#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2flf n ARG 2 N 0.00 0.00 -0.15 2.12 5.12 -1.26 -1.93 116.66 120.56 2flf n ARG 2 Ca 0.00 0.00 -0.04 0.00 -1.93 0.00 0.00 57.85 55.88 2flf n ARG 2 Cb 0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.26 2flf n ARG 2 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2flf n ALA 3 N -0.83 -0.23 -0.11 7.54 0.00 -1.26 -1.06 120.51 124.57 2flf n ALA 3 Ca 0.00 0.30 -0.11 0.00 0.00 0.00 0.00 53.44 53.64 2flf n ALA 3 Cb 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.43 2flf n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2flf h ARG 4 N 0.00 0.54 -0.96 0.00 2.47 -1.82 -1.44 114.38 113.17 2flf h ARG 4 Ca 0.06 -0.16 0.07 0.00 -1.26 0.00 0.00 59.98 58.69 2flf h ARG 4 Cb 0.15 -0.05 -0.07 0.00 -1.65 0.00 0.00 29.97 28.35 2flf h ARG 4 CO -0.33 0.66 0.62 -0.07 0.56 0.00 0.00 179.97 181.41 2flf h LEU 5 N 0.35 0.96 0.19 3.04 3.38 -1.31 -0.36 115.31 121.57 2flf h LEU 5 Ca 0.09 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2flf h LEU 5 Cb 0.41 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2flf h LEU 5 CO 0.01 0.60 -0.09 0.22 0.09 0.00 0.00 178.44 179.27 2flf h TYR 6 N 1.08 -0.24 -0.50 1.13 3.20 -0.96 -0.21 116.97 120.47 2flf h TYR 6 Ca 0.42 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.39 2flf h TYR 6 Cb 0.24 0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.49 2flf h TYR 6 CO -0.00 0.13 -0.16 0.00 -1.64 0.00 0.00 178.16 176.49 2flf h ALA 7 N -0.00 0.27 -0.41 1.82 0.00 -0.91 1.41 119.26 121.44 2flf h ALA 7 Ca -0.03 0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.13 2flf h ALA 7 Cb 0.48 0.44 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 2flf h ALA 7 CO 0.04 -0.48 0.09 0.00 0.00 0.00 0.00 179.25 178.91 2flf h ALA 8 N 1.42 0.45 0.02 0.00 0.00 -1.06 0.39 119.26 120.49 2flf h ALA 8 Ca 0.24 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2flf h ALA 8 Cb 0.41 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2flf h ALA 8 CO -0.54 -0.31 -0.03 0.74 0.00 0.00 0.00 179.25 179.12 2flf h PHE 9 N 0.23 -0.08 0.09 0.00 -1.00 0.16 0.49 116.94 116.82 2flf h PHE 9 Ca 0.20 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.98 2flf h PHE 9 Cb 0.23 0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.81 2flf h PHE 9 CO -0.19 -0.05 -0.10 -0.09 -1.61 0.00 0.00 178.31 176.27 2flf h ARG 10 N -0.07 -0.21 -0.11 1.51 2.43 0.23 -0.13 114.38 118.03 2flf h ARG 10 Ca 0.01 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2flf h ARG 10 Cb 0.07 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 2flf h ARG 10 CO -0.02 -0.14 -0.21 0.37 -1.51 0.00 0.00 179.97 178.46 2flf h GLN 11 N -0.21 -0.18 -0.86 0.20 4.15 0.01 0.29 115.11 118.51 2flf h GLN 11 Ca 0.01 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.54 2flf h GLN 11 Cb 0.21 0.04 -0.12 0.00 0.21 0.00 0.00 27.48 27.82 2flf h GLN 11 CO -0.04 -0.12 -0.53 0.28 -1.93 0.00 0.00 178.83 176.49 2flf h VAL 12 N -0.18 0.01 -0.51 2.39 2.07 -0.74 0.74 116.25 120.03 2flf h VAL 12 Ca 0.02 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.69 2flf h VAL 12 Cb 0.24 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 2flf h VAL 12 CO -0.20 0.00 0.40 1.23 0.02 0.00 0.00 177.57 179.02 2flf h GLY 13 N -0.09 0.00 1.23 2.17 0.00 -0.01 0.73 103.07 107.10 2flf h GLY 13 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.18 2flf h GLY 13 CO -0.87 0.00 -1.52 0.83 0.00 0.00 0.00 176.54 174.98 2flf h GLU 14 N 0.00 0.46 0.09 4.80 5.08 0.41 -3.10 114.58 122.33 2flf h GLU 14 Ca 0.24 -0.79 -0.27 0.00 -1.00 0.00 0.00 59.36 57.54 2flf h GLU 14 Cb 1.05 0.30 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 2flf h GLU 14 CO -0.00 1.37 -1.29 -0.44 -1.00 0.00 0.00 179.01 177.65 2flf h ASP 15 N 0.13 0.30 -0.80 1.42 3.45 -0.69 -3.02 116.42 117.22 2flf h ASP 15 Ca -0.26 -0.36 0.07 0.00 0.43 0.00 0.00 57.03 56.92 2flf h ASP 15 Cb 2.13 -0.10 -0.05 0.00 -0.56 0.00 0.00 39.33 40.75 2flf h ASP 15 CO 0.24 1.29 0.52 -0.07 -1.57 0.00 0.00 179.24 179.65 2flf h LEU 16 N 0.05 0.73 0.36 1.55 -0.00 0.35 -2.57 115.31 115.78 2flf h LEU 16 Ca -0.14 0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.73 2flf h LEU 16 Cb 1.94 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 42.46 2flf h LEU 16 CO 0.17 0.46 -0.17 0.15 -0.00 0.00 0.00 178.44 179.05 2flf h PHE 17 N 0.83 -0.45 -0.89 1.13 3.57 -1.55 -2.41 116.94 117.17 2flf h PHE 17 Ca 0.35 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.99 2flf h PHE 17 Cb 0.30 0.15 -0.15 0.00 2.79 0.00 0.00 35.95 39.04 2flf h PHE 17 CO -0.00 -0.28 -0.36 0.00 -2.23 0.00 0.00 178.31 175.44 2flf h ALA 18 N -1.44 0.15 0.00 2.41 0.00 -1.39 0.50 119.26 119.49 2flf h ALA 18 Ca -0.05 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2flf h ALA 18 Cb 0.37 0.92 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2flf h ALA 18 CO 0.08 -0.61 0.00 0.94 0.00 0.00 0.00 179.25 179.66 2flf n GLN 19 N -5.47 0.13 -3.47 0.00 -0.06 -0.98 -4.76 117.38 102.77 2flf n GLN 19 Ca 0.09 0.00 -0.18 0.00 -2.00 0.00 0.00 57.00 54.91 2flf n GLN 19 Cb 0.39 -1.28 0.08 0.00 -4.06 0.00 0.00 30.24 25.38 2flf n GLN 19 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2flf n GLY 20 N -0.58 -0.36 0.11 1.69 0.00 0.17 -4.91 105.19 101.31 2flf n GLY 20 Ca 0.02 0.11 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 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 -4.18 1.65 -3.81 0.99 4.77 -0.91 -4.66 117.00 110.85 2flf n LEU 21 Ca -0.28 0.25 -0.26 0.00 -0.03 0.00 0.00 56.01 55.70 2flf n LEU 21 Cb 0.67 -0.39 -0.17 0.00 -2.33 0.00 0.00 43.42 41.19 2flf n LEU 21 CO 0.62 0.62 -0.40 0.27 -1.33 0.00 0.00 177.39 177.18 2flf s ILE 22 N -2.57 0.68 0.09 -0.08 -5.25 -1.24 -2.54 121.20 110.29 2flf s ILE 22 Ca -0.14 -0.25 0.03 0.00 -0.99 0.00 0.00 60.65 59.30 2flf s ILE 22 Cb 0.07 -0.89 -0.04 0.00 2.95 0.00 0.00 42.46 44.56 2flf s ILE 22 CO 0.79 0.16 0.10 -0.94 -1.79 0.00 0.00 174.94 173.26 2flf s SER 23 N 1.83 5.63 -1.61 4.36 1.04 -1.26 -4.11 113.70 119.58 2flf s SER 23 Ca 0.03 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.47 2flf s SER 23 Cb -0.14 -1.54 0.00 0.00 0.10 0.00 0.00 66.02 64.44 2flf s SER 23 CO -0.07 0.16 0.00 0.00 0.98 0.00 0.00 173.24 174.31 2flf n ALA 24 N 0.34 -0.23 -4.15 5.32 0.00 -1.26 -1.05 120.51 119.47 