#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2atf s LEU 6 N 0.00 4.39 0.31 -4.62 1.43 -1.26 -5.06 118.68 113.87 2atf s LEU 6 Ca 0.00 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.06 2atf s LEU 6 Cb 0.00 -2.68 -0.02 0.00 0.03 0.00 0.00 46.19 43.53 2atf s LEU 6 CO 0.00 -0.60 0.46 -0.76 0.23 0.00 0.00 176.35 175.68 2atf s LEU 7 N 2.59 4.07 -0.01 1.79 1.43 -1.26 -5.05 118.68 122.23 2atf s LEU 7 Ca 0.21 0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.05 2atf s LEU 7 Cb -0.15 -2.91 -0.05 0.00 0.03 0.00 0.00 46.19 43.11 2atf s LEU 7 CO 0.15 -0.31 1.39 -0.75 0.23 0.00 0.00 176.35 177.07 2atf s LYS 8 N -4.16 4.28 0.18 1.70 2.20 -1.26 -4.95 119.74 117.72 2atf s LYS 8 Ca 0.41 1.94 -0.31 0.00 -0.36 0.00 0.00 55.97 57.65 2atf s LYS 8 Cb -0.09 -3.60 -0.10 0.00 -1.51 0.00 0.00 37.83 32.53 2atf s LYS 8 CO 0.32 -0.59 1.50 -2.14 -0.36 0.00 0.00 175.35 174.08 2atf s PRO 9 N 2.52 4.25 0.17 4.03 0.02 -1.26 -4.89 135.00 139.84 2atf s PRO 9 Ca 0.63 2.29 0.11 0.00 0.02 0.00 0.00 61.00 64.05 2atf s PRO 9 Cb -0.31 -3.16 -0.10 0.00 0.02 0.00 0.00 34.50 30.95 2atf s PRO 9 CO 0.26 -0.52 1.28 0.00 -0.33 0.00 0.00 177.00 177.68 2atf h ARG 10 N 6.32 0.00 -3.83 5.54 3.08 -1.92 -3.42 114.38 120.14 2atf h ARG 10 Ca -0.43 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.49 2atf h ARG 10 Cb 1.21 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.17 2atf h ARG 10 CO 0.87 0.73 -0.17 0.95 -1.07 0.00 0.00 179.97 181.28 2atf s THR 11 N -2.81 0.00 0.23 2.04 -4.23 -1.26 -4.96 115.64 104.65 2atf s THR 11 Ca 0.02 -1.50 -0.08 0.00 -1.18 0.00 0.00 61.69 58.95 2atf s THR 11 Cb 0.09 -2.37 0.20 0.00 1.34 0.00 0.00 72.50 71.76 2atf s THR 11 CO 0.79 0.00 1.87 0.25 -0.54 0.00 0.00 174.62 176.99 2atf h LEU 12 N 2.25 1.05 -0.88 4.79 5.85 -1.92 0.11 115.31 126.56 2atf h LEU 12 Ca -0.28 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.33 2atf h LEU 12 Cb 1.25 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 2atf h LEU 12 CO 0.38 0.81 0.31 0.00 -0.34 0.00 0.00 178.44 179.60 2atf h ALA 13 N 1.29 1.11 -0.15 1.25 0.00 -1.97 -0.26 119.26 120.53 2atf h ALA 13 Ca 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2atf h ALA 13 Cb -0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2atf h ALA 13 CO -0.06 0.64 0.05 -0.44 0.00 0.00 0.00 179.25 179.44 2atf h ASP 14 N 1.10 0.22 -0.52 0.00 3.32 -1.78 -1.07 116.42 117.68 2atf h ASP 14 Ca 0.25 -0.20 0.10 0.00 0.02 0.00 0.00 57.03 57.20 2atf h ASP 14 Cb 0.20 -0.06 -0.09 0.00 0.22 0.00 0.00 39.33 39.61 2atf h ASP 14 CO -0.02 0.37 0.01 0.25 -1.72 0.00 0.00 179.24 178.13 2atf h LEU 15 N 0.06 -0.20 -0.78 1.55 5.85 -0.26 -0.61 115.31 120.92 2atf h LEU 15 Ca 0.05 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 2atf h LEU 15 Cb 0.22 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 2atf h LEU 15 CO -0.00 -0.07 0.47 0.40 -0.34 0.00 0.00 178.44 178.90 2atf h ILE 16 N 0.13 1.22 -0.31 4.05 2.04 -0.63 0.11 117.51 124.12 2atf h ILE 16 Ca 0.27 -0.48 0.05 0.00 1.00 0.00 0.00 64.86 65.70 2atf h ILE 16 Cb 0.40 0.13 -0.05 0.00 -0.74 0.00 0.00 36.82 36.56 2atf h ILE 16 CO -0.43 0.23 -0.00 -0.09 0.00 0.00 0.00 178.15 177.85 2atf h ARG 17 N 1.07 0.08 -0.59 2.37 2.43 -0.64 -0.43 114.38 118.66 2atf h ARG 17 Ca 0.28 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.42 2atf h ARG 17 Cb -0.04 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 2atf h ARG 17 CO -0.05 0.05 0.29 0.82 -1.51 0.00 0.00 179.97 179.57 2atf h ILE 18 N 0.08 1.21 -0.78 1.20 2.04 -0.62 -2.36 117.51 118.28 2atf h ILE 18 Ca 0.15 -0.59 0.04 0.00 1.00 0.00 0.00 64.86 65.45 2atf h ILE 18 Cb 0.20 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 2atf h ILE 18 CO -0.25 0.24 0.49 -0.07 0.00 0.00 0.00 178.15 178.56 2atf h LEU 19 N 0.81 0.81 -1.63 1.44 3.38 -0.30 -0.31 115.31 119.51 2atf h LEU 19 Ca 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2atf h LEU 19 Cb 0.12 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2atf h LEU 19 CO -0.03 0.55 0.02 0.45 0.09 0.00 0.00 178.44 179.52 2atf h HIS 20 N 0.95 0.25 -0.20 1.13 3.86 -0.60 -1.41 115.15 119.13 2atf h HIS 20 Ca 0.32 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.47 2atf h HIS 20 Cb 0.04 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.42 2atf h HIS 20 CO -0.03 0.25 -0.07 0.93 0.86 0.00 0.00 177.93 179.87 2atf h GLU 21 N 0.25 0.39 0.00 2.45 5.08 -0.65 -2.91 114.58 119.20 2atf h GLU 21 Ca 0.06 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 2atf h GLU 21 Cb 0.14 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2atf h GLU 21 CO 0.00 0.66 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.45 2atf h LEU 22 N 0.10 0.00 -3.34 1.33 3.38 -0.74 -2.08 115.31 113.96 2atf h LEU 22 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2atf h LEU 22 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2atf h LEU 22 CO 0.02 0.15 0.00 0.49 0.09 0.00 0.00 178.44 179.20 2atf n PHE 23 N -4.27 1.71 0.24 1.13 3.72 -0.57 -4.55 117.46 114.87 2atf n PHE 23 Ca -0.02 -0.68 0.09 0.00 -0.05 0.00 0.00 57.45 56.78 2atf n PHE 23 Cb 0.22 -0.37 0.59 0.00 -0.94 0.00 0.00 39.48 38.98 2atf n PHE 23 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2atf h ALA 24 N 3.85 1.40 -3.50 4.37 0.00 -1.16 -3.44 119.26 120.77 2atf h ALA 24 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2atf h ALA 24 Cb 1.69 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2atf h ALA 24 CO 0.35 0.24 0.00 0.41 0.00 0.00 0.00 179.25 180.24 2atf n GLY 25 N -0.69 1.84 0.05 0.00 0.00 -1.26 -5.05 105.19 100.09 2atf n GLY 25 Ca -0.02 -2.07 0.10 0.00 0.00 0.00 0.00 46.02 44.03 2atf n GLY 25 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2atf n ASP 26 N -1.55 1.06 -4.69 1.61 8.00 -1.26 -4.95 116.55 114.78 2atf n ASP 26 Ca 0.00 -0.99 -0.30 0.00 0.71 0.00 0.00 54.79 54.21 2atf n ASP 26 Cb 0.00 0.88 -0.05 0.00 -0.02 0.00 0.00 41.12 41.93 2atf n ASP 26 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2atf n GLU 27 N -1.35 0.76 -3.73 -1.24 -0.58 -1.26 -5.14 120.64 108.09 2atf n GLU 27 Ca 0.05 -3.57 -0.18 0.00 -0.42 0.00 0.00 57.16 53.03 2atf n GLU 27 Cb 0.34 0.79 -0.17 0.00 -0.57 0.00 0.00 31.44 31.83 