#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2odh s LYS 2 N 0.00 4.19 -0.18 3.17 2.47 -1.26 -5.02 119.74 123.11 2odh s LYS 2 Ca 0.00 2.43 -0.05 0.00 -1.56 0.00 0.00 55.97 56.79 2odh s LYS 2 Cb 0.00 -3.11 -0.03 0.00 -1.46 0.00 0.00 37.83 33.23 2odh s LYS 2 CO 0.00 -0.61 0.01 0.42 0.16 0.00 0.00 175.35 175.33 2odh s ILE 3 N 0.80 4.19 0.23 5.43 -1.09 -1.26 -4.53 121.20 124.97 2odh s ILE 3 Ca 0.68 -0.24 0.02 0.00 -2.23 0.00 0.00 60.65 58.88 2odh s ILE 3 Cb -0.45 -2.87 -0.03 0.00 -1.58 0.00 0.00 42.46 37.52 2odh s ILE 3 CO 0.36 0.46 0.38 0.26 -1.23 0.00 0.00 174.94 175.16 2odh s TRP 4 N 0.61 3.47 0.27 3.97 0.52 -0.03 -4.89 118.94 122.86 2odh s TRP 4 Ca -0.00 0.15 0.07 0.00 0.02 0.00 0.00 56.10 56.34 2odh s TRP 4 Cb -0.14 -1.71 -0.03 0.00 -1.15 0.00 0.00 33.47 30.44 2odh s TRP 4 CO 0.02 0.39 0.24 -1.54 0.02 0.00 0.00 176.95 176.08 2odh s SER 5 N -3.65 5.57 0.21 2.95 1.04 -1.26 -0.64 113.70 117.92 2odh s SER 5 Ca 0.36 -0.27 -0.09 0.00 0.48 0.00 0.00 55.95 56.43 2odh s SER 5 Cb -0.10 -1.35 0.23 0.00 0.10 0.00 0.00 66.02 64.89 2odh s SER 5 CO 0.30 -0.12 1.84 0.50 0.98 0.00 0.00 173.24 176.74 2odh h LYS 6 N 1.39 0.80 -0.92 4.02 3.64 -1.98 -1.45 116.57 122.07 2odh h LYS 6 Ca -0.48 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.85 2odh h LYS 6 Cb 1.24 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 32.84 2odh h LYS 6 CO 0.60 0.53 0.57 1.49 -2.27 0.00 0.00 179.45 180.36 2odh h GLU 7 N 0.82 1.24 -0.82 1.90 4.81 -1.99 -1.02 114.58 119.53 2odh h GLU 7 Ca 0.30 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2odh h GLU 7 Cb 0.09 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.17 2odh h GLU 7 CO -0.14 0.86 0.51 1.49 -0.73 0.00 0.00 179.01 180.99 2odh h GLU 8 N 1.27 1.10 -0.19 1.92 4.81 -1.83 0.62 114.58 122.28 2odh h GLU 8 Ca 0.33 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.47 2odh h GLU 8 Cb -0.08 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.06 2odh h GLU 8 CO -0.06 0.76 0.10 0.28 -0.73 0.00 0.00 179.01 179.36 2odh h VAL 9 N 1.12 1.10 -0.69 0.32 2.07 -0.52 -0.40 116.25 119.25 2odh h VAL 9 Ca 0.29 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 2odh h VAL 9 Cb -0.07 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 2odh h VAL 9 CO -0.06 0.10 0.42 0.58 0.02 0.00 0.00 177.57 178.63 2odh h VAL 10 N 0.20 1.20 -0.86 2.57 2.07 -0.96 -0.60 116.25 119.86 2odh h VAL 10 Ca 0.07 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 2odh h VAL 10 Cb 0.07 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.04 2odh h VAL 10 CO -0.01 0.20 0.44 0.78 0.02 0.00 0.00 177.57 179.00 2odh h ASN 11 N 0.93 1.11 -0.54 0.57 2.35 -0.69 -1.86 115.58 117.44 2odh h ASN 11 Ca 0.25 -0.12 -0.05 0.00 -0.55 0.00 0.00 56.30 55.82 2odh h ASN 11 Cb -0.04 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.03 2odh h ASN 11 CO -0.05 0.91 0.13 0.50 -1.65 0.00 0.00 177.43 177.28 2odh h LYS 12 N 1.22 0.87 -0.53 0.81 1.63 -0.59 -0.30 116.57 119.68 2odh h LYS 12 Ca 0.30 -0.21 0.04 0.00 -0.85 0.00 0.00 60.65 59.93 2odh h LYS 12 Cb 0.08 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.56 2odh h LYS 12 CO -0.04 0.82 0.28 -0.07 -3.45 0.00 0.00 179.45 176.99 2odh h LEU 13 N 0.77 0.42 -0.57 5.20 3.38 -0.74 -0.35 115.31 123.41 2odh h LEU 13 Ca 0.17 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 2odh h LEU 13 Cb 0.34 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2odh h LEU 13 CO 0.00 0.29 0.19 0.45 0.09 0.00 0.00 178.44 179.46 2odh h HIS 14 N 0.55 0.91 -0.58 1.13 3.86 -1.08 -0.94 115.15 119.00 2odh h HIS 14 Ca 0.23 -0.09 0.07 0.00 -1.16 0.00 0.00 60.37 59.42 2odh h HIS 14 Cb 0.11 -0.27 -0.06 0.00 1.06 0.00 0.00 27.41 28.26 2odh h HIS 14 CO -0.09 0.76 0.27 1.49 0.86 0.00 0.00 177.93 181.22 2odh h GLU 15 N 0.80 0.48 -0.17 2.45 4.81 -0.52 -0.24 114.58 122.19 2odh h GLU 15 Ca 0.19 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 2odh h GLU 15 Cb 0.27 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2odh h GLU 15 CO -0.01 0.32 -0.00 0.82 -0.73 0.00 0.00 179.01 179.41 2odh h ILE 16 N 0.50 1.26 -0.97 2.32 2.04 -0.88 -2.92 117.51 118.86 2odh h ILE 16 Ca 0.28 -0.86 0.07 0.00 1.00 0.00 0.00 64.86 65.35 2odh h ILE 16 Cb 0.25 1.48 -0.07 0.00 -0.74 0.00 0.00 36.82 37.74 2odh h ILE 16 CO -0.23 0.26 0.63 0.50 0.00 0.00 0.00 178.15 179.31 2odh h LYS 17 N 0.06 1.07 0.00 2.37 3.64 -0.86 -1.99 116.57 120.85 2odh h LYS 17 Ca 0.05 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2odh h LYS 17 Cb 0.39 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2odh h LYS 17 CO 0.01 0.71 0.00 0.09 -2.27 0.00 0.00 179.45 177.98 2odh n ASN 18 N -4.51 0.56 0.07 4.20 3.02 -0.13 -2.01 115.26 116.46 2odh n ASN 18 Ca 0.15 0.64 0.12 0.00 -0.03 0.00 0.00 54.58 55.47 2odh n ASN 18 Cb 0.21 -0.76 0.47 0.00 -0.61 0.00 0.00 39.78 39.09 2odh n ASN 18 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2odh n LYS 19 N -2.12 0.14 0.00 3.52 5.02 -0.75 -5.02 118.16 118.95 2odh n LYS 19 Ca 0.02 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.52 2odh n LYS 19 Cb 0.21 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 2odh n LYS 19 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2odh n GLY 20 N 0.88 0.48 3.67 0.72 0.00 -0.85 -4.77 105.19 105.32 2odh n GLY 20 Ca 0.05 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 2odh n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2odh s TYR 21 N 0.00 3.09 -0.11 1.61 2.02 -1.26 -4.42 117.35 118.28 2odh s TYR 21 Ca 0.00 1.19 -0.05 0.00 -0.37 0.00 0.00 57.07 57.84 2odh s TYR 21 Cb 0.00 -3.42 -0.04 0.00 -0.40 0.00 0.00 41.96 38.10 2odh s TYR 21 CO 0.00 -1.29 0.09 -0.51 -1.57 0.00 0.00 175.55 172.27 2odh s LEU 22 N 2.85 4.10 0.59 -1.29 1.43 0.48 -4.80 118.68 122.04 2odh s LEU 22 Ca 0.53 0.35 -0.04 0.00 -1.03 0.00 0.00 54.13 53.95 2odh s LEU 22 Cb -0.22 -1.98 0.02 0.00 0.03 0.00 0.00 46.19 44.05 2odh s LEU 22 CO 0.17 0.40 0.87 -0.44 0.23 0.00 0.00 176.35 177.57 2odh s SER 23 N -0.98 5.40 -0.24 2.29 0.01 -1.26 -0.92 113.70 118.00 2odh s SER 23 Ca 0.14 0.46 -0.28 0.00 1.31 0.00 0.00 55.95 57.58 2odh s SER 23 Cb -0.12 -1.40 0.01 0.00 0.21 0.00 0.00 66.02 64.72 2odh s SER 23 CO 0.03 -1.14 0.98 -0.69 0.41 0.00 0.00 173.24 172.84 2odh s VAL 24 N -2.94 4.71 0.31 3.43 1.01 -1.25 -4.96 120.40 120.71 2odh s VAL 24 Ca 0.55 1.86 -0.29 0.00 0.00 0.00 0.00 61.98 64.10 2odh s VAL 24 Cb -0.10 -4.26 -0.11 0.00 0.00 0.00 0.00 36.38 31.90 2odh s VAL 24 CO 0.43 -0.18 1.46 -2.84 0.00 0.00 0.00 175.10 173.96 2odh s PRO 25 N 3.14 4.22 0.32 2.72 0.02 -1.26 -4.92 135.00 139.24 2odh s PRO 25 Ca 0.41 2.41 0.19 0.00 0.02 0.00 0.00 61.00 64.03 2odh s PRO 25 Cb -0.15 -3.05 0.15 0.00 0.02 0.00 0.00 34.50 31.48 2odh s PRO 25 CO 0.07 -0.44 1.43 1.79 -0.33 0.00 0.00 177.00 179.52 2odh h THR 26 N 3.26 0.41 0.00 0.99 1.35 -1.98 -3.16 112.91 113.77 2odh h THR 26 Ca -0.48 -1.61 0.00 0.00 -0.55 0.00 0.00 66.41 63.77 2odh h THR 26 Cb 1.23 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 69.79 2odh h THR 26 CO 0.72 0.24 0.00 -0.90 -0.25 0.00 0.00 175.52 175.33 2odh n