2flf n ALA 24 Ca -0.08 0.25 -0.35 0.00 0.00 0.00 0.00 53.44 53.25 2flf n ALA 24 Cb 0.52 -1.83 -0.04 0.00 0.00 0.00 0.00 19.45 18.10 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 -2.36 -0.71 0.00 0.00 -2.24 -1.26 -4.71 114.28 103.00 2flf n THR 25 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2flf n THR 25 Cb 0.60 -1.32 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 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 -4.13 0.00 -0.89 6.98 0.00 -0.22 -4.35 120.51 117.90 2flf n ALA 26 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2flf n ALA 26 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 3.80 -0.28 3.61 0.00 0.00 -1.26 -4.83 105.19 106.23 2flf n GLY 27 Ca 0.00 -0.87 -0.01 0.00 0.00 0.00 0.00 46.02 45.15 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 -4.00 -0.03 -0.28 1.61 2.20 0.26 -4.96 114.94 109.74 2flf s ASN 28 Ca 0.00 -0.01 -0.20 0.00 -0.94 0.00 0.00 52.86 51.70 2flf s ASN 28 Cb 0.00 0.04 0.09 0.00 -2.00 0.00 0.00 41.25 39.39 2flf s ASN 28 CO 0.00 -0.07 0.80 0.72 -2.94 0.00 0.00 177.10 175.60 2flf s PHE 29 N -2.12 -0.81 0.14 1.54 -0.12 -1.26 -0.04 117.98 115.31 2flf s PHE 29 Ca 0.12 1.77 0.02 0.00 -0.05 0.00 0.00 56.93 58.80 2flf s PHE 29 Cb 0.02 0.43 -0.01 0.00 -0.63 0.00 0.00 43.02 42.83 2flf s PHE 29 CO -0.04 -0.40 0.08 -1.13 -0.05 0.00 0.00 175.22 173.69 2flf n SER 30 N 3.38 0.39 -3.69 1.98 3.41 0.26 -3.83 113.62 115.51 2flf n SER 30 Ca -0.17 -1.85 -0.13 0.00 -0.26 0.00 0.00 58.87 56.46 2flf n SER 30 Cb 0.57 0.53 -0.13 0.00 -0.26 0.00 0.00 64.21 64.92 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 -2.33 -0.25 0.58 -3.33 -7.23 -1.16 -1.78 120.40 104.90 2flf s VAL 31 Ca 0.12 0.23 -0.18 0.00 -1.81 0.00 0.00 61.98 60.34 2flf s VAL 31 Cb 0.01 -0.41 -0.08 0.00 0.56 0.00 0.00 36.38 36.46 2flf s VAL 31 CO 0.08 0.10 0.58 -1.14 -0.31 0.00 0.00 175.10 174.41 2flf n ARG 32 N 4.88 0.54 -2.26 4.82 0.63 0.20 -3.03 116.66 122.45 2flf n ARG 32 Ca -0.14 0.21 -0.02 0.00 -0.92 0.00 0.00 57.85 56.98 2flf n ARG 32 Cb 0.51 -1.76 -0.01 0.00 0.45 0.00 0.00 32.46 31.65 2flf n ARG 32 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2flf n THR 33 N -1.73 0.00 -0.01 5.15 -2.24 0.82 -4.85 114.28 111.42 2flf n THR 33 Ca 0.12 -0.27 -0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2flf n THR 33 Cb 0.48 0.12 0.28 0.00 -2.10 0.00 0.00 70.33 69.12 2flf n THR 33 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2flf h LYS 34 N 0.00 0.54 0.00 -0.78 1.57 -2.00 -3.31 116.57 112.59 2flf h LYS 34 Ca -0.03 -0.12 -0.38 0.00 -1.87 0.00 0.00 60.65 58.25 2flf h LYS 34 Cb 0.13 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 2flf h LYS 34 CO 0.04 0.57 -2.38 0.41 -0.57 0.00 0.00 179.45 177.53 2flf n GLY 35 N -0.85 -0.36 0.00 3.86 0.00 -1.26 -5.07 105.19 101.50 2flf n GLY 35 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 1.98 -1.11 3.46 -0.02 0.00 -1.25 -3.82 105.19 104.44 2flf n GLY 36 Ca -0.45 0.58 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 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 0.28 -0.56 -0.37 1.61 -0.12 -0.86 -0.13 117.98 117.84 2flf s PHE 37 Ca 0.00 0.91 -0.13 0.00 -0.05 0.00 0.00 56.93 57.67 2flf s PHE 37 Cb 0.00 0.35 0.01 0.00 -0.63 0.00 0.00 43.02 42.76 2flf s PHE 37 CO 0.00 -0.58 0.24 -1.17 -0.05 0.00 0.00 175.22 173.66 2flf s LEU 38 N -1.30 4.76 0.34 -1.99 2.96 -1.17 -0.85 118.68 121.43 2flf s LEU 38 Ca -0.11 -0.82 0.10 0.00 -0.22 0.00 0.00 54.13 53.08 2flf s LEU 38 Cb -0.01 -2.09 -0.06 0.00 0.50 0.00 0.00 46.19 44.53 2flf s LEU 38 CO 0.08 -0.36 -0.07 -0.51 -1.32 0.00 0.00 176.35 174.17 2flf s ILE 39 N 1.63 2.39 -0.10 6.68 2.07 -1.01 -3.00 121.20 129.87 2flf s ILE 39 Ca 0.04 -2.14 -0.21 0.00 -1.41 0.00 0.00 60.65 56.93 2flf s ILE 39 Cb -0.19 -2.67 -0.04 0.00 0.13 0.00 0.00 42.46 39.69 2flf s ILE 39 CO 0.08 -0.22 0.59 0.42 -1.91 0.00 0.00 174.94 173.91 2flf s THR 40 N -2.57 5.11 0.92 4.00 -4.23 -1.25 -1.24 115.64 116.39 2flf s THR 40 Ca 0.33 1.20 -0.12 0.00 -1.18 0.00 0.00 61.69 61.92 2flf s THR 40 Cb 0.01 -3.93 0.06 0.00 1.34 0.00 0.00 72.50 69.98 2flf s THR 40 CO 0.17 0.28 0.61 0.29 -0.54 0.00 0.00 174.62 175.43 2flf n LYS 41 N 3.81 -0.27 -3.36 3.99 5.02 -0.05 -3.92 118.16 123.38 2flf n LYS 41 Ca -0.04 -0.03 -0.38 0.00 -2.02 0.00 0.00 58.31 55.84 2flf n LYS 41 Cb 0.51 -1.99 -0.06 0.00 -0.02 0.00 0.00 35.03 33.47 2flf n LYS 41 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2flf s SER 42 N -2.12 6.97 -0.62 4.39 1.04 -1.21 -4.30 113.70 117.85 2flf s SER 42 Ca 0.60 1.15 -0.01 0.00 0.48 0.00 0.00 55.95 58.17 2flf s SER 42 Cb -0.23 -2.32 -0.01 0.00 0.10 0.00 0.00 66.02 63.57 2flf s SER 42 CO 0.64 0.29 0.52 0.61 0.98 0.00 0.00 173.24 176.29 2flf n GLY 43 N 1.76 -0.02 3.11 7.32 0.00 -1.26 -4.88 105.19 111.22 2flf n GLY 43 Ca -0.12 -0.10 -0.09 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 -3.19 0.16 -0.75 1.61 0.11 -1.26 -5.09 120.40 111.98 2flf s VAL 44 Ca 0.05 -1.29 -0.26 0.00 -2.93 0.00 0.00 61.98 57.55 2flf s VAL 44 Cb -0.01 -1.06 -0.01 0.00 -1.53 0.00 0.00 36.38 33.77 2flf s VAL 44 CO 0.39 -0.71 1.71 -1.10 -3.33 0.00 0.00 175.10 172.05 2flf s GLN 45 N -3.02 2.84 0.20 1.54 -1.52 -1.26 -4.70 119.66 113.74 2flf s GLN 45 Ca -0.01 0.03 -0.10 0.00 -1.95 0.00 0.00 55.36 53.33 2flf s GLN 45 Cb 0.01 -4.60 0.12 0.00 -0.22 0.00 0.00 33.01 28.33 2flf s GLN 45 CO -0.07 -2.69 1.76 0.87 -0.25 0.00 0.00 175.29 174.92 2flf h LYS 46 N 12.48 1.05 0.00 2.91 1.57 -1.89 0.58 116.57 133.26 2flf h LYS 46 Ca -0.13 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 2flf h LYS 46 Cb 1.09 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2flf h LYS 46 CO 1.25 0.85 0.00 0.00 -0.57 0.00 0.00 179.45 180.99 2flf n ALA 47 N -2.39 1.45 -2.82 3.86 0.00 -1.23 -1.11 120.51 118.27 2flf n ALA 47 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2flf n ALA 47 Cb 0.16 -1.03 0.05 0.00 0.00 0.00 0.00 19.45 18.63 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 -1.13 1.62 -1.70 0.00 1.74 0.15 -4.68 116.66 112.67 2flf n ARG 48 Ca 0.01 -3.37 -0.44 0.00 -0.77 0.00 0.00 57.85 53.28 2flf n ARG 48 Cb 0.01 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 29.95 2flf n ARG 48 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2flf n LEU 49 N -0.56 3.63 -4.41 0.55 7.94 -0.27 -4.87 117.00 119.01 2flf n LEU 49 Ca 0.06 1.11 -0.21 0.00 -1.11 0.00 0.00 56.01 55.87 2flf n LEU 49 Cb 0.82 -1.50 -0.10 0.00 0.53 0.00 0.00 43.42 43.17 2flf n LEU 49 CO 0.06 -0.13 -0.38 0.42 -1.11 0.00 0.00 177.39 176.25 2flf s THR 50 N 0.42 1.64 0.03 1.96 -4.23 -1.26 -4.80 115.64 109.40 2flf s THR 50 Ca 0.71 -2.14 0.10 0.00 -1.18 0.00 0.00 61.69 59.18 2flf s THR 50 Cb -0.59 -2.38 0.10 0.00 1.34 0.00 0.00 72.50 70.98 2flf s THR 50 CO 0.43 -0.35 1.18 -2.65 -0.54 0.00 0.00 174.62 172.69 2flf n PRO 51 N -0.54 0.07 -2.33 3.99 -0.02 -1.26 -1.61 135.00 133.30 2flf n PRO 51 Ca -0.06 0.53 -0.20 0.00 -2.02 0.00 0.00 63.50 61.76 2flf n PRO 51 Cb 0.63 -2.10 0.02 0.00 -0.02 0.00 0.00 33.50 32.03 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 -1.95 3.06 -0.00 -0.52 4.71 -1.26 -4.60 120.64 120.08 2flf n GLU 52 Ca -0.01 -4.08 0.00 0.00 -0.01 0.00 0.00 57.16 53.06 2flf n GLU 52 Cb 0.38 -2.08 0.00 0.00 -1.01 0.00 0.00 31.44 28.73 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 1.05 -4.28 1.62 10.43 -0.63 -5.05 116.55 119.12 2flf n ASP 53 Ca 0.34 -1.53 -0.15 0.00 2.57 0.00 0.00 54.79 56.02 2flf n ASP 53 Cb 0.84 -0.00 -0.10 0.00 1.84 0.00 0.00 41.12 43.70 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 -0.53 2.29 -0.16 0.64 1.43 -1.26 -0.88 118.68 120.22 2flf s LEU 54 Ca 0.00 -1.14 -0.29 0.00 -1.03 0.00 0.00 54.13 51.67 2flf s LEU 54 Cb 0.00 -0.25 0.10 0.00 0.03 0.00 0.00 46.19 46.07 2flf s LEU 54 CO 0.00 -0.46 0.86 -1.48 0.23 0.00 0.00 176.35 175.50 2flf s LEU 55 N -3.23 -0.53 0.61 1.79 0.05 -0.37 -4.91 118.68 112.09 2flf s LEU 55 Ca 0.23 0.73 -0.18 0.00 0.05 0.00 0.00 54.13 54.96 2flf s LEU 55 Cb 0.05 2.16 -0.03 0.00 -2.05 0.00 0.00 46.19 46.33 2flf s LEU 55 CO 0.05 -0.38 1.20 -1.61 -0.55 0.00 0.00 176.35 175.05 2flf s GLU 56 N -0.69 2.88 -0.27 1.48 0.41 -1.25 -2.40 118.70 118.85 2flf s GLU 56 Ca -0.04 1.77 0.00 0.00 -0.41 0.00 0.00 54.97 56.30 2flf s GLU 56 Cb -0.02 -1.92 0.15 0.00 -1.78 0.00 0.00 34.13 30.56 2flf s GLU 56 CO 0.03 -1.27 0.41 0.08 -0.49 0.00 0.00 175.26 174.02 2flf s VAL 57 N -1.71 -0.65 0.89 2.63 1.01 -0.03 -4.74 120.40 117.80 2flf s VAL 57 Ca 0.76 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 62.43 2flf s VAL 57 Cb -0.29 -0.93 0.13 0.00 0.00 0.00 0.00 36.38 35.29 2flf s VAL 57 CO 0.35 -0.21 1.09 -2.16 0.00 0.00 0.00 175.10 174.18 2flf s PRO 58 N 2.57 1.26 0.00 2.72 0.04 -1.26 -2.02 135.00 138.31 2flf s PRO 58 Ca 0.11 1.02 0.26 0.00 0.04 0.00 0.00 61.00 62.43 2flf s PRO 58 Cb -0.14 -1.79 1.05 0.00 0.04 0.00 0.00 34.50 33.66 2flf s PRO 58 CO -0.25 -2.29 1.73 1.28 0.04 0.00 0.00 177.00 177.51 2flf n LEU 59 N -3.94 1.32 0.13 -3.56 4.32 -1.25 -4.15 117.00 109.87 2flf n LEU 59 Ca 0.08 -0.48 -0.05 0.00 -0.02 0.00 0.00 56.01 55.53 2flf n LEU 59 Cb 0.54 -0.03 -0.03 0.00 -1.62 0.00 0.00 43.42 42.28 2flf n LEU 59 CO 0.54 0.24 0.31 -0.33 -1.22 0.00 0.00 177.39 176.93 2flf h GLU 60 N 1.95 -0.33 0.00 3.23 5.08 -1.91 -3.49 114.58 119.10 2flf h GLU 60 Ca 0.00 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2flf h GLU 60 Cb 0.42 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2flf h GLU 60 CO 0.00 -0.22 0.00 0.41 -1.00 0.00 0.00 179.01 178.20 2flf n GLY 61 N 0.01 1.62 3.57 -3.84 0.00 -1.26 -5.09 105.19 100.19 2flf n GLY 61 Ca -0.04 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 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 0.00 2.52 -0.42 1.61 0.02 -1.26 -4.92 135.00 132.54 2flf s PRO 62 Ca 0.00 1.41 -0.19 0.00 0.02 0.00 0.00 61.00 62.25 2flf s PRO 62 Cb 0.00 -4.47 0.02 0.00 0.02 0.00 0.00 34.50 30.07 2flf s PRO 62 CO 0.00 -2.81 0.53 0.42 -0.33 0.00 0.00 177.00 174.80 2flf s ILE 63 N 10.39 4.98 0.71 2.83 1.01 -1.26 -4.60 121.20 135.25 2flf s ILE 63 Ca 0.92 -0.11 -0.16 0.00 0.00 0.00 0.00 60.65 61.30 2flf s ILE 63 Cb -0.20 -4.10 0.01 0.00 0.01 0.00 0.00 42.46 38.18 2flf s ILE 63 CO 0.28 -0.48 1.06 -0.81 0.00 0.00 0.00 174.94 174.99 2flf n PRO 64 N 5.88 0.60 -2.81 2.79 -0.04 -1.26 -4.99 135.00 135.18 2flf n PRO 64 Ca -0.05 0.26 -0.27 0.00 -0.04 0.00 0.00 63.50 63.40 2flf n PRO 64 Cb 0.48 -2.31 -0.01 0.00 -0.04 0.00 0.00 33.50 31.62 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 -3.41 3.58 0.00 0.54 -1.05 -1.26 -3.90 118.70 113.20 2flf s GLU 65 Ca 0.75 0.16 0.00 0.00 -0.15 0.00 0.00 54.97 55.74 2flf s GLU 65 Cb -0.35 -2.43 0.00 0.00 -0.44 0.00 0.00 34.13 30.91 2flf s GLU 65 CO 0.48 -0.11 0.00 0.41 0.95 0.00 0.00 175.26 176.99 2flf n GLY 66 N -1.96 2.33 3.78 -3.83 0.00 -1.26 -5.04 105.19 99.22 2flf n GLY 66 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.50 3.08 0.19 4.61 0.00 -1.25 -3.31 121.76 122.57 2flf s ALA 67 Ca 0.00 0.68 -0.29 0.00 0.00 0.00 0.00 51.96 52.36 2flf s ALA 67 Cb 0.00 -3.27 -0.17 0.00 0.00 0.00 0.00 23.12 19.68 2flf s ALA 67 CO 0.00 -0.20 0.57 0.45 0.00 0.00 0.00 175.76 176.58 2flf n SER 68 N -0.11 -1.10 0.05 0.00 2.88 -1.25 -4.45 113.62 109.64 2flf n SER 68 Ca 0.05 1.13 0.03 0.00 -1.33 0.00 0.00 58.87 58.75 2flf n SER 68 Cb 0.50 -0.96 0.40 0.00 -0.75 0.00 0.00 64.21 63.40 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 1.15 1.14 0.00 2.46 2.07 -1.94 0.14 116.25 121.27 2flf h VAL 69 Ca -0.30 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 66.73 2flf h VAL 69 Cb 1.44 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2flf h VAL 69 CO 0.58 0.18 0.00 -0.62 0.02 0.00 0.00 177.57 177.72 2flf n GLU 70 N -4.37 0.94 0.22 1.57 1.02 -1.26 -3.92 120.64 114.84 2flf n GLU 70 Ca 0.01 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.29 2flf n GLU 70 Cb 0.17 -1.25 0.53 0.00 -0.02 0.00 0.00 31.44 30.87 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 0.00 0.00 0.35 1.62 0.02 -1.27 0.32 113.55 114.59 2flf h SER 71 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2flf h SER 71 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2flf h SER 71 CO 0.00 0.00 -0.17 0.58 -1.14 0.00 0.00 176.83 176.10 2flf h VAL 72 N 0.00 0.61 -0.61 2.27 2.07 -1.82 -2.92 116.25 115.85 2flf h VAL 72 Ca 0.09 -0.58 0.10 0.00 0.82 0.00 0.00 66.70 67.14 2flf h VAL 72 Cb 1.39 0.88 -0.08 0.00 -1.52 0.00 0.00 31.29 31.96 2flf h VAL 72 CO -0.00 0.10 0.20 0.58 0.02 0.00 0.00 177.57 178.47 2flf h VAL 73 N -0.81 0.72 -0.55 2.57 2.07 -0.67 -0.82 116.25 118.76 2flf h VAL 73 Ca -0.05 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.37 2flf h VAL 73 Cb 0.52 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 2flf h VAL 73 CO 0.08 0.06 0.36 0.45 0.02 0.00 0.00 177.57 178.55 2flf h HIS 74 N 0.36 0.65 -0.03 1.57 3.86 -1.58 -2.12 115.15 117.86 2flf h HIS 74 Ca 0.32 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.54 2flf h HIS 74 Cb 0.43 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 28.68 2flf h HIS 74 CO -0.19 0.39 -0.00 -0.09 0.86 0.00 0.00 177.93 178.90 2flf h ARG 75 N 0.68 0.05 -0.10 2.45 2.43 -0.97 -2.44 114.38 116.48 2flf h ARG 75 Ca 0.21 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.40 2flf h ARG 75 Cb 0.01 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2flf h ARG 75 CO -0.05 0.35 0.08 1.49 -1.51 0.00 0.00 179.97 180.33 2flf h GLU 76 N -0.26 0.00 -0.08 0.20 4.57 -0.75 0.68 114.58 118.94 2flf h GLU 76 Ca 0.01 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.07 2flf h GLU 76 Cb 0.33 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.93 2flf h GLU 76 CO 0.00 0.00 -0.40 0.28 -1.18 0.00 0.00 179.01 177.71 2flf h VAL 77 N 0.00 1.40 -0.21 0.32 2.07 -1.31 -2.25 116.25 116.27 2flf h VAL 77 Ca 0.05 -1.78 -0.08 0.00 0.82 0.00 0.00 66.70 65.70 2flf h VAL 77 Cb 0.21 2.29 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 2flf h VAL 77 CO -0.00 0.52 -0.22 1.88 0.02 0.00 0.00 177.57 179.77 2flf h TYR 78 N -0.04 0.42 0.00 1.57 0.99 -0.52 0.37 116.97 119.75 2flf h TYR 78 Ca -0.03 -0.08 0.00 0.00 2.00 0.00 0.00 58.73 60.63 2flf h TYR 78 Cb 1.06 -0.11 0.00 0.00 1.00 0.00 0.00 36.73 38.68 2flf h TYR 78 CO 0.12 0.58 -0.06 -2.13 -0.00 0.00 0.00 178.16 176.68 2flf n ARG 79 N -4.16 0.21 0.00 4.88 0.63 0.22 -4.21 116.66 114.23 2flf n ARG 79 Ca -0.00 0.16 0.00 0.00 -0.92 0.00 0.00 57.85 57.08 2flf n ARG 79 Cb 0.37 -1.73 0.00 0.00 0.45 0.00 0.00 32.46 31.55 2flf n ARG 79 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2flf n ARG 80 N -2.08 -0.01 -4.22 -0.14 1.74 -0.85 -5.05 116.66 106.06 2flf n ARG 80 Ca 0.06 -0.22 -0.13 0.00 -0.77 0.00 0.00 57.85 56.79 2flf n ARG 80 Cb 0.41 -0.59 -0.10 0.00 -1.02 0.00 0.00 32.46 31.16 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 -0.04 0.82 0.32 0.55 2.01 0.11 -4.92 115.64 114.48 2flf s THR 81 Ca 0.00 -1.98 0.31 0.00 0.31 0.00 0.00 61.69 60.33 2flf s THR 81 Cb 0.00 -1.87 0.34 0.00 0.01 0.00 0.00 72.50 70.98 2flf s THR 81 CO 0.00 -0.71 2.06 1.23 -0.69 0.00 0.00 174.62 176.51 2flf h GLY 82 N 2.82 0.00 -3.77 4.40 0.00 -1.87 -3.42 103.07 101.23 2flf h GLY 82 Ca -0.36 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.47 2flf h GLY 82 CO 0.64 0.00 0.01 0.00 0.00 0.00 0.00 176.54 177.19 2flf n ALA 83 N -2.18 -2.49 0.27 3.60 0.00 -1.26 -4.87 120.51 113.58 2flf n ALA 83 Ca -0.01 0.37 0.03 0.00 0.00 0.00 0.00 53.44 53.83 2flf n ALA 83 Cb 0.26 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 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 0.93 4.58 -3.67 0.00 5.12 0.23 -4.76 116.66 119.09 2flf n ARG 84 Ca 0.13 -0.09 -0.13 0.00 -1.93 0.00 0.00 57.85 55.82 2flf n ARG 84 Cb 0.06 -0.81 -0.08 0.00 -1.16 0.00 0.00 32.46 30.47 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 -1.44 -1.47 -0.02 7.54 0.00 -0.35 0.62 121.76 126.63 2flf s ALA 85 Ca 0.03 1.68 0.02 0.00 0.00 0.00 0.00 51.96 53.69 2flf s ALA 85 Cb 0.04 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 22.19 2flf s ALA 85 CO 0.22 -0.28 -0.07 -1.17 0.00 0.00 0.00 175.76 174.46 2flf s LEU 86 N 0.35 1.79 -0.24 0.00 2.96 -0.73 0.10 118.68 122.91 2flf s LEU 86 Ca -0.00 -0.15 -0.02 0.00 -0.22 0.00 0.00 54.13 53.74 2flf s LEU 86 Cb -0.04 -0.45 0.07 0.00 0.50 0.00 0.00 46.19 46.28 2flf s LEU 86 CO 0.00 0.05 0.04 -0.69 -1.32 0.00 0.00 176.35 174.43 2flf s VAL 87 N 0.19 0.81 -0.20 1.68 1.01 0.77 -0.58 120.40 124.08 2flf s VAL 87 Ca -0.02 -0.94 -0.07 0.00 0.00 0.00 0.00 61.98 60.94 2flf s VAL 87 Cb -0.07 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 2flf s VAL 87 CO 0.00 -0.35 0.06 -2.28 0.00 0.00 0.00 175.10 172.54 2flf s HIS 88 N 1.70 3.20 0.36 5.22 2.46 0.94 0.45 115.29 129.63 2flf s HIS 88 Ca 0.02 -0.04 -0.08 0.00 0.47 0.00 0.00 55.06 55.43 2flf s HIS 88 Cb -0.17 -2.11 0.02 0.00 -0.13 0.00 0.00 32.58 30.19 2flf s HIS 88 CO -0.13 0.04 0.61 0.00 -2.47 0.00 0.00 174.74 172.78 2flf s ALA 89 N 0.64 0.13 -0.43 1.58 0.00 0.18 -0.58 121.76 123.29 2flf s ALA 89 Ca 0.03 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.82 2flf s ALA 89 Cb -0.13 0.96 0.12 0.00 0.00 0.00 0.00 23.12 24.06 2flf s ALA 89 CO 0.02 -0.87 0.17 -1.01 0.00 0.00 0.00 175.76 174.06 2flf s HIS 90 N -2.76 3.55 -0.32 0.00 3.76 -1.05 0.36 115.29 118.83 2flf s HIS 90 Ca 0.24 -2.92 -0.16 0.00 -0.15 0.00 0.00 55.06 52.07 2flf s HIS 90 Cb -0.02 -2.98 -0.02 0.00 1.11 0.00 0.00 32.58 30.67 2flf s HIS 90 CO 0.17 -0.89 0.41 -1.25 -0.85 0.00 0.00 174.74 172.32 2flf s PRO 91 N 0.53 3.72 0.00 8.40 0.04 -1.26 -4.45 135.00 141.98 2flf s PRO 91 Ca 0.13 -0.20 0.00 0.00 0.04 0.00 0.00 61.00 60.96 2flf s PRO 91 Cb -0.22 -3.76 0.00 0.00 0.04 0.00 0.00 34.50 30.56 2flf s PRO 91 CO -0.05 -0.48 0.00 0.54 0.04 0.00 0.00 177.00 177.05 2flf n ARG 92 N 5.46 0.00 -0.33 4.56 1.74 -1.26 0.19 116.66 127.03 2flf n ARG 92 Ca -0.08 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2flf n ARG 92 Cb 0.50 -0.21 0.04 0.00 -1.02 0.00 0.00 32.46 31.77 2flf n ARG 92 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2flf n VAL 93 N 0.00 -0.44 0.17 1.55 0.31 -1.26 0.12 118.33 118.78 2flf n VAL 93 Ca 0.00 1.99 -0.16 0.00 -0.01 0.00 0.00 64.34 66.16 2flf n VAL 93 Cb 0.00 -2.64 -0.09 0.00 -0.91 0.00 0.00 33.84 30.20 2flf n VAL 93 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2flf h ALA 94 N 1.21 -1.04 -1.00 3.52 0.00 -1.81 -0.12 119.26 120.02 2flf h ALA 94 Ca 0.30 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 55.27 2flf h ALA 94 Cb 0.52 0.80 -0.11 0.00 0.00 0.00 0.00 17.79 19.00 2flf h ALA 94 CO -0.85 -1.12 0.61 0.28 0.00 0.00 0.00 179.25 178.18 2flf h VAL 95 N -0.80 0.70 0.15 0.00 2.07 0.64 -2.67 116.25 116.34 2flf h VAL 95 Ca -0.03 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 2flf h VAL 95 Cb 0.75 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 2flf h VAL 95 CO -0.18 0.14 -0.18 0.00 0.02 0.00 0.00 177.57 177.37 