#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 -0.31 0.00 2.12 5.12 -1.26 -2.69 116.66 119.64 2flf n ARG 2 Ca 0.00 1.10 0.00 0.00 -1.93 0.00 0.00 57.85 57.02 2flf n ARG 2 Cb 0.00 -1.61 0.00 0.00 -1.16 0.00 0.00 32.46 29.69 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 -3.42 0.00 -0.27 7.54 0.00 -1.26 -0.55 120.51 122.55 2flf n ALA 3 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.49 2flf n ALA 3 Cb 0.18 0.02 0.17 0.00 0.00 0.00 0.00 19.45 19.82 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 0.61 -0.74 0.00 3.08 -1.95 -1.54 114.38 113.84 2flf h ARG 4 Ca 0.00 -0.04 0.11 0.00 0.07 0.00 0.00 59.98 60.12 2flf h ARG 4 Cb 0.00 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 29.86 2flf h ARG 4 CO 0.00 0.41 0.49 1.25 -1.07 0.00 0.00 179.97 181.05 2flf h LEU 5 N 0.63 0.55 -0.34 3.04 5.85 -0.96 0.11 115.31 124.19 2flf h LEU 5 Ca 0.40 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 59.01 2flf h LEU 5 Cb 0.47 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 2flf h LEU 5 CO -0.30 0.32 -0.27 0.22 -0.34 0.00 0.00 178.44 178.06 2flf h TYR 6 N 0.60 0.93 -0.04 1.25 3.20 0.17 -2.27 116.97 120.82 2flf h TYR 6 Ca 0.35 -0.26 0.01 0.00 3.14 0.00 0.00 58.73 61.97 2flf h TYR 6 Cb 0.55 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 2flf h TYR 6 CO -0.00 1.03 0.13 0.00 -1.64 0.00 0.00 178.16 177.68 2flf h ALA 7 N 0.75 1.29 0.00 1.82 0.00 -0.25 -0.74 119.26 122.13 2flf h ALA 7 Ca 0.06 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2flf h ALA 7 Cb 0.84 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 2flf h ALA 7 CO 0.07 -0.15 -0.16 0.00 0.00 0.00 0.00 179.25 179.01 2flf h ALA 8 N 1.78 0.01 -0.86 0.00 0.00 -0.76 -2.57 119.26 116.86 2flf h ALA 8 Ca 0.02 -0.23 0.11 0.00 0.00 0.00 0.00 54.91 54.80 2flf h ALA 8 Cb 0.27 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.13 2flf h ALA 8 CO -0.00 0.14 0.49 0.74 0.00 0.00 0.00 179.25 180.62 2flf h PHE 9 N -1.00 0.89 0.41 0.00 -1.00 -1.31 0.12 116.94 115.05 2flf h PHE 9 Ca -0.02 0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.78 2flf h PHE 9 Cb 0.31 -0.27 -0.00 0.00 3.61 0.00 0.00 35.95 39.59 2flf h PHE 9 CO -0.00 0.34 -0.24 -0.09 -1.61 0.00 0.00 178.31 176.71 2flf h ARG 10 N 0.80 -0.59 -0.22 1.51 9.65 -1.28 0.45 114.38 124.70 2flf h ARG 10 Ca 0.43 0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 59.34 2flf h ARG 10 Cb 0.43 0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.13 2flf h ARG 10 CO -0.27 -0.39 0.12 0.37 2.80 0.00 0.00 179.97 182.60 2flf h GLN 11 N -0.61 0.30 -0.31 0.20 4.15 -0.98 -1.83 115.11 116.02 2flf h GLN 11 Ca -0.05 -0.03 0.07 0.00 0.77 0.00 0.00 58.65 59.41 2flf h GLN 11 Cb 0.50 -0.06 -0.08 0.00 0.21 0.00 0.00 27.48 28.05 2flf h GLN 11 CO 0.06 0.27 -0.24 0.28 -1.93 0.00 0.00 178.83 177.26 2flf h VAL 12 N 0.25 0.38 -0.58 2.39 2.07 -0.61 0.40 116.25 120.55 2flf h VAL 12 Ca 0.08 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.64 2flf h VAL 12 Cb 0.05 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 2flf h VAL 12 CO -0.01 0.00 0.33 1.23 0.02 0.00 0.00 177.57 179.14 2flf h GLY 13 N -0.21 0.83 1.00 2.17 0.00 -0.77 0.43 103.07 106.52 2flf h GLY 13 Ca 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2flf h GLY 13 CO -0.43 0.18 0.22 0.83 0.00 0.00 0.00 176.54 177.33 2flf h GLU 14 N 0.64 0.45 -0.06 4.80 5.08 -0.39 -2.00 114.58 123.10 2flf h GLU 14 Ca 0.25 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2flf h GLU 14 Cb 0.09 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2flf h GLU 14 CO -0.13 0.31 -0.03 -0.44 -1.00 0.00 0.00 179.01 177.72 2flf h ASP 15 N 0.45 0.12 -1.01 1.42 3.45 0.24 -0.86 116.42 120.24 2flf h ASP 15 Ca 0.12 -0.42 0.23 0.00 0.43 0.00 0.00 57.03 57.38 2flf h ASP 15 Cb -0.03 -0.03 -0.11 0.00 -0.56 0.00 0.00 39.33 38.59 2flf h ASP 15 CO -0.03 0.52 0.62 -0.07 -1.57 0.00 0.00 179.24 178.71 2flf h LEU 16 N -0.27 0.65 0.01 1.55 3.38 -0.11 0.56 115.31 121.08 2flf h LEU 16 Ca 0.01 0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 2flf h LEU 16 Cb 0.48 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.23 2flf h LEU 16 CO 0.01 0.17 -0.46 0.15 0.09 0.00 0.00 178.44 178.40 2flf h PHE 17 N 0.60 0.45 -0.06 1.13 3.57 -1.21 -0.93 116.94 120.49 2flf h PHE 17 Ca 0.60 -0.25 -0.13 0.00 3.53 0.00 0.00 57.97 61.72 2flf h PHE 17 Cb 1.16 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 2flf h PHE 17 CO -0.00 1.07 -0.56 0.00 -2.23 0.00 0.00 178.31 176.59 2flf h ALA 18 N 0.28 0.95 0.00 2.41 0.00 -0.55 -2.83 119.26 119.52 2flf h ALA 18 Ca -0.06 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 2flf h ALA 18 Cb 1.20 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2flf h ALA 18 CO 0.09 0.70 -0.01 0.37 0.00 0.00 0.00 179.25 180.40 2flf h GLN 19 N 0.14 0.00 0.00 0.00 5.75 0.04 -3.47 115.11 117.57 2flf h GLN 19 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2flf h GLN 19 Cb 1.03 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.58 2flf h GLN 19 CO 0.08 0.01 0.00 0.41 -2.65 0.00 0.00 178.83 176.68 2flf n GLY 20 N 0.02 0.74 0.79 2.39 0.00 -1.07 -4.97 105.19 103.10 2flf n GLY 20 Ca 0.01 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 2.38 -3.51 0.99 4.77 -0.37 -4.62 117.00 116.63 2flf n LEU 21 Ca 0.00 -0.98 -0.14 0.00 -0.03 0.00 0.00 56.01 54.85 2flf n LEU 21 Cb 0.00 -0.14 -0.05 0.00 -2.33 0.00 0.00 43.42 40.90 2flf n LEU 21 CO 0.00 0.49 0.53 0.27 -1.33 0.00 0.00 177.39 177.35 2flf s ILE 22 N -1.72 0.00 0.98 -0.08 -4.36 -1.15 0.10 121.20 114.97 2flf s ILE 22 Ca 0.34 0.00 -0.15 0.00 -0.26 0.00 0.00 60.65 60.58 2flf s ILE 22 Cb 0.20 -1.00 0.18 0.00 1.25 0.00 0.00 42.46 43.09 2flf s ILE 22 CO 0.29 0.00 1.20 -0.44 0.24 0.00 0.00 174.94 176.23 2flf s SER 23 N -1.59 2.94 0.66 4.36 0.01 -1.26 -4.65 113.70 114.17 2flf s SER 23 Ca -0.05 0.62 0.27 0.00 1.31 0.00 0.00 55.95 58.10 2flf s SER 23 Cb -0.00 -0.93 1.43 0.00 0.21 0.00 0.00 66.02 66.73 2flf s SER 23 CO 0.02 -2.87 1.81 0.00 0.41 0.00 0.00 173.24 172.61 2flf h ALA 24 N -1.73 1.52 0.00 1.44 0.00 -1.98 -3.18 119.26 115.34 2flf h ALA 24 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2flf h ALA 24 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2flf h ALA 24 CO 0.48 -0.47 0.00 0.25 0.00 0.00 0.00 179.25 179.52 2flf n THR 25 N -2.95 0.00 -1.00 0.00 -2.24 -1.26 -2.41 114.28 104.43 2flf n THR 25 Ca -0.00 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 2flf n THR 25 Cb 0.49 1.37 0.24 0.00 -2.10 0.00 0.00 70.33 70.33 