ASP 27 N -3.10 0.00 -4.63 5.36 5.75 -1.26 -4.72 116.55 113.95 2odh n ASP 27 Ca 0.02 -0.49 -0.40 0.00 -0.01 0.00 0.00 54.79 53.91 2odh n ASP 27 Cb 0.64 -0.11 -0.07 0.00 -1.03 0.00 0.00 41.12 40.55 2odh n ASP 27 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 2odh s MET 28 N -2.22 4.10 0.22 0.11 1.75 -1.20 -5.05 119.30 117.00 2odh s MET 28 Ca 0.31 0.35 -0.30 0.00 -1.25 0.00 0.00 55.69 54.81 2odh s MET 28 Cb 0.17 -3.63 -0.09 0.00 2.84 0.00 0.00 34.83 34.11 2odh s MET 28 CO 0.32 -0.31 1.36 0.12 -0.65 0.00 0.00 175.02 175.85 2odh s PHE 29 N 2.19 3.17 -0.01 4.11 5.36 -1.26 -5.00 117.98 126.54 2odh s PHE 29 Ca 0.22 1.15 0.03 0.00 -0.96 0.00 0.00 56.93 57.37 2odh s PHE 29 Cb -0.16 -3.68 -0.01 0.00 -0.34 0.00 0.00 43.02 38.84 2odh s PHE 29 CO 0.09 -2.17 -0.10 1.03 -1.46 0.00 0.00 175.22 172.62 2odh s ARG 30 N -0.23 0.80 0.00 10.12 0.52 -1.26 -5.12 118.95 123.79 2odh s ARG 30 Ca 0.58 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 55.44 2odh s ARG 30 Cb -0.38 -0.78 0.00 0.00 0.52 0.00 0.00 34.95 34.31 2odh s ARG 30 CO 0.40 0.21 0.00 0.25 0.02 0.00 0.00 175.30 176.18 2odh n THR 31 N 2.86 0.00 0.64 0.02 -2.24 -1.26 -5.00 114.28 109.29 2odh n THR 31 Ca -0.14 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.77 2odh n THR 31 Cb 0.56 -0.94 0.46 0.00 -2.10 0.00 0.00 70.33 68.32 2odh n THR 31 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2odh n ASP 32 N 0.00 0.56 -4.07 3.42 8.00 -1.26 -4.89 116.55 118.31 2odh n ASP 32 Ca 0.00 0.58 -0.08 0.00 0.71 0.00 0.00 54.79 56.00 2odh n ASP 32 Cb 0.00 -0.72 -0.10 0.00 -0.02 0.00 0.00 41.12 40.29 2odh n ASP 32 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2odh s ASP 33 N -4.04 0.41 0.00 -2.24 2.15 -1.26 -4.93 116.67 106.76 2odh s ASP 33 Ca 0.10 -0.99 0.00 0.00 0.43 0.00 0.00 52.55 52.08 2odh s ASP 33 Cb 0.13 0.24 0.00 0.00 -0.30 0.00 0.00 42.92 42.98 2odh s ASP 33 CO 0.51 -0.64 0.00 0.61 -0.17 0.00 0.00 175.17 175.48 2odh n GLY 34 N 0.05 0.77 0.35 2.66 0.00 -1.26 -4.97 105.19 102.78 2odh n GLY 34 Ca -0.13 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.90 2odh n GLY 34 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2odh h VAL 35 N 0.00 1.19 -0.18 1.61 3.04 -1.92 -1.98 116.25 118.02 2odh h VAL 35 Ca 0.00 -0.36 0.00 0.00 -1.01 0.00 0.00 66.70 65.34 2odh h VAL 35 Cb 0.00 0.13 -0.01 0.00 -2.01 0.00 0.00 31.29 29.40 2odh h VAL 35 CO 0.00 0.18 0.12 0.58 -1.01 0.00 0.00 177.57 177.44 2odh h VAL 36 N 0.98 1.06 -0.39 1.51 2.07 -1.93 -1.13 116.25 118.42 2odh h VAL 36 Ca 0.26 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 67.61 2odh h VAL 36 Cb -0.10 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2odh h VAL 36 CO -0.06 0.05 0.00 1.23 0.02 0.00 0.00 177.57 178.82 2odh h GLY 37 N 0.23 0.67 0.96 2.17 0.00 -1.63 -0.99 103.07 104.48 2odh h GLY 37 Ca 0.07 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 2odh h GLY 37 CO -0.01 0.38 0.18 1.46 0.00 0.00 0.00 176.54 178.54 2odh h GLN 38 N 0.59 0.69 -0.48 4.80 4.20 -0.91 -0.66 115.11 123.34 2odh h GLN 38 Ca 0.12 -0.13 -0.11 0.00 0.06 0.00 0.00 58.65 58.59 2odh h GLN 38 Cb 0.37 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2odh h GLN 38 CO 0.01 0.63 -0.13 0.82 -0.67 0.00 0.00 178.83 179.49 2odh h ILE 39 N 0.60 1.27 -0.49 2.54 2.04 -0.99 -1.98 117.51 120.50 2odh h ILE 39 Ca 0.15 -1.28 0.01 0.00 1.00 0.00 0.00 64.86 64.75 2odh h ILE 39 Cb 0.21 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 2odh h ILE 39 CO -0.01 0.44 0.31 0.25 0.00 0.00 0.00 178.15 179.14 2odh h LEU 