2flf h ALA 96 N 1.65 -0.85 -0.84 1.67 0.00 0.26 -2.91 119.26 118.23 2flf h ALA 96 Ca 0.58 -0.06 0.21 0.00 0.00 0.00 0.00 54.91 55.64 2flf h ALA 96 Cb 0.91 0.46 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 2flf h ALA 96 CO -0.38 -0.87 0.57 -0.07 0.00 0.00 0.00 179.25 178.51 2flf h LEU 97 N -0.33 0.24 0.00 0.00 3.38 -0.86 -3.02 115.31 114.72 2flf h LEU 97 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2flf h LEU 97 Cb 0.30 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2flf h LEU 97 CO -0.04 0.10 0.00 -1.20 0.09 0.00 0.00 178.44 177.39 2flf n SER 98 N -4.42 0.00 -1.59 -0.43 7.64 -1.03 -2.95 113.62 110.84 2flf n SER 98 Ca 0.17 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.14 2flf n SER 98 Cb 0.75 0.00 0.36 0.00 -1.01 0.00 0.00 64.21 64.30 2flf n SER 98 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2flf n PHE 99 N -0.42 1.60 0.00 1.43 3.01 -1.14 -4.52 117.46 117.41 2flf n PHE 99 Ca 0.00 -0.67 0.00 0.00 1.01 0.00 0.00 57.45 57.79 2flf n PHE 99 Cb 0.00 -0.33 0.00 0.00 -0.01 0.00 0.00 39.48 39.14 2flf n PHE 99 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 2flf n HIS 100 N 0.78 -0.19 -2.15 1.38 8.25 -1.15 -5.09 115.22 117.04 2flf n HIS 100 Ca 0.26 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.29 2flf n HIS 100 Cb 0.98 0.08 -0.03 0.00 1.12 0.00 0.00 29.99 32.14 2flf n HIS 100 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2flf s LEU 101 N -3.30 4.16 0.00 2.41 1.43 -1.25 -4.84 118.68 117.29 2flf s LEU 101 Ca 0.00 1.91 0.30 0.00 -1.03 0.00 0.00 54.13 55.32 2flf s LEU 101 Cb 0.00 -3.53 1.55 0.00 0.03 0.00 0.00 46.19 44.24 2flf s LEU 101 CO 0.00 -0.98 2.04 -1.20 0.23 0.00 0.00 176.35 176.44 2flf n SER 102 N 7.37 0.28 -3.63 2.29 7.64 -1.26 -4.62 113.62 121.69 2flf n SER 102 Ca 0.17 -0.74 -0.10 0.00 1.01 0.00 0.00 58.87 59.21 2flf n SER 102 Cb 0.44 -0.09 -0.03 0.00 -1.01 0.00 0.00 64.21 63.53 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 -2.26 1.39 -0.23 1.43 0.52 -1.26 -2.84 118.95 115.69 2flf s ARG 103 Ca 0.37 -0.73 -0.01 0.00 -0.52 0.00 0.00 55.73 54.85 2flf s ARG 103 Cb 0.21 0.56 0.07 0.00 0.52 0.00 0.00 34.95 36.30 2flf s ARG 103 CO 0.42 -0.60 0.01 -1.17 0.02 0.00 0.00 175.30 173.98 2flf s LEU 104 N -2.83 1.89 -0.99 2.53 2.96 0.12 -4.93 118.68 117.43 2flf s LEU 104 Ca 0.06 -1.09 -0.04 0.00 -0.22 0.00 0.00 54.13 52.83 2flf s LEU 104 Cb -0.02 -0.86 0.25 0.00 0.50 0.00 0.00 46.19 46.07 2flf s LEU 104 CO -0.06 -0.30 0.97 0.54 -1.32 0.00 0.00 176.35 176.18 2flf n ARG 105 N 4.87 3.13 -1.53 1.98 5.12 -1.26 -1.39 116.66 127.58 2flf n ARG 105 Ca -0.09 -4.49 -0.40 0.00 -1.93 0.00 0.00 57.85 50.95 2flf n ARG 105 Cb 0.45 -2.47 0.02 0.00 -1.16 0.00 0.00 32.46 29.31 2flf n ARG 105 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2flf n PRO 106 N 2.30 0.82 -0.04 5.56 -0.02 -1.26 -4.93 135.00 137.44 2flf n PRO 106 Ca 0.23 0.30 0.04 0.00 -2.02 0.00 0.00 63.50 62.06 2flf n PRO 106 Cb 0.38 -1.81 -0.16 0.00 -0.02 0.00 0.00 33.50 31.88 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 0.51 0.00 -4.71 2.45 4.77 -1.26 -4.68 117.00 114.08 2flf n LEU 107 Ca 0.11 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.73 2flf n LEU 107 Cb 0.43 0.14 0.09 0.00 -2.33 0.00 0.00 43.42 41.75 2flf n LEU 107 CO 0.53 0.14 0.85 0.47 -1.33 0.00 0.00 177.39 178.06 2flf n ASP 108 N -2.36 1.71 0.19 -1.43 8.00 -1.26 -4.91 116.55 116.48 2flf n ASP 108 Ca -0.12 0.74 -0.08 0.00 0.71 0.00 0.00 54.79 56.05 2flf n ASP 108 Cb 0.71 -1.54 -0.04 0.00 -0.02 0.00 0.00 41.12 40.24 2flf n ASP 108 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2flf h LEU 109 N 0.03 -0.41 -1.66 0.64 5.85 -2.01 -2.81 115.31 114.94 2flf h LEU 109 Ca -0.49 0.01 0.29 0.00 0.84 0.00 0.00 57.88 58.53 2flf h LEU 109 Cb 1.33 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 42.42 2flf h LEU 109 CO 0.50 -0.29 0.93 -0.08 -0.34 0.00 0.00 178.44 179.17 2flf h GLU 110 N -0.51 0.00 -0.00 1.25 4.81 -2.00 0.73 114.58 118.85 2flf h GLU 110 Ca -0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2flf h GLU 110 Cb 0.38 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2flf h GLU 110 CO 0.08 0.00 -0.12 0.41 -0.73 0.00 0.00 179.01 178.66 2flf n GLY 111 N -1.68 -1.31 0.11 1.92 0.00 -1.07 -3.50 105.19 99.66 2flf n GLY 111 Ca 0.21 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 2flf n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2flf n GLN 112 N -1.36 0.68 0.27 1.61 6.02 0.25 -3.95 117.38 120.91 2flf n GLN 112 Ca 0.09 0.03 -0.11 0.00 -0.01 0.00 0.00 57.00 57.00 2flf n GLN 112 Cb 0.31 -1.52 -0.05 0.00 1.02 0.00 0.00 30.24 30.00 2flf n GLN 112 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2flf h HIS 113 N 0.00 -0.65 0.00 1.08 2.76 -1.58 -3.29 115.15 113.48 2flf h HIS 113 Ca -0.56 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 57.60 2flf h HIS 113 Cb 2.17 0.21 0.00 0.00 1.55 0.00 0.00 27.41 31.34 2flf h HIS 113 CO 0.01 -0.40 0.00 0.66 -1.30 0.00 0.00 177.93 176.89 2flf n TYR 114 N -4.15 0.00 -1.46 5.26 4.01 -1.23 -4.37 117.16 115.22 2flf n TYR 114 Ca -0.09 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.30 2flf n TYR 114 Cb 0.28 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.23 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 -0.15 3.05 0.02 7.72 4.77 -1.25 -4.70 117.00 126.46 2flf n LEU 115 Ca 0.00 -2.79 0.01 0.00 -0.03 0.00 0.00 56.01 53.19 2flf n LEU 115 Cb 0.00 -1.34 0.03 0.00 -2.33 0.00 0.00 43.42 39.78 2flf n LEU 115 CO 0.00 -1.45 0.53 0.29 -1.33 0.00 0.00 177.39 175.43 2flf n LYS 116 N 7.73 0.01 0.00 3.23 5.02 -1.24 -4.39 118.16 128.52 2flf n LYS 116 Ca 0.47 0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.99 2flf n LYS 116 Cb 0.44 -1.85 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 2flf n LYS 116 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2flf n GLU 117 N -1.28 0.00 -4.47 1.97 2.13 -1.26 -4.94 120.64 112.79 2flf n GLU 117 Ca -0.00 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.57 2flf n GLU 117 Cb 0.33 0.00 -0.17 0.00 0.27 0.00 0.00 31.44 31.88 2flf n GLU 117 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2flf s VAL 118 N -2.00 1.16 -0.11 6.31 1.01 -0.49 -4.85 120.40 121.43 2flf s VAL 118 Ca 0.00 -0.47 -0.15 0.00 0.00 0.00 0.00 61.98 61.36 2flf s VAL 118 