2atf n GLU 27 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2atf s VAL 28 N -2.77 -0.03 -0.65 2.62 1.01 -1.26 -4.84 120.40 114.47 2atf s VAL 28 Ca 0.09 0.31 -0.22 0.00 0.00 0.00 0.00 61.98 62.17 2atf s VAL 28 Cb -0.01 -0.17 0.08 0.00 0.00 0.00 0.00 36.38 36.28 2atf s VAL 28 CO 0.06 0.16 0.93 0.21 0.00 0.00 0.00 175.10 176.45 2atf s ASN 29 N 1.71 6.18 0.20 3.32 3.84 -1.26 -4.91 114.94 124.02 2atf s ASN 29 Ca -0.01 -1.07 -0.11 0.00 0.21 0.00 0.00 52.86 51.88 2atf s ASN 29 Cb -0.12 -2.40 0.13 0.00 -0.55 0.00 0.00 41.25 38.30 2atf s ASN 29 CO -0.03 -1.39 1.83 0.58 -2.79 0.00 0.00 177.10 175.30 2atf h VAL 30 N 5.97 1.20 -0.66 -5.21 2.07 -1.99 -1.54 116.25 116.09 2atf h VAL 30 Ca -0.28 -0.45 -0.07 0.00 0.82 0.00 0.00 66.70 66.72 2atf h VAL 30 Cb 1.07 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 2atf h VAL 30 CO 1.17 0.21 0.14 -0.33 0.02 0.00 0.00 177.57 178.78 2atf h GLU 31 N 0.94 1.06 -0.40 1.57 4.39 -1.99 -0.45 114.58 119.70 2atf h GLU 31 Ca 0.25 -0.26 -0.13 0.00 0.34 0.00 0.00 59.36 59.56 2atf h GLU 31 Cb -0.02 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.48 2atf h GLU 31 CO -0.05 0.95 -0.27 0.93 -1.16 0.00 0.00 179.01 179.41 2atf h GLU 32 N 1.01 0.90 -0.40 2.33 5.08 -1.88 -1.53 114.58 120.09 2atf h GLU 32 Ca 0.21 -0.43 -0.07 0.00 -1.00 0.00 0.00 59.36 58.07 2atf h GLU 32 Cb 0.38 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2atf h GLU 32 CO 0.00 1.08 -0.03 0.28 -1.00 0.00 0.00 179.01 179.35 2atf h VAL 33 N 0.72 1.27 -0.85 3.13 2.07 -1.05 -1.41 116.25 120.13 2atf h VAL 33 Ca 0.08 -1.06 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 2atf h VAL 33 Cb 0.85 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 2atf h VAL 33 CO 0.07 0.36 0.52 -0.61 0.02 0.00 0.00 177.57 177.93 2atf h GLN 34 N 0.55 1.15 -0.65 1.57 4.15 -1.07 -1.57 115.11 119.23 2atf h GLN 34 Ca 0.11 -0.10 -0.08 0.00 0.77 0.00 0.00 58.65 59.35 2atf h GLN 34 Cb 0.52 -0.24 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 2atf h GLN 34 CO 0.03 0.80 0.09 0.00 -1.93 0.00 0.00 178.83 177.82 2atf h ALA 35 N 1.28 0.94 -0.38 3.38 0.00 -0.97 -0.81 119.26 122.69 2atf h ALA 35 Ca 0.31 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.78 2atf h ALA 35 Cb -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2atf h ALA 35 CO -0.06 0.66 -0.38 -0.24 0.00 0.00 0.00 179.25 179.23 2atf h VAL 36 N 1.00 1.27 -0.36 0.00 3.04 -1.08 -0.47 116.25 119.65 2atf h VAL 36 Ca 0.20 -1.56 -0.03 0.00 -1.01 0.00 0.00 66.70 64.30 2atf h VAL 36 Cb 0.44 1.38 -0.02 0.00 -2.01 0.00 0.00 31.29 31.09 2atf h VAL 36 CO 0.01 0.52 0.12 -0.07 -1.01 0.00 0.00 177.57 177.14 2atf h LEU 37 N 0.76 0.52 -1.22 3.16 3.38 -1.13 -2.31 115.31 118.47 2atf h LEU 37 Ca 0.06 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 2atf h LEU 37 Cb 0.97 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2atf h LEU 37 CO 0.09 0.58 0.02 -0.08 0.09 0.00 0.00 178.44 179.14 2atf h GLU 38 N 0.43 0.55 0.00 1.13 4.81 -1.02 -2.91 114.58 117.57 2atf h GLU 38 Ca 0.12 -0.11 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 2atf h GLU 38 Cb 0.24 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2atf h GLU 38 CO -0.01 0.56 -0.24 0.00 -0.73 0.00 0.00 179.01 178.59 2atf h ALA 39 N 1.50 1.07 -2.33 2.92 0.00 -0.55 -3.42 119.26 118.45 2atf h ALA 39 Ca 0.12 -0.22 -0.55 0.00 0.00 0.00 0.00 54.91 54.26 2atf h ALA 39 Cb 0.31 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2atf h ALA 39 CO 0.01 0.31 0.93 -0.47 0.00 0.00 0.00 179.25 180.03 2atf s TYR 40 N -3.75 2.55 -0.37 0.00 5.04 -0.97 -4.64 117.35 115.21 2atf s TYR 40 Ca -0.00 0.60 -0.23 0.00 -2.44 0.00 0.00 57.07 55.00 2atf s TYR 40 Cb 0.11 -3.75 0.01 0.00 0.35 0.00 0.00 41.96 38.67 2atf s TYR 40 CO 0.64 -2.94 0.76 -1.21 -1.34 0.00 0.00 175.55 171.46 2atf s GLU 41 N 3.01 3.72 -0.06 4.97 0.41 -1.26 -4.97 118.70 124.51 2atf s GLU 41 Ca 0.67 0.24 -0.38 0.00 -0.41 0.00 0.00 54.97 55.09 2atf s GLU 41 Cb -0.32 -3.82 -0.16 0.00 -1.78 0.00 0.00 34.13 28.06 2atf s GLU 41 CO 0.27 -0.85 1.55 0.45 -0.49 0.00 0.00 175.26 176.19 2atf n SER 42 N 6.37 2.19 -3.96 -0.19 2.88 -1.26 -4.95 113.62 114.69 2atf n SER 42 Ca 0.02 1.09 -0.31 0.00 -1.33 0.00 0.00 58.87 58.34 2atf n SER 42 Cb 0.48 -1.21 -0.15 0.00 -0.75 0.00 0.00 64.21 62.59 2atf n SER 42 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2atf s ASN 43 N 1.95 4.51 0.53 -3.46 3.84 -1.26 -5.02 114.94 116.02 2atf s ASN 43 Ca 0.90 -1.90 0.31 0.00 0.21 0.00 0.00 52.86 52.38 2atf s ASN 43 Cb -0.95 -1.42 1.46 0.00 -0.55 0.00 0.00 41.25 39.78 2atf s ASN 43 CO 0.53 -0.36 1.90 -0.65 -2.79 0.00 0.00 177.10 175.73 2atf h PRO 44 N 7.75 0.02 0.00 0.43 0.11 -1.92 -0.59 132.00 137.80 2atf h PRO 44 Ca -0.09 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.00 2atf h PRO 44 Cb 1.03 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 2atf h PRO 44 CO 0.49 0.01 -0.13 0.00 -0.21 0.00 0.00 178.00 178.17 2atf h ALA 45 N 1.57 1.76 0.00 -0.75 0.00 -2.01 -0.66 119.26 119.17 2atf h ALA 45 Ca 0.42 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 2atf h ALA 45 Cb 1.64 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 2atf h ALA 45 CO -0.01 0.16 -0.39 0.93 0.00 0.00 0.00 179.25 179.95 2atf h GLU 46 N 0.00 0.00 -0.01 0.00 5.08 -1.54 -3.34 114.58 114.77 2atf h GLU 46 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2atf h GLU 46 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2atf h GLU 46 CO 0.02 0.39 0.00 -2.67 -1.00 0.00 0.00 179.01 175.74 2atf n TRP 47 N -3.34 0.01 -0.34 4.33 4.27 -0.97 -4.72 117.44 116.68 2atf n TRP 47 Ca 0.01 -0.10 0.15 0.00 -3.89 0.00 0.00 57.50 53.67 2atf n TRP 47 Cb 0.60 -0.01 0.36 0.00 -1.36 0.00 0.00 31.31 30.89 2atf n TRP 47 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2atf h ALA 48 N 0.28 1.76 -0.89 -1.67 0.00 -1.26 0.52 119.26 118.01 2atf h ALA 48 Ca 0.00 0.08 0.22 0.00 0.00 0.00 0.00 54.91 55.20 2atf h ALA 48 Cb 0.15 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 2atf h ALA 48 CO 0.00 -0.14 0.60 1.25 0.00 0.00 0.00 179.25 180.96 2atf h LEU 49 N 0.69 0.32 0.00 0.00 5.85 -1.84 -1.64 115.31 118.69 2atf h LEU 49 Ca 0.58 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.34 