40 N 0.79 0.53 -0.49 1.44 5.85 -0.92 -0.05 115.31 122.46 2odh h LEU 40 Ca 0.12 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2odh h LEU 40 Cb 0.69 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 2odh h LEU 40 CO 0.05 0.38 0.26 -0.33 -0.34 0.00 0.00 178.44 178.46 2odh h GLU 41 N 0.63 0.70 -0.91 1.25 5.08 -1.04 -0.53 114.58 119.76 2odh h GLU 41 Ca 0.19 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 2odh h GLU 41 Cb -0.04 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.03 2odh h GLU 41 CO -0.06 0.56 0.60 0.00 -1.00 0.00 0.00 179.01 179.11 2odh h ARG 42 N 0.66 1.17 -0.05 2.33 3.08 -0.93 -0.87 114.38 119.77 2odh h ARG 42 Ca 0.17 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 60.05 2odh h ARG 42 Cb 0.07 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 2odh h ARG 42 CO -0.03 0.77 -0.43 1.96 -1.07 0.00 0.00 179.97 181.18 2odh h GLN 43 N 1.21 0.11 0.00 0.04 1.08 -0.50 -1.59 115.11 115.46 2odh h GLN 43 Ca 0.34 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.49 2odh h GLN 43 Cb -0.10 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.32 2odh h GLN 43 CO -0.08 0.52 0.00 1.19 -0.95 0.00 0.00 178.83 179.50 2odh n PHE 44 N -4.02 0.23 -2.05 2.96 3.01 -0.25 -4.93 117.46 112.40 2odh n PHE 44 Ca -0.02 0.07 -0.02 0.00 1.01 0.00 0.00 57.45 58.49 2odh n PHE 44 Cb 0.47 -0.61 -0.00 0.00 -0.01 0.00 0.00 39.48 39.33 2odh n PHE 44 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2odh n GLY 45 N 1.10 0.29 3.34 1.37 0.00 -0.43 -5.05 105.19 105.81 2odh n GLY 45 Ca 0.06 -0.79 -0.18 0.00 0.00 0.00 0.00 46.02 45.10 2odh n GLY 45 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2odh s VAL 46 N -2.12 1.71 -0.53 1.61 -7.23 -0.61 -5.01 120.40 108.21 2odh s VAL 46 Ca 0.00 -2.21 0.10 0.00 -1.81 0.00 0.00 61.98 58.06 2odh s VAL 46 Cb -0.00 -2.05 0.27 0.00 0.56 0.00 0.00 36.38 35.17 2odh s VAL 46 CO 0.00 -0.60 1.22 0.00 -0.31 0.00 0.00 175.10 175.41 2odh n GLN 47 N -0.38 2.80 -4.15 4.82 3.00 -1.26 -4.20 117.38 118.01 2odh n GLN 47 Ca -0.08 -2.10 -0.11 0.00 -0.01 0.00 0.00 57.00 54.70 2odh n GLN 47 Cb 0.60 -1.33 -0.09 0.00 0.00 0.00 0.00 30.24 29.43 2odh n GLN 47 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.06 175.23 2odh s GLU 48 N -1.45 1.27 -0.20 -1.09 1.03 -1.26 -5.05 118.70 111.95 2odh s GLU 48 Ca 0.22 -1.54 0.01 0.00 0.03 0.00 0.00 54.97 53.69 2odh s GLU 48 Cb 0.14 0.31 0.28 0.00 -0.80 0.00 0.00 34.13 34.06 2odh s GLU 48 CO 0.10 -0.44 1.45 0.27 -1.33 0.00 0.00 175.26 175.31 2odh n ASN 49 N -0.29 3.63 -3.55 0.83 6.94 -1.26 -4.83 115.26 116.72 2odh n ASN 49 Ca 0.01 -2.72 -0.13 0.00 -0.02 0.00 0.00 54.58 51.73 2odh n ASN 49 Cb 0.65 -0.69 -0.04 0.00 -2.36 0.00 0.00 39.78 37.34 2odh n ASN 49 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2odh s ASN 50 N 0.06 -0.42 0.02 0.53 2.20 -1.26 -0.66 114.94 115.40 2odh s ASN 50 Ca 0.25 0.03 -0.03 0.00 -0.94 0.00 0.00 52.86 52.17 2odh s ASN 50 Cb 0.21 0.51 -0.01 0.00 -2.00 0.00 0.00 41.25 39.95 2odh s ASN 50 CO 0.04 -0.80 0.03 0.27 -2.94 0.00 0.00 177.10 173.70 2odh s ILE 51 N -3.04 0.10 -0.20 0.54 -4.36 -0.27 -4.89 121.20 109.09 2odh s ILE 51 Ca -0.02 -0.86 -0.07 0.00 -0.26 0.00 0.00 60.65 59.43 2odh s ILE 51 Cb -0.00 -0.37 -0.04 0.00 1.25 0.00 0.00 42.46 43.30 2odh s ILE 51 CO -0.06 -0.47 0.06 -0.89 0.24 0.00 0.00 174.94 173.81 2odh s THR 52 N -1.53 4.64 -0.19 8.37 2.01 -1.26 -0.72 115.64 126.96 2odh s THR 52 Ca -0.15 -0.08 -0.06 0.00 0.31 0.00 0.00 61.69 61.71 2odh s THR 52 Cb -0.09 -3.11 -0.04 0.00 0.01 0.00 0.00 