Cb 0.00 -1.08 -0.05 0.00 0.00 0.00 0.00 36.38 35.26 2flf s VAL 118 CO 0.00 0.37 0.37 -2.16 0.00 0.00 0.00 175.10 173.68 2flf s PRO 119 N 0.85 4.17 -0.16 2.72 0.04 -1.26 0.16 135.00 141.52 2flf s PRO 119 Ca -0.11 0.27 -0.01 0.00 0.04 0.00 0.00 61.00 61.19 2flf s PRO 119 Cb -0.15 -3.37 -0.01 0.00 0.04 0.00 0.00 34.50 31.00 2flf s PRO 119 CO 0.01 0.34 -0.10 0.08 0.04 0.00 0.00 177.00 177.37 2flf s VAL 120 N 0.10 3.11 0.20 -0.36 1.01 -1.13 -2.42 120.40 120.92 2flf s VAL 120 Ca 0.21 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.65 2flf s VAL 120 Cb -0.14 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 2flf s VAL 120 CO 0.08 0.49 0.05 -0.76 0.00 0.00 0.00 175.10 174.96 2flf s LEU 121 N 0.78 3.45 0.00 3.92 1.43 -1.05 -4.74 118.68 122.46 2flf s LEU 121 Ca -0.04 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 2flf s LEU 121 Cb -0.15 -2.05 0.00 0.00 0.03 0.00 0.00 46.19 44.02 2flf s LEU 121 CO 0.01 0.05 0.00 0.00 0.23 0.00 0.00 176.35 176.64 2flf n ALA 122 N -0.46 0.00 -1.80 4.21 0.00 -1.26 -2.77 120.51 118.44 2flf n ALA 122 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2flf n ALA 122 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2flf n ALA 122 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2flf n PRO 123 N -1.51 0.00 0.00 0.00 -0.04 -1.26 -4.74 135.00 127.45 2flf n PRO 123 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2flf n PRO 123 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2flf n PRO 123 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2flf n LYS 124 N 0.00 0.00 0.00 0.54 5.02 -1.26 -4.69 118.16 117.77 2flf n LYS 124 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2flf n LYS 124 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2flf n LYS 124 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2flf n ALA 128 N -3.00 0.00 -2.06 7.82 0.00 -1.26 -5.19 120.51 116.83 2flf n ALA 128 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 2flf n ALA 128 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 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 0.00 2.50 -1.34 0.00 -4.23 -1.26 -4.78 115.64 106.53 2flf s THR 129 Ca 0.00 -1.05 0.00 0.00 -1.18 0.00 0.00 61.69 59.46 2flf s THR 129 Cb 0.00 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.29 2flf s THR 129 CO 0.00 0.00 0.55 -0.62 -0.54 0.00 0.00 174.62 174.01 2flf n GLU 130 N -2.01 0.00 -0.06 3.99 -0.58 -1.26 -2.08 120.64 118.63 2flf n GLU 130 Ca 0.11 0.12 -0.05 0.00 -0.42 0.00 0.00 57.16 56.92 2flf n GLU 130 Cb 0.61 -1.53 -0.02 0.00 -0.57 0.00 0.00 31.44 29.93 2flf n GLU 130 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2flf n GLU 131 N -1.05 0.40 0.15 3.49 4.71 -1.26 -4.38 120.64 122.69 2flf n GLU 131 Ca 0.00 0.35 -0.14 0.00 -0.01 0.00 0.00 57.16 57.36 2flf n GLU 131 Cb 0.03 -1.42 -0.08 0.00 -1.01 0.00 0.00 31.44 28.97 2flf n GLU 131 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2flf h ALA 132 N -1.18 -0.29 -0.74 0.62 0.00 -1.75 -3.27 119.26 112.64 2flf h ALA 132 Ca 0.00 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.91 2flf h ALA 132 Cb 0.58 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.40 2flf h ALA 132 CO 0.00 -0.67 -0.44 0.00 0.00 0.00 0.00 179.25 178.15 2flf n ALA 133 N -2.22 -0.48 -0.19 0.00 0.00 -0.88 -1.50 120.51 115.24 2flf n ALA 133 Ca -0.09 0.63 -0.09 0.00 0.00 0.00 0.00 53.44 53.89 2flf n ALA 133 Cb 0.14 0.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.57 2flf n ALA 133 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2flf h LEU 134 N 0.00 -1.50 -2.00 0.00 5.85 -1.76 0.28 115.31 116.19 2flf h LEU 134 Ca 0.12 0.24 0.20 0.00 0.84 0.00 0.00 57.88 59.28 2flf h LEU 134 Cb 0.30 0.67 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 2flf h LEU 134 CO -0.70 -0.34 0.51 -1.28 -0.34 0.00 0.00 178.44 176.29 2flf h SER 135 N -0.25 0.00 -0.26 1.25 0.87 -1.34 -0.79 113.55 113.04 2flf h SER 135 Ca 0.17 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.66 2flf h SER 135 Cb 0.57 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 2flf h SER 135 CO -0.67 0.00 -0.13 0.58 -0.53 0.00 0.00 176.83 176.08 2flf h VAL 136 N 0.00 1.30 0.24 2.23 2.07 0.33 -1.91 116.25 120.51 2flf h VAL 136 Ca 0.33 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 2flf h VAL 136 Cb 1.34 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 32.66 2flf h VAL 136 CO -0.00 0.38 -0.13 0.00 0.02 0.00 0.00 177.57 177.84 2flf h ALA 137 N 0.73 -0.34 -0.70 1.67 0.00 -0.75 -1.13 119.26 118.74 2flf h ALA 137 Ca 0.06 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2flf h ALA 137 Cb 0.64 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 2flf h ALA 137 CO 0.04 -0.69 0.46 0.93 0.00 0.00 0.00 179.25 179.99 2flf h GLU 138 N -0.34 0.68 -0.34 0.00 5.08 -1.44 -0.96 114.58 117.25 2flf h GLU 138 Ca -0.03 -0.04 -0.13 0.00 -1.00 0.00 0.00 59.36 58.16 2flf h GLU 138 Cb 0.27 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2flf h GLU 138 CO 0.05 0.45 -0.31 0.00 -1.00 0.00 0.00 179.01 178.19 2flf h ALA 139 N 1.62 0.80 -0.06 3.43 0.00 -0.89 -2.74 119.26 121.43 2flf h ALA 139 Ca 0.31 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2flf h ALA 139 Cb 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2flf h ALA 139 CO -0.10 0.65 0.00 1.28 0.00 0.00 0.00 179.25 181.07 2flf n LEU 140 N -4.07 0.31 0.01 0.00 4.77 -0.41 -2.02 117.00 115.60 2flf n LEU 140 Ca -0.01 -0.16 -0.04 0.00 -0.03 0.00 0.00 56.01 55.77 2flf n LEU 140 Cb 0.48 -0.04 -0.11 0.00 -2.33 0.00 0.00 43.42 41.42 2flf n LEU 140 CO 0.46 0.08 -0.34 0.03 -1.33 0.00 0.00 177.39 176.29 2flf h ARG 141 N 0.33 0.00 0.00 3.23 3.08 -1.12 -3.37 114.38 116.53 2flf h ARG 141 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2flf h ARG 141 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2flf h ARG 141 CO 0.00 0.43 -1.11 0.39 -1.07 0.00 0.00 179.97 178.61 2flf n GLU 142 N -3.00 1.26 -4.28 0.04 1.02 -1.20 -4.99 120.64 109.49 2flf n GLU 142 Ca -0.12 -0.05 -0.23 0.00 -0.02 0.00 0.00 57.16 56.74 2flf n GLU 142 Cb 0.94 -1.10 -0.12 0.00 -0.02 0.00 0.00 31.44 31.13 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 -2.33 1.75 -0.42 -0.32 3.76 -0.86 -5.04 115.29 111.85 2flf s HIS 143 Ca -0.01 -0.43 0.23 0.00 -0.15 0.00 0.00 55.06 54.70 2flf s HIS 143 