#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ogf n LEU 1 N 0.00 1.70 -4.72 1.04 4.77 -1.26 -4.94 117.00 113.59 2ogf n LEU 1 Ca 0.00 -0.73 -0.42 0.00 -0.03 0.00 0.00 56.01 54.83 2ogf n LEU 1 Cb 0.00 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 40.93 2ogf n LEU 1 CO 0.00 0.37 1.32 -0.13 -1.33 0.00 0.00 177.39 177.61 2ogf s ARG 2 N -1.75 4.17 0.35 3.23 0.52 -1.26 -4.89 118.95 119.32 2ogf s ARG 2 Ca 0.31 2.50 0.08 0.00 -0.52 0.00 0.00 55.73 58.09 2ogf s ARG 2 Cb 0.17 -3.15 0.78 0.00 0.52 0.00 0.00 34.95 33.26 2ogf s ARG 2 CO 0.24 -0.70 1.90 -0.24 0.02 0.00 0.00 175.30 176.53 2ogf h VAL 3 N 3.98 0.90 0.00 3.52 3.04 -1.94 -0.91 116.25 124.83 2ogf h VAL 3 Ca -0.43 -0.25 0.00 0.00 -1.01 0.00 0.00 66.70 65.01 2ogf h VAL 3 Cb 1.20 0.11 0.00 0.00 -2.01 0.00 0.00 31.29 30.59 2ogf h VAL 3 CO 0.94 0.13 0.00 -1.84 -1.01 0.00 0.00 177.57 175.79 2ogf n GLU 4 N -4.53 0.11 0.09 4.17 0.00 -1.26 -1.63 120.64 117.59 2ogf n GLU 4 Ca 0.15 0.42 0.13 0.00 0.00 0.00 0.00 57.16 57.86 2ogf n GLU 4 Cb 0.38 -1.74 0.37 0.00 0.00 0.00 0.00 31.44 30.45 2ogf n GLU 4 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2ogf n GLU 5 N -1.95 0.26 -2.70 3.44 1.02 -0.35 -4.61 120.64 115.75 2ogf n GLU 5 Ca 0.02 0.18 -0.34 0.00 -0.02 0.00 0.00 57.16 57.00 2ogf n GLU 5 Cb 0.15 -1.77 -0.06 0.00 -0.02 0.00 0.00 31.44 29.74 2ogf n GLU 5 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2ogf s THR 6 N -3.11 4.11 0.22 2.62 -4.23 -0.65 -4.96 115.64 109.64 2ogf s THR 6 Ca 0.10 1.39 -0.08 0.00 -1.18 0.00 0.00 61.69 61.92 2ogf s THR 6 Cb 0.13 -3.60 0.18 0.00 1.34 0.00 0.00 72.50 70.54 2ogf s THR 6 CO 0.62 -0.21 1.82 -0.33 -0.54 0.00 0.00 174.62 175.98 2ogf h GLU 7 N 2.00 1.21 -0.45 3.99 4.39 -1.90 -2.27 114.58 121.55 2ogf h GLU 7 Ca -0.49 -0.17 0.05 0.00 0.34 0.00 0.00 59.36 59.09 2ogf h GLU 7 Cb 1.20 -0.22 -0.05 0.00 -0.10 0.00 0.00 28.75 29.58 2ogf h GLU 7 CO 0.61 0.93 0.18 0.28 -1.16 0.00 0.00 179.01 179.85 2ogf h VAL 8 N 1.20 0.89 -0.04 3.13 2.07 -1.93 -2.19 116.25 119.39 2ogf h VAL 8 Ca 0.29 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.68 2ogf h VAL 8 Cb 0.10 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 2ogf h VAL 8 CO -0.04 0.07 0.02 0.15 0.02 0.00 0.00 177.57 177.79 2ogf h PHE 9 N 0.37 0.05 -0.51 1.57 3.57 -1.77 -3.07 116.94 117.15 2ogf h PHE 9 Ca 0.21 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.77 2ogf h PHE 9 Cb 0.18 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 2ogf h PHE 9 CO -0.14 0.05 0.34 0.87 -2.23 0.00 0.00 178.31 177.21 2ogf h LYS 10 N 0.03 0.43 0.00 1.11 1.57 -1.13 -2.33 116.57 116.26 2ogf h LYS 10 Ca 0.01 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2ogf h LYS 10 Cb 0.02 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.23 2ogf h LYS 10 CO -0.00 0.29 0.00 1.57 -0.57 0.00 0.00 179.45 180.73 2ogf h LYS 11 N 0.45 0.00 -0.01 3.15 2.10 -1.30 -2.05 116.57 118.92 2ogf h LYS 11 Ca 0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.87 2ogf h LYS 11 Cb 0.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.64 2ogf h LYS 11 CO -0.06 0.00 -0.01 0.66 -2.00 0.00 0.00 179.45 178.04 2ogf n TYR 12 N -2.45 0.00 -1.42 0.07 4.01 -0.88 -4.05 117.16 112.44 2ogf n TYR 12 Ca 0.01 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.82 2ogf n TYR 12 Cb 0.21 -0.02 0.11 0.00 -0.31 0.00 0.00 39.34 39.33 2ogf n TYR 12 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2ogf n PHE 13 N -0.50 0.00 0.27 -0.72 3.72 -0.77 -4.76 117.46 114.71 2ogf n PHE 13 Ca 0.21 -0.78 0.15 0.00 -0.05 0.00 0.00 57.45 56.98 2ogf n PHE 13 Cb 0.23 -0.13 0.74 0.00 -0.94 0.00 0.00 39.48 39.38 2ogf n PHE 13 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2ogf h LYS 14 N 0.14 0.00 -0.40 -1.08 1.57 -1.70 -3.08 116.57 112.03 2ogf h LYS 14 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2ogf h LYS 14 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 2ogf h LYS 14 CO 0.00 0.08 0.00 0.27 -0.57 0.00 0.00 179.45 179.24 2ogf n ASN 15 N -3.33 2.04 -4.23 0.86 6.94 -1.26 -4.87 115.26 111.41 2ogf n ASN 15 Ca -0.01 -2.04 -0.26 0.00 -0.02 0.00 0.00 54.58 52.25 2ogf n ASN 15 Cb 0.27 -0.27 -0.15 0.00 -2.36 0.00 0.00 39.78 37.27 2ogf n ASN 15 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2ogf s LEU 16 N -1.03 2.10 0.98 -4.53 1.43 -1.16 -5.10 118.68 111.36 2ogf s LEU 16 Ca 0.24 -0.43 -0.12 0.00 -1.03 0.00 0.00 54.13 52.79 2ogf s LEU 16 Cb 0.13 -1.00 0.18 0.00 0.03 0.00 0.00 46.19 45.53 2ogf s LEU 16 CO 0.16 0.20 1.09 0.42 0.23 0.00 0.00 176.35 178.46 2ogf s THR 17 N -0.62 2.19 0.30 5.49 -4.23 -1.26 -4.81 115.64 112.70 2ogf s THR 17 Ca 0.07 0.06 0.02 0.00 -1.18 0.00 0.00 61.69 60.66 2ogf s THR 17 Cb -0.08 -2.56 0.13 0.00 1.34 0.00 0.00 72.50 71.34 2ogf s THR 17 CO 0.00 -0.08 1.82 0.44 -0.54 0.00 0.00 174.62 176.26 2ogf h ASP 18 N -1.82 0.59 -0.24 3.99 3.32 -1.96 -0.42 116.42 119.87 2ogf h ASP 18 Ca -0.53 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.33 2ogf h ASP 18 Cb 1.32 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 2ogf h ASP 18 CO 0.57 0.67 -0.06 0.03 -1.72 0.00 0.00 179.24 178.74 2ogf h ARG 19 N 0.59 0.47 -0.27 3.56 3.08 -1.93 -0.41 114.38 119.47 2ogf h ARG 19 Ca 0.12 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 60.00 2ogf h ARG 19 Cb 0.40 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 2ogf h ARG 19 CO 0.02 0.69 0.17 0.93 -1.07 0.00 0.00 179.97 180.71 2ogf h GLU 20 N 0.21 0.34 -0.61 0.04 5.08 -1.91 -1.53 114.58 116.20 2ogf h GLU 20 Ca 0.06 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2ogf h GLU 20 Cb 0.52 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2ogf h GLU 20 CO 0.02 0.23 0.40 -0.09 -1.00 0.00 0.00 179.01 178.57 2ogf h ARG 21 N 0.35 0.79 -0.63 2.33 2.43 -1.02 -0.37 114.38 118.26 2ogf h ARG 21 Ca 0.10 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2ogf h ARG 21 Cb -0.03 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.32 2ogf h ARG 21 CO -0.03 0.52 0.37 0.00 -1.51 0.00 0.00 179.97 179.31 2ogf h ALA 22 N 1.24 0.80 0.00 2.80 0.00 -0.78 -0.75 119.26 122.57 2ogf h ALA 22 Ca 0.23 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.85 2ogf h ALA 22 Cb -0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 2ogf h ALA 22 CO -0.06 0.30 -0.88 -0.39 0.00 0.00 0.00 179.25 178.21 2ogf h VAL 23 N 0.85 1.49 0.24 0.00 -1.51 -1.10 -0.97 116.25 115.25 2ogf h VAL 23 Ca 0.22 -2.61 0.00 0.00 -1.23 0.00 0.00 66.70 63.09 2ogf h VAL 23 Cb 0.00 2.46 -0.02 0.00 -2.13 0.00 0.00 31.29 31.61 2ogf h VAL 23 CO -0.04 0.76 -0.21 0.15 -1.23 0.00 0.00 177.57 177.00 2ogf h PHE 24 N 0.12 -0.56 -0.84 5.19 3.57 -0.82 0.59 116.94 124.19 2ogf h PHE 24 Ca -0.05 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.45 2ogf h PHE 24 Cb 1.51 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 40.42 2ogf h PHE 24 CO 0.03 -0.32 0.51 0.93 -2.23 0.00 0.00 178.31 177.23 2ogf h GLU 25 N -0.47 1.13 -0.47 1.11 4.39 -1.15 -1.21 114.58 117.90 2ogf h GLU 25 Ca -0.01 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 59.56 2ogf h GLU 25 Cb 0.43 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 2ogf h GLU 25 CO -0.03 0.78 0.16 0.78 -1.16 0.00 0.00 179.01 179.54 2ogf h GLY 26 N 1.16 0.78 0.99 -3.84 0.00 -1.01 -1.85 103.07 99.31 2ogf h GLY 26 Ca 0.30 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2ogf h GLY 26 CO -0.06 0.42 0.22 -1.33 0.00 0.00 0.00 176.54 175.79 2ogf h GLY 27 N 0.63 0.47 0.11 4.60 0.00 -0.55 -1.96 103.07 106.36 2ogf h GLY 27 Ca 0.15 -0.17 0.07 0.00 0.00 0.00 0.00 47.33 47.38 2ogf h GLY 27 CO -0.01 0.17 -0.21 -2.22 0.00 0.00 0.00 176.54 174.26 2ogf h ILE 28 N 0.44 0.42 -0.59 2.60 2.04 -1.04 -1.16 117.51 120.22 2ogf h ILE 28 Ca 0.12 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.91 2ogf h ILE 28 Cb -0.05 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 2ogf h ILE 28 CO -0.03 0.00 0.10 0.74 0.00 0.00 0.00 178.15 178.95 2ogf h THR 29 N -0.18 1.26 -0.29 -0.27 2.02 -1.16 0.11 112.91 114.40 2ogf h THR 29 Ca 0.16 -0.99 -0.04 0.00 0.77 0.00 0.00 66.41 66.31 2ogf h THR 29 Cb 0.43 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 2ogf h THR 29 CO -0.42 0.36 0.02 -0.07 0.37 