2atf h LEU 49 Cb 1.00 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2atf h LEU 49 CO -0.37 0.12 -0.81 -1.22 -0.34 0.00 0.00 178.44 175.82 2atf n TYR 50 N -4.46 0.01 -2.09 1.25 4.01 0.16 -4.64 117.16 111.39 2atf n TYR 50 Ca 0.19 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.51 2atf n TYR 50 Cb 0.75 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.67 2atf n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2atf n ALA 51 N -1.52 5.62 -2.69 -0.72 0.00 -0.62 -4.80 120.51 115.79 2atf n ALA 51 Ca 0.04 -4.14 -0.42 0.00 0.00 0.00 0.00 53.44 48.93 2atf n ALA 51 Cb 0.34 -3.15 -0.11 0.00 0.00 0.00 0.00 19.45 16.53 2atf n ALA 51 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2atf s LYS 52 N 1.17 2.87 0.33 0.00 1.02 -1.26 -5.03 119.74 118.83 2atf s LYS 52 Ca 0.44 -1.08 -0.02 0.00 0.02 0.00 0.00 55.97 55.33 2atf s LYS 52 Cb 0.12 -3.84 -0.04 0.00 -0.52 0.00 0.00 37.83 33.55 2atf s LYS 52 CO -0.03 -0.73 0.56 -0.06 -0.92 0.00 0.00 175.35 174.16 2atf s PHE 53 N 1.60 3.50 0.01 3.18 0.08 -1.26 -4.75 117.98 120.34 2atf s PHE 53 Ca 0.03 0.48 0.08 0.00 0.12 0.00 0.00 56.93 57.65 2atf s PHE 53 Cb -0.19 -1.99 -0.03 0.00 -0.57 0.00 0.00 43.02 40.24 2atf s PHE 53 CO 0.08 0.13 -0.24 0.34 -0.10 0.00 0.00 175.22 175.42 2atf s ASP 54 N -3.68 3.28 0.44 1.36 2.15 -1.26 -5.05 116.67 113.92 2atf s ASP 54 Ca 0.42 -0.49 0.13 0.00 0.43 0.00 0.00 52.55 53.03 2atf s ASP 54 Cb -0.10 -0.39 0.99 0.00 -0.30 0.00 0.00 42.92 43.11 2atf s ASP 54 CO 0.34 0.29 2.02 -0.61 -0.17 0.00 0.00 175.17 177.04 2atf h GLN 55 N 5.05 0.13 0.00 4.34 4.15 -2.00 -3.34 115.11 123.44 2atf h GLN 55 Ca -0.45 -0.02 -0.34 0.00 0.77 0.00 0.00 58.65 58.61 2atf h GLN 55 Cb 1.14 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 28.74 2atf h GLN 55 CO 0.46 0.21 -2.33 0.66 -1.93 0.00 0.00 178.83 175.90 2atf n TYR 56 N -4.38 0.00 -4.02 3.99 4.01 -1.26 -4.96 117.16 110.54 2atf n TYR 56 Ca -0.01 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.61 2atf n TYR 56 Cb 0.19 -0.94 -0.04 0.00 -0.31 0.00 0.00 39.34 38.24 2atf n TYR 56 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 2atf s ARG 57 N -2.53 1.82 0.59 -0.72 1.70 -1.25 -4.99 118.95 113.57 2atf s ARG 57 Ca -0.10 -1.54 -0.15 0.00 -0.47 0.00 0.00 55.73 53.47 2atf s ARG 57 Cb 0.06 0.48 -0.04 0.00 -0.57 0.00 0.00 34.95 34.88 2atf s ARG 57 CO 0.81 -0.77 1.05 1.52 -1.08 0.00 0.00 175.30 176.83 2atf s TYR 58 N -3.30 3.08 0.12 5.89 -0.85 -1.26 -4.19 117.35 116.84 2atf s TYR 58 Ca 0.26 1.49 0.10 0.00 -0.52 0.00 0.00 57.07 58.41 2atf s TYR 58 Cb -0.01 -2.96 -0.04 0.00 0.38 0.00 0.00 41.96 39.33 2atf s TYR 58 CO 0.15 -1.01 -0.25 0.95 -1.52 0.00 0.00 175.55 173.87 2atf s THR 59 N -2.54 2.40 -0.17 -3.49 -4.23 -0.61 -4.94 115.64 102.05 2atf s THR 59 Ca 0.62 -1.68 -0.02 0.00 -1.18 0.00 0.00 61.69 59.43 2atf s THR 59 Cb -0.15 -2.07 -0.01 0.00 1.34 0.00 0.00 72.50 71.61 2atf s THR 59 CO 0.38 0.10 -0.08 -0.13 -0.54 0.00 0.00 174.62 174.36 2atf s ARG 60 N -2.05 3.45 -0.27 3.99 0.52 -1.26 -1.79 118.95 121.54 2atf s ARG 60 Ca 0.15 -0.62 0.00 0.00 -0.52 0.00 0.00 55.73 54.74 2atf s ARG 60 Cb -0.10 -2.84 0.08 0.00 0.52 0.00 0.00 34.95 32.60 2atf s ARG 60 CO 0.07 0.06 0.02 -0.80 0.02 0.00 0.00 175.30 174.66 2atf s ASN 61 N 0.80 3.91 0.19 0.23 0.01 0.28 0.22 114.94 120.57 2atf s ASN 61 Ca -0.03 -1.40 -0.30 0.00 -0.71 0.00 0.00 52.86 50.42 2atf s ASN 61 Cb -0.15 -1.08 -0.08 0.00 0.41 0.00 0.00 41.25 40.35 2atf s ASN 61 CO 0.01 -0.32 1.26 -0.22 -1.51 0.00 0.00 177.10 176.32 2atf s LEU 62 N 1.44 4.43 -0.15 0.60 2.96 -0.35 -0.36 118.68 127.25 2atf s LEU 62 Ca 0.02 2.31 -0.03 0.00 -0.22 0.00 0.00 54.13 56.21 2atf s LEU 62 Cb -0.18 -3.61 -0.08 0.00 0.50 0.00 0.00 46.19 42.82 2atf s LEU 62 CO -0.12 -0.46 -0.16 0.52 -1.32 0.00 0.00 176.35 174.81 2atf n VAL 63 N 2.65 0.85 -3.75 1.68 0.31 0.38 -1.33 118.33 119.12 2atf n VAL 63 Ca 0.06 -0.28 -0.13 0.00 -0.01 0.00 0.00 64.34 63.98 2atf n VAL 63 Cb 0.44 -1.32 -0.11 0.00 -0.91 0.00 0.00 33.84 31.94 2atf n VAL 63 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2atf s ASP 64 N -5.85 -0.37 0.00 4.52 2.15 -0.81 -4.70 116.67 111.61 2atf s ASP 64 Ca -0.21 0.70 0.22 0.00 0.43 0.00 0.00 52.55 53.70 2atf s ASP 64 Cb 0.07 0.69 0.64 0.00 -0.30 0.00 0.00 42.92 44.01 2atf s ASP 64 CO 0.31 -0.13 1.50 0.00 -0.17 0.00 0.00 175.17 176.68 2atf n GLN 65 N 3.15 1.98 -1.90 4.34 6.02 -1.26 -0.71 117.38 129.00 2atf n GLN 65 Ca -0.15 -1.47 -0.13 0.00 -0.01 0.00 0.00 57.00 55.23 2atf n GLN 65 Cb 0.57 -1.44 -0.03 0.00 1.02 0.00 0.00 30.24 30.37 2atf n GLN 65 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2atf n GLY 66 N 1.25 0.45 3.14 1.08 0.00 -1.13 -1.13 105.19 108.85 2atf n GLY 66 Ca 0.17 -0.36 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 2atf n GLY 66 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2atf n ASN 67 N -0.36 -4.04 0.00 1.61 4.13 -1.26 -1.31 115.26 114.03 2atf n ASN 67 Ca -0.15 -0.26 0.00 0.00 1.68 0.00 0.00 54.58 55.86 2atf n ASN 67 Cb 0.54 -3.34 0.00 0.00 -1.54 0.00 0.00 39.78 35.44 2atf n ASN 67 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2atf n GLY 68 N -1.14 1.62 0.11 7.41 0.00 -0.29 -4.90 105.19 108.00 2atf n GLY 68 Ca -0.05 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.04 2atf n GLY 68 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2atf n LYS 69 N -2.00 0.61 -3.47 1.61 4.76 -0.43 -4.64 118.16 114.60 2atf n LYS 69 Ca 0.00 0.17 -0.14 0.00 -2.87 0.00 0.00 58.31 55.47 2atf n LYS 69 Cb 0.00 -1.82 -0.04 0.00 -1.84 0.00 0.00 35.03 31.33 2atf n LYS 69 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 2atf s PHE 70 N -3.19 -0.55 -0.15 2.13 -0.12 -1.25 -4.18 117.98 110.67 2atf s PHE 70 Ca -0.01 0.61 -0.03 0.00 -0.05 0.00 0.00 56.93 57.45 2atf s PHE 70 Cb 0.09 0.50 -0.02 0.00 -0.63 0.00 0.00 43.02 42.96 2atf s PHE 70 CO 0.80 -0.70 -0.06 -0.80 -0.05 0.00 0.00 175.22 174.40 2atf s ASN 71 N -2.09 4.56 0.11 1.98 0.01 -0.57 -2.84 114.94 116.11 2atf s ASN 71 Ca -0.03 -0.20 0.07 0.00 -0.71 0.00 0.00 52.86 51.99 2atf s ASN 71 Cb -0.01 -1.73 -0.04 0.00 0.41 0.00 0.00 41.25 39.88 2atf s ASN 71 CO -0.04 0.16 -0.08 -0.22 -1.51 0.00 0.00 177.10 