2flf n THR 25 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2flf s ALA 26 N 0.00 0.45 0.19 6.98 0.00 -1.20 -4.77 121.76 123.41 2flf s ALA 26 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.10 2flf s ALA 26 Cb 0.00 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.20 2flf s ALA 26 CO 0.00 -3.64 0.00 0.41 0.00 0.00 0.00 175.76 172.53 2flf n GLY 27 N -0.66 -2.13 3.58 0.00 0.00 -1.26 -4.70 105.19 100.03 2flf n GLY 27 Ca 0.12 -1.34 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 2flf n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2flf s ASN 28 N -5.65 -0.37 0.10 1.61 2.20 -0.73 -5.02 114.94 107.07 2flf s ASN 28 Ca 0.00 0.43 -0.11 0.00 -0.94 0.00 0.00 52.86 52.25 2flf s ASN 28 Cb 0.00 0.34 0.01 0.00 -2.00 0.00 0.00 41.25 39.60 2flf s ASN 28 CO 0.00 -0.33 0.25 0.72 -2.94 0.00 0.00 177.10 174.80 2flf s PHE 29 N -1.01 0.07 0.19 1.54 -0.12 -1.26 0.08 117.98 117.47 2flf s PHE 29 Ca -0.01 -0.47 -0.24 0.00 -0.05 0.00 0.00 56.93 56.15 2flf s PHE 29 Cb -0.01 0.02 0.05 0.00 -0.63 0.00 0.00 43.02 42.45 2flf s PHE 29 CO 0.01 -0.59 0.85 -1.54 -0.05 0.00 0.00 175.22 173.90 2flf s SER 30 N -2.85 -0.24 -0.01 1.98 1.04 0.98 -2.71 113.70 111.89 2flf s SER 30 Ca 0.05 -0.44 0.03 0.00 0.48 0.00 0.00 55.95 56.07 2flf s SER 30 Cb 0.04 0.58 -0.01 0.00 0.10 0.00 0.00 66.02 66.73 2flf s SER 30 CO -0.11 -1.05 -0.10 0.68 0.98 0.00 0.00 173.24 173.64 2flf s VAL 31 N -3.53 0.79 0.36 5.02 -7.23 -0.69 0.60 120.40 115.72 2flf s VAL 31 Ca 0.11 -0.43 -0.28 0.00 -1.81 0.00 0.00 61.98 59.57 2flf s VAL 31 Cb -0.03 -0.66 -0.10 0.00 0.56 0.00 0.00 36.38 36.15 2flf s VAL 31 CO 0.03 0.22 1.32 -0.60 -0.31 0.00 0.00 175.10 175.76 2flf s ARG 32 N -0.24 4.21 0.29 4.82 3.52 0.70 -0.57 118.95 131.68 2flf s ARG 32 Ca 0.04 2.23 0.02 0.00 -0.13 0.00 0.00 55.73 57.89 2flf s ARG 32 Cb -0.04 -2.96 -0.06 0.00 -1.56 0.00 0.00 34.95 30.33 2flf s ARG 32 CO -0.00 -0.32 0.08 0.95 -0.81 0.00 0.00 175.30 175.20 2flf s THR 33 N -1.18 0.85 0.00 4.11 -4.23 0.61 -4.81 115.64 110.99 2flf s THR 33 Ca 0.52 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 2flf s THR 33 Cb -0.40 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 70.74 2flf s THR 33 CO 0.53 0.00 0.54 0.29 -0.54 0.00 0.00 174.62 175.44 2flf n LYS 34 N -0.58 0.00 0.00 3.99 5.02 -1.26 -3.15 118.16 122.19 2flf n LYS 34 Ca -0.01 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 2flf n LYS 34 Cb 0.66 -1.02 0.00 0.00 -0.02 0.00 0.00 35.03 34.66 2flf n LYS 34 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2flf n GLY 35 N -0.98 -3.06 0.00 0.72 0.00 -1.26 -4.92 105.19 95.69 2flf n GLY 35 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.46 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 -0.71 0.97 3.21 -0.02 0.00 -1.19 -4.52 105.19 102.94 2flf n GLY 36 Ca 0.00 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 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 0.45 -0.15 -0.16 1.61 -0.12 -0.67 -0.28 117.98 118.66 2flf s PHE 37 Ca 0.00 0.24 -0.11 0.00 -0.05 0.00 0.00 56.93 57.00 2flf s PHE 37 Cb 0.00 0.07 -0.05 0.00 -0.63 0.00 0.00 43.02 42.41 2flf s PHE 37 CO 0.00 -0.35 0.21 -1.17 -0.05 0.00 0.00 175.22 173.86 2flf s LEU 38 N -1.20 4.26 0.06 -1.99 2.96 0.27 -1.66 118.68 121.39 2flf s LEU 38 Ca -0.13 0.41 -0.07 0.00 -0.22 0.00 0.00 54.13 54.12 2flf s LEU 38 Cb -0.05 -2.22 -0.01 0.00 0.50 0.00 0.00 46.19 44.40 2flf s LEU 38 CO 0.03 0.19 0.13 -0.51 -1.32 0.00 0.00 176.35 174.87 2flf s ILE 39 N 0.14 0.15 0.57 6.68 2.07 -0.89 -1.70 121.20 128.21 2flf s ILE 39 Ca 0.13 -1.21 -0.20 0.00 -1.41 0.00 0.00 60.65 57.96 2flf s ILE 39 Cb -0.12 -1.17 -0.04 0.00 0.13 0.00 0.00 42.46 41.26 2flf s ILE 39 CO 0.02 -0.67 1.28 0.42 -1.91 0.00 0.00 174.94 174.08 2flf s THR 40 N -3.31 2.33 1.07 4.00 -4.23 -1.10 -1.17 115.64 113.23 2flf s THR 40 Ca 0.01 0.22 -0.18 0.00 -1.18 0.00 0.00 61.69 60.56 2flf s THR 40 Cb 0.03 -3.10 0.25 0.00 1.34 0.00 0.00 72.50 71.02 2flf s THR 40 CO -0.08 -0.03 1.26 0.29 -0.54 0.00 0.00 174.62 175.53 2flf n LYS 41 N -1.34 -1.92 -3.60 3.99 5.02 0.11 -2.96 118.16 117.46 2flf n LYS 41 Ca 0.12 -1.97 -0.32 0.00 -2.02 0.00 0.00 58.31 54.12 2flf n LYS 41 Cb 0.47 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.96 2flf n LYS 41 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2flf s SER 42 N -5.44 6.54 -1.16 4.39 0.15 0.20 -4.41 113.70 113.97 2flf s SER 42 Ca 0.75 0.69 -0.27 0.00 0.70 0.00 0.00 55.95 57.82 2flf s SER 42 Cb -0.04 -2.13 0.02 0.00 -1.71 0.00 0.00 66.02 62.16 2flf s SER 42 CO 0.54 0.04 0.74 0.61 1.20 0.00 0.00 173.24 176.37 2flf n GLY 43 N 0.15 -0.94 2.95 9.45 0.00 -1.26 -4.99 105.19 110.54 2flf n GLY 43 Ca -0.02 0.41 -0.17 0.00 0.00 0.00 0.00 46.02 46.23 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 -3.47 0.48 -0.35 1.61 0.11 -1.26 -5.07 120.40 112.45 2flf s VAL 44 Ca 0.47 -0.21 -0.28 0.00 -2.93 0.00 0.00 61.98 59.03 2flf s VAL 44 Cb -0.21 -0.44 -0.07 0.00 -1.53 0.00 0.00 36.38 34.13 2flf s VAL 44 CO 0.91 0.16 2.31 0.00 -3.33 0.00 0.00 175.10 175.15 2flf n GLN 45 N 3.25 1.51 0.23 1.54 1.13 -1.26 -4.65 117.38 119.12 2flf n GLN 45 Ca -0.17 0.30 0.15 0.00 -1.94 0.00 0.00 57.00 55.35 2flf n GLN 45 Cb 0.56 -3.22 0.80 0.00 0.11 0.00 0.00 30.24 28.49 2flf n GLN 45 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 2flf h LYS 46 N 16.51 0.00 0.00 -1.09 6.56 -1.80 -0.30 116.57 136.45 2flf h LYS 46 Ca -0.33 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.26 2flf h LYS 46 Cb 1.26 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.92 2flf h LYS 46 CO 1.05 0.00 -0.41 0.00 -2.06 0.00 0.00 179.45 178.03 2flf h ALA 47 N 2.02 0.74 -0.29 3.86 0.00 -1.78 -3.31 119.26 120.50 2flf h ALA 47 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 2flf h ALA 47 Cb 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 17.60 2flf h ALA 47 CO 0.00 0.00 -0.76 0.54 0.00 0.00 0.00 179.25 179.03 2flf n ARG 48 N -2.28 2.02 -1.61 0.00 1.74 -0.14 -4.43 116.66 111.96 2flf n ARG 48 Ca 0.04 -3.41 -0.45 0.00 -0.77 0.00 0.00 57.85 53.26 2flf n ARG 48 Cb 0.45 -1.58 -0.02 0.00 -1.02 0.00 0.00 32.46 30.29 2flf n ARG 48 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2flf n LEU 49 N -0.68 2.15 -4.62 0.55 4.77 -1.12 -4.92 117.00 113.14 2flf n LEU 49 Ca 0.24 1.17 -0.28 0.00 -0.03 0.00 0.00 56.01 57.11 2flf n LEU 49 Cb 0.86 -1.32 -0.11 0.00 -2.33 0.00 0.00 43.42 40.53 2flf n LEU 49 CO 0.11 -1.14 -0.29 0.42 -1.33 0.00 0.00 177.39 175.17 2flf s THR 50 N -0.76 2.03 0.57 -5.08 -4.23 -1.26 -4.89 115.64 102.03 2flf s THR 50 Ca 0.62 -2.00 0.35 0.00 -1.18 0.00 0.00 61.69 59.48 2flf s THR 50 Cb -0.71 -2.98 0.38 0.00 1.34 0.00 0.00 72.50 70.54 2flf s THR 50 CO 0.57 -0.01 2.27 -0.65 -0.54 0.00 0.00 174.62 176.25 2flf h PRO 51 N 1.78 0.00 -0.06 3.99 0.11 -1.98 -0.81 132.00 135.04 2flf h PRO 51 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2flf h PRO 51 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2flf h PRO 51 CO 0.80 0.02 0.00 0.39 -0.21 0.00 0.00 178.00 179.00 2flf n GLU 52 N -3.51 1.32 -0.78 1.05 4.71 -1.26 -3.74 120.64 118.44 2flf n GLU 52 Ca -0.03 -0.48 0.07 0.00 -0.01 0.00 0.00 57.16 56.71 2flf n GLU 52 Cb 0.11 -1.37 0.36 0.00 -1.01 0.00 0.00 31.44 29.52 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 -0.33 5.14 -4.08 1.62 10.43 -0.31 -4.91 116.55 124.11 2flf n ASP 53 Ca 0.17 -2.78 -0.16 0.00 2.57 0.00 0.00 54.79 54.59 2flf n ASP 53 Cb 0.19 -0.65 -0.12 0.00 1.84 0.00 0.00 41.12 42.38 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 -2.37 2.20 0.01 0.64 1.43 -1.25 0.07 118.68 119.42 2flf s LEU 54 Ca 0.49 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.14 2flf s LEU 54 Cb 0.36 -0.32 -0.01 0.00 0.03 0.00 0.00 46.19 46.26 2flf s LEU 54 CO 0.15 -0.10 -0.07 -0.76 0.23 0.00 0.00 176.35 175.81 2flf s LEU 55 N -1.28 2.11 0.63 1.79 1.43 -0.32 -4.89 118.68 118.14 2flf s LEU 55 Ca -0.05 -0.28 -0.12 0.00 -1.03 0.00 0.00 54.13 52.66 2flf s LEU 55 Cb -0.08 -0.26 -0.03 0.00 0.03 0.00 0.00 46.19 45.85 2flf s LEU 55 CO 0.01 -0.03 1.03 -1.61 0.23 0.00 0.00 176.35 175.98 2flf s GLU 56 N -0.70 3.45 -0.24 1.70 0.41 -1.26 -2.10 118.70 119.95 2flf s GLU 56 Ca -0.02 0.84 -0.06 0.00 -0.41 0.00 0.00 54.97 55.32 2flf s GLU 56 Cb -0.05 -2.06 0.12 0.00 -1.78 0.00 0.00 34.13 30.36 2flf s GLU 56 CO 0.00 -0.69 0.49 0.08 -0.49 0.00 0.00 175.26 174.65 2flf s VAL 57 N -3.06 -0.77 0.63 2.63 1.01 -0.66 -4.75 120.40 115.42 2flf s VAL 57 Ca 0.56 0.06 -0.16 0.00 0.00 0.00 0.00 61.98 62.45 2flf s VAL 57 Cb -0.12 -0.82 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 2flf s VAL 57 CO 0.51 0.01 1.10 -2.16 0.00 0.00 0.00 175.10 174.56 2flf s PRO 58 N 2.70 2.99 0.11 2.72 0.04 -1.26 -1.67 135.00 140.63 2flf s PRO 58 Ca 0.03 1.39 0.15 0.00 0.04 0.00 0.00 61.00 62.61 2flf s PRO 58 Cb -0.13 -1.98 0.67 0.00 0.04 0.00 0.00 34.50 33.11 2flf s PRO 58 CO -0.16 -1.10 1.47 1.28 0.04 0.00 0.00 177.00 178.54 2flf n LEU 59 N -2.16 0.25 -3.78 -3.56 4.77 -1.26 -4.61 117.00 106.65 2flf n LEU 59 Ca 0.10 0.58 -0.14 0.00 -0.03 0.00 0.00 56.01 56.52 2flf n LEU 59 Cb 0.52 -0.56 -0.15 0.00 -2.33 0.00 0.00 43.42 40.90 2flf n LEU 59 CO 0.47 -0.46 -0.31 -1.61 -1.33 0.00 0.00 177.39 174.14 2flf s GLU 60 N -3.15 0.01 0.00 3.23 0.41 -1.26 -5.02 118.70 112.91 2flf s GLU 60 Ca 0.04 0.21 0.00 0.00 -0.41 0.00 0.00 54.97 54.81 2flf s GLU 60 Cb 0.07 -0.19 0.00 0.00 -1.78 0.00 0.00 34.13 32.24 2flf s GLU 60 CO 0.25 -0.14 0.00 0.41 -0.49 0.00 0.00 175.26 175.29 2flf n GLY 61 N 4.00 0.13 3.59 -1.39 0.00 -1.26 -4.99 105.19 105.27 2flf n GLY 61 Ca -0.25 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.28 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 3.42 -0.21 1.61 0.02 -1.26 -4.97 135.00 133.60 2flf s PRO 62 Ca 0.00 0.88 -0.29 0.00 0.02 0.00 0.00 61.00 61.61 2flf s PRO 62 Cb 0.00 -4.10 -0.03 0.00 0.02 0.00 0.00 34.50 30.40 2flf s PRO 62 CO 0.00 -1.77 1.61 0.42 -0.33 0.00 0.00 177.00 176.93 2flf s ILE 63 N 6.03 3.70 0.26 2.83 1.01 -1.26 -4.84 121.20 128.92 2flf s ILE 63 Ca 0.62 0.79 -0.31 0.00 0.00 0.00 0.00 60.65 61.76 2flf s ILE 63 Cb -0.14 -3.70 -0.12 0.00 0.01 0.00 0.00 42.46 38.50 2flf s ILE 63 CO 0.30 -0.28 1.58 -0.81 0.00 0.00 0.00 174.94 175.73 2flf n PRO 64 N 7.62 2.54 -2.26 2.79 -0.04 -1.26 -4.92 135.00 139.47 2flf n PRO 64 Ca 0.19 0.91 -0.36 0.00 -0.04 0.00 0.00 63.50 64.19 2flf n PRO 64 Cb 0.45 -2.68 -0.00 0.00 -0.04 0.00 0.00 33.50 31.23 2flf n PRO 64 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2flf s GLU 65 N -0.05 3.55 0.00 0.54 -1.05 -1.26 -3.12 118.70 117.31 2flf s GLU 65 Ca 0.68 1.69 0.00 0.00 -0.15 0.00 0.00 54.97 57.19 2flf s GLU 65 Cb -0.54 -2.20 0.00 0.00 -0.44 0.00 0.00 34.13 30.95 2flf s GLU 65 CO 0.45 -0.70 0.00 0.41 0.95 0.00 0.00 175.26 176.36 2flf n GLY 66 N 0.30 2.53 3.76 -3.83 0.00 -1.26 -5.07 105.19 101.62 2flf n GLY 66 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.33 2.11 0.26 4.61 0.00 -1.18 0.58 121.76 125.81 2flf s ALA 67 Ca 0.00 0.19 -0.28 0.00 0.00 0.00 0.00 51.96 51.87 2flf s ALA 67 Cb 0.00 -3.25 -0.15 0.00 0.00 0.00 0.00 23.12 19.71 2flf s ALA 67 CO 0.00 -1.88 0.74 0.45 0.00 0.00 0.00 175.76 175.07 2flf n SER 68 N -3.59 -0.08 0.25 0.00 2.88 -1.15 -4.33 113.62 107.60 2flf n SER 68 Ca 0.09 1.13 0.07 0.00 -1.33 0.00 0.00 58.87 58.83 2flf n SER 68 Cb 0.54 -1.12 0.61 0.00 -0.75 0.00 0.00 64.21 63.49 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 1.43 1.02 -0.95 2.46 2.07 -1.92 -1.93 116.25 118.43 2flf h VAL 69 Ca -0.34 -0.19 -0.48 0.00 0.82 0.00 0.00 66.70 66.51 2flf h VAL 69 Cb 1.39 1.10 -0.28 0.00 -1.52 0.00 0.00 31.29 31.98 2flf h VAL 69 CO 0.58 0.05 0.60 -0.62 0.02 0.00 0.00 177.57 178.21 2flf n GLU 70 N -4.44 2.37 0.19 1.57 1.02 -1.26 -4.40 120.64 115.69 2flf n GLU 70 Ca -0.03 -2.94 0.03 0.00 -0.02 0.00 0.00 57.16 54.20 2flf n GLU 70 Cb 0.14 -2.15 0.38 0.00 -0.02 0.00 0.00 31.44 29.79 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 1.15 0.00 -0.81 1.62 0.02 -1.68 -2.51 113.55 111.34 2flf h SER 71 Ca 0.59 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.59 2flf h SER 71 Cb 2.78 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 65.26 2flf h SER 71 CO 1.04 0.34 0.49 -0.37 -1.14 0.00 0.00 176.83 177.20 2flf h VAL 72 N 0.00 1.03 -0.31 2.27 -1.51 -1.84 0.29 116.25 116.18 2flf h VAL 72 Ca -0.00 -0.31 -0.03 0.00 -1.23 0.00 0.00 66.70 65.13 2flf h VAL 72 Cb 0.60 0.04 -0.01 0.00 -2.13 0.00 0.00 31.29 29.79 2flf h VAL 72 CO 0.04 0.17 0.08 0.58 -1.23 0.00 0.00 177.57 177.21 2flf h VAL 73 N 0.91 1.21 0.33 7.19 2.07 -1.79 0.09 116.25 126.26 2flf h VAL 73 Ca 0.35 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 2flf h VAL 73 Cb 0.16 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2flf h VAL 73 CO -0.17 0.24 -0.23 0.45 0.02 0.00 0.00 177.57 177.88 2flf h HIS 74 N 0.34 -0.61 -0.90 1.57 3.86 -1.27 -0.78 115.15 117.37 2flf h HIS 74 Ca 0.10 -0.00 0.20 0.00 -1.16 0.00 0.00 60.37 59.50 2flf h HIS 74 Cb 0.28 0.22 -0.11 0.00 1.06 0.00 0.00 27.41 28.85 2flf h HIS 74 CO 0.01 -0.35 0.44 -0.09 0.86 0.00 0.00 177.93 178.80 2flf h ARG 75 N -0.56 0.50 0.11 2.45 2.43 -0.27 0.57 114.38 119.62 2flf h ARG 75 Ca -0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2flf h ARG 75 Cb 0.47 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2flf h ARG 75 CO 0.01 0.33 -0.06 1.49 -1.51 0.00 0.00 179.97 180.24 2flf h GLU 76 N 0.51 -0.15 -0.63 0.20 4.57 -0.37 -2.79 114.58 115.92 2flf h GLU 76 Ca 0.54 0.01 0.10 0.00 -1.18 0.00 0.00 59.36 58.83 2flf h GLU 76 Cb 0.94 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.53 2flf h GLU 76 CO -0.46 0.03 0.42 0.28 -1.18 0.00 0.00 179.01 178.11 2flf h VAL 77 N -0.31 0.91 -0.00 0.32 2.07 0.51 -1.03 116.25 118.71 2flf h VAL 77 Ca -0.02 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2flf h VAL 77 Cb 0.25 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2flf h VAL 77 CO 0.03 0.09 -0.13 -1.22 0.02 0.00 0.00 177.57 176.35 2flf n TYR 78 N -4.48 0.00 -0.06 1.57 0.53 -0.33 -2.49 117.16 111.91 2flf n TYR 78 Ca 0.10 0.00 -0.12 0.00 -1.02 0.00 0.00 57.90 56.86 2flf n TYR 78 Cb 0.36 -0.39 -0.14 0.00 -1.03 0.00 0.00 39.34 38.14 2flf n TYR 78 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 2flf n ARG 79 N -1.42 0.67 -0.21 -0.72 1.74 -0.45 -4.50 116.66 111.77 2flf n ARG 79 Ca 0.08 0.18 0.09 0.00 -0.77 0.00 0.00 57.85 57.43 2flf n ARG 79 Cb 0.32 -1.66 0.18 0.00 -1.02 0.00 0.00 32.46 30.28 2flf n ARG 79 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2flf n ARG 80 N -3.03 2.02 -3.78 5.56 1.74 -0.84 -5.03 116.66 113.30 2flf n ARG 80 Ca -0.27 -2.62 -0.09 0.00 -0.77 0.00 0.00 57.85 54.09 2flf n ARG 80 Cb 1.08 -1.60 -0.04 0.00 -1.02 0.00 0.00 32.46 30.88 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 -2.73 0.02 -0.69 0.55 2.01 -1.04 -4.85 115.64 108.91 2flf s THR 81 Ca 0.34 -0.89 -0.02 0.00 0.31 0.00 0.00 61.69 61.43 2flf s THR 81 Cb 0.29 -1.69 0.35 0.00 0.01 0.00 0.00 72.50 71.46 2flf s THR 81 CO 0.05 -0.10 2.11 0.61 -0.69 0.00 0.00 174.62 176.60 2flf n GLY 82 N -0.35 5.43 3.82 4.40 0.00 -1.26 -4.70 105.19 112.52 2flf n GLY 82 Ca -0.09 -2.23 -0.33 0.00 0.00 0.00 0.00 46.02 43.37 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 -3.55 3.03 0.00 4.61 0.00 -1.26 -4.86 121.76 119.73 2flf s ALA 83 Ca 0.56 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.95 2flf s ALA 83 Cb 0.45 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 20.40 2flf s ALA 83 CO -0.20 0.08 0.00 0.54 0.00 0.00 0.00 175.76 176.18 2flf n ARG 84 N -0.63 4.53 -3.56 0.00 1.74 -0.26 -4.76 116.66 113.72 2flf n ARG 84 Ca 0.07 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 57.00 2flf n ARG 84 Cb 0.54 -0.36 -0.06 0.00 -1.02 0.00 0.00 32.46 31.56 2flf n ARG 84 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2flf s ALA 85 N -0.70 -1.83 -0.07 7.54 0.00 -1.10 -0.22 121.76 125.39 2flf s ALA 85 Ca 0.00 1.56 -0.03 0.00 0.00 0.00 0.00 51.96 53.49 2flf s ALA 85 Cb 0.00 -0.51 0.03 0.00 0.00 0.00 0.00 23.12 22.64 2flf s ALA 85 CO 0.00 -0.34 0.15 -1.17 0.00 0.00 0.00 175.76 174.40 2flf s LEU 86 N -0.76 0.83 -0.14 0.00 2.96 0.20 -0.57 118.68 121.20 2flf s LEU 86 Ca -0.06 0.31 0.02 0.00 -0.22 0.00 0.00 54.13 54.18 2flf s LEU 86 Cb -0.01 0.41 0.01 0.00 0.50 0.00 0.00 46.19 47.09 2flf s LEU 86 CO 0.05 -0.13 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.06 2flf s VAL 87 N 0.99 2.24 -0.37 1.68 1.01 -0.32 -0.01 120.40 125.62 2flf s VAL 87 Ca -0.08 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 2flf s VAL 87 Cb -0.10 -1.91 0.08 0.00 0.00 0.00 0.00 36.38 34.45 2flf s VAL 87 CO -0.05 0.54 0.13 -2.28 0.00 0.00 0.00 175.10 173.44 2flf s HIS 88 N 0.81 3.42 0.00 5.22 2.46 0.11 -1.22 115.29 126.08 2flf s HIS 88 Ca -0.07 -2.03 0.00 0.00 0.47 0.00 0.00 55.06 53.43 2flf s HIS 88 Cb -0.15 -2.72 0.00 0.00 -0.13 0.00 0.00 32.58 29.58 2flf s HIS 88 CO -0.01 -0.88 0.00 0.00 -2.47 0.00 0.00 174.74 171.38 2flf n ALA 89 N 4.66 0.00 -3.37 1.58 0.00 -1.19 -1.78 120.51 120.42 2flf n ALA 89 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.10 2flf n ALA 89 Cb 0.43 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.79 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 -0.01 0.31 -1.80 0.00 8.25 0.12 -2.14 115.22 119.94 2flf n HIS 90 Ca 0.00 -3.62 -0.42 0.00 -0.26 0.00 0.00 57.72 53.42 2flf n HIS 90 Cb 0.00 -0.18 -0.03 0.00 1.12 0.00 0.00 29.99 30.90 2flf n HIS 90 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2flf s PRO 91 N -0.92 4.16 -0.03 -0.41 0.04 -1.26 -4.42 135.00 132.16 2flf s PRO 91 Ca 0.34 2.49 -0.16 0.00 0.04 0.00 0.00 61.00 63.71 2flf s PRO 91 Cb 0.10 -3.65 -0.09 0.00 0.04 0.00 0.00 34.50 30.90 2flf s PRO 91 CO -0.14 -0.81 0.67 0.00 0.04 0.00 0.00 177.00 176.77 2flf h ARG 92 N 8.66 -0.55 -1.00 4.56 3.08 -1.92 -1.20 114.38 126.02 2flf h ARG 92 Ca -0.45 0.04 0.16 0.00 0.07 0.00 0.00 59.98 59.80 2flf h ARG 92 Cb 1.21 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 31.29 2flf h ARG 92 CO 0.94 -0.36 0.62 0.28 -1.07 0.00 0.00 179.97 180.38 2flf h VAL 93 N -1.09 0.79 -0.69 2.04 2.07 -1.92 -1.39 116.25 116.07 2flf h VAL 93 Ca -0.06 -0.29 -0.06 0.00 0.82 0.00 0.00 66.70 67.11 2flf h VAL 93 Cb 0.43 -0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.03 2flf h VAL 93 CO 0.10 0.16 0.20 0.00 0.02 0.00 0.00 177.57 178.05 2flf h ALA 94 N 1.60 0.90 -0.46 1.67 0.00 -1.87 -1.85 119.26 119.26 2flf h ALA 94 Ca 0.55 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 55.14 2flf h ALA 94 Cb 0.73 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2flf h ALA 94 CO -0.34 0.59 -0.08 0.28 0.00 0.00 0.00 179.25 179.70 2flf h VAL 95 N 1.01 1.27 -0.78 0.00 2.07 -0.19 -2.67 116.25 116.95 2flf h VAL 95 Ca 0.22 -1.19 0.02 0.00 0.82 0.00 0.00 66.70 66.57 2flf h VAL 95 Cb 0.32 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 2flf h VAL 95 CO -0.00 0.41 0.51 0.00 0.02 0.00 0.00 177.57 178.50 2flf h ALA 96 N 0.88 1.01 0.00 1.67 0.00 -1.11 -0.77 119.26 120.95 2flf h ALA 96 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2flf h ALA 96 Cb 0.62 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2flf h ALA 96 CO 0.04 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.93 2flf n LEU 97 N -4.57 0.00 0.04 0.00 4.77 -0.71 -3.26 117.00 113.27 2flf n LEU 97 Ca 0.08 0.01 0.04 0.00 -0.03 0.00 0.00 56.01 56.12 2flf n LEU 97 Cb 0.05 -0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.05 2flf n LEU 97 CO 0.35 -0.00 -0.34 -1.20 -1.33 0.00 0.00 177.39 174.87 2flf n SER 98 N -1.01 0.66 0.27 -1.43 7.64 -0.31 -3.90 113.62 115.53 2flf n SER 98 Ca 0.23 0.27 0.18 0.00 1.01 0.00 0.00 58.87 60.57 2flf n SER 98 Cb 0.12 0.60 0.90 0.00 -1.01 0.00 0.00 64.21 64.82 2flf n SER 98 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 2flf h PHE 99 N 0.00 0.00 0.00 1.43 -1.00 -1.51 -3.07 116.94 112.79 2flf h PHE 99 Ca -0.12 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.66 2flf h PHE 99 Cb 1.37 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.93 2flf h PHE 99 CO 0.00 0.00 -0.11 0.72 -1.61 0.00 0.00 178.31 177.31 2flf n HIS 100 N -3.31 0.00 -3.56 -0.55 8.25 -1.26 -5.07 115.22 109.72 2flf n HIS 100 Ca -0.00 -0.21 -0.22 0.00 -0.26 0.00 0.00 57.72 57.03 2flf n HIS 100 Cb 0.32 -0.04 -0.01 0.00 1.12 0.00 0.00 29.99 31.38 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 -0.52 3.20 -0.02 2.41 1.43 -1.16 -5.02 118.68 119.00 2flf s LEU 101 Ca 0.03 -0.87 0.01 0.00 -1.03 0.00 0.00 54.13 52.28 2flf s LEU 101 Cb 0.03 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 44.41 2flf s LEU 101 CO 0.00 -0.85 0.00 -0.24 0.23 0.00 0.00 176.35 175.50 2flf n SER 102 N -1.69 4.40 -4.04 2.29 2.88 -1.26 -4.88 113.62 111.31 2flf n SER 102 Ca 0.04 -0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.46 2flf n SER 102 Cb 0.62 0.42 -0.11 0.00 -0.75 0.00 0.00 64.21 64.39 2flf n SER 102 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2flf s ARG 103 N -2.04 0.48 -0.20 -1.46 0.52 -1.26 0.13 118.95 115.12 2flf s ARG 103 Ca -0.01 -0.75 -0.02 0.00 -0.52 0.00 0.00 55.73 54.43 2flf s ARG 103 Cb 0.01 -0.17 0.00 0.00 0.52 0.00 0.00 34.95 35.30 2flf s ARG 103 CO 0.07 0.02 -0.11 -1.17 0.02 0.00 0.00 175.30 174.13 2flf s LEU 104 N -1.62 2.59 -0.31 2.53 2.96 0.12 -4.90 118.68 120.05 2flf s LEU 104 Ca -0.11 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.35 2flf s LEU 104 Cb -0.09 -1.63 0.08 0.00 0.50 0.00 0.00 46.19 45.05 2flf s LEU 104 CO -0.00 0.01 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.89 2flf s ARG 105 N 1.30 1.85 0.18 1.98 1.81 -1.26 -1.46 118.95 123.35 2flf s ARG 105 Ca 0.04 -1.63 -0.33 0.00 -1.72 0.00 0.00 55.73 52.09 2flf s ARG 105 Cb -0.14 -3.09 -0.15 0.00 -0.45 0.00 0.00 34.95 31.12 2flf s ARG 105 CO -0.06 -0.78 1.26 -2.30 -0.68 0.00 0.00 175.30 172.75 2flf n PRO 106 N 4.35 1.42 0.00 3.54 -0.02 -1.26 -4.90 135.00 138.13 2flf n PRO 106 Ca -0.04 0.51 0.12 0.00 -2.02 0.00 0.00 63.50 62.06 2flf n PRO 106 Cb 0.42 -2.07 0.16 0.00 -0.02 0.00 0.00 33.50 31.99 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 2.18 0.72 -4.88 2.45 4.77 -1.26 -4.67 117.00 116.30 2flf n LEU 107 Ca 0.15 -0.17 -0.36 0.00 -0.03 0.00 0.00 56.01 55.60 2flf n LEU 107 Cb 0.26 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.12 2flf n LEU 107 CO 0.62 0.17 -0.09 1.51 -1.33 0.00 0.00 177.39 178.26 2flf s ASP 108 N -2.94 6.48 0.02 -1.43 -4.77 -1.26 -5.02 116.67 107.75 2flf s ASP 108 Ca 0.12 0.54 -0.04 0.00 -3.30 0.00 0.00 52.55 49.87 2flf s ASP 108 Cb 0.17 -2.09 -0.01 0.00 -1.09 0.00 0.00 42.92 39.90 2flf s ASP 108 CO 0.72 0.32 1.07 -0.11 0.70 0.00 0.00 175.17 177.86 2flf n LEU 109 N 1.48 -0.14 -0.28 2.11 7.94 -1.26 -1.52 117.00 125.33 2flf n LEU 109 Ca -0.15 1.10 0.08 0.00 -1.11 0.00 0.00 56.01 55.94 2flf n LEU 109 Cb 0.54 -0.46 0.21 0.00 0.53 0.00 0.00 43.42 44.23 2flf n LEU 109 CO 0.37 -0.62 0.85 -0.08 -1.11 0.00 0.00 177.39 176.79 2flf h GLU 110 N 0.00 0.11 -0.43 1.96 4.81 -2.00 -0.05 114.58 118.99 2flf h GLU 110 Ca 0.02 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 2flf h GLU 110 Cb 0.06 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 2flf h GLU 110 CO -0.13 0.07 -0.11 0.78 -0.73 0.00 0.00 179.01 178.89 2flf h GLY 111 N 0.11 0.83 2.00 1.92 0.00 -1.77 -2.70 103.07 103.46 2flf h GLY 111 Ca 0.47 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 2flf h GLY 111 CO -0.71 0.57 -0.24 1.46 0.00 0.00 0.00 176.54 177.63 2flf h GLN 112 N 0.69 0.00 -0.00 4.80 4.20 0.05 -0.31 115.11 124.54 2flf h GLN 112 Ca 0.12 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.83 2flf h GLN 112 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 2flf h GLN 112 CO 0.04 0.24 -0.00 1.25 -0.67 0.00 0.00 178.83 179.69 2flf h HIS 113 N 0.00 0.00 0.00 2.96 2.76 -0.97 -3.30 115.15 116.60 2flf h HIS 113 Ca -0.00 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2flf h HIS 113 Cb 0.68 -0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.64 2flf h HIS 113 CO 0.00 0.63 -0.17 1.88 -1.30 0.00 0.00 177.93 178.97 2flf h TYR 114 N -0.63 0.00 -1.93 5.26 0.05 -1.52 -3.40 116.97 114.80 2flf h TYR 114 Ca -0.00 0.00 -0.79 0.00 0.05 0.00 0.00 58.73 57.99 2flf h TYR 114 Cb 0.63 0.00 -0.23 0.00 1.01 0.00 0.00 36.73 38.14 2flf h TYR 114 CO 0.15 0.03 1.45 1.28 -1.05 0.00 0.00 178.16 180.01 2flf n LEU 115 N -4.72 7.56 -0.17 3.88 4.77 -0.13 -4.83 117.00 123.36 2flf n LEU 115 Ca -0.03 -5.24 -0.05 0.00 -0.03 0.00 0.00 56.01 50.67 2flf n LEU 115 Cb 0.10 -1.23 -0.04 0.00 -2.33 0.00 0.00 43.42 39.92 2flf n LEU 115 CO 0.04 2.05 0.22 0.29 -1.33 0.00 0.00 177.39 178.66 2flf n LYS 116 N 0.49 -0.18 -3.73 3.23 5.02 -1.24 -4.29 118.16 117.46 2flf n LYS 116 Ca 0.51 0.68 -0.12 0.00 -2.02 0.00 0.00 58.31 57.36 2flf n LYS 116 Cb 0.26 -1.00 -0.13 0.00 -0.02 0.00 0.00 35.03 34.15 2flf n LYS 116 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2flf s GLU 117 N -5.00 0.25 -0.35 1.97 2.12 -1.26 -4.55 118.70 111.87 2flf s GLU 117 Ca -0.05 0.55 -0.10 0.00 0.36 0.00 0.00 54.97 55.73 2flf s GLU 117 Cb 0.05 -0.07 0.02 0.00 0.26 0.00 0.00 34.13 34.38 2flf s GLU 117 CO 0.26 -0.15 0.18 0.08 -0.54 0.00 0.00 175.26 175.09 2flf s VAL 118 N 1.14 4.51 0.38 3.70 1.01 -0.53 -4.82 120.40 125.79 2flf s VAL 118 Ca -0.08 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 2flf s VAL 118 Cb -0.09 -3.44 -0.09 0.00 0.00 0.00 0.00 36.38 32.76 2flf s VAL 118 CO -0.08 -0.11 1.06 -2.16 0.00 0.00 0.00 175.10 173.81 2flf s PRO 119 N 1.56 4.24 -0.33 2.72 0.04 -1.26 0.15 135.00 142.13 2flf s PRO 119 Ca 0.03 1.57 -0.09 0.00 0.04 0.00 0.00 61.00 62.54 2flf s PRO 119 Cb -0.18 -2.66 0.01 0.00 0.04 0.00 0.00 34.50 31.71 2flf s PRO 119 CO 0.06 -0.08 0.15 0.08 0.04 0.00 0.00 177.00 177.25 2flf s VAL 120 N -1.57 4.39 0.09 -0.36 1.01 0.36 -0.50 120.40 123.82 2flf s VAL 120 Ca 0.55 -0.66 -0.25 0.00 0.00 0.00 0.00 61.98 61.62 2flf s VAL 120 Cb -0.24 -3.32 -0.06 0.00 0.00 0.00 0.00 36.38 32.75 2flf s VAL 120 CO 0.30 -0.04 0.77 -0.76 0.00 0.00 0.00 175.10 175.38 2flf s LEU 121 N 1.55 4.51 -0.40 3.92 1.43 0.92 -4.75 118.68 125.86 