0.00 0.00 175.52 175.79 2ogf h LEU 30 N 0.88 0.49 -0.59 2.58 3.38 -1.23 0.36 115.31 121.18 2ogf h LEU 30 Ca 0.18 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 2ogf h LEU 30 Cb 0.42 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2ogf h LEU 30 CO 0.01 0.65 0.35 1.23 0.09 0.00 0.00 178.44 180.78 2ogf h GLY 31 N 0.31 0.86 0.77 0.83 0.00 -1.04 -1.75 103.07 103.04 2ogf h GLY 31 Ca 0.09 -0.36 0.02 0.00 0.00 0.00 0.00 47.33 47.08 2ogf h GLY 31 CO 0.01 0.35 -0.06 0.00 0.00 0.00 0.00 176.54 176.84 2ogf h ALA 32 N 1.17 -0.00 -0.20 3.60 0.00 -0.68 -2.26 119.26 120.90 2ogf h ALA 32 Ca 0.21 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2ogf h ALA 32 Cb -0.01 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2ogf h ALA 32 CO -0.04 -0.53 0.12 1.25 0.00 0.00 0.00 179.25 180.05 2ogf h LEU 33 N -0.07 0.24 0.23 0.00 6.46 -0.75 -0.15 115.31 121.27 2ogf h LEU 33 Ca 0.05 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2ogf h LEU 33 Cb 0.14 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 39.99 2ogf h LEU 33 CO -0.11 0.22 -0.21 0.15 -0.62 0.00 0.00 178.44 177.87 2ogf h PHE 34 N 0.24 -0.54 0.00 1.25 3.57 -1.30 -2.58 116.94 117.58 2ogf h PHE 34 Ca 0.07 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.46 2ogf h PHE 34 Cb 0.02 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 2ogf h PHE 34 CO -0.05 -0.31 -0.54 0.45 -2.23 0.00 0.00 178.31 175.63 2ogf h HIS 35 N -0.46 0.00 -0.39 0.41 3.86 -1.26 -1.73 115.15 115.58 2ogf h HIS 35 Ca -0.01 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.06 2ogf h HIS 35 Cb 0.42 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.88 2ogf h HIS 35 CO -0.14 0.54 -0.32 0.37 0.86 0.00 0.00 177.93 179.24 2ogf h GLN 36 N 0.00 0.88 0.00 2.45 5.75 -0.98 -3.38 115.11 119.83 2ogf h GLN 36 Ca -0.01 -0.42 -0.06 0.00 -0.15 0.00 0.00 58.65 58.01 2ogf h GLN 36 Cb 1.31 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.84 2ogf h GLN 36 CO 0.07 1.07 -1.72 1.19 -2.65 0.00 0.00 178.83 176.79 2ogf n PHE 37 N -4.07 0.00 -1.71 3.99 3.72 -0.98 -4.93 117.46 113.47 2ogf n PHE 37 Ca -0.01 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.96 2ogf n PHE 37 Cb 0.51 -0.41 -0.02 0.00 -0.94 0.00 0.00 39.48 38.62 2ogf n PHE 37 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2ogf n VAL 38 N -2.12 1.26 0.00 -4.37 0.31 -0.66 -1.58 118.33 111.17 2ogf n VAL 38 Ca -0.08 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 2ogf n VAL 38 Cb 0.52 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 2ogf n VAL 38 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ogf n GLY 39 N 1.75 3.28 3.72 2.92 0.00 0.84 -4.93 105.19 112.77 2ogf n GLY 39 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2ogf n GLY 39 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ogf s THR 40 N -2.84 3.01 0.20 2.61 2.01 -0.62 -4.24 115.64 115.78 2ogf s THR 40 Ca 0.00 0.74 -0.33 0.00 0.31 0.00 0.00 61.69 62.41 2ogf s THR 40 Cb 0.00 -3.47 -0.13 0.00 0.01 0.00 0.00 72.50 68.91 2ogf s THR 40 CO 0.00 0.06 1.61 -2.65 -0.69 0.00 0.00 174.62 172.95 2ogf n PRO 41 N 3.77 2.40 -3.81 4.92 -0.02 -1.26 -0.38 135.00 140.63 2ogf n PRO 41 Ca 0.12 0.86 -0.16 0.00 -2.02 0.00 0.00 63.50 62.30 2ogf n PRO 41 Cb 0.41 -2.65 -0.16 0.00 -0.02 0.00 0.00 33.50 31.08 2ogf n PRO 41 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2ogf s VAL 42 N 0.78 0.00 0.32 -1.45 0.11 0.69 -4.87 120.40 115.98 2ogf s VAL 42 Ca 0.75 0.19 0.06 0.00 -2.93 0.00 0.00 61.98 60.05 2ogf s VAL 42 Cb -0.60 -0.13 -0.03 0.00 -1.53 0.00 0.00 36.38 34.09 2ogf s VAL 42 CO 0.39 0.11 0.27 -0.94 -3.33 0.00 0.00 175.10 171.59 2ogf s SER 43 N 1.09 1.53 0.45 3.54 1.04 -1.26 -1.15 113.70 118.93 2ogf s SER 43 Ca -0.09 -1.72 0.17 0.00 0.48 0.00 0.00 55.95 54.78 2ogf s SER 43 Cb -0.13 0.54 1.10 0.00 0.10 0.00 0.00 66.02 67.63 2ogf s SER 43 CO -0.03 -1.05 1.96 0.11 0.98 0.00 0.00 173.24 175.21 2ogf h LYS 44 N 2.18 0.33 -0.57 4.02 1.57 -1.49 -0.96 116.57 121.66 2ogf h LYS 44 Ca -0.26 -0.02 0.11 0.00 -1.87 0.00 0.00 60.65 58.62 2ogf h LYS 44 Cb 1.23 -0.07 -0.10 0.00 0.08 