175.41 2atf s LEU 72 N 0.44 3.12 -0.06 0.60 2.96 0.11 -1.39 118.68 124.46 2atf s LEU 72 Ca -0.05 -0.37 -0.03 0.00 -0.22 0.00 0.00 54.13 53.46 2atf s LEU 72 Cb -0.15 -1.89 0.04 0.00 0.50 0.00 0.00 46.19 44.69 2atf s LEU 72 CO 0.03 0.17 0.14 -0.63 -1.32 0.00 0.00 176.35 174.74 2atf s ILE 74 N -1.30 -0.08 -0.12 6.68 1.01 0.51 -0.47 121.20 127.43 2atf s ILE 74 Ca 0.23 0.21 -0.03 0.00 0.00 0.00 0.00 60.65 61.07 2atf s ILE 74 Cb -0.11 -0.23 -0.03 0.00 0.01 0.00 0.00 42.46 42.10 2atf s ILE 74 CO 0.15 0.09 -0.02 -0.76 0.00 0.00 0.00 174.94 174.40 2atf s LEU 75 N 1.35 3.40 -0.18 2.97 1.02 0.67 -0.56 118.68 127.35 2atf s LEU 75 Ca -0.07 0.01 -0.00 0.00 0.02 0.00 0.00 54.13 54.08 2atf s LEU 75 Cb -0.12 -1.79 0.01 0.00 0.02 0.00 0.00 46.19 44.31 2atf s LEU 75 CO -0.06 0.28 -0.16 0.00 0.02 0.00 0.00 176.35 176.44 2atf s TRP 77 N 1.18 3.22 1.07 0.00 0.52 0.28 -1.57 118.94 123.64 2atf s TRP 77 Ca 0.02 -2.19 -0.12 0.00 0.02 0.00 0.00 56.10 53.82 2atf s TRP 77 Cb -0.14 -1.96 0.23 0.00 -1.15 0.00 0.00 33.47 30.45 2atf s TRP 77 CO -0.07 -0.86 1.06 0.20 0.02 0.00 0.00 176.95 177.30 2atf s GLY 78 N 1.14 1.57 0.01 0.98 0.00 -1.26 -1.22 107.32 108.54 2atf s GLY 78 Ca -0.07 -0.18 -0.35 0.00 0.00 0.00 0.00 44.72 44.11 2atf s GLY 78 CO -0.05 0.46 1.65 1.18 0.00 0.00 0.00 173.10 176.34 2atf n GLU 79 N -4.51 1.83 -0.69 2.90 4.71 -1.26 -1.29 120.64 122.33 2atf n GLU 79 Ca 0.05 0.67 0.00 0.00 -0.01 0.00 0.00 57.16 57.86 2atf n GLU 79 Cb 0.55 -2.42 0.00 0.00 -1.01 0.00 0.00 31.44 28.56 2atf n GLU 79 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2atf n GLY 80 N 3.66 1.47 3.75 0.62 0.00 -0.65 -4.98 105.19 109.06 2atf n GLY 80 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 2atf n GLY 80 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2atf s HIS 81 N -3.63 3.73 0.27 1.61 3.76 -0.41 -4.78 115.29 115.84 2atf s HIS 81 Ca 0.00 1.76 -0.01 0.00 -0.15 0.00 0.00 55.06 56.66 2atf s HIS 81 Cb 0.00 -3.17 -0.03 0.00 1.11 0.00 0.00 32.58 30.50 2atf s HIS 81 CO 0.00 -0.18 0.28 0.20 -0.85 0.00 0.00 174.74 174.18 2atf s GLY 82 N -0.78 1.56 0.49 -2.22 0.00 -1.26 -0.42 107.32 104.69 2atf s GLY 82 Ca 0.44 -1.65 0.09 0.00 0.00 0.00 0.00 44.72 43.60 2atf s GLY 82 CO 0.36 -1.24 0.67 -1.35 0.00 0.00 0.00 173.10 171.54 2atf s SER 83 N -3.21 5.42 0.99 1.64 1.04 -0.08 -4.78 113.70 114.72 2atf s SER 83 Ca 0.36 -0.61 -0.12 0.00 0.48 0.00 0.00 55.95 56.06 2atf s SER 83 Cb 0.03 -0.24 0.18 0.00 0.10 0.00 0.00 66.02 66.10 2atf s SER 83 CO 0.17 -1.01 1.09 -0.94 0.98 0.00 0.00 173.24 173.52 2atf s SER 84 N -4.49 2.69 -0.03 7.02 1.04 -1.26 -4.63 113.70 114.04 2atf s SER 84 Ca 0.58 1.32 -0.30 0.00 0.48 0.00 0.00 55.95 58.03 2atf s SER 84 Cb -0.08 -1.99 -0.04 0.00 0.10 0.00 0.00 66.02 64.01 2atf s SER 84 CO 0.36 -3.11 1.22 -0.63 0.98 0.00 0.00 173.24 172.05 2atf s ILE 85 N -2.90 4.17 0.17 -1.02 1.01 -1.26 -4.33 121.20 117.04 2atf s ILE 85 Ca 0.65 1.52 -0.07 0.00 0.00 0.00 0.00 60.65 62.74 2atf s ILE 85 Cb -0.19 -3.97 -0.02 0.00 0.01 0.00 0.00 42.46 38.29 2atf s ILE 85 CO 0.58 0.02 0.26 -1.38 0.00 0.00 0.00 174.94 174.42 2atf s HIS 86 N 1.99 0.54 0.03 3.97 -3.43 0.07 -0.84 115.29 117.62 2atf s HIS 86 Ca 0.57 -0.89 0.00 0.00 -0.80 0.00 0.00 55.06 53.94 2atf s HIS 86 Cb -0.26 -0.14 0.00 0.00 -1.43 0.00 0.00 32.58 30.75 2atf s HIS 86 CO 0.24 -0.72 0.03 -0.40 -2.00 0.00 0.00 174.74 171.89 2atf n ASP 87 N -0.23 0.56 -1.37 7.38 5.68 -1.11 -2.36 116.55 125.10 2atf n ASP 87 Ca -0.05 -1.08 0.04 0.00 -0.50 0.00 0.00 54.79 53.20 2atf n ASP 87 Cb 0.63 -0.01 0.04 0.00 -1.14 0.00 0.00 41.12 40.64 2atf n ASP 87 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2atf n HIS 88 N -0.83 0.00 -3.68 2.11 8.25 -1.26 -4.67 115.22 115.14 2atf n HIS 88 Ca 0.00 -0.59 -0.23 0.00 -0.26 0.00 0.00 57.72 56.64 2atf n HIS 88 Cb 0.03 -0.16 0.05 0.00 1.12 0.00 0.00 29.99 31.03 2atf n HIS 88 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2atf n THR 89 N 0.31 -3.90 -2.06 1.59 -1.04 -1.26 -0.97 114.28 106.95 2atf n THR 89 Ca 0.07 -0.28 -0.21 0.00 -2.04 0.00 0.00 64.05 61.60 2atf n THR 89 Cb 1.09 -3.85 -0.04 0.00 -1.82 0.00 0.00 70.33 65.71 2atf n THR 89 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2atf n ASP 90 N -3.01 -5.74 -4.59 8.00 8.00 -1.26 -4.96 116.55 112.99 2atf n ASP 90 Ca -0.15 0.21 -0.24 0.00 0.71 0.00 0.00 54.79 55.31 2atf n ASP 90 Cb 0.62 -4.88 -0.08 0.00 -0.02 0.00 0.00 41.12 36.75 2atf n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2atf s SER 91 N -2.36 4.26 0.31 -2.24 0.01 -0.15 -4.77 113.70 108.76 2atf s SER 91 Ca 0.00 -0.70 -0.27 0.00 1.31 0.00 0.00 55.95 56.28 2atf s SER 91 Cb 0.00 -0.70 -0.09 0.00 0.21 0.00 0.00 66.02 65.44 2atf s SER 91 CO 0.00 0.04 1.01 -1.00 0.41 0.00 0.00 173.24 173.71 2atf s HIS 92 N -2.16 3.62 -0.09 2.43 3.76 0.83 -4.50 115.29 119.19 2atf s HIS 92 Ca 0.29 1.76 -0.02 0.00 -0.15 0.00 0.00 55.06 56.94 2atf s HIS 92 Cb -0.07 -3.09 0.04 0.00 1.11 0.00 0.00 32.58 30.56 2atf s HIS 92 CO 0.17 -0.16 0.03 0.00 -0.85 0.00 0.00 174.74 173.93 2atf s PHE 94 N 2.02 2.89 -0.12 0.00 0.08 -0.07 -1.09 117.98 121.69 2atf s PHE 94 Ca 0.04 -0.02 -0.02 0.00 0.12 0.00 0.00 56.93 57.05 2atf s PHE 94 Cb -0.13 -1.68 0.04 0.00 -0.57 0.00 0.00 43.02 40.68 2atf s PHE 94 CO -0.05 0.32 0.02 -1.17 -0.10 0.00 0.00 175.22 174.23 2atf s LEU 95 N -0.94 0.82 -0.10 -0.37 0.20 -0.15 -1.58 118.68 116.56 2atf s LEU 95 Ca 0.13 -0.39 0.02 0.00 0.69 0.00 0.00 54.13 54.58 2atf s LEU 95 Cb -0.11 -0.50 -0.02 0.00 -0.43 0.00 0.00 46.19 45.13 2atf s LEU 95 CO 0.03 -0.24 -0.16 -0.75 -0.29 0.00 0.00 176.35 174.94 2atf s LYS 96 N 1.93 3.07 0.03 1.98 2.20 0.13 -0.16 119.74 128.91 2atf s LYS 96 Ca 0.03 -0.73 -0.30 0.00 -0.36 0.00 0.00 55.97 54.60 2atf s LYS 96 Cb -0.14 -2.49 -0.04 0.00 -1.51 0.00 0.00 37.83 33.64 2atf s LYS 96 CO -0.07 0.32 1.10 -0.51 -0.36 0.00 0.00 175.35 175.83 2atf s LEU 97 N 0.05 4.37 -0.15 5.43 2.01 -0.42 -0.02 118.68 129.95 2atf s LEU 97 Ca -0.06 1.84 0.19 0.00 0.01 0.00 0.00 54.13 56.11 2atf s LEU 97 Cb -0.15 -3.57 -0.27 0.00 0.01 0.00 0.00 46.19 42.20 2atf s LEU 97 CO 0.05 -0.38 0.18 0.18 1.01 0.00 0.00 176.35 177.39 2atf n LEU 98 N 3.96 0.00 -3.64 1.79 4.77 0.71 -0.54 117.00 124.06 2atf n LEU 98 Ca 0.08 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.95 2atf n LEU 98 Cb 0.48 0.36 -0.07 0.00 -2.33 0.00 0.00 43.42 41.87 2atf n LEU 98 CO 0.54 0.36 0.44 -1.58 -1.33 0.00 0.00 177.39 175.83 2atf s GLN 99 N -2.77 0.73 2.26 3.23 0.74 -0.74 -4.83 119.66 118.28 2atf s GLN 99 Ca -0.09 1.02 0.00 0.00 0.05 0.00 0.00 55.36 56.33 2atf s GLN 99 Cb 0.08 0.28 0.00 0.00 1.10 0.00 0.00 33.01 34.47 2atf s GLN 99 CO 0.85 -0.11 0.00 0.41 -0.55 0.00 0.00 175.29 175.89 2atf n GLY 100 N 3.25 -1.07 3.06 2.59 0.00 -1.26 -1.05 105.19 110.71 2atf n GLY 100 Ca -0.16 -1.27 -0.10 0.00 0.00 0.00 0.00 46.02 44.48 2atf n GLY 100 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2atf s ASN 101 N -4.00 0.12 0.04 1.61 0.01 -1.26 -3.01 114.94 108.45 2atf s ASN 101 Ca 0.00 -0.35 0.04 0.00 -0.71 0.00 0.00 52.86 51.84 2atf s ASN 101 Cb 0.00 0.17 -0.02 0.00 0.41 0.00 0.00 41.25 41.81 2atf s ASN 101 CO 0.00 -0.36 -0.13 -0.76 -1.51 0.00 0.00 177.10 174.34 2atf s LEU 102 N -1.51 2.18 -0.17 0.60 1.43 -0.79 -4.66 118.68 115.76 2atf s LEU 102 Ca -0.14 -0.46 -0.15 0.00 -1.03 0.00 0.00 54.13 52.35 2atf s LEU 102 Cb -0.08 -0.54 -0.04 0.00 0.03 0.00 0.00 46.19 45.56 2atf s LEU 102 CO -0.00 0.01 0.34 -0.75 0.23 0.00 0.00 176.35 176.17 2atf s LYS 103 N -1.17 4.24 -0.17 1.70 2.20 0.17 -0.51 119.74 126.20 2atf s LYS 103 Ca 0.00 0.15 -0.03 0.00 -0.36 0.00 0.00 55.97 55.73 2atf s LYS 103 Cb -0.08 -3.46 -0.02 0.00 -1.51 0.00 0.00 37.83 32.76 2atf s LYS 103 CO 0.01 0.15 -0.06 -2.00 -0.36 0.00 0.00 175.35 173.09 2atf s GLU 104 N 0.72 3.50 -0.17 4.03 2.12 0.47 -1.17 118.70 128.20 2atf s GLU 104 Ca 0.18 -0.60 -0.02 0.00 0.36 0.00 0.00 54.97 54.89 2atf s GLU 104 Cb -0.14 -2.88 -0.01 0.00 0.26 0.00 0.00 34.13 31.37 2atf s GLU 104 CO 0.06 0.08 -0.09 0.99 -0.54 0.00 0.00 175.26 175.76 2atf s THR 105 N 0.75 3.24 -0.10 -1.70 2.01 0.10 -1.34 115.64 118.59 2atf s THR 105 Ca -0.03 -0.57 -0.09 0.00 0.31 0.00 0.00 61.69 61.31 2atf s THR 105 Cb -0.15 -2.41 -0.04 0.00 0.01 0.00 0.00 72.50 69.91 2atf s THR 105 CO 0.02 0.49 0.19 -0.76 -0.69 0.00 0.00 174.62 173.87 2atf s LEU 106 N 0.77 4.40 0.03 4.42 1.43 0.36 -1.13 118.68 128.97 2atf s LEU 106 Ca -0.04 0.56 0.04 0.00 -1.03 0.00 0.00 54.13 53.67 2atf s LEU 106 Cb -0.15 -2.17 -0.02 0.00 0.03 0.00 0.00 46.19 43.88 2atf s LEU 106 CO 0.01 0.39 -0.13 -0.36 0.23 0.00 0.00 176.35 176.49 2atf s PHE 107 N -1.00 1.16 0.61 0.29 0.08 -0.20 0.30 117.98 119.22 2atf s PHE 107 Ca 0.17 -0.34 -0.11 0.00 0.12 0.00 0.00 56.93 56.76 2atf s PHE 107 Cb -0.13 -0.69 -0.04 0.00 -0.57 0.00 0.00 43.02 41.59 2atf s PHE 107 CO 0.06 0.02 1.02 -0.51 -0.10 0.00 0.00 175.22 175.71 2atf s ASP 108 N -1.07 6.26 0.26 1.36 1.01 -1.26 -0.96 116.67 122.26 2atf s ASP 108 Ca 0.01 1.42 -0.31 0.00 0.71 0.00 0.00 52.55 54.38 2atf s ASP 108 Cb -0.08 -2.47 -0.12 0.00 1.01 0.00 0.00 42.92 41.27 2atf s ASP 108 CO 0.01 -0.84 1.57 0.79 0.21 0.00 0.00 175.17 176.91 2atf n TRP 109 N -2.65 2.65 -2.07 4.23 7.02 -1.26 -4.79 117.44 120.57 2atf n TRP 109 Ca 0.06 0.26 -0.38 0.00 -1.02 0.00 0.00 57.50 56.42 2atf n TRP 109 Cb 0.54 -2.58 0.01 0.00 -2.42 0.00 0.00 31.31 26.86 2atf n TRP 109 CO 0.00 0.00 0.00 -2.14 -2.02 0.00 0.00 177.69 173.53 2atf s PRO 110 N -0.13 3.55 0.99 -0.99 0.02 -1.26 -5.06 135.00 132.11 2atf s PRO 110 Ca 0.68 1.97 -0.17 0.00 0.02 0.00 0.00 61.00 63.50 2atf s PRO 110 Cb -0.54 -2.38 0.23 0.00 0.02 0.00 0.00 34.50 31.83 2atf s PRO 110 CO 0.46 -0.78 1.18 -0.25 -0.33 0.00 0.00 177.00 177.27 2atf n ASP 111 N -0.64 -0.52 0.12 2.53 8.00 -1.26 -5.01 116.55 119.77 2atf n ASP 111 Ca 0.08 -1.36 -0.01 0.00 0.71 0.00 0.00 54.79 54.21 2atf n ASP 111 Cb 0.47 -0.95 0.09 0.00 -0.02 0.00 0.00 41.12 40.70 2atf n ASP 111 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2atf h LYS 112 N 0.00 0.00 -6.50 -1.24 1.79 -1.97 -3.43 116.57 105.22 2atf h LYS 112 Ca -0.40 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.54 2atf h LYS 112 Cb 1.13 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.79 2atf h LYS 112 CO 0.28 0.67 0.64 0.15 -1.08 0.00 0.00 179.45 180.11 2atf s LYS 113 N -3.23 4.38 -0.05 3.15 -0.14 -1.26 -4.95 119.74 117.64 2atf s LYS 113 Ca 0.00 1.89 -0.31 0.00 -1.36 0.00 0.00 55.97 56.20 2atf s LYS 113 Cb 0.11 -3.32 -0.09 0.00 -1.68 0.00 0.00 37.83 32.84 2atf s LYS 113 CO 0.76 -0.34 2.00 0.45 -0.76 0.00 0.00 175.35 177.46 2atf n SER 114 N 4.03 3.77 -3.77 2.83 2.88 -1.26 -4.94 113.62 117.17 2atf n SER 114 Ca 0.10 0.80 -0.10 0.00 -1.33 0.00 0.00 58.87 58.33 2atf n SER 114 Cb 0.45 -1.48 -0.07 0.00 -0.75 0.00 0.00 64.21 62.36 2atf n SER 114 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2atf s ASN 115 N 5.06 -0.06 0.00 -3.46 0.01 -1.10 -4.99 114.94 110.40 2atf s ASN 115 Ca 0.93 -0.38 0.00 0.00 -0.71 0.00 0.00 52.86 52.70 2atf s ASN 115 Cb -0.50 0.37 0.00 0.00 0.41 0.00 0.00 41.25 41.53 2atf s ASN 115 CO 0.44 -0.70 0.00 1.21 -1.51 0.00 0.00 177.10 176.54 2atf n GLU 116 N 0.21 2.79 -3.64 -0.60 4.07 -1.09 -3.40 120.64 118.97 2atf n GLU 116 Ca -0.17 0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 56.85 2atf n GLU 116 Cb 0.61 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.92 2atf n GLU 116 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 2atf s ILE 118 N 0.00 0.00 0.39 6.31 -1.09 -1.26 -4.96 121.20 120.59 2atf s ILE 118 Ca 0.00 0.00 -0.28 0.00 -2.23 0.00 0.00 60.65 58.14 2atf s ILE 118 Cb 0.00 -1.00 -0.11 0.00 -1.58 0.00 0.00 42.46 39.77 2atf s ILE 118 CO 0.00 0.00 1.46 2.29 -1.23 0.00 0.00 174.94 177.46 2atf n LYS 119 N 3.43 2.56 0.01 2.79 2.85 -1.26 -4.59 118.16 123.95 2atf n LYS 119 Ca -0.17 0.90 -0.13 0.00 -1.05 0.00 0.00 58.31 57.86 2atf n LYS 119 Cb 0.57 -2.63 -0.14 0.00 -0.65 0.00 0.00 35.03 32.18 2atf n LYS 119 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 2atf h LYS 120 N 2.80 0.10 -1.87 -1.58 2.10 -0.52 -3.49 116.57 114.12 2atf h LYS 120 Ca -0.50 -0.17 0.25 0.00 -2.00 0.00 0.00 60.65 58.22 2atf h LYS 120 Cb 1.25 0.07 -0.11 0.00 -0.90 0.00 0.00 32.23 32.54 2atf h LYS 120 CO 0.63 0.81 0.67 -1.54 -2.00 0.00 0.00 179.45 178.02 2atf s SER 121 N -6.52 -0.12 0.05 7.07 1.04 -1.20 -5.01 113.70 109.02 2atf s SER 