Cb 0.05 -0.96 0.18 0.00 1.11 0.00 0.00 32.58 32.96 2flf s HIS 143 CO 0.31 0.20 1.22 0.00 -0.85 0.00 0.00 174.74 175.63 2flf h ARG 144 N 4.03 0.00 -3.92 1.40 3.08 -1.86 -3.36 114.38 113.76 2flf h ARG 144 Ca -0.46 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.49 2flf h ARG 144 Cb 1.18 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 31.10 2flf h ARG 144 CO 0.40 0.00 -0.41 0.00 -1.07 0.00 0.00 179.97 178.90 2flf s ALA 145 N -3.27 -0.01 -0.16 0.04 0.00 -1.25 0.96 121.76 118.07 2flf s ALA 145 Ca 0.03 -0.81 -0.30 0.00 0.00 0.00 0.00 51.96 50.88 2flf s ALA 145 Cb 0.10 0.60 0.12 0.00 0.00 0.00 0.00 23.12 23.94 2flf s ALA 145 CO 0.75 -0.53 0.98 0.00 0.00 0.00 0.00 175.76 176.95 2flf s LEU 147 N -0.99 3.63 -0.31 0.00 1.43 -1.01 0.16 118.68 121.58 2flf s LEU 147 Ca -0.02 0.08 -0.02 0.00 -1.03 0.00 0.00 54.13 53.14 2flf s LEU 147 Cb -0.01 -2.00 0.06 0.00 0.03 0.00 0.00 46.19 44.27 2flf s LEU 147 CO 0.02 0.31 0.03 -0.22 0.23 0.00 0.00 176.35 176.72 2flf s LEU 148 N -1.35 4.08 0.01 1.79 0.20 0.62 -2.53 118.68 121.49 2flf s LEU 148 Ca 0.18 -1.35 -0.14 0.00 0.69 0.00 0.00 54.13 53.50 2flf s LEU 148 Cb -0.12 -1.73 -0.07 0.00 -0.43 0.00 0.00 46.19 43.84 2flf s LEU 148 CO 0.08 -0.30 0.38 -1.14 -0.29 0.00 0.00 176.35 175.08 2flf n ARG 149 N 4.63 0.00 0.00 1.98 0.63 -1.11 0.12 116.66 122.90 2flf n ARG 149 Ca -0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.81 2flf n ARG 149 Cb 0.43 -0.54 0.00 0.00 0.45 0.00 0.00 32.46 32.81 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 0.56 0.55 0.00 5.14 0.00 -1.26 -4.74 105.19 105.45 2flf n GLY 150 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 0.33 -5.12 115.22 120.29 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 2.53 4.01 3.13 -1.41 0.00 -1.11 -4.84 105.19 107.51 2flf n GLY 152 Ca 0.00 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.18 1.12 -0.18 4.61 0.00 0.16 -0.27 121.76 126.01 2flf s ALA 153 Ca 0.00 -0.75 -0.02 0.00 0.00 0.00 0.00 51.96 51.19 2flf s ALA 153 Cb 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 2flf s ALA 153 CO 0.00 0.22 -0.10 -0.06 0.00 0.00 0.00 175.76 175.82 2flf s PHE 154 N -0.72 2.88 -0.12 0.00 0.40 0.12 -0.65 117.98 119.90 2flf s PHE 154 Ca 0.02 -0.93 0.00 0.00 -0.60 0.00 0.00 56.93 55.42 2flf s PHE 154 Cb -0.07 -1.98 -0.02 0.00 0.51 0.00 0.00 43.02 41.46 2flf s PHE 154 CO 0.01 -0.46 -0.12 0.00 0.70 0.00 0.00 175.22 175.35 2flf s ALA 155 N 1.02 2.69 -0.09 5.36 0.00 0.17 -1.45 121.76 129.47 2flf s ALA 155 Ca -0.01 -0.89 -0.09 0.00 0.00 0.00 0.00 51.96 50.97 2flf s ALA 155 Cb -0.15 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.72 2flf s ALA 155 CO -0.01 0.32 0.21 0.08 0.00 0.00 0.00 175.76 176.35 2flf s VAL 156 N 0.11 5.38 -0.12 0.00 1.01 0.27 -0.16 120.40 126.89 2flf s VAL 156 Ca -0.05 0.37 0.03 0.00 0.00 0.00 0.00 61.98 62.32 2flf s VAL 156 Cb -0.15 -3.48 0.01 0.00 0.00 0.00 0.00 36.38 32.76 2flf s VAL 156 CO 0.04 0.60 -0.23 -0.83 0.00 0.00 0.00 175.10 174.69 2flf s GLY 157 N -1.07 1.34 0.00 4.51 0.00 0.29 -4.18 107.32 108.22 2flf s GLY 157 Ca 0.18 -1.04 0.09 0.00 0.00 0.00 0.00 44.72 43.95 2flf s GLY 157 CO 0.07 -0.15 0.81 1.04 0.00 0.00 0.00 173.10 174.87 2flf n LEU 158 N 3.83 1.82 -4.77 0.66 4.77 -1.26 0.78 117.00 122.84 2flf n LEU 158 Ca -0.20 -1.03 -0.39 0.00 -0.03 0.00 0.00 56.01 54.36 2flf n LEU 158 Cb 0.52 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 2flf n LEU 158 CO 0.27 0.36 0.87 -0.54 -1.33 0.00 0.00 177.39 177.02 2flf s LYS 159 N -0.80 4.29 0.04 3.23 1.02 -1.26 -4.80 119.74 121.46 2flf s LYS 159 Ca 0.11 1.93 -0.09 0.00 0.02 0.00 0.00 55.97 57.94 2flf s LYS 159 Cb 0.08 -2.92 -0.03 0.00 -0.52 0.00 0.00 37.83 34.44 2flf s LYS 159 CO 0.12 -0.14 1.15 1.49 -0.92 0.00 0.00 175.35 177.05 2flf h GLU 160 N 3.14 -0.09 -6.26 1.68 4.81 -1.98 -3.38 114.58 112.50 2flf h GLU 160 Ca -0.48 0.01 -0.55 0.00 -0.13 0.00 0.00 59.36 58.20 2flf h GLU 160 Cb 1.23 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 2flf h GLU 160 CO 0.64 -0.06 1.14 0.00 -0.73 0.00 0.00 179.01 180.01 2flf s ALA 161 N -4.28 3.45 0.17 2.92 0.00 -1.26 -4.87 121.76 117.90 2flf s ALA 161 Ca -0.04 0.84 -0.25 0.00 0.00 0.00 0.00 51.96 52.51 2flf s ALA 161 Cb 0.02 -3.81 0.04 0.00 0.00 0.00 0.00 23.12 19.38 2flf s ALA 161 CO 0.17 -1.67 1.57 -1.00 0.00 0.00 0.00 175.76 174.83 2flf h PRO 162 N 10.38 -0.20 -0.74 0.00 0.13 -1.91 0.77 132.00 140.42 2flf h PRO 162 Ca -0.39 0.01 0.13 0.00 -0.87 0.00 0.00 66.00 64.88 2flf h PRO 162 Cb 1.18 0.05 -0.13 0.00 0.13 0.00 0.00 31.00 32.22 2flf h PRO 162 CO 0.97 -0.13 -0.32 1.05 -0.23 0.00 0.00 178.00 179.33 2flf h GLU 163 N -0.21 -0.08 0.26 0.86 4.11 -1.91 0.56 114.58 118.18 2flf h GLU 163 Ca 0.19 0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.61 2flf h GLU 163 Cb 0.56 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2flf h GLU 163 CO -0.71 -0.05 -0.12 0.93 0.07 0.00 0.00 179.01 179.13 2flf h GLU 164 N -0.08 -0.33 -0.99 1.06 5.08 -1.36 -1.64 114.58 116.30 2flf h GLU 164 Ca 0.30 0.02 0.35 0.00 -1.00 0.00 0.00 59.36 59.03 2flf h GLU 164 Cb 0.57 0.08 -0.16 0.00 0.50 0.00 0.00 28.75 29.74 2flf h GLU 164 CO -0.79 -0.04 0.51 0.00 -1.00 0.00 0.00 179.01 177.69 2flf h ALA 165 N 0.03 1.96 -0.06 3.43 0.00 0.24 0.73 119.26 125.58 2flf h ALA 165 Ca -0.04 0.23 -0.25 0.00 0.00 0.00 0.00 54.91 54.85 2flf h ALA 165 Cb 0.45 0.25 0.02 0.00 0.00 0.00 0.00 17.79 18.50 2flf h ALA 165 CO 0.06 -0.70 -0.95 1.25 0.00 0.00 0.00 179.25 178.91 2flf h LEU 166 N 0.19 0.93 -1.57 0.00 5.85 0.22 -1.22 115.31 119.69 2flf h LEU 166 Ca 0.76 -0.69 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2flf h LEU 166 Cb 1.83 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.57 2flf h LEU 166 CO -0.68 1.49 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.82 2flf h LEU 167 N 0.45 0.22 0.04 2.25 3.38 0.12 0.30 115.31 122.06 2flf h LEU 167 Ca -0.10 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 2flf h LEU 167 Cb 1.59 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.29 2flf h LEU 167 CO 0.19 0.29 -0.02 -0.08 0.09 0.00 0.00 178.44 178.91 2flf h GLU 168 N 0.24 -0.05 -0.02 1.13 4.81 0.04 0.20 114.58 120.93 2flf h GLU 168 Ca 0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2flf h GLU 168 Cb 0.20 