0.00 0.00 32.23 33.37 2ogf h LYS 44 CO 0.38 0.22 -0.01 -0.92 -0.57 0.00 0.00 179.45 178.55 2ogf h TYR 45 N 0.34 -0.06 -0.12 -1.35 3.20 -1.88 -3.23 116.97 113.87 2ogf h TYR 45 Ca 0.31 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.23 2ogf h TYR 45 Cb 0.76 0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.14 2ogf h TYR 45 CO -0.00 -0.15 0.00 0.27 -1.64 0.00 0.00 178.16 176.64 2ogf n ASN 46 N -5.27 2.19 -0.08 -2.11 6.94 -0.94 -4.76 115.26 111.23 2ogf n ASN 46 Ca 0.07 -1.83 -0.08 0.00 -0.02 0.00 0.00 54.58 52.72 2ogf n ASN 46 Cb 0.32 -0.08 -0.02 0.00 -2.36 0.00 0.00 39.78 37.64 2ogf n ASN 46 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 2ogf h LYS 47 N 0.89 -0.26 -0.41 -3.83 3.64 -1.21 -1.03 116.57 114.35 2ogf h LYS 47 Ca 0.00 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 2ogf h LYS 47 Cb 0.52 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 2ogf h LYS 47 CO 0.00 -0.18 0.06 0.93 -2.27 0.00 0.00 179.45 177.99 2ogf h GLU 48 N -0.27 0.69 -0.54 1.90 5.08 -1.86 -1.30 114.58 118.28 2ogf h GLU 48 Ca 0.15 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 2ogf h GLU 48 Cb 0.52 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 2ogf h GLU 48 CO -0.46 0.74 0.07 0.66 -1.00 0.00 0.00 179.01 179.01 2ogf h SER 49 N 0.54 0.82 -0.18 1.42 4.64 -1.84 -1.09 113.55 117.87 2ogf h SER 49 Ca 0.12 -0.18 -0.03 0.00 -0.47 0.00 0.00 61.79 61.24 2ogf h SER 49 Cb 0.39 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2ogf h SER 49 CO 0.01 0.84 -0.00 0.25 -0.87 0.00 0.00 176.83 177.06 2ogf h LEU 50 N 0.82 0.31 -0.36 5.97 5.85 -1.04 -0.12 115.31 126.74 2ogf h LEU 50 Ca 0.17 -0.31 0.04 0.00 0.84 0.00 0.00 57.88 58.61 2ogf h LEU 50 Cb 0.39 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 2ogf h LEU 50 CO 0.01 0.55 0.15 -0.33 -0.34 0.00 0.00 178.44 178.48 2ogf h GLU 51 N 0.06 0.31 -0.41 1.25 5.08 -1.04 0.01 114.58 119.84 2ogf h GLU 51 Ca 0.05 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 2ogf h GLU 51 Cb 0.39 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2ogf h GLU 51 CO 0.01 0.20 0.01 -0.09 -1.00 0.00 0.00 179.01 178.15 2ogf h ARG 52 N 0.32 0.72 -0.78 2.33 2.43 -1.16 -1.95 114.38 116.29 2ogf h ARG 52 Ca 0.16 -0.22 -0.05 0.00 -0.81 0.00 0.00 59.98 59.06 2ogf h ARG 52 Cb 0.11 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 2ogf h ARG 52 CO -0.14 0.79 0.31 0.00 -1.51 0.00 0.00 179.97 179.42 2ogf h ALA 53 N 0.90 1.01 0.01 2.80 0.00 -0.71 -1.17 119.26 122.09 2ogf h ALA 53 Ca 0.12 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2ogf h ALA 53 Cb 0.46 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2ogf h ALA 53 CO 0.02 0.64 -0.01 0.82 0.00 0.00 0.00 179.25 180.72 2ogf h ILE 54 N 1.13 1.05 -0.11 0.00 2.04 -0.88 -0.62 117.51 120.11 2ogf h ILE 54 Ca 0.26 -0.18 0.04 0.00 1.00 0.00 0.00 64.86 65.98 2ogf h ILE 54 Cb 0.22 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 2ogf h ILE 54 CO -0.02 0.05 -0.22 -0.33 0.00 0.00 0.00 178.15 177.62 2ogf h GLU 55 N -0.09 -0.28 -0.36 2.37 5.08 -1.12 -2.94 114.58 117.24 2ogf h GLU 55 Ca -0.00 0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.29 2ogf h GLU 55 Cb 0.09 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2ogf h GLU 55 CO 0.00 -0.19 -0.14 0.93 -1.00 0.00 0.00 179.01 178.61 2ogf h GLU 56 N -0.29 0.64 -0.33 2.33 5.08 -1.17 -1.98 114.58 118.85 2ogf h GLU 56 Ca 0.09 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2ogf h GLU 56 Cb 0.43 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2ogf h GLU 56 CO -0.28 0.75 0.00 0.00 -1.00 0.00 0.00 179.01 178.48 2ogf n ALA 57 N -2.48 1.33 0.00 3.43 0.00 -0.25 -3.59 120.51 118.95 2ogf n ALA 57 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2ogf n ALA 57 Cb 0.36 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.81 2ogf n ALA 57 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ogf n LYS 59 N 0.44 0.00 0.17 0.00 5.02 -0.75 -4.26 118.16 118.78 2ogf n LYS 59 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 2ogf n LYS 59 Cb 0.05 -0.32 0.49 0.00 -0.02 0.00 0.00 35.03 