121 Ca -0.08 -0.25 -0.06 0.00 0.48 0.00 0.00 55.95 56.04 2atf s SER 121 Cb 0.08 0.31 -0.01 0.00 0.10 0.00 0.00 66.02 66.50 2atf s SER 121 CO 0.82 -0.57 0.12 -1.83 0.98 0.00 0.00 173.24 172.75 2atf s GLU 122 N -2.83 0.65 0.18 4.02 -1.05 -1.26 -0.49 118.70 117.92 2atf s GLU 122 Ca 0.13 -0.79 -0.14 0.00 -0.15 0.00 0.00 54.97 54.01 2atf s GLU 122 Cb 0.02 0.26 0.02 0.00 -0.44 0.00 0.00 34.13 33.98 2atf s GLU 122 CO -0.01 -0.17 0.43 -0.98 0.95 0.00 0.00 175.26 175.47 2atf s ARG 123 N -2.88 1.27 -0.26 -4.83 1.70 -0.45 -5.00 118.95 108.50 2atf s ARG 123 Ca -0.03 -0.96 -0.07 0.00 -0.47 0.00 0.00 55.73 54.21 2atf s ARG 123 Cb 0.00 0.46 -0.02 0.00 -0.57 0.00 0.00 34.95 34.83 2atf s ARG 123 CO -0.06 -0.51 0.07 0.99 -1.08 0.00 0.00 175.30 174.71 2atf s THR 124 N -3.90 4.20 -0.18 4.99 2.01 -1.26 -0.40 115.64 121.10 2atf s THR 124 Ca 0.11 -0.31 -0.19 0.00 0.31 0.00 0.00 61.69 61.62 2atf s THR 124 Cb 0.01 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.47 2atf s THR 124 CO -0.03 0.28 0.51 -0.76 -0.69 0.00 0.00 174.62 173.94 2atf s LEU 125 N 1.58 4.18 0.38 4.42 1.43 0.34 -4.97 118.68 126.05 2atf s LEU 125 Ca 0.06 0.73 0.08 0.00 -1.03 0.00 0.00 54.13 53.96 2atf s LEU 125 Cb -0.16 -2.72 -0.03 0.00 0.03 0.00 0.00 46.19 43.32 2atf s LEU 125 CO 0.03 -0.13 0.31 -0.13 0.23 0.00 0.00 176.35 176.65 2atf s ARG 126 N 1.36 2.54 0.08 1.70 0.52 -1.26 -1.89 118.95 122.00 2atf s ARG 126 Ca 0.25 -1.50 -0.36 0.00 -0.52 0.00 0.00 55.73 53.60 2atf s ARG 126 Cb -0.15 -2.35 -0.18 0.00 0.52 0.00 0.00 34.95 32.79 2atf s ARG 126 CO 0.10 -0.07 1.13 0.39 0.02 0.00 0.00 175.30 176.87 2atf n GLU 127 N -1.42 0.60 -0.04 3.54 1.02 -1.16 -1.24 120.64 121.94 2atf n GLU 127 Ca 0.01 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 2atf n GLU 127 Cb 0.61 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2atf n GLU 127 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2atf n ASN 128 N 1.97 0.00 -4.77 1.62 3.02 0.30 -4.96 115.26 112.44 2atf n ASN 128 Ca 0.18 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.37 2atf n ASN 128 Cb 0.16 -0.31 -0.02 0.00 -0.61 0.00 0.00 39.78 39.01 2atf n ASN 128 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2atf s GLN 129 N -0.01 3.81 -0.17 3.52 0.74 -0.37 -4.55 119.66 122.63 2atf s GLN 129 Ca 0.00 1.68 0.01 0.00 0.05 0.00 0.00 55.36 57.10 2atf s GLN 129 Cb 0.00 -2.38 0.02 0.00 1.10 0.00 0.00 33.01 31.75 2atf s GLN 129 CO 0.00 -0.49 -0.18 0.00 -0.55 0.00 0.00 175.29 174.07 2atf s ALA 131 N 1.34 4.27 0.00 0.00 0.00 0.77 -4.91 121.76 123.23 2atf s ALA 131 Ca 0.05 -1.48 -0.00 0.00 0.00 0.00 0.00 51.96 50.52 2atf s ALA 131 Cb -0.13 -1.69 -0.00 0.00 0.00 0.00 0.00 23.12 21.30 2atf s ALA 131 CO -0.12 -0.09 -0.00 -0.47 0.00 0.00 0.00 175.76 175.08 2atf s TYR 132 N -2.22 0.03 0.03 0.00 6.14 -1.26 -0.98 117.35 119.09 2atf s TYR 132 Ca 0.47 -0.06 -0.08 0.00 0.64 0.00 0.00 57.07 58.04 2atf s TYR 132 Cb -0.10 -0.02 0.00 0.00 0.42 0.00 0.00 41.96 42.26 2atf s TYR 132 CO 0.32 -0.02 0.16 -1.50 0.64 0.00 0.00 175.55 175.15 2atf s ILE 133 N -0.16 0.11 0.25 3.14 2.07 -0.25 -5.03 121.20 121.33 2atf s ILE 133 Ca -0.02 -0.88 -0.09 0.00 -1.41 0.00 0.00 60.65 58.25 2atf s ILE 133 Cb -0.01 -0.79 -0.01 0.00 0.13 0.00 0.00 42.46 41.78 2atf s ILE 133 CO -0.00 -0.49 0.41 0.54 -1.91 0.00 0.00 174.94 173.49 2atf s ASN 134 N -1.91 0.10 0.52 4.50 2.20 -1.26 -1.87 114.94 117.21 2atf s ASN 134 Ca -0.08 -1.10 0.21 0.00 -0.94 0.00 0.00 52.86 50.95 2atf s ASN 134 Cb -0.03 0.56 1.37 0.00 -2.00 0.00 0.00 41.25 41.15 2atf s ASN 134 CO -0.03 -1.11 2.11 0.44 -2.94 0.00 0.00 177.10 175.58 2atf h ASP 135 N 2.31 0.00 0.37 3.54 3.32 -1.79 -1.51 116.42 122.65 2atf h ASP 135 Ca -0.28 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.69 2atf h ASP 135 Cb 1.25 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 2atf h ASP 135 CO 0.39 0.08 -0.36 0.28 -1.72 0.00 0.00 179.24 177.91 2atf h SER 136 N 0.00 0.00 0.07 6.45 0.02 -1.96 -3.16 113.55 114.96 2atf h SER 136 Ca -0.00 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.74 2atf h SER 136 Cb 0.16 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.73 2atf h SER 136 CO 0.01 0.36 -0.88 0.40 -1.14 0.00 0.00 176.83 175.58 2atf h ILE 137 N 0.00 1.39 0.00 3.27 2.04 -1.69 -3.50 117.51 119.02 2atf h ILE 137 Ca -0.00 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.55 2atf h ILE 137 Cb 0.64 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 2atf h ILE 137 CO 0.05 0.68 0.00 0.61 0.00 0.00 0.00 178.15 179.49 2atf n GLY 138 N 1.30 0.25 3.64 5.37 0.00 -1.06 -4.95 105.19 109.74 2atf n GLY 138 Ca -0.12 -1.41 -0.25 0.00 0.00 0.00 0.00 46.02 44.25 2atf n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2atf s LEU 139 N 0.00 3.21 0.10 0.99 1.43 -0.14 -4.39 118.68 119.88 2atf s LEU 139 Ca 0.00 -0.54 -0.05 0.00 -1.03 0.00 0.00 54.13 52.50 2atf s LEU 139 Cb 0.00 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 2atf s LEU 139 CO 0.00 0.05 0.13 -1.38 0.23 0.00 0.00 176.35 175.38 2atf s HIS 140 N -2.02 0.42 0.04 0.29 -3.43 -1.00 -1.03 115.29 108.57 2atf s HIS 140 Ca 0.29 -0.86 0.08 0.00 -0.80 0.00 0.00 55.06 53.77 2atf s HIS 140 Cb -0.08 -0.22 -0.03 0.00 -1.43 0.00 0.00 32.58 30.83 2atf s HIS 140 CO 0.19 -0.54 -0.20 0.50 -2.00 0.00 0.00 174.74 172.69 2atf s ARG 141 N -3.93 2.00 -0.05 -0.38 3.52 -0.28 -0.75 118.95 119.07 2atf s ARG 141 Ca 0.11 -1.01 0.05 0.00 -0.13 0.00 0.00 55.73 54.75 2atf s ARG 141 Cb 0.06 -2.14 -0.00 0.00 -1.56 0.00 0.00 34.95 31.30 2atf s ARG 141 CO -0.06 0.53 -0.20 0.08 -0.81 0.00 0.00 175.30 174.84 2atf s VAL 142 N -0.90 1.65 -0.06 7.11 1.01 -1.26 -0.73 120.40 127.23 2atf s VAL 142 Ca 0.14 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 2atf s VAL 142 Cb -0.10 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 34.88 2atf s VAL 142 CO 0.05 0.47 0.15 -1.61 0.00 0.00 0.00 175.10 174.15 2atf s GLU 143 N 0.04 0.16 -0.65 2.72 2.02 -0.32 -0.90 118.70 121.78 2atf s GLU 143 Ca -0.06 0.22 -0.21 0.00 0.02 0.00 0.00 54.97 54.94 2atf s GLU 143 Cb -0.13 0.06 0.08 0.00 0.10 0.00 0.00 34.13 34.24 2atf s GLU 143 CO 0.03 -0.03 0.88 1.21 0.02 0.00 0.00 175.26 177.37 2atf s ASN 144 N 0.19 6.19 