72.50 69.28 2odh s THR 52 CO -0.00 0.43 0.04 -0.76 -0.69 0.00 0.00 174.62 173.63 2odh s LEU 53 N 0.69 3.60 0.00 4.42 1.02 0.12 -0.85 118.68 127.68 2odh s LEU 53 Ca 0.03 -0.03 0.00 0.00 0.02 0.00 0.00 54.13 54.15 2odh s LEU 53 Cb -0.13 -1.91 0.00 0.00 0.02 0.00 0.00 46.19 44.16 2odh s LEU 53 CO 0.02 0.13 0.00 0.61 0.02 0.00 0.00 176.35 177.13 2odh n GLY 54 N 3.82 0.00 0.01 -3.19 0.00 0.19 -1.17 105.19 104.86 2odh n GLY 54 Ca -0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.98 2odh n GLY 54 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2odh n ASP 55 N 0.00 0.36 0.17 1.61 8.00 -1.26 -4.11 116.55 121.32 2odh n ASP 55 Ca 0.00 -0.06 0.12 0.00 0.71 0.00 0.00 54.79 55.56 2odh n ASP 55 Cb 0.00 0.01 0.14 0.00 -0.02 0.00 0.00 41.12 41.24 2odh n ASP 55 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2odh h LEU 56 N 0.06 0.00 0.00 0.64 3.38 -1.88 -3.50 115.31 114.02 2odh h LEU 56 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2odh h LEU 56 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2odh h LEU 56 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2odh n GLY 57 N 1.15 -1.84 3.69 0.83 0.00 -0.31 -4.93 105.19 103.78 2odh n GLY 57 Ca 0.03 -1.93 -0.38 0.00 0.00 0.00 0.00 46.02 43.74 2odh n GLY 57 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2odh s GLU 58 N 0.00 4.24 -0.07 1.61 2.12 -1.26 -0.70 118.70 124.64 2odh s GLU 58 Ca 0.00 0.29 0.05 0.00 0.36 0.00 0.00 54.97 55.67 2odh s GLU 58 Cb 0.00 -3.49 -0.01 0.00 0.26 0.00 0.00 34.13 30.88 2odh s GLU 58 CO 0.00 0.04 -0.21 -0.06 -0.54 0.00 0.00 175.26 174.49 2odh s PHE 59 N 1.04 2.54 0.39 5.30 0.08 0.10 -4.58 117.98 122.85 2odh s PHE 59 Ca 0.21 -0.61 -0.24 0.00 0.12 0.00 0.00 56.93 56.41 2odh s PHE 59 Cb -0.15 -1.64 -0.09 0.00 -0.57 0.00 0.00 43.02 40.57 2odh s PHE 59 CO 0.08 -0.15 1.05 -1.21 -0.10 0.00 0.00 175.22 174.90 2odh s GLU 60 N -0.18 4.19 -0.27 0.44 2.02 -0.32 -1.11 118.70 123.48 2odh s GLU 60 Ca -0.02 1.54 -0.02 0.00 0.02 0.00 0.00 54.97 56.49 2odh s GLU 60 Cb -0.14 -2.59 0.03 0.00 0.10 0.00 0.00 34.13 31.54 2odh s GLU 60 CO 0.03 -0.12 -0.03 -1.17 0.02 0.00 0.00 175.26 173.99 2odh s LEU 61 N -2.56 3.44 0.01 1.80 2.96 0.16 -0.27 118.68 124.23 2odh s LEU 61 Ca 0.57 -0.98 0.04 0.00 -0.22 0.00 0.00 54.13 53.54 2odh s LEU 61 Cb -0.23 -1.69 -0.01 0.00 0.50 0.00 0.00 46.19 44.76 2odh s LEU 61 CO 0.29 -0.17 -0.13 -0.54 -1.32 0.00 0.00 176.35 174.47 2odh s LYS 62 N 1.32 1.00 0.02 1.98 1.02 -0.42 -4.66 119.74 119.99 2odh s LYS 62 Ca -0.01 -0.57 0.08 0.00 0.02 0.00 0.00 55.97 55.49 2odh s LYS 62 Cb -0.18 -0.98 -0.02 0.00 -0.52 0.00 0.00 37.83 36.14 2odh s LYS 62 CO -0.03 0.26 -0.22 0.20 -0.92 0.00 0.00 175.35 174.63 2odh s GLY 63 N -0.61 1.16 0.02 -3.33 0.00 -1.26 -0.87 107.32 102.43 2odh s GLY 63 Ca 0.04 -1.06 -0.04 0.00 0.00 0.00 0.00 44.72 43.66 2odh s GLY 63 CO 0.00 -0.95 0.05 1.06 0.00 0.00 0.00 173.10 173.27 2odh s MET 64 N -0.93 0.42 0.29 2.90 -1.94 -0.37 -4.22 119.30 115.45 2odh s MET 64 Ca 0.09 -0.56 -0.29 0.00 -1.71 0.00 0.00 55.69 53.22 2odh s MET 64 Cb -0.09 0.16 -0.10 0.00 2.01 0.00 0.00 34.83 36.82 2odh s MET 64 CO 0.01 -0.09 1.24 1.03 -0.01 0.00 0.00 175.02 177.20 2odh s ARG 65 N -1.61 4.46 -0.10 2.03 0.52 -1.26 -0.71 118.95 122.28 2odh s ARG 65 Ca -0.14 2.04 -0.30 0.00 -0.52 0.00 0.00 55.73 56.82 2odh s ARG 65 Cb -0.08 -3.14 -0.02 0.00 0.52 0.00 0.00 34.95 32.24 2odh s ARG 65 CO -0.01 -0.07 1.05 1.21 0.02 0.00 0.00 175.30 177.50 2odh s ASN 66 N -0.44 7.21 0.02 0.23 3.04 0.32 -4.78 114.94 120.53 2odh