35.23 2ogf n LYS 59 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 2ogf h ASN 60 N 0.00 0.14 -4.12 4.39 -0.26 -1.86 -3.43 115.58 110.43 2ogf h ASN 60 Ca 0.00 -0.02 -0.49 0.00 -0.56 0.00 0.00 56.30 55.24 2ogf h ASN 60 Cb 0.00 -0.04 0.05 0.00 -1.06 0.00 0.00 38.32 37.28 2ogf h ASN 60 CO 0.00 0.23 0.39 -1.10 -1.06 0.00 0.00 177.43 175.89 2ogf s GLN 61 N -4.89 3.50 -0.06 0.81 -0.21 -1.26 -4.89 119.66 112.66 2ogf s GLN 61 Ca -0.05 1.39 -0.40 0.00 0.02 0.00 0.00 55.36 56.31 2ogf s GLN 61 Cb 0.16 -2.05 -0.19 0.00 1.00 0.00 0.00 33.01 31.94 2ogf s GLN 61 CO 0.71 -0.69 1.27 -2.30 -2.12 0.00 0.00 175.29 172.16 2ogf n PRO 62 N -1.42 0.42 -1.05 2.91 -0.02 -1.26 -2.44 135.00 132.14 2ogf n PRO 62 Ca 0.10 0.15 -0.02 0.00 -2.02 0.00 0.00 63.50 61.71 2ogf n PRO 62 Cb 0.52 -1.71 -0.01 0.00 -0.02 0.00 0.00 33.50 32.29 2ogf n PRO 62 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ogf s VAL 64 N -1.58 4.20 -0.22 0.00 1.01 -1.02 -1.69 120.40 121.09 2ogf s VAL 64 Ca 0.00 1.49 -0.12 0.00 0.00 0.00 0.00 61.98 63.35 2ogf s VAL 64 Cb 0.00 -3.96 -0.18 0.00 0.00 0.00 0.00 36.38 32.24 2ogf s VAL 64 CO 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 175.10 175.02 2ogf n TYR 65 N 5.98 0.58 -3.50 5.22 9.36 -0.11 -4.89 117.16 129.79 2ogf n TYR 65 Ca 0.13 0.19 -0.14 0.00 3.32 0.00 0.00 57.90 61.41 2ogf n TYR 65 Cb 0.45 -1.07 -0.04 0.00 -0.63 0.00 0.00 39.34 38.06 2ogf n TYR 65 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2ogf s ASP 66 N -7.04 -0.53 -0.19 2.98 2.15 -1.11 -5.00 116.67 107.94 2ogf s ASP 66 Ca -0.32 0.16 -0.18 0.00 0.43 0.00 0.00 52.55 52.64 2ogf s ASP 66 Cb 0.09 0.55 0.05 0.00 -0.30 0.00 0.00 42.92 43.31 2ogf s ASP 66 CO 0.60 -0.83 0.52 -0.51 -0.17 0.00 0.00 175.17 174.78 2ogf s ILE 67 N -2.93 0.00 -0.06 4.11 2.07 -1.26 -0.31 121.20 122.82 2ogf s ILE 67 Ca -0.03 -0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.22 2ogf s ILE 67 Cb -0.00 -0.72 0.02 0.00 0.13 0.00 0.00 42.46 41.88 2ogf s ILE 67 CO -0.06 -0.00 -0.09 -0.75 -1.91 0.00 0.00 174.94 172.13 2ogf s LYS 68 N 0.23 1.33 -0.15 3.50 2.20 0.27 -4.93 119.74 122.19 2ogf s LYS 68 Ca -0.00 -0.27 0.02 0.00 -0.36 0.00 0.00 55.97 55.35 2ogf s LYS 68 Cb -0.04 -1.18 0.01 0.00 -1.51 0.00 0.00 37.83 35.11 2ogf s LYS 68 CO 0.01 -0.04 -0.21 0.08 -0.36 0.00 0.00 175.35 174.83 2ogf s VAL 69 N 0.84 2.09 -0.04 4.02 1.01 -1.26 -1.49 120.40 125.56 2ogf s VAL 69 Ca -0.12 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 60.97 2ogf s VAL 69 Cb -0.15 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 2ogf s VAL 69 CO 0.02 0.55 -0.25 -0.54 0.00 0.00 0.00 175.10 174.87 2ogf s LYS 70 N 0.89 2.38 -0.24 2.72 -0.14 0.29 -4.85 119.74 120.80 2ogf s LYS 70 Ca -0.05 -0.91 -0.07 0.00 -1.36 0.00 0.00 55.97 53.58 2ogf s LYS 70 Cb -0.15 -2.12 -0.03 0.00 -1.68 0.00 0.00 37.83 33.85 2ogf s LYS 70 CO -0.04 0.45 0.06 0.42 -0.76 0.00 0.00 175.35 175.49 2ogf s ILE 71 N -0.34 4.32 0.30 2.17 1.01 -1.26 -0.79 121.20 126.60 2ogf s ILE 71 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.50 2ogf s ILE 71 Cb -0.12 -3.01 -0.04 0.00 0.01 0.00 0.00 42.46 39.30 2ogf s ILE 71 CO 0.02 0.36 0.49 -0.13 0.00 0.00 0.00 174.94 175.68 2ogf s ARG 72 N 1.44 3.50 -1.52 2.79 0.52 -1.26 -4.52 118.95 119.91 2ogf s ARG 72 Ca 0.05 -0.35 -0.06 0.00 -0.52 0.00 0.00 55.73 54.85 2ogf s ARG 72 Cb -0.15 -2.73 0.01 0.00 0.52 0.00 0.00 34.95 32.60 2ogf s ARG 72 CO 0.03 0.25 0.73 0.09 0.02 0.00 0.00 175.30 176.42 2ogf n ASN 73 N -1.40 -6.13 -4.73 0.23 3.02 -1.26 -4.88 115.26 100.11 2ogf n ASN 73 Ca -0.05 -0.35 -0.41 0.00 -0.03 0.00 0.00 54.58 53.75 2ogf n ASN 73 Cb 0.55 -4.92 -0.05 0.00 -0.61 0.00 0.00 39.78 34.75 2ogf n ASN 73 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2ogf s VAL 74 N -3.21 4.59 0.54 2.41 1.01 -1.26 -5.06 120.40 119.42 2ogf s VAL 74 Ca 0.37 1.90 0.03 0.00 0.00 0.00 0.00 61.98 64.28 2ogf s VAL 74 Cb -0.16 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 31.99 2ogf s VAL 74 CO 0.46 0.33 0.20 -0.83 0.00 0.00 0.00 175.10 175.26 2ogf s GLY 75 N -0.01 2.76 0.35 4.51 0.00 -1.26 -4.76 