2flf s LEU 121 Ca 0.03 1.53 0.03 0.00 -1.03 0.00 0.00 54.13 54.69 2flf s LEU 121 Cb -0.18 -3.26 0.16 0.00 0.03 0.00 0.00 46.19 42.94 2flf s LEU 121 CO 0.05 0.09 0.36 0.00 0.23 0.00 0.00 176.35 177.08 2flf s ALA 122 N -0.48 0.43 0.71 4.21 0.00 -1.26 -1.35 121.76 124.02 2flf s ALA 122 Ca 0.38 -1.72 -0.12 0.00 0.00 0.00 0.00 51.96 50.50 2flf s ALA 122 Cb -0.22 -1.84 0.02 0.00 0.00 0.00 0.00 23.12 21.09 2flf s ALA 122 CO 0.24 -2.08 1.08 -2.14 0.00 0.00 0.00 175.76 172.86 2flf s PRO 123 N 0.73 2.70 0.24 0.00 0.02 -1.26 -5.06 135.00 132.37 2flf s PRO 123 Ca 0.25 1.13 0.01 0.00 0.02 0.00 0.00 61.00 62.42 2flf s PRO 123 Cb -0.08 -1.95 -0.00 0.00 0.02 0.00 0.00 34.50 32.48 2flf s PRO 123 CO -0.09 -1.29 0.05 1.63 -0.33 0.00 0.00 177.00 176.96 2flf n LYS 124 N -3.03 0.99 -4.02 5.54 5.02 -1.26 -5.12 118.16 116.28 2flf n LYS 124 Ca 0.09 -1.90 -0.30 0.00 -2.02 0.00 0.00 58.31 54.17 2flf n LYS 124 Cb 0.53 0.81 -0.16 0.00 -0.02 0.00 0.00 35.03 36.19 2flf n LYS 124 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2flf s THR 125 N -2.21 1.59 0.05 -0.18 -4.23 -1.26 -5.17 115.64 104.24 2flf s THR 125 Ca 0.07 -0.69 -0.10 0.00 -1.18 0.00 0.00 61.69 59.78 2flf s THR 125 Cb 0.00 -1.52 -0.02 0.00 1.34 0.00 0.00 72.50 72.30 2flf s THR 125 CO 0.05 0.42 0.51 0.52 -0.54 0.00 0.00 174.62 175.58 2flf n VAL 126 N 4.76 -0.22 0.00 2.29 0.31 -1.26 -5.33 118.33 118.87 2flf n VAL 126 Ca -0.17 0.81 0.00 0.00 -0.01 0.00 0.00 64.34 64.97 2flf n VAL 126 Cb 0.49 -1.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.42 2flf n VAL 126 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2flf n THR 129 N -4.36 0.00 0.30 2.52 -2.24 -1.26 -5.32 114.28 103.91 2flf n THR 129 Ca 0.01 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 61.96 2flf n THR 129 Cb 0.09 0.00 0.93 0.00 -2.10 0.00 0.00 70.33 69.24 2flf n THR 129 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2flf h GLU 130 N 0.00 0.00 -0.09 -0.78 4.81 -1.98 0.73 114.58 117.27 2flf h GLU 130 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2flf h GLU 130 Cb 0.00 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 2flf h GLU 130 CO 0.00 0.04 0.01 0.93 -0.73 0.00 0.00 179.01 179.26 2flf h GLU 131 N 0.00 0.15 -0.52 1.92 5.08 -2.03 0.23 114.58 119.41 2flf h GLU 131 Ca -0.00 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 2flf h GLU 131 Cb 0.19 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2flf h GLU 131 CO 0.01 0.38 -0.07 0.00 -1.00 0.00 0.00 179.01 178.33 2flf h ALA 132 N 0.76 0.70 0.00 3.43 0.00 -1.51 -1.27 119.26 121.37 2flf h ALA 132 Ca 0.03 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2flf h ALA 132 Cb 0.31 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2flf h ALA 132 CO 0.00 0.58 -0.02 0.00 0.00 0.00 0.00 179.25 179.81 2flf h ALA 133 N 0.92 1.40 0.00 0.00 0.00 0.74 0.36 119.26 122.68 2flf h ALA 133 Ca 0.14 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2flf h ALA 133 Cb 0.62 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2flf h ALA 133 CO 0.04 0.02 -1.17 -0.07 0.00 0.00 0.00 179.25 178.08 2flf h LEU 134 N 0.00 0.00 0.00 0.00 3.38 0.04 -3.14 115.31 115.59 2flf h LEU 134 Ca -0.00 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 2flf h LEU 134 Cb 0.06 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.82 2flf h LEU 134 CO 0.00 0.30 -0.69 -1.28 0.09 0.00 0.00 178.44 176.86 2flf h SER 135 N 0.00 0.61 -0.21 -0.43 0.87 0.14 -2.09 113.55 112.44 2flf h SER 135 Ca -0.08 -0.76 -0.01 0.00 -1.23 0.00 0.00 61.79 59.71 2flf h SER 135 Cb 1.30 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 63.06 2flf h SER 135 CO 0.02 1.29 0.10 0.58 -0.53 0.00 0.00 176.83 178.29 2flf h VAL 136 N -0.01 1.14 -0.21 2.23 2.07 -1.18 0.25 116.25 120.55 2flf h VAL 136 Ca -0.09 -0.40 0.05 0.00 0.82 0.00 0.00 66.70 67.08 2flf h VAL 136 Cb 1.40 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 32.13 2flf h VAL 136 CO 0.14 0.13 -0.14 0.00 0.02 0.00 0.00 177.57 177.72 2flf h ALA 137 N 0.96 0.01 -0.61 1.67 0.00 -1.60 0.41 119.26 120.11 2flf h ALA 137 Ca 0.07 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2flf h ALA 137 Cb 0.12 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2flf h ALA 137 CO -0.01 -0.57 0.09 1.49 0.00 0.00 0.00 179.25 180.25 2flf h GLU 138 N -0.14 0.99 -0.38 0.00 4.22 -1.20 -2.36 114.58 115.71 2flf h GLU 138 Ca 0.12 -0.26 -0.01 0.00 0.08 0.00 0.00 59.36 59.30 2flf h GLU 138 Cb 0.32 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2flf h GLU 138 CO -0.29 0.92 0.20 0.00 -2.18 0.00 0.00 179.01 177.66 2flf h ALA 139 N 1.16 0.49 0.00 2.92 0.00 0.00 -2.58 119.26 121.25 2flf h ALA 139 Ca 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2flf h ALA 139 Cb 0.42 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2flf h ALA 139 CO 0.01 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.57 2flf n LEU 140 N -4.74 0.00 0.09 0.00 4.77 0.14 -2.79 117.00 114.47 2flf n LEU 140 Ca -0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 2flf n LEU 140 Cb 0.09 -0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.09 2flf n LEU 140 CO 0.36 -0.00 0.08 -0.09 -1.33 0.00 0.00 177.39 176.41 2flf h ARG 141 N 0.00 0.35 -0.01 3.23 2.43 -1.01 -3.34 114.38 116.03 2flf h ARG 141 Ca 0.00 -0.45 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2flf h ARG 141 Cb 0.00 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 2flf h ARG 141 CO 0.00 1.15 -0.09 0.39 -1.51 0.00 0.00 179.97 179.92 2flf n GLU 142 N -3.66 1.23 -4.25 0.20 1.02 -1.22 -4.97 120.64 109.00 2flf n GLU 142 Ca -0.07 -0.76 -0.16 0.00 -0.02 0.00 0.00 57.16 56.15 2flf n GLU 142 Cb 0.92 -1.09 -0.10 0.00 -0.02 0.00 0.00 31.44 31.15 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 -0.94 1.32 -0.69 -0.32 3.76 -1.12 -5.05 115.29 112.26 2flf s HIS 143 Ca 0.08 -0.68 0.20 0.00 -0.15 0.00 0.00 55.06 54.51 2flf s HIS 143 Cb 0.07 -0.67 -0.24 0.00 1.11 0.00 0.00 32.58 32.84 2flf s HIS 143 CO 0.15 0.12 0.73 0.54 -0.85 0.00 0.00 174.74 175.44 2flf n ARG 144 N 0.03 0.51 -3.87 1.40 1.74 -1.26 -4.45 116.66 110.76 2flf n ARG 144 Ca -0.12 -0.05 -0.12 0.00 -0.77 0.00 0.00 57.85 56.79 2flf n ARG 144 Cb 0.59 -1.45 -0.13 0.00 -1.02 0.00 0.00 32.46 30.46 2flf n ARG 144 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2flf s ALA 145 N -3.02 -0.11 0.00 7.54 0.00 -1.26 -1.12 121.76 123.79 2flf s ALA 145 Ca 0.03 0.