s ASN 66 Ca 0.49 1.58 0.01 0.00 0.04 0.00 0.00 52.86 54.98 2odh s ASN 66 Cb -0.36 -2.56 -0.01 0.00 -1.54 0.00 0.00 41.25 36.78 2odh s ASN 66 CO 0.46 -0.48 -0.04 -0.13 -3.04 0.00 0.00 177.10 173.88 2odh s ARG 67 N 2.07 0.29 0.07 0.43 0.52 -1.26 -4.86 118.95 116.20 2odh s ARG 67 Ca 0.50 -0.41 -0.14 0.00 -0.52 0.00 0.00 55.73 55.16 2odh s ARG 67 Cb -0.19 -0.09 -0.24 0.00 0.52 0.00 0.00 34.95 34.95 2odh s ARG 67 CO 0.18 0.01 1.17 0.87 0.02 0.00 0.00 175.30 177.55 2odh h LYS 68 N 5.25 0.69 -7.31 3.54 1.57 -2.04 -3.45 116.57 114.81 2odh h LYS 68 Ca -0.30 -0.77 -0.49 0.00 -1.87 0.00 0.00 60.65 57.23 2odh h LYS 68 Cb 1.21 0.23 0.16 0.00 0.08 0.00 0.00 32.23 33.90 2odh h LYS 68 CO 0.45 1.34 0.23 0.00 -0.57 0.00 0.00 179.45 180.90 2odh s ALA 69 N -3.25 1.40 0.46 3.86 0.00 -1.26 -4.95 121.76 118.02 2odh s ALA 69 Ca -0.10 0.04 -0.24 0.00 0.00 0.00 0.00 51.96 51.66 2odh s ALA 69 Cb 0.06 -3.24 -0.08 0.00 0.00 0.00 0.00 23.12 19.87 2odh s ALA 69 CO 0.92 -2.50 1.31 0.36 0.00 0.00 0.00 175.76 175.85 2odh n LYS 70 N -4.00 1.90 -3.95 0.00 2.85 -1.26 -5.04 118.16 108.67 2odh n LYS 70 Ca 0.07 0.68 -0.09 0.00 -1.05 0.00 0.00 58.31 57.92 2odh n LYS 70 Cb 0.54 -2.46 -0.07 0.00 -0.65 0.00 0.00 35.03 32.39 2odh n LYS 70 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2odh s SER 71 N -0.63 0.08 -0.01 -5.58 1.04 -1.26 -5.07 113.70 102.27 2odh s SER 71 Ca 0.64 -0.85 0.05 0.00 0.48 0.00 0.00 55.95 56.27 2odh s SER 71 Cb -0.47 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.04 2odh s SER 71 CO 0.56 -0.85 -0.17 0.20 0.98 0.00 0.00 173.24 173.96 2odh s ASN 72 N -2.95 2.01 -0.05 7.02 0.01 -1.26 -1.41 114.94 118.31 2odh s ASN 72 Ca 0.15 -0.31 -0.21 0.00 -0.71 0.00 0.00 52.86 51.78 2odh s ASN 72 Cb 0.04 -0.24 -0.05 0.00 0.41 0.00 0.00 41.25 41.41 2odh s ASN 72 CO -0.02 0.21 0.59 -0.22 -1.51 0.00 0.00 177.10 176.15 2odh s LEU 73 N -0.38 4.35 -0.13 0.60 2.96 -0.02 -4.88 118.68 121.18 2odh s LEU 73 Ca 0.06 1.08 -0.23 0.00 -0.22 0.00 0.00 54.13 54.82 2odh s LEU 73 Cb -0.07 -2.91 -0.03 0.00 0.50 0.00 0.00 46.19 43.69 2odh s LEU 73 CO -0.01 0.01 0.71 -0.89 -1.32 0.00 0.00 176.35 174.86 2odh s THR 74 N 0.31 5.00 -0.16 3.68 2.01 -1.26 -1.34 115.64 123.88 2odh s THR 74 Ca 0.32 1.41 0.04 0.00 0.31 0.00 0.00 61.69 63.76 2odh s THR 74 Cb -0.17 -4.03 -0.23 0.00 0.01 0.00 0.00 72.50 68.08 2odh s THR 74 CO 0.16 0.16 0.21 0.18 -0.69 0.00 0.00 174.62 174.63 2odh n LEU 75 N 4.50 1.93 -3.74 4.42 4.77 0.93 -4.99 117.00 124.81 2odh n LEU 75 Ca -0.00 0.12 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 2odh n LEU 75 Cb 0.50 -0.52 -0.06 0.00 -2.33 0.00 0.00 43.42 41.01 2odh n LEU 75 CO 0.46 0.72 0.03 0.72 -1.33 0.00 0.00 177.39 178.00 2odh s PHE 76 N -2.54 -0.05 -0.35 -1.77 -0.12 -1.10 -4.97 117.98 107.08 2odh s PHE 76 Ca -0.20 -0.26 0.00 0.00 -0.05 0.00 0.00 56.93 56.42 2odh s PHE 76 Cb 0.07 0.10 0.14 0.00 -0.63 0.00 0.00 43.02 42.71 2odh s PHE 76 CO 0.74 -0.60 0.25 -1.58 -0.05 0.00 0.00 175.22 173.99 2odh s HIS 77 N -3.52 0.35 0.06 3.49 2.46 -1.26 -1.86 115.29 115.02 2odh s HIS 77 Ca 0.02 -1.28 -0.27 0.00 0.47 0.00 0.00 55.06 53.99 2odh s HIS 77 Cb 0.02 -0.75 0.09 0.00 -0.13 0.00 0.00 32.58 31.81 2odh s HIS 77 CO -0.10 -0.87 0.96 -1.59 -2.47 0.00 0.00 174.74 170.67 2odh s LYS 78 N 1.31 0.95 0.59 2.88 -2.85 -0.66 -4.95 119.74 117.01 2odh s LYS 78 Ca 0.17 -0.46 -0.10 0.00 -1.00 0.00 0.00 55.97 54.58 2odh s LYS 78 Cb -0.20 0.37 -0.04 0.00 -2.06 0.00 0.00 37.83 35.90 2odh s LYS 78 CO -0.05 -0.43 0.98 0.15 0.10 0.00 0.00 175.35 