 2flf h SER 179 CO 0.08 -0.15 0.26 0.00 -1.14 0.00 0.00 176.83 175.88 2flf h ALA 180 N 1.35 1.86 -0.18 3.77 0.00 -1.37 -0.18 119.26 124.51 2flf h ALA 180 Ca 0.19 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 2flf h ALA 180 Cb 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2flf h ALA 180 CO -0.42 0.09 -0.54 1.96 0.00 0.00 0.00 179.25 180.35 2flf h GLN 181 N 0.41 0.68 -0.29 0.00 4.20 -0.36 -2.37 115.11 117.38 2flf h GLN 181 Ca 0.16 -0.49 -0.04 0.00 0.06 0.00 0.00 58.65 58.33 2flf h GLN 181 Cb 0.13 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 2flf h GLN 181 CO -0.04 1.11 -0.01 0.82 -0.67 0.00 0.00 178.83 180.05 2flf h ILE 182 N 0.37 1.18 0.51 2.54 2.04 -0.27 -1.41 117.51 122.47 2flf h ILE 182 Ca -0.02 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.12 2flf h ILE 182 Cb 1.16 0.97 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 2flf h ILE 182 CO 0.11 0.24 -0.30 -0.07 0.00 0.00 0.00 178.15 178.13 2flf h LEU 183 N 0.42 -0.75 -0.06 1.44 3.38 -0.83 0.54 115.31 119.45 2flf h LEU 183 Ca 0.09 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2flf h LEU 183 Cb 0.29 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2flf h LEU 183 CO 0.01 -0.47 -0.05 0.25 0.09 0.00 0.00 178.44 178.27 2flf h LEU 184 N -0.75 -0.17 -0.67 1.67 5.85 -1.01 0.40 115.31 120.62 2flf h LEU 184 Ca -0.07 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.82 2flf h LEU 184 Cb 0.60 0.07 -0.11 0.00 0.37 0.00 0.00 40.66 41.59 2flf h LEU 184 CO 0.08 -0.03 0.04 1.88 -0.34 0.00 0.00 178.44 180.07 2flf h TYR 185 N -0.02 0.03 -0.99 1.25 0.99 -1.33 0.75 116.97 117.65 2flf h TYR 185 Ca 0.01 0.05 0.11 0.00 2.00 0.00 0.00 58.73 60.89 2flf h TYR 185 Cb 0.05 0.09 -0.08 0.00 1.00 0.00 0.00 36.73 37.79 2flf h TYR 185 CO -0.74 -0.16 0.63 1.25 -0.00 0.00 0.00 178.16 179.13 2flf h HIS 186 N 0.15 1.12 0.13 4.88 -0.00 0.14 -0.15 115.15 121.42 2flf h HIS 186 Ca 0.36 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.76 2flf h HIS 186 Cb 0.60 -0.36 0.00 0.00 -0.00 0.00 0.00 27.41 27.66 2flf h HIS 186 CO -0.35 0.48 -0.06 -0.09 -0.00 0.00 0.00 177.93 177.90 2flf h ARG 187 N 1.01 -0.17 -0.72 5.26 2.43 0.45 -1.54 114.38 121.10 2flf h ARG 187 Ca 0.47 0.01 0.15 0.00 -0.81 0.00 0.00 59.98 59.81 2flf h ARG 187 Cb 0.43 0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 29.89 2flf h ARG 187 CO -0.24 0.30 -0.06 -0.07 -1.51 0.00 0.00 179.97 178.40 2flf h LEU 188 N -0.77 -0.45 0.63 3.80 3.38 0.67 0.22 115.31 122.79 2flf h LEU 188 Ca -0.02 0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 2flf h LEU 188 Cb 0.54 0.37 0.01 0.00 0.09 0.00 0.00 40.66 41.67 2flf h LEU 188 CO 0.03 -0.19 -0.30 -0.25 0.09 0.00 0.00 178.44 177.82 2flf h TRP 189 N 0.06 -0.78 0.00 1.13 2.91 -1.06 -2.10 115.95 116.11 2flf h TRP 189 Ca 0.37 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.37 2flf h TRP 189 Cb 0.62 0.26 0.00 0.00 -0.51 0.00 0.00 29.16 29.53 2flf h TRP 189 CO -0.46 -0.45 0.00 0.94 -1.03 0.00 0.00 178.44 177.44 2flf n GLN 190 N -5.36 0.00 0.23 2.65 7.27 -0.58 -2.45 117.38 119.13 2flf n GLN 190 Ca -0.12 0.22 0.08 0.00 0.07 0.00 0.00 57.00 57.26 2flf n GLN 190 Cb 0.36 -1.09 0.23 0.00 2.41 0.00 0.00 30.24 32.15 2flf n GLN 190 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2flf h GLY 191 N 0.00 0.00 1.00 1.69 0.00 -0.74 -3.51 103.07 101.52 2flf h GLY 191 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2flf h GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54