0.00 -0.19 2.47 0.44 -0.66 114.94 123.38 2atf s ASN 144 Ca -0.01 -1.19 0.29 0.00 0.42 0.00 0.00 52.86 52.37 2atf s ASN 144 Cb -0.02 -2.38 1.19 0.00 -1.45 0.00 0.00 41.25 38.60 2atf s ASN 144 CO -0.00 -1.32 1.84 1.33 -3.72 0.00 0.00 177.10 175.23 2atf n VAL 145 N 5.77 0.00 -1.87 -5.21 0.24 -1.26 -1.63 118.33 114.37 2atf n VAL 145 Ca -0.05 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.34 61.78 2atf n VAL 145 Cb 0.44 -0.07 -0.00 0.00 -1.47 0.00 0.00 33.84 32.74 2atf n VAL 145 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2atf s SER 146 N -2.48 6.35 0.05 -1.34 0.15 -1.26 -4.67 113.70 110.48 2atf s SER 146 Ca 0.28 2.94 0.24 0.00 0.70 0.00 0.00 55.95 60.12 2atf s SER 146 Cb 0.20 -2.66 0.37 0.00 -1.71 0.00 0.00 66.02 62.22 2atf s SER 146 CO 0.48 -0.86 1.31 1.41 1.20 0.00 0.00 173.24 176.78 2atf n HIS 147 N 0.40 0.22 0.00 3.44 8.25 -1.26 -2.10 115.22 124.17 2atf n HIS 147 Ca 0.02 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2atf n HIS 147 Cb 0.40 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2atf n HIS 147 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2atf n THR 148 N -1.77 0.00 -3.95 1.59 -2.24 -1.26 -4.93 114.28 101.72 2atf n THR 148 Ca 0.04 -0.26 -0.29 0.00 -2.27 0.00 0.00 64.05 61.28 2atf n THR 148 Cb 0.38 1.00 -0.17 0.00 -2.10 0.00 0.00 70.33 69.45 2atf n THR 148 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2atf s GLU 149 N -0.51 1.83 0.73 -0.78 0.41 -1.26 -5.03 118.70 114.08 2atf s GLU 149 Ca 0.00 -0.46 -0.16 0.00 -0.41 0.00 0.00 54.97 53.94 2atf s GLU 149 Cb 0.00 -1.92 0.04 0.00 -1.78 0.00 0.00 34.13 30.47 2atf s GLU 149 CO 0.00 -0.30 1.25 -1.25 -0.49 0.00 0.00 175.26 174.47 2atf s PRO 150 N 1.59 2.08 0.17 0.39 0.04 -1.26 -4.53 135.00 133.47 2atf s PRO 150 Ca 0.04 1.91 0.11 0.00 0.04 0.00 0.00 61.00 63.09 2atf s PRO 150 Cb -0.13 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 2atf s PRO 150 CO -0.09 -1.91 -0.22 0.00 0.04 0.00 0.00 177.00 174.82 2atf s ALA 151 N -1.78 2.58 -0.04 8.56 0.00 -0.35 -4.33 121.76 126.39 2atf s ALA 151 Ca 0.78 -1.54 0.01 0.00 0.00 0.00 0.00 51.96 51.20 2atf s ALA 151 Cb -0.33 -0.44 0.02 0.00 0.00 0.00 0.00 23.12 22.38 2atf s ALA 151 CO 0.45 0.48 -0.04 0.08 0.00 0.00 0.00 175.76 176.74 2atf s VAL 152 N -1.47 0.45 0.10 0.00 1.01 -0.21 -0.56 120.40 119.72 2atf s VAL 152 Ca 0.19 -0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.14 2atf s VAL 152 Cb -0.09 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 2atf s VAL 152 CO 0.10 0.20 -0.14 -0.94 0.00 0.00 0.00 175.10 174.32 2atf s SER 153 N 0.87 1.80 -0.20 3.32 1.04 -0.03 -0.20 113.70 120.30 2atf s SER 153 Ca -0.11 -0.72 -0.03 0.00 0.48 0.00 0.00 55.95 55.56 2atf s SER 153 Cb -0.14 -0.05 -0.01 0.00 0.10 0.00 0.00 66.02 65.92 2atf s SER 153 CO -0.00 -0.13 -0.06 -0.22 0.98 0.00 0.00 173.24 173.81 2atf s LEU 154 N -2.13 2.84 -0.04 2.42 2.96 0.98 -0.24 118.68 125.47 2atf s LEU 154 Ca 0.04 -0.38 0.06 0.00 -0.22 0.00 0.00 54.13 53.62 2atf s LEU 154 Cb -0.07 -1.71 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 2atf s LEU 154 CO 0.02 0.02 -0.22 -1.00 -1.32 0.00 0.00 176.35 173.85 2atf s HIS 155 N 1.25 2.48 -0.10 5.38 3.76 -1.26 0.19 115.29 127.00 2atf s HIS 155 Ca 0.03 -0.40 0.02 0.00 -0.15 0.00 0.00 55.06 54.56 2atf s HIS 155 Cb -0.14 -1.57 0.02 0.00 1.11 0.00 0.00 32.58 32.00 2atf s HIS 155 CO -0.02 0.00 -0.14 -1.17 -0.85 0.00 0.00 174.74 172.56 2atf s LEU 156 N -0.55 1.64 -0.07 0.89 0.20 -0.61 -4.25 118.68 115.93 2atf s LEU 156 Ca 0.08 -0.38 0.04 0.00 0.69 0.00 0.00 54.13 54.56 2atf s LEU 156 Cb -0.11 -1.00 -0.00 0.00 -0.43 0.00 0.00 46.19 44.66 2atf s LEU 156 CO 0.00 0.01 -0.20 -0.31 -0.29 0.00 0.00 176.35 175.56 2atf s TYR 157 N 0.97 2.03 -0.07 5.38 2.02 -0.48 -0.89 117.35 126.31 2atf s TYR 157 Ca -0.08 -0.69 -0.03 0.00 -0.37 0.00 0.00 57.07 55.90 2atf s TYR 157 Cb -0.15 -1.37 0.04 0.00 -0.40 0.00 0.00 41.96 40.08 2atf s TYR 157 CO -0.01 -0.26 0.15 0.45 -1.57 0.00 0.00 175.55 174.30 2atf s SER 158 N 0.20 0.55 0.93 2.29 0.15 -0.65 -1.51 113.70 115.66 2atf s SER 158 Ca -0.10 0.30 -0.11 0.00 0.70 0.00 0.00 55.95 56.74 2atf s SER 158 Cb -0.15 0.22 0.15 0.00 -1.71 0.00 0.00 66.02 64.53 2atf s SER 158 CO 0.05 -0.22 1.09 -2.84 1.20 0.00 0.00 173.24 172.52 2atf s PRO 159 N 1.98 0.94 0.63 5.44 0.02 -1.26 -0.12 135.00 142.63 2atf s PRO 159 Ca -0.00 1.06 -0.18 0.00 0.02 0.00 0.00 61.00 61.90 2atf s PRO 159 Cb -0.12 -1.75 -0.02 0.00 0.02 0.00 0.00 34.50 32.63 2atf s PRO 159 CO -0.06 -2.53 1.28 -2.14 -0.33 0.00 0.00 177.00 173.22 2atf s PRO 160 N -4.77 2.68 -0.03 5.54 0.02 -1.25 -4.78 135.00 132.41 2atf s PRO 160 Ca 0.65 2.02 -0.08 0.00 0.02 0.00 0.00 61.00 63.61 2atf s PRO 160 Cb -0.20 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.44 2atf s PRO 160 CO 0.58 -1.49 0.19 -0.59 -0.33 0.00 0.00 177.00 175.36 2atf s PHE 161 N -1.43 -0.09 0.00 6.54 -0.12 -1.26 -5.03 117.98 116.59 2atf s PHE 161 Ca 0.81 0.18 0.00 0.00 -0.05 0.00 0.00 56.93 57.87 2atf s PHE 161 Cb -0.36 0.02 0.00 0.00 -0.63 0.00 0.00 43.02 42.05 2atf s PHE 161 CO 0.39 -0.23 0.78 -0.40 -0.05 0.00 0.00 175.22 175.71 2atf n ASP 162 N 2.00 1.46 -4.27 1.98 5.68 -1.26 -5.01 116.55 117.13 2atf n ASP 162 Ca -0.19 -1.61 -0.21 0.00 -0.50 0.00 0.00 54.79 52.28 2atf n ASP 162 Cb 0.57 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.43 2atf n ASP 162 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2atf s THR 163 N -0.61 1.56 0.19 2.12 -4.23 -1.26 -4.53 115.64 108.88 2atf s THR 163 Ca 0.00 -1.69 -0.04 0.00 -1.18 0.00 0.00 61.69 58.78 2atf s THR 163 Cb 0.00 -1.59 0.02 0.00 1.34 0.00 0.00 72.50 72.27 2atf s THR 163 CO 0.00 -0.27 0.32 0.00 -0.54 0.00 0.00 174.62 174.13 2atf s HIS 165 N -4.85 2.68 -0.02 0.00 3.76 -1.26 -0.02 115.29 115.58 2atf s HIS 165 Ca 0.11 -0.17 -0.02 0.00 -0.15 0.00 0.00 55.06 54.83 2atf s HIS 165 Cb -0.02 -1.56 -0.04 0.00 1.11 0.00 0.00 32.58 32.08 2atf s HIS 165 CO 0.08 0.25 0.10 0.00 -0.85 0.00 0.00 174.74 174.32 2atf s ALA 166 N -0.87 3.67 -0.06 -1.40 0.00 -0.20 -2.74 121.76 120.16 2atf s ALA 166 Ca 0.14 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.31 2atf s ALA 166 Cb -0.11 -1.67 -0.02 0.00 0.00 0.00 