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 2flf h GLU 168 CO 0.01 0.39 0.01 0.00 -0.73 0.00 0.00 179.01 178.69 2flf h ALA 169 N 0.42 0.03 -0.17 2.92 0.00 -0.75 0.71 119.26 122.42 2flf h ALA 169 Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2flf h ALA 169 Cb 0.47 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 2flf h ALA 169 CO 0.01 -0.48 -0.41 -0.92 0.00 0.00 0.00 179.25 177.45 2flf h TYR 170 N 0.02 -1.18 -0.98 0.00 -0.00 -0.43 -1.09 116.97 113.32 2flf h TYR 170 Ca 0.01 0.05 0.17 0.00 -0.00 0.00 0.00 58.73 58.96 2flf h TYR 170 Cb 0.00 0.54 -0.09 0.00 -0.00 0.00 0.00 36.73 37.18 2flf h TYR 170 CO -0.08 -0.46 0.61 0.78 -0.00 0.00 0.00 178.16 179.00 2flf h GLY 171 N -0.46 1.55 2.00 1.82 0.00 -0.03 -0.34 103.07 107.61 2flf h GLY 171 Ca 0.09 -0.34 -0.13 0.00 0.00 0.00 0.00 47.33 46.94 2flf h GLY 171 CO -0.42 0.01 -0.63 1.41 0.00 0.00 0.00 176.54 176.92 2flf h LEU 172 N 0.75 0.00 -0.06 3.11 3.38 0.30 -1.50 115.31 121.29 2flf h LEU 172 Ca 0.53 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.43 2flf h LEU 172 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2flf h LEU 172 CO -0.30 0.63 -0.23 -0.03 0.09 0.00 0.00 178.44 178.60 2flf h MET 173 N 0.00 0.26 -0.49 1.13 4.05 -0.09 -1.17 114.93 118.62 2flf h MET 173 Ca -0.01 -0.20 0.09 0.00 -0.28 0.00 0.00 59.70 59.31 2flf h MET 173 Cb 1.17 0.04 -0.08 0.00 -0.80 0.00 0.00 31.60 31.92 2flf h MET 173 CO 0.08 0.83 0.02 1.15 0.23 0.00 0.00 176.91 179.22 2flf h THR 174 N -0.26 0.63 -0.54 -0.77 2.02 -1.08 -1.61 112.91 111.30 2flf h THR 174 Ca -0.01 -0.05 0.05 0.00 0.77 0.00 0.00 66.41 67.18 2flf h THR 174 Cb 0.86 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 67.71 2flf h THR 174 CO 0.05 0.02 0.27 0.74 0.37 0.00 0.00 175.52 176.97 2flf h THR 175 N 0.13 0.94 -0.84 3.16 2.02 -1.17 -1.87 112.91 115.28 2flf h THR 175 Ca 0.25 -0.18 0.17 0.00 0.77 0.00 0.00 66.41 67.42 2flf h THR 175 Cb 0.37 0.37 -0.11 0.00 -1.74 0.00 0.00 68.15 67.04 2flf h THR 175 CO -0.40 0.09 0.39 0.25 0.37 0.00 0.00 175.52 176.22 2flf h LEU 176 N 0.52 0.39 0.27 2.58 5.85 -0.20 -2.60 115.31 122.12 2flf h LEU 176 Ca 0.24 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 59.07 2flf h LEU 176 Cb 0.17 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.27 2flf h LEU 176 CO -0.18 0.11 -0.13 -0.33 -0.34 0.00 0.00 178.44 177.57 2flf h GLU 177 N 0.50 -0.35 -1.57 1.25 4.39 -1.15 0.44 114.58 118.09 2flf h GLU 177 Ca 0.49 0.02 0.47 0.00 0.34 0.00 0.00 59.36 60.69 2flf h GLU 177 Cb 0.80 0.08 -0.08 0.00 -0.10 0.00 0.00 28.75 29.44 2flf h GLU 177 CO -0.44 -0.23 1.10 -1.91 -1.16 0.00 0.00 179.01 176.37 2flf n GLU 178 N -3.01 -0.01 -0.09 2.33 2.13 -1.00 0.50 120.64 121.48 2flf n GLU 178 Ca -0.05 0.98 -0.18 0.00 0.66 0.00 0.00 57.16 58.57 2flf n GLU 178 Cb 0.14 -2.16 -0.11 0.00 0.27 0.00 0.00 31.44 29.59 2flf n GLU 178 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 2flf h SER 179 N 0.00 0.00 -1.06 4.31 0.02 -1.24 -3.14 113.55 112.44 2flf h SER 179 Ca 0.80 -0.54 0.29 0.00 -0.84 0.00 0.00 61.79 61.50 2flf h SER 179 Cb 3.05 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 65.48 2flf h SER 179 CO -0.12 1.30 0.67 0.00 -1.14 0.00 0.00 176.83 177.53 2flf h ALA 180 N -0.46 2.17 -0.28 3.77 0.00 0.48 0.89 119.26 125.83 2flf h ALA 180 Ca -0.24 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 2flf h ALA 180 Cb 1.13 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2flf h ALA 180 CO -0.14 -0.64 -0.03 1.96 0.00 0.00 0.00 179.25 180.40 2flf h GLN 181 N 0.39 0.52 0.00 0.00 4.20 -0.89 -2.04 115.11 117.29 2flf h GLN 181 Ca 0.65 -0.18 -0.10 0.00 0.06 0.00 0.00 58.65 59.07 2flf h GLN 181 Cb 1.59 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.32 2flf h GLN 181 CO -0.38 0.70 -0.49 0.82 -0.67 0.00 0.00 178.83 178.80 2flf h ILE 182 N 0.30 1.28 0.00 2.54 2.04 0.50 0.44 117.51 124.60 2flf h ILE 182 Ca 0.08 -1.74 -0.03 0.00 1.00 0.00 0.00 64.86 64.17 2flf h ILE 182 Cb 0.48 1.96 -0.00 0.00 -0.74 0.00 0.00 36.82 38.51 2flf h ILE 182 CO 0.02 0.48 -0.15 -0.07 0.00 0.00 0.00 178.15 178.43 2flf h LEU 183 N 0.00 0.00 0.00 1.44 4.07 0.47 -2.33 115.31 118.96 2flf h LEU 183 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2flf h LEU 183 Cb 0.92 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.66 2flf h LEU 183 CO 0.06 0.15 0.00 -0.11 -1.08 0.00 0.00 178.44 177.47 2flf n LEU 184 N -3.40 1.14 -0.26 1.67 7.94 -0.05 -2.76 117.00 121.27 2flf n LEU 184 Ca -0.00 0.36 -0.00 0.00 -1.11 0.00 0.00 56.01 55.25 2flf n LEU 184 Cb 0.34 -0.26 0.06 0.00 0.53 0.00 0.00 43.42 44.09 2flf n LEU 184 CO 0.31 -0.26 0.67 1.88 -1.11 0.00 0.00 177.39 178.87 2flf h TYR 185 N 0.00 -0.65 -0.27 1.96 0.99 -1.11 0.55 116.97 118.45 2flf h TYR 185 Ca 0.00 0.08 0.07 0.00 2.00 0.00 0.00 58.73 60.87 2flf h TYR 185 Cb 0.00 0.40 -0.07 0.00 1.00 0.00 0.00 36.73 38.06 2flf h TYR 185 CO 0.02 -0.36 -0.21 1.25 -0.00 0.00 0.00 178.16 178.87 2flf h HIS 186 N -0.05 -0.54 -0.84 4.88 2.76 -1.60 0.42 115.15 120.18 2flf h HIS 186 Ca 0.33 0.04 0.10 0.00 -2.20 0.00 0.00 60.37 58.64 2flf h HIS 186 Cb 0.57 0.28 -0.06 0.00 1.55 0.00 0.00 27.41 29.75 2flf h HIS 186 CO -0.65 -0.28 0.54 -0.09 -1.30 0.00 0.00 177.93 176.14 2flf h ARG 187 N -0.19 0.76 0.63 5.26 9.65 -0.39 -2.80 114.38 127.31 2flf h ARG 187 Ca 0.15 -0.05 -0.03 0.00 -1.10 0.00 0.00 59.98 58.95 2flf h ARG 187 Cb 0.42 -0.17 0.01 0.00 -1.39 0.00 0.00 29.97 28.83 2flf h ARG 187 CO -0.39 0.50 -0.30 -0.07 2.80 0.00 0.00 179.97 182.51 2flf h LEU 188 N 0.78 -0.72 0.00 3.80 3.38 0.37 -1.11 115.31 121.82 2flf h LEU 188 Ca 0.39 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2flf h LEU 188 Cb 0.45 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2flf h LEU 188 CO -0.16 -0.34 0.00 1.87 0.09 0.00 0.00 178.44 179.90 2flf n TRP 189 N -5.26 0.00 -0.08 1.13 -0.00 0.11 -2.23 117.44 111.11 2flf n TRP 189 Ca -0.11 0.00 0.06 0.00 -0.00 0.00 0.00 57.50 57.45 2flf n TRP 189 Cb 0.34 -0.38 0.41 0.00 -0.00 0.00 0.00 31.31 31.67 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 0.60 0.00 5.87 4.15 -1.67 -3.52 115.11 120.55 2flf h GLN 190 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2flf h GLN 190 Cb 0.00 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.55 2flf h GLN 190 CO 0.00 0.40 0.00 0.41 -1.93 0.00 0.00 178.83 177.71