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.97 2flf s ALA 145 Cb 0.14 -0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.22 2flf s ALA 145 CO 0.82 -0.06 0.11 0.00 0.00 0.00 0.00 175.76 176.64 2flf s LEU 147 N -1.30 4.38 -0.47 0.00 1.43 0.34 -0.00 118.68 123.07 2flf s LEU 147 Ca -0.14 0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.44 2flf s LEU 147 Cb -0.08 -2.11 0.12 0.00 0.03 0.00 0.00 46.19 44.16 2flf s LEU 147 CO 0.01 0.40 0.21 -0.22 0.23 0.00 0.00 176.35 176.98 2flf s LEU 148 N -1.09 4.69 -0.27 1.79 2.96 0.37 -0.06 118.68 127.07 2flf s LEU 148 Ca 0.16 -2.62 -0.25 0.00 -0.22 0.00 0.00 54.13 51.20 2flf s LEU 148 Cb -0.12 -1.69 -0.11 0.00 0.50 0.00 0.00 46.19 44.78 2flf s LEU 148 CO 0.05 -0.33 0.96 -1.14 -1.32 0.00 0.00 176.35 174.57 2flf n ARG 149 N 3.68 0.00 -1.07 1.98 0.63 -0.45 0.33 116.66 121.75 2flf n ARG 149 Ca 0.04 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.95 2flf n ARG 149 Cb 0.37 -0.81 -0.01 0.00 0.45 0.00 0.00 32.46 32.46 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 2.80 0.51 2.71 5.14 0.00 -1.26 -4.85 105.19 110.24 2flf n GLY 150 Ca 0.21 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 45.99 2flf n GLY 150 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2flf n HIS 151 N -2.65 -1.11 -4.26 1.61 -0.00 0.15 -5.15 115.22 103.81 2flf n HIS 151 Ca -0.02 -2.03 0.00 0.00 -0.00 0.00 0.00 57.72 55.67 2flf n HIS 151 Cb 0.22 0.96 0.00 0.00 -0.00 0.00 0.00 29.99 31.17 2flf n HIS 151 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2flf n GLY 152 N -0.85 -0.48 3.32 1.57 0.00 -1.21 -4.66 105.19 102.88 2flf n GLY 152 Ca -0.05 -1.09 -0.18 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.26 1.85 -0.03 4.61 0.00 -0.91 -0.48 121.76 125.54 2flf s ALA 153 Ca 0.00 -1.78 0.02 0.00 0.00 0.00 0.00 51.96 50.20 2flf s ALA 153 Cb 0.00 1.18 0.01 0.00 0.00 0.00 0.00 23.12 24.30 2flf s ALA 153 CO 0.00 -0.52 -0.08 -0.06 0.00 0.00 0.00 175.76 175.11 2flf s PHE 154 N -3.67 0.88 -0.04 0.00 0.40 0.99 -3.15 117.98 113.40 2flf s PHE 154 Ca 0.36 -0.23 0.04 0.00 -0.60 0.00 0.00 56.93 56.51 2flf s PHE 154 Cb 0.05 -0.66 -0.00 0.00 0.51 0.00 0.00 43.02 42.92 2flf s PHE 154 CO 0.17 -0.12 -0.16 0.00 0.70 0.00 0.00 175.22 175.81 2flf s ALA 155 N 0.35 1.44 -0.06 5.36 0.00 -0.36 -1.32 121.76 127.17 2flf s ALA 155 Ca -0.05 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.23 2flf s ALA 155 Cb -0.10 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 2flf s ALA 155 CO 0.01 0.26 0.08 0.08 0.00 0.00 0.00 175.76 176.19 2flf s VAL 156 N 0.03 4.87 -0.08 0.00 1.01 -0.28 -1.18 120.40 124.78 2flf s VAL 156 Ca -0.03 -0.19 0.03 0.00 0.00 0.00 0.00 61.98 61.79 2flf s VAL 156 Cb -0.11 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 2flf s VAL 156 CO 0.02 0.49 -0.16 -0.83 0.00 0.00 0.00 175.10 174.62 2flf s GLY 157 N -1.34 1.49 0.00 4.51 0.00 0.27 -4.31 107.32 107.95 2flf s GLY 157 Ca 0.19 -0.96 0.06 0.00 0.00 0.00 0.00 44.72 44.00 2flf s GLY 157 CO 0.09 -0.53 0.51 1.04 0.00 0.00 0.00 173.10 174.20 2flf n LEU 158 N 2.87 1.01 -4.63 0.66 4.77 -1.26 -1.10 117.00 119.32 2flf n LEU 158 Ca -0.18 -0.81 -0.35 0.00 -0.03 0.00 0.00 56.01 54.64 2flf n LEU 158 Cb 0.52 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.71 2flf n LEU 158 CO 0.27 0.22 0.60 0.29 -1.33 0.00 0.00 177.39 177.43 2flf n LYS 159 N -0.22 0.45 -0.04 3.23 4.01 -1.26 -4.89 118.16 119.43 2flf n LYS 159 Ca 0.02 0.21 -0.16 0.00 -0.51 0.00 0.00 58.31 57.88 2flf n LYS 159 Cb 0.12 -2.28 -0.07 0.00 -0.51 0.00 0.00 35.03 32.29 2flf n LYS 159 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 2flf h GLU 160 N -0.40 0.74 -6.54 1.97 3.07 -1.96 -3.43 114.58 108.03 2flf h GLU 160 Ca -0.47 -0.55 -0.53 0.00 -0.50 0.00 0.00 59.36 57.31 2flf h GLU 160 Cb 1.32 0.10 0.01 0.00 -0.84 0.00 0.00 28.75 29.34 2flf h GLU 160 CO 0.47 1.17 0.55 0.00 -1.40 0.00 0.00 179.01 179.80 2flf s ALA 161 N -3.87 3.40 0.01 3.43 0.00 -1.26 -4.95 121.76 118.53 2flf s ALA 161 Ca -0.11 0.87 -0.08 0.00 0.00 0.00 0.00 51.96 52.64 2flf s ALA 161 Cb 0.08 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 2flf s ALA 161 CO 0.88 -0.40 1.12 -1.00 0.00 0.00 0.00 175.76 176.36 2flf h PRO 162 N 6.28 -0.25 -0.89 0.00 0.13 -1.90 -2.17 132.00 133.20 2flf h PRO 162 Ca -0.43 0.02 0.26 0.00 -0.87 0.00 0.00 66.00 64.98 2flf h PRO 162 Cb 1.21 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.37 2flf h PRO 162 CO 0.79 -0.17 0.98 1.05 -0.23 0.00 0.00 178.00 180.42 2flf h GLU 163 N -0.26 0.00 0.00 0.86 -0.00 -1.92 2.37 114.58 115.63 2flf h GLU 163 Ca -0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 59.36 59.23 2flf h GLU 163 Cb 0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 28.94 2flf h GLU 163 CO 0.03 0.00 -0.52 0.93 -0.00 0.00 0.00 179.01 179.45 2flf h GLU 164 N 0.00 0.00 0.08 1.06 5.08 -1.87 -2.29 114.58 116.65 2flf h GLU 164 Ca 0.42 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.52 2flf h GLU 164 Cb 2.37 0.00 0.03 0.00 0.50 0.00 0.00 28.75 31.65 2flf h GLU 164 CO -0.00 0.52 -1.09 0.00 -1.00 0.00 0.00 179.01 177.44 2flf h ALA 165 N 1.48 0.02 0.39 3.43 0.00 0.46 -0.82 119.26 124.22 2flf h ALA 165 Ca -0.01 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 54.16 2flf h ALA 165 Cb 1.38 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2flf h ALA 165 CO 0.07 0.62 -0.19 1.25 0.00 0.00 0.00 179.25 181.00 2flf h LEU 166 N 0.20 -0.44 -2.05 0.00 5.85 -1.29 0.11 115.31 117.69 2flf h LEU 166 Ca -0.16 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.57 2flf h LEU 166 Cb 1.77 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.91 2flf h LEU 166 CO 0.21 -0.22 0.16 -0.07 -0.34 0.00 0.00 178.44 178.18 2flf h LEU 167 N -0.64 0.00 -0.13 2.25 3.38 -1.48 -0.23 115.31 118.45 2flf h LEU 167 Ca -0.05 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2flf h LEU 167 Cb 0.47 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 2flf h LEU 167 CO 0.09 0.00 -0.21 -0.08 0.09 0.00 0.00 178.44 178.33 2flf h GLU 168 N 0.00 0.37 -0.10 1.13 4.81 -0.23 -2.46 114.58 118.10 2flf h GLU 168 Ca 0.10 -0.23 -0.13 0.00 -0.13 0.00 0.00 59.36 58.98 2flf h GLU 168 Cb 0.42 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2flf h GLU 168 CO -0.00 0.81 -0.51 0.00 -0.73 0.00 0.00 179.01 178.58 2flf h ALA 169 N 0.56 0.95 -0.65 2.92 0.00 0.18 -0.96 119.26 122.26 2flf h ALA 169 Ca 0.01 -0.48 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 2flf h ALA 169 Cb 0.78 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 2flf h ALA 169 CO 0.05 0.67 0.14 -0.92 0.00 0.00 0.00 179.25 179.18 2flf h TYR 170 N 0.21 1.09 -0.40 0.00 5.03 -1.13 -0.57 116.97 121.20 2flf h TYR 170 Ca 0.01 -0.13 0.00 0.00 2.58 0.00 0.00 58.73 61.19 2flf h TYR 170 Cb 0.98 -0.31 -0.02 0.00 1.55 0.00 0.00 36.73 38.93 2flf h TYR 170 CO 0.02 0.90 0.27 0.78 -1.32 0.00 0.00 178.16 178.81 2flf h GLY 171 N 1.05 0.56 1.06 1.82 0.00 -0.89 -1.09 103.07 105.59 2flf h GLY 171 Ca 0.20 -0.21 0.01 0.00 0.00 0.00 0.00 47.33 47.33 2flf h GLY 171 CO 0.00 0.21 0.61 1.41 0.00 0.00 0.00 176.54 178.77 2flf h LEU 172 N 0.54 1.10 -0.61 3.11 3.38 -0.75 -2.12 115.31 119.96 2flf h LEU 172 Ca 0.15 -0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.16 2flf h LEU 172 Cb -0.06 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.35 2flf h LEU 172 CO -0.03 0.81 0.27 -0.03 0.09 0.00 0.00 178.44 179.54 2flf h MET 173 N 1.28 0.47 -0.37 1.13 4.05 0.13 0.16 114.93 121.78 2flf h MET 173 Ca 0.34 -0.03 -0.04 0.00 -0.28 0.00 0.00 59.70 59.69 2flf h MET 173 Cb -0.13 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.55 2flf h MET 173 CO -0.07 0.31 0.06 1.79 0.23 0.00 0.00 176.91 179.24 2flf h THR 174 N 0.49 1.24 -0.55 -0.77 1.35 -1.04 -2.05 112.91 111.58 2flf h THR 174 Ca 0.29 -0.84 0.08 0.00 -0.55 0.00 0.00 66.41 65.40 2flf h THR 174 Cb 0.30 1.07 -0.07 0.00 -1.73 0.00 0.00 68.15 67.72 2flf h THR 174 CO -0.25 0.28 0.18 0.74 -0.25 0.00 0.00 175.52 176.22 2flf h THR 175 N 0.46 0.77 0.17 6.82 2.02 -0.55 0.18 112.91 122.77 2flf h THR 175 Ca 0.11 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2flf h THR 175 Cb 0.35 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 2flf h THR 175 CO 0.01 0.06 -0.16 0.25 0.37 0.00 0.00 175.52 176.05 2flf h LEU 176 N 0.35 -0.42 -1.84 2.58 5.85 -0.45 0.13 115.31 121.51 2flf h LEU 176 Ca 0.27 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 2flf h LEU 176 Cb 0.34 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 2flf h LEU 176 CO -0.30 -0.24 -0.04 -0.08 -0.34 0.00 0.00 178.44 177.44 2flf h GLU 177 N -0.35 0.04 -0.02 1.25 4.57 -0.74 0.31 114.58 119.64 2flf h GLU 177 Ca 0.00 -0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 57.97 2flf h GLU 177 Cb 0.33 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 2flf h GLU 177 CO -0.04 0.09 -0.86 1.49 -1.18 0.00 0.00 179.01 178.52 2flf h GLU 178 N 0.04 0.34 -0.19 1.92 4.81 -0.15 -2.17 114.58 119.19 2flf h GLU 178 Ca 0.01 -0.34 -0.16 0.00 -0.13 0.00 0.00 59.36 58.75 2flf h GLU 178 Cb 0.11 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 2flf h GLU 178 CO 0.01 1.01 -0.54 0.77 -0.73 0.00 0.00 179.01 179.53 2flf h SER 179 N 0.20 0.61 -0.54 1.04 0.02 0.61 -1.49 113.55 114.00 2flf h SER 179 Ca -0.05 -0.32 -0.09 0.00 -0.84 0.00 0.00 61.79 60.48 2flf h SER 179 Cb 1.47 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.82 2flf h SER 179 CO 0.14 1.03 -0.01 0.00 -1.14 0.00 0.00 176.83 176.85 2flf h ALA 180 N 0.98 0.73 -0.68 3.77 0.00 -0.91 -0.87 119.26 122.29 2flf h ALA 180 Ca 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2flf h ALA 180 Cb 1.08 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2flf h ALA 180 CO 0.10 0.57 0.37 1.96 0.00 0.00 0.00 179.25 182.24 2flf h GLN 181 N 0.85 0.95 -0.73 0.00 4.20 -1.29 -0.26 115.11 118.83 2flf h GLN 181 Ca 0.15 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 2flf h GLN 181 Cb 0.55 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 2flf h GLN 181 CO 0.03 0.72 0.29 0.82 -0.67 0.00 0.00 178.83 180.02 2flf h ILE 182 N 0.93 1.25 -0.64 2.54 2.04 -0.89 -0.98 117.51 121.77 2flf h ILE 182 Ca 0.24 -0.79 0.01 0.00 1.00 0.00 0.00 64.86 65.31 2flf h ILE 182 Cb 0.05 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 2flf h ILE 182 CO -0.04 0.32 0.42 -0.07 0.00 0.00 0.00 178.15 178.78 2flf h LEU 183 N 1.05 0.74 0.74 1.44 3.38 -0.53 -1.65 115.31 120.49 2flf h LEU 183 Ca 0.24 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 2flf h LEU 183 Cb 0.22 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.79 2flf h LEU 183 CO -0.02 0.54 -0.36 0.25 0.09 0.00 0.00 178.44 178.94 2flf h LEU 184 N 0.87 -0.84 -1.59 1.67 5.85 -0.57 -2.02 115.31 118.67 2flf h LEU 184 Ca 0.23 0.03 0.08 0.00 0.84 0.00 0.00 57.88 59.07 2flf h LEU 184 Cb -0.10 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 2flf h LEU 184 CO -0.05 -0.54 0.40 1.88 -0.34 0.00 0.00 178.44 179.79 2flf h TYR 185 N -1.13 0.49 -0.23 1.25 0.99 -1.23 0.35 116.97 117.47 2flf h TYR 185 Ca -0.10 0.01 -0.04 0.00 2.00 0.00 0.00 58.73 60.60 2flf h TYR 185 Cb 0.76 -0.16 -0.01 0.00 1.00 0.00 0.00 36.73 38.32 2flf h TYR 185 CO 0.03 0.25 -0.05 1.25 -0.00 0.00 0.00 178.16 179.64 2flf h HIS 186 N 0.48 0.36 0.07 4.88 2.76 -1.22 0.23 115.15 122.71 2flf h HIS 186 Ca 0.27 -0.03 -0.29 0.00 -2.20 0.00 0.00 60.37 58.12 2flf h HIS 186 Cb 0.44 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.27 2flf h HIS 186 CO -0.00 0.41 -1.49 -0.09 -1.30 0.00 0.00 177.93 175.45 2flf h ARG 187 N 0.34 0.15 0.00 5.26 2.43 0.31 -3.12 114.38 119.74 2flf h ARG 187 Ca 0.07 -0.25 -0.12 0.00 -0.81 0.00 0.00 59.98 58.88 2flf h ARG 187 Cb 0.31 0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.96 2flf h ARG 187 CO 0.01 0.96 -0.46 -0.07 -1.51 0.00 0.00 179.97 178.90 2flf h LEU 188 N 0.04 0.40 -1.58 3.80 3.38 -0.50 -2.00 115.31 118.85 2flf h LEU 188 Ca -0.22 -0.78 0.03 0.00 0.09 0.00 0.00 57.88 57.00 2flf h LEU 188 Cb 1.97 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 42.57 2flf h LEU 188 CO 0.13 1.12 0.32 -0.25 0.09 0.00 0.00 178.44 179.86 2flf h TRP 189 N -0.29 0.52 -0.27 1.13 2.91 -0.71 -2.34 115.95 116.91 2flf h TRP 189 Ca -0.06 0.01 -0.12 0.00 1.13 0.00 0.00 58.89 59.85 2flf h TRP 189 Cb 1.20 -0.18 -0.00 0.00 -0.51 0.00 0.00 29.16 29.67 2flf h TRP 189 CO 0.16 0.31 -0.32 0.37 -1.03 0.00 0.00 178.44 177.93 2flf h GLN 190 N 0.55 0.69 -1.61 2.65 4.15 -1.52 -3.19 115.11 116.82 2flf h GLN 190 Ca 0.19 -0.38 0.00 0.00 0.77 0.00 0.00 58.65 59.23 2flf h GLN 190 Cb 0.09 0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.80 2flf h GLN 190 CO -0.05 1.00 0.00 0.41 -1.93 0.00 0.00 178.83 178.26 2flf n GLY 191 N 0.22 0.78 0.00 2.39 0.00 -0.76 -4.56 105.19 103.27 2flf n GLY 191 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2flf n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2flf n ALA 192 N 0.81 0.00 -0.18 4.61 0.00 -1.21 -5.05 120.51 119.50 2flf n ALA 192 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2flf n ALA 192 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2flf n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91