0.00 23.12 21.32 2atf s ALA 166 CO 0.04 0.69 -0.16 -0.06 0.00 0.00 0.00 175.76 176.27 2atf s PHE 167 N -1.19 2.66 -0.29 0.00 0.08 -0.02 -0.79 117.98 118.44 2atf s PHE 167 Ca 0.22 -0.31 -0.28 0.00 0.12 0.00 0.00 56.93 56.68 2atf s PHE 167 Cb -0.12 -1.65 0.01 0.00 -0.57 0.00 0.00 43.02 40.69 2atf s PHE 167 CO 0.13 0.07 1.03 0.34 -0.10 0.00 0.00 175.22 176.69 2atf s ASP 168 N -0.50 6.95 0.57 1.36 2.15 0.30 -4.32 116.67 123.18 2atf s ASP 168 Ca 0.07 1.11 0.33 0.00 0.43 0.00 0.00 52.55 54.49 2atf s ASP 168 Cb -0.12 -2.52 1.75 0.00 -0.30 0.00 0.00 42.92 41.73 2atf s ASP 168 CO 0.01 -0.77 2.16 -0.61 -0.17 0.00 0.00 175.17 175.79 2atf h GLN 169 N 7.88 0.00 0.00 4.34 4.15 -1.95 0.48 115.11 130.00 2atf h GLN 169 Ca -0.20 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.12 2atf h GLN 169 Cb 1.06 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.74 2atf h GLN 169 CO 1.00 0.05 -0.71 0.00 -1.93 0.00 0.00 178.83 177.24 2atf h ARG 170 N 0.00 0.00 0.00 1.69 2.47 -1.91 -3.41 114.38 113.22 2atf h ARG 170 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2atf h ARG 170 Cb 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.55 2atf h ARG 170 CO 0.01 0.35 -0.51 0.25 0.56 0.00 0.00 179.97 180.62 2atf n THR 171 N -3.08 0.00 -0.90 2.04 -2.24 -0.93 -2.68 114.28 106.49 2atf n THR 171 Ca -0.01 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2atf n THR 171 Cb 0.72 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 2atf n THR 171 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2atf n GLY 172 N 1.29 1.04 3.75 3.38 0.00 0.16 -2.70 105.19 112.12 2atf n GLY 172 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2atf n GLY 172 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2atf s HIS 173 N -3.85 3.02 0.21 1.61 5.04 -1.26 -4.62 115.29 115.44 2atf s HIS 173 Ca 0.00 1.14 0.09 0.00 -1.54 0.00 0.00 55.06 54.74 2atf s HIS 173 Cb 0.00 -3.79 -0.04 0.00 0.04 0.00 0.00 32.58 28.79 2atf s HIS 173 CO 0.00 -2.45 -0.03 -1.59 -2.34 0.00 0.00 174.74 168.33 2atf s LYS 174 N -0.78 2.25 0.04 2.88 -2.85 -1.26 -0.54 119.74 119.48 2atf s LYS 174 Ca 0.56 -1.26 0.02 0.00 -1.00 0.00 0.00 55.97 54.29 2atf s LYS 174 Cb -0.41 -2.23 -0.02 0.00 -2.06 0.00 0.00 37.83 33.11 2atf s LYS 174 CO 0.46 0.42 -0.08 0.54 0.10 0.00 0.00 175.35 176.79 2atf s ASN 175 N -3.15 0.90 0.20 0.03 4.22 0.03 -4.96 114.94 112.21 2atf s ASN 175 Ca 0.28 -0.52 -0.30 0.00 -2.14 0.00 0.00 52.86 50.18 2atf s ASN 175 Cb -0.08 0.02 -0.08 0.00 1.28 0.00 0.00 41.25 42.39 2atf s ASN 175 CO 0.18 -0.17 0.95 -0.75 -2.04 0.00 0.00 177.10 175.27 2atf s LYS 176 N -1.46 4.80 -0.00 3.55 2.20 -1.26 -1.04 119.74 126.53 2atf s LYS 176 Ca -0.08 1.48 0.04 0.00 -0.36 0.00 0.00 55.97 57.05 2atf s LYS 176 Cb -0.09 -3.31 -0.01 0.00 -1.51 0.00 0.00 37.83 32.90 2atf s LYS 176 CO 0.00 0.41 -0.14 0.08 -0.36 0.00 0.00 175.35 175.34 2atf s VAL 177 N -0.78 1.13 0.21 4.02 1.01 0.97 -4.91 120.40 122.05 2atf s VAL 177 Ca 0.43 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.78 2atf s VAL 177 Cb -0.25 -0.95 0.03 0.00 0.00 0.00 0.00 36.38 35.21 2atf s VAL 177 CO 0.31 0.28 0.24 0.41 0.00 0.00 0.00 175.10 176.35 2atf n THR 178 N 2.63 0.00 -3.55 3.92 -1.04 -1.26 -1.57 114.28 113.40 2atf n THR 178 Ca -0.15 -0.76 -0.07 0.00 -2.04 0.00 0.00 64.05 61.04 2atf n THR 178 Cb 0.55 -0.63 -0.02 0.00 -1.82 0.00 0.00 70.33 68.40 2atf n THR 178 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2atf s THR 180 N -0.60 0.00 -0.13 12.58 -4.23 -1.26 -5.02 115.64 116.98 2atf s THR 180 Ca 0.19 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.56 2atf s THR 180 Cb -0.01 -1.00 -0.05 0.00 1.34 0.00 0.00 72.50 72.78 2atf s THR 180 CO 0.12 0.00 0.29 -0.36 -0.54 0.00 0.00 174.62 174.13 2atf s PHE 181 N -2.59 3.51 0.22 3.99 0.08 -1.26 -4.66 117.98 117.28 2atf s PHE 181 Ca 0.07 0.64 0.01 0.00 0.12 0.00 0.00 56.93 57.77 2atf s PHE 181 Cb -0.01 -2.29 0.20 0.00 -0.57 0.00 0.00 43.02 40.35 2atf s PHE 181 CO -0.06 0.35 1.54 1.25 -0.10 0.00 0.00 175.22 178.20 2atf h HIS 182 N 6.21 0.47 -3.48 0.36 -0.00 -0.51 -3.43 115.15 114.77 2atf h HIS 182 Ca -0.44 -0.17 -0.06 0.00 -0.00 0.00 0.00 60.37 59.70 2atf h HIS 182 Cb 1.18 -0.09 -0.13 0.00 -0.00 0.00 0.00 27.41 28.38 2atf h HIS 182 CO 0.63 0.85 -0.12 -1.54 -0.00 0.00 0.00 177.93 177.76 2atf s SER 183 N -6.91 -0.17 -0.03 3.26 1.04 -1.20 -1.39 113.70 108.31 2atf s SER 183 Ca -0.05 -0.42 -0.01 0.00 0.48 0.00 0.00 55.95 55.95 2atf s SER 183 Cb 0.12 0.46 0.03 0.00 0.10 0.00 0.00 66.02 66.73 2atf s SER 183 CO 0.81 -0.86 0.03 -0.54 0.98 0.00 0.00 173.24 173.67 2atf s LYS 184 N -3.83 0.06 -1.45 4.02 1.02 0.06 -1.22 119.74 118.40 2atf s LYS 184 Ca 0.05 0.23 -0.11 0.00 0.02 0.00 0.00 55.97 56.16 2atf s LYS 184 Cb 0.02 -0.44 0.05 0.00 -0.52 0.00 0.00 37.83 36.94 2atf s LYS 184 CO -0.10 -0.23 1.03 1.19 -0.92 0.00 0.00 175.35 176.32 2atf n PHE 185 N 4.64 -2.52 -0.77 3.18 3.72 -0.44 -1.35 117.46 123.93 2atf n PHE 185 Ca -0.17 0.91 0.00 0.00 -0.05 0.00 0.00 57.45 58.14 2atf n PHE 185 Cb 0.50 -4.44 0.00 0.00 -0.94 0.00 0.00 39.48 34.60 2atf n PHE 185 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2atf n GLY 186 N -1.80 1.08 3.44 1.37 0.00 -1.26 -5.02 105.19 103.00 2atf n GLY 186 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 2atf n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2atf s ILE 187 N -3.62 4.23 0.26 -0.61 -1.09 -0.45 -4.95 121.20 114.97 2atf s ILE 187 Ca 0.00 -0.20 -0.31 0.00 -2.23 0.00 0.00 60.65 57.91 2atf s ILE 187 Cb 0.00 -2.97 -0.12 0.00 -1.58 0.00 0.00 42.46 37.79 2atf s ILE 187 CO 0.00 0.36 1.58 -1.14 -1.23 0.00 0.00 174.94 174.51 2atf n ARG 188 N 4.81 2.55 -3.76 2.79 3.00 -1.26 -0.76 116.66 124.03 2atf n ARG 188 Ca -0.16 0.91 -0.28 0.00 -0.00 0.00 0.00 57.85 58.32 2atf n ARG 188 Cb 0.51 -2.68 -0.12 0.00 0.00 0.00 0.00 32.46 30.18 2atf n ARG 188 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2atf s THR 189 N 0.27 2.11 -2.00 5.15 -4.23 -0.48 -4.88 115.64 111.58 2atf s THR 189 Ca 0.68 -3.68 0.01 0.00 -1.18 0.00 0.00 61.69 57.52 2atf s THR 189 Cb -0.54 -2.41 0.01 0.00 1.34 0.00 0.00 72.50 70.91 2atf s THR 189 CO 0.45 -1.04 0.53 -2.65 -0.54 0.00 0.00 174.62 171.36