107.32 108.91 2ogf s GLY 75 Ca 0.44 -0.60 0.06 0.00 0.00 0.00 0.00 44.72 44.61 2ogf s GLY 75 CO 0.27 -2.09 1.90 0.83 0.00 0.00 0.00 173.10 174.01 2ogf h GLU 76 N 1.00 0.46 -6.13 2.90 4.39 -1.96 -1.34 114.58 113.90 2ogf h GLU 76 Ca -0.40 -0.09 -0.58 0.00 0.34 0.00 0.00 59.36 58.62 2ogf h GLU 76 Cb 1.32 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.85 2ogf h GLU 76 CO 0.65 0.50 -0.09 0.21 -1.16 0.00 0.00 179.01 179.12 2ogf s LYS 77 N -4.95 4.14 0.50 2.33 2.20 -1.26 -4.58 119.74 118.12 2ogf s LYS 77 Ca -0.07 0.63 -0.19 0.00 -0.36 0.00 0.00 55.97 55.98 2ogf s LYS 77 Cb 0.16 -3.25 -0.08 0.00 -1.51 0.00 0.00 37.83 33.14 2ogf s LYS 77 CO 0.76 0.60 1.01 1.52 -0.36 0.00 0.00 175.35 178.88 2ogf s TYR 78 N -0.92 3.15 0.16 4.03 -0.85 -1.26 -4.73 117.35 116.93 2ogf s TYR 78 Ca 0.27 1.55 0.02 0.00 -0.52 0.00 0.00 57.07 58.39 2ogf s TYR 78 Cb -0.18 -2.95 -0.05 0.00 0.38 0.00 0.00 41.96 39.16 2ogf s TYR 78 CO 0.17 -0.65 -0.02 0.14 -1.52 0.00 0.00 175.55 173.67 2ogf s VAL 79 N -2.26 0.74 0.04 -3.49 -7.23 -0.30 -4.91 120.40 102.98 2ogf s VAL 79 Ca 0.64 -1.98 -0.30 0.00 -1.81 0.00 0.00 61.98 58.52 2ogf s VAL 79 Cb -0.13 -2.02 -0.06 0.00 0.56 0.00 0.00 36.38 34.73 2ogf s VAL 79 CO 0.24 -0.57 1.38 -0.44 -0.31 0.00 0.00 175.10 175.40 2ogf s SER 80 N -3.15 6.86 0.01 4.85 0.01 -1.26 -0.22 113.70 120.80 2ogf s SER 80 Ca 0.21 2.16 -0.37 0.00 1.31 0.00 0.00 55.95 59.26 2ogf s SER 80 Cb 0.06 -2.57 -0.16 0.00 0.21 0.00 0.00 66.02 63.56 2ogf s SER 80 CO 0.02 -0.68 1.48 -0.11 0.41 0.00 0.00 173.24 174.36 2ogf n LEU 81 N 4.86 2.06 -4.41 2.44 7.94 0.49 -4.73 117.00 125.64 2ogf n LEU 81 Ca 0.12 1.10 -0.25 0.00 -1.11 0.00 0.00 56.01 55.87 2ogf n LEU 81 Cb 0.44 -1.22 -0.11 0.00 0.53 0.00 0.00 43.42 43.06 2ogf n LEU 81 CO 0.58 -0.78 -0.51 1.51 -1.11 0.00 0.00 177.39 177.09 2ogf s ASP 82 N 1.34 3.28 0.48 1.96 -4.77 -1.26 -0.11 116.67 117.59 2ogf s ASP 82 Ca 0.87 -0.91 0.17 0.00 -3.30 0.00 0.00 52.55 49.37 2ogf s ASP 82 Cb -0.93 -0.24 1.16 0.00 -1.09 0.00 0.00 42.92 41.81 2ogf s ASP 82 CO 0.50 0.06 2.03 1.23 0.70 0.00 0.00 175.17 179.68 2ogf h GLY 83 N 2.96 0.30 -4.09 2.12 0.00 -1.93 -3.34 103.07 99.08 2ogf h GLY 83 Ca -0.44 -0.09 -0.05 0.00 0.00 0.00 0.00 47.33 46.76 2ogf h GLY 83 CO 0.52 0.06 0.06 0.28 0.00 0.00 0.00 176.54 177.46 2ogf n LYS 84 N -4.46 0.68 -1.09 4.80 5.02 -1.26 -4.81 118.16 117.03 2ogf n LYS 84 Ca 0.06 -0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 2ogf n LYS 84 Cb 0.34 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 2ogf n LYS 84 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2ogf n LEU 86 N 2.31 0.00 -3.68 -0.35 4.77 -1.26 -4.50 117.00 114.30 2ogf n LEU 86 Ca 0.10 0.29 -0.28 0.00 -0.03 0.00 0.00 56.01 56.09 2ogf n LEU 86 Cb 0.32 -1.42 -0.16 0.00 -2.33 0.00 0.00 43.42 39.83 2ogf n LEU 86 CO 0.10 0.00 -0.35 -0.62 -1.33 0.00 0.00 177.39 175.20 2ogf s ASP 87 N -2.26 3.09 -0.03 -1.43 2.15 0.03 -4.14 116.67 114.08 2ogf s ASP 87 Ca 0.00 -0.99 0.04 0.00 0.43 0.00 0.00 52.55 52.02 2ogf s ASP 87 Cb 0.00 -0.52 -0.00 0.00 -0.30 0.00 0.00 42.92 42.10 2ogf s ASP 87 CO 0.00 -0.36 -0.13 -0.69 -0.17 0.00 0.00 175.17 173.82 2ogf s VAL 88 N 1.92 1.13 -0.14 1.11 1.01 0.26 -0.54 120.40 125.15 2ogf s VAL 88 Ca 0.03 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.48 2ogf s VAL 88 Cb -0.17 -0.98 0.00 0.00 0.00 0.00 0.00 36.38 35.23 2ogf s VAL 88 CO -0.16 0.33 -0.20 -1.81 0.00 0.00 0.00 175.10 173.26 2ogf s ASP 89 N 0.09 3.31 -0.04 3.32 1.01 -0.56 -1.25 116.67 122.56 2ogf s ASP 89 Ca -0.03 -0.54 0.04 0.00 0.71 0.00 0.00 52.55 52.73 2ogf s ASP 89 Cb -0.10 -1.48 -0.00 0.00 1.01 0.00 0.00 42.92 42.35 2ogf s ASP 89 CO 0.01 0.10 -0.15 -0.22 0.21 0.00 0.00 175.17 175.12 2ogf s LEU 90 N 0.69 1.90 -0.15 1.23 2.96 -0.35 -0.56 118.68 124.40 2ogf s LEU 90 Ca -0.09 -0.31 -0.00 0.00 -0.22 0.00 0.00 54.13 53.51 2ogf s LEU 90 Cb -0.16 -0.86 -0.01 0.00 0.50 0.00 0.00 46.19 45.66 2ogf s LEU 90 CO 0.01 0.14 -0.13 -0.54 -1.32 0.00 0.00 176.35 174.51 2ogf s LYS 91 N 0.02 3.30 -0.15 1.98 1.02 0.58 -0.06 119.74 126.43 2ogf s LYS 91 Ca -0.02 -0.71 -0.03 0.00 0.02 0.00 0.00 55.97 55.23 2ogf s LYS 91 Cb -0.10 -2.66 -0.02 0.00 -0.52 0.00 0.00 37.83 34.52 2ogf s LYS 91 CO 0.01 0.07 -0.06 0.42 -0.92 0.00 0.00 175.35 174.88 2ogf s ILE 92 N 0.69 3.65 -0.22 2.17 -1.09 -0.16 -0.94 121.20 125.31 2ogf s ILE 92 Ca -0.06 -0.44 -0.02 0.00 -2.23 0.00 0.00 60.65 57.89 2ogf s ILE 92 Cb -0.15 -2.59 0.01 0.00 -1.58 0.00 0.00 42.46 38.15 2ogf s ILE 92 CO 0.02 0.50 -0.08 -0.75 -1.23 0.00 0.00 174.94 173.40 2ogf s LYS 93 N 0.39 3.15 -0.28 2.79 2.20 -0.68 -0.75 119.74 126.55 2ogf s LYS 93 Ca -0.06 -0.77 0.02 0.00 -0.36 0.00 0.00 55.97 54.80 2ogf s LYS 93 Cb -0.15 -2.93 0.06 0.00 -1.51 0.00 0.00 37.83 33.31 2ogf s LYS 93 CO 0.04 -0.26 -0.06 0.42 -0.36 0.00 0.00 175.35 175.12 2ogf s ILE 94 N 1.40 2.39 0.00 5.43 -1.09 0.34 -4.82 121.20 124.85 2ogf s ILE 94 Ca 0.04 -1.66 0.00 0.00 -2.23 0.00 0.00 60.65 56.80 2ogf s ILE 94 Cb -0.15 -2.44 0.00 0.00 -1.58 0.00 0.00 42.46 38.29 2ogf s ILE 94 CO -0.05 -0.12 0.00 0.59 -1.23 0.00 0.00 174.94 174.13 2ogf n ASN 95 N 4.46 0.00 -0.94 3.58 3.02 -1.26 -0.62 115.26 123.50 2ogf n ASN 95 Ca -0.12 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.55 2ogf n ASN 95 Cb 0.42 0.00 0.10 0.00 -0.61 0.00 0.00 39.78 39.69 2ogf n ASN 95 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ogf n LYS 96 N 2.87 2.26 -3.39 3.52 4.01 -1.26 -4.92 118.16 121.24 2ogf n LYS 96 Ca 0.00 -1.90 -0.38 0.00 -0.51 0.00 0.00 58.31 55.52 2ogf n LYS 96 Cb 0.00 -1.45 -0.06 0.00 -0.51 0.00 0.00 35.03 33.01 2ogf n LYS 96 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 2ogf s THR 97 N -1.95 5.17 -0.16 -0.18 2.01 0.21 -4.50 115.64 116.24 2ogf s THR 97 Ca 0.27 0.86 0.01 0.00 0.31 0.00 0.00 61.69 63.15 2ogf s THR 97 Cb 0.20 -3.76 0.02 0.00 0.01 0.00 0.00 72.50 68.96 2ogf s THR 97 CO 0.29 0.39 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.72 2ogf s VAL 98 N 0.22 2.03 -0.13 3.82 1.01 0.28 -0.50 120.40 127.13 2ogf s VAL 98 Ca 0.24 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.16 2ogf s VAL 98 Cb -0.15 -1.82 -0.05 0.00 0.00 0.00 0.00 36.38 34.36 2ogf s VAL 98 CO 0.10 0.54 0.27 0.00 0.00 0.00 0.00 175.10 176.01 2ogf s ALA 99 N 1.14 3.67 -0.27 5.51 0.00 0.07 0.62 121.76 132.49 2ogf s ALA 99 Ca 0.01 -0.46 -0.07 0.00 0.00 0.00 0.00 51.96 51.43 2ogf s ALA 99 Cb -0.14 -2.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.67 2ogf s ALA 99 CO -0.09 0.26 0.08 -1.01 0.00 0.00 0.00 175.76 175.00 2ogf s HIS 100 N -0.09 3.11 0.27 0.00 3.76 0.47 -0.99 115.29 121.82 2ogf s HIS 100 Ca 0.17 -0.59 0.11 0.00 -0.15 0.00 0.00 55.06 54.59 2ogf s HIS 100 Cb -0.13 -2.26 -0.05 0.00 1.11 0.00 0.00 32.58 31.25 2ogf s HIS 100 CO 0.05 -0.43 -0.13 -0.51 -0.85 0.00 0.00 174.74 172.87 2ogf s LEU 101 N 1.58 2.80 -0.01 0.89 1.02 0.91 -0.24 118.68 125.64 2ogf s LEU 101 Ca 0.05 -0.87 0.02 0.00 0.02 0.00 0.00 54.13 53.35 2ogf s LEU 101 Cb -0.16 -1.33 -0.00 0.00 0.02 0.00 0.00 46.19 44.72 2ogf s LEU 101 CO 0.03 0.03 -0.07 -0.75 0.02 0.00 0.00 176.35 175.62 2ogf s LYS 102 N -3.50 0.61 -0.16 1.70 2.47 0.37 -1.21 119.74 120.02 2ogf s LYS 102 Ca 0.30 -0.25 0.01 0.00 -1.56 0.00 0.00 55.97 54.47 2ogf s LYS 102 Cb -0.06 -0.59 0.01 0.00 -1.46 0.00 0.00 37.83 35.73 2ogf s LYS 102 CO 0.16 0.14 -0.18 -1.17 0.16 0.00 0.00 175.35 174.47 2ogf s LEU 103 N -0.10 2.32 -0.01 5.43 2.96 -0.38 -0.98 118.68 127.93 2ogf s LEU 103 Ca 0.02 -0.54 -0.28 0.00 -0.22 0.00 0.00 54.13 53.10 2ogf s LEU 103 Cb -0.04 -1.52 0.07 0.00 0.50 0.00 0.00 46.19 45.20 2ogf s LEU 103 CO -0.00 0.06 0.64 -1.83 -1.32 0.00 0.00 176.35 173.90 2ogf s GLU 104 N 0.94 1.08 -0.04 1.98 -1.05 -0.62 -0.57 118.70 120.42 2ogf s GLU 104 Ca -0.03 0.08 -0.30 0.00 -0.15 0.00 0.00 54.97 54.57 2ogf s GLU 104 Cb -0.15 0.51 -0.03 0.00 -0.44 0.00 0.00 34.13 34.01 2ogf s GLU 104 CO -0.03 -0.37 1.16 -0.47 0.95 0.00 0.00 175.26 176.50 2ogf s TYR 105 N -1.73 3.30 -0.47 4.83 5.04 -1.26 -0.84 117.35 126.22 2ogf s TYR 105 Ca -0.09 1.31 -0.09 0.00 -2.44 0.00 0.00 57.07 55.76 2ogf s TYR 105 Cb -0.00 -3.37 0.12 0.00 0.35 0.00 0.00 41.96 39.05 2ogf s TYR 105 