176.11 2odh s LYS 79 N -3.13 3.60 0.74 1.78 1.02 -1.26 -3.97 119.74 118.51 2odh s LYS 79 Ca 0.09 0.65 -0.14 0.00 0.02 0.00 0.00 55.97 56.59 2odh s LYS 79 Cb -0.01 -2.13 0.04 0.00 -0.52 0.00 0.00 37.83 35.21 2odh s LYS 79 CO -0.03 -0.50 1.16 -1.25 -0.92 0.00 0.00 175.35 173.81 2odh s PRO 80 N -5.08 2.19 -0.01 -1.68 0.04 -1.26 -4.89 135.00 124.31 2odh s PRO 80 Ca 0.54 1.58 0.22 0.00 0.04 0.00 0.00 61.00 63.37 2odh s PRO 80 Cb -0.11 -1.86 -0.26 0.00 0.04 0.00 0.00 34.50 32.31 2odh s PRO 80 CO 0.52 -1.76 0.72 1.33 0.04 0.00 0.00 177.00 177.85 2odh n VAL 81 N -2.89 0.01 -3.81 -0.36 0.24 -0.05 -4.99 118.33 106.49 2odh n VAL 81 Ca 0.12 -0.25 -0.10 0.00 -2.04 0.00 0.00 64.34 62.07 2odh n VAL 81 Cb 0.51 0.48 -0.07 0.00 -1.47 0.00 0.00 33.84 33.29 2odh n VAL 81 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2odh s ALA 82 N -3.25 -0.43 0.00 2.33 0.00 -1.18 -5.03 121.76 114.20 2odh s ALA 82 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.60 2odh s ALA 82 Cb 0.15 0.45 0.00 0.00 0.00 0.00 0.00 23.12 23.72 2odh s ALA 82 CO 0.88 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.57 2odh n GLY 83 N 0.17 -1.14 3.77 0.00 0.00 -1.26 -1.37 105.19 105.36 2odh n GLY 83 Ca -0.17 -1.38 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 2odh n GLY 83 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2odh s GLN 84 N 0.00 4.29 0.86 1.61 -1.52 -0.60 -4.94 119.66 119.35 2odh s GLN 84 Ca 0.00 2.31 -0.12 0.00 -1.95 0.00 0.00 55.36 55.60 2odh s GLN 84 Cb 0.00 -3.05 0.10 0.00 -0.22 0.00 0.00 33.01 29.84 2odh s GLN 84 CO 0.00 -0.30 1.12 0.95 -0.25 0.00 0.00 175.29 176.82 2odh s THR 85 N -0.98 2.44 0.37 -0.19 -4.23 -1.26 -4.69 115.64 107.10 2odh s THR 85 Ca 0.51 0.14 0.04 0.00 -1.18 0.00 0.00 61.69 61.21 2odh s THR 85 Cb -0.42 -2.92 0.24 0.00 1.34 0.00 0.00 72.50 70.75 2odh s THR 85 CO 0.54 -0.19 2.00 0.58 -0.54 0.00 0.00 174.62 177.01 2odh h VAL 86 N -1.29 1.15 -0.32 2.29 2.07 -1.96 -1.36 116.25 116.83 2odh h VAL 86 Ca -0.49 -0.37 -0.15 0.00 0.82 0.00 0.00 66.70 66.51 2odh h VAL 86 Cb 1.31 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 2odh h VAL 86 CO 0.61 0.16 -0.42 0.40 0.02 0.00 0.00 177.57 178.35 2odh h ILE 87 N 0.66 1.28 0.00 4.57 2.04 -1.98 -0.82 117.51 123.26 2odh h ILE 87 Ca 0.17 -1.60 -0.07 0.00 1.00 0.00 0.00 64.86 64.36 2odh h ILE 87 Cb 0.02 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2odh h ILE 87 CO -0.03 0.52 -0.36 1.56 0.00 0.00 0.00 178.15 179.85 2odh h GLN 88 N 0.64 0.00 -0.15 2.37 4.20 -1.74 0.99 115.11 121.42 2odh h GLN 88 Ca 0.05 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.57 2odh h GLN 88 Cb 0.98 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.77 2odh h GLN 88 CO 0.09 0.36 -0.63 0.82 -0.67 0.00 0.00 178.83 178.80 2odh h ILE 89 N 0.00 1.31 -0.38 2.54 2.04 -1.10 -3.09 117.51 118.84 2odh h ILE 89 Ca -0.00 -1.87 -0.05 0.00 1.00 0.00 0.00 64.86 63.94 2odh h ILE 89 Cb 0.73 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.80 2odh h ILE 89 CO 0.05 0.58 0.04 0.15 0.00 0.00 0.00 178.15 178.97 2odh h PHE 90 N 0.39 0.68 -0.94 1.37 3.57 -0.70 0.10 116.94 121.41 2odh h PHE 90 Ca -0.03 -0.10 0.02 0.00 3.53 0.00 0.00 57.97 61.39 2odh h PHE 90 Cb 1.26 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.76 2odh h PHE 90 CO 0.10 0.69 0.62 -0.91 -2.23 0.00 0.00 178.31 176.58 2odh h ASN 91 N 0.47 1.06 0.10 0.41 2.35 -0.90 -0.40 115.58 118.67 2odh h ASN 91 Ca 0.11 -0.02 -0.16 0.00 -0.55 0.00 0.00 56.30 55.68 2odh h ASN 91 Cb 0.39 -0.25 0.01 0.00 0.05 0.00 0.00 38.32 38.52 2odh h ASN 91 CO 0.01 0.74 -0.73 -0.09 -1.65 0.00 0.00 177.43 175.72 2odh h ARG 92 N 1.24 0.22 -0.00 0.81 2.43 -1.42 -3.40 114.38 114.26 2odh h ARG 92 Ca 0.36 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2odh h ARG 92 Cb -0.07 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2odh h ARG 92 CO -0.10 1.18 -0.71 1.19 -1.51 0.00 0.00 179.97 180.02 2odh n PHE 93 N -4.21 0.00 -1.45 2.20 3.01 0.01 -4.98 117.46 112.04 2odh n PHE 93 Ca -0.15 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.00 2odh n PHE 93 Cb 0.76 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 40.29 2odh n PHE 93 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2odh s GLY 94 N -2.51 1.67 0.16 1.37 0.00 -0.16 -4.92 107.32 102.92 2odh s GLY 94 Ca 0.09 0.14 0.07 0.00 0.00 0.00 0.00 44.72 45.02 2odh s GLY 94 CO 0.65 0.47 -0.16 -2.52 0.00 0.00 0.00 173.10 171.54 2odh s TYR 95 N -3.00 1.67 -0.03 1.90 1.13 -0.34 -4.87 117.35 113.81 2odh s TYR 95 Ca 0.59 -0.52 0.00 0.00 -1.41 0.00 0.00 57.07 55.73 2odh s TYR 95 Cb -0.15 -0.83 -0.04 0.00 -1.10 0.00 0.00 41.96 39.85 2odh s TYR 95 CO 0.55 0.28 0.02 0.08 -2.51 0.00 0.00 175.55 173.97 2odh s VAL 96 N -2.31 4.35 0.12 -3.49 1.01 -1.26 -1.31 120.40 117.50 2odh s VAL 96 Ca 0.15 -0.45 -0.17 0.00 0.00 0.00 0.00 61.98 61.51 2odh s VAL 96 Cb -0.04 -2.92 0.04 0.00 0.00 0.00 0.00 36.38 33.46 2odh s VAL 96 CO 0.05 0.44 0.43 -1.59 0.00 0.00 0.00 175.10 174.44 2odh s LYS 97 N -1.40 1.09 0.00 2.72 -2.85 -0.77 -5.01 119.74 113.51 2odh s LYS 97 Ca 0.18 -0.63 0.00 0.00 -1.00 0.00 0.00 55.97 54.53 2odh s LYS 97 Cb -0.12 0.48 0.00 0.00 -2.06 0.00 0.00 37.83 36.14 2odh s LYS 97 CO 0.09 -0.43 0.00 -0.35 0.10 0.00 0.00 175.35 174.76 2odh n PRO 98 N -0.17 1.69 0.00 1.78 -0.04 -1.26 -1.44 135.00 135.55 2odh n PRO 98 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 2odh n PRO 98 Cb 0.63 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.09 2odh n PRO 98 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2odh n GLU 104 N -0.14 0.00 0.00 0.54 2.13 -1.26 -4.53 120.64 117.39 2odh n GLU 104 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2odh n GLU 104 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2odh n GLU 104 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2odh n VAL 105 N 0.00 0.00 -2.19 6.31 0.31 -1.26 -5.15 118.33 116.34 2odh n VAL 105 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.96 2odh n VAL 105 Cb 0.00 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2odh n VAL 105 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 2odh s MET 106 N -4.15 3.70 -0.01 5.55 -1.94 -1.26 -4.94 119.30 116.25 2odh s MET 106 Ca 0.00 1.84 0.01 0.00 -1.71 0.00 0.00 55.69 55.84 2odh s MET 106 Cb 0.00 -2.41 0.00 0.00 2.01 0.00 0.00 34.83 34.44 2odh s MET 106 CO 0.00 -0.62 -0.04 0.15 -0.01 0.00 0.00 175.02 174.50 2odh s LYS 107 N -2.69 0.45 0.04 2.03 1.02 -0.52 -1.76 119.74 118.31 2odh s LYS 107 Ca 0.64 -0.13 0.04 0.00 0.02 0.00 0.00 55.97 56.54 2odh s LYS 107 Cb -0.30 -0.47 -0.04 0.00 -0.52 0.00 0.00 37.83 36.50 2odh s LYS 107 CO 0.37 0.04 -0.05 0.21 -0.92 0.00 0.00 175.35 175.00 2odh s LYS 108 N 0.21 2.48 -0.12 1.68 2.20 -0.50 -1.86 119.74 123.84 2odh s LYS 108 Ca -0.02 -0.80 -0.10 0.00 -0.36 0.00 0.00 55.97 54.69 2odh s LYS 108 Cb -0.06 -2.48 0.03 0.00 -1.51 0.00 0.00 37.83 33.81 2odh s LYS 108 CO -0.00 0.57 0.30 0.21 -0.36 0.00 0.00 175.35 176.07 2odh s LYS 109 N -1.78 0.33 -0.33 4.03 2.20 -0.43 -1.40 119.74 122.37 2odh s LYS 109 Ca 0.20 0.45 -0.02 0.00