CO 0.05 -1.08 0.35 0.42 -1.34 0.00 0.00 175.55 173.95 2ogf s ILE 106 N 1.92 4.21 0.29 3.14 -1.09 0.19 -4.94 121.20 124.93 2ogf s ILE 106 Ca 0.55 -1.79 0.02 0.00 -2.23 0.00 0.00 60.65 57.20 2ogf s ILE 106 Cb -0.24 -3.77 0.29 0.00 -1.58 0.00 0.00 42.46 37.15 2ogf s ILE 106 CO 0.23 -0.78 1.86 -0.65 -1.23 0.00 0.00 174.94 174.37 2ogf h PRO 107 N 8.45 0.95 -0.37 2.79 0.11 -1.95 -0.85 132.00 141.13 2ogf h PRO 107 Ca -0.21 -0.06 0.06 0.00 0.11 0.00 0.00 66.00 65.90 2ogf h PRO 107 Cb 1.07 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.95 2ogf h PRO 107 CO 0.86 0.63 0.25 0.93 -0.21 0.00 0.00 178.00 180.46 2ogf h GLU 108 N 0.98 0.23 -0.21 1.05 3.07 -1.96 -1.46 114.58 116.28 2ogf h GLU 108 Ca 0.47 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 2ogf h GLU 108 Cb 0.45 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 2ogf h GLU 108 CO -0.23 0.15 0.00 0.44 -1.40 0.00 0.00 179.01 177.97 2ogf n ILE 109 N -4.47 1.27 -4.14 3.13 -5.35 -0.97 -5.00 119.36 103.83 2ogf n ILE 109 Ca 0.05 -1.24 -0.33 0.00 -0.27 0.00 0.00 62.75 60.95 2ogf n ILE 109 Cb 0.27 0.32 -0.04 0.00 -1.74 0.00 0.00 39.64 38.45 2ogf n ILE 109 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2ogf n ASP 110 N -0.09 -0.92 -3.79 7.28 2.03 -0.36 -4.94 116.55 115.77 2ogf n ASP 110 Ca 0.10 -1.21 -0.14 0.00 0.52 0.00 0.00 54.79 54.07 2ogf n ASP 110 Cb 0.46 -2.06 -0.15 0.00 -0.72 0.00 0.00 41.12 38.65 2ogf n ASP 110 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2ogf s TYR 111 N -4.03 -0.05 -0.80 -0.67 5.04 -1.01 -4.99 117.35 110.83 2ogf s TYR 111 Ca 0.15 0.24 -0.26 0.00 -2.44 0.00 0.00 57.07 54.75 2ogf s TYR 111 Cb -0.07 -0.11 0.03 0.00 0.35 0.00 0.00 41.96 42.15 2ogf s TYR 111 CO 0.96 -0.09 1.38 -1.25 -1.34 0.00 0.00 175.55 175.21 2ogf s PRO 112 N 0.78 3.22 0.00 4.97 0.04 -1.26 -0.63 135.00 142.11 2ogf s PRO 112 Ca -0.06 -0.37 0.00 0.00 0.04 0.00 0.00 61.00 60.61 2ogf s PRO 112 Cb -0.09 -4.48 0.00 0.00 0.04 0.00 0.00 34.50 29.98 2ogf s PRO 112 CO -0.03 -2.24 0.00 -0.11 0.04 0.00 0.00 177.00 174.66 2ogf n LEU 113 N 9.65 0.00 0.00 -3.56 7.94 -0.02 -4.84 117.00 126.17 2ogf n LEU 113 Ca 0.12 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 2ogf n LEU 113 Cb 0.50 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.45 2ogf n LEU 113 CO 0.70 -0.22 0.00 0.00 -1.11 0.00 0.00 177.39 176.76 2ogf n TYR 115 N -0.56 0.00 -3.71 1.96 0.18 -0.15 -1.59 117.16 113.29 2ogf n TYR 115 Ca 0.00 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.41 2ogf n TYR 115 Cb 0.00 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 38.84 2ogf n TYR 115 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2ogf s VAL 116 N -1.70 4.73 -0.01 -3.48 1.01 -1.26 -0.48 120.40 119.20 2ogf s VAL 116 Ca 0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 61.98 61.73 2ogf s VAL 116 Cb 0.00 -3.22 -0.14 0.00 0.00 0.00 0.00 36.38 33.02 2ogf s VAL 116 CO 0.00 0.31 0.97 0.11 0.00 0.00 0.00 175.10 176.49 2ogf h LYS 117 N 8.19 -0.52 -2.58 2.72 1.79 -0.94 -3.48 116.57 121.76 2ogf h LYS 117 Ca -0.37 0.04 0.08 0.00 -2.18 0.00 0.00 60.65 58.22 2ogf h LYS 117 Cb 1.18 0.12 -0.12 0.00 -1.58 0.00 0.00 32.23 31.83 2ogf h LYS 117 CO 0.58 -0.22 0.38 -1.59 -1.08 0.00 0.00 179.45 177.52 2ogf s LYS 118 N -4.06 1.15 0.05 3.15 -2.85 -1.15 -5.02 119.74 111.01 2ogf s LYS 118 Ca -0.12 -0.51 0.05 0.00 -1.00 0.00 0.00 55.97 54.38 2ogf s LYS 118 Cb 0.01 0.47 -0.04 0.00 -2.06 0.00 0.00 37.83 36.22 2ogf s LYS 118 CO 0.42 -0.51 -0.06 -0.06 0.10 0.00 0.00 175.35 175.24 2ogf s PHE 119 N -3.43 2.88 -0.22 1.78 0.08 -1.26 -0.39 117.98 117.42 2ogf s PHE 119 Ca 0.06 -0.06 0.02 0.00 0.12 0.00 0.00 56.93 57.07 2ogf s PHE 119 Cb -0.02 -1.55 0.04 0.00 -0.57 0.00 0.00 43.02 40.93 2ogf s PHE 119 CO -0.06 0.42 -0.15 -2.00 -0.10 0.00 0.00 175.22 173.33 2ogf s GLU 120 N -1.84 2.59 0.00 0.44 2.12 0.20 -4.98 118.70 117.24 2ogf s GLU 120 Ca 0.20 -1.07 0.00 0.00 0.36 0.00 0.00 54.97 54.47 2ogf s GLU 120 Cb -0.11 -2.71 0.00 0.00 0.26 0.00 0.00 34.13 31.57 2ogf s GLU 120 CO 0.12 -0.39 0.24 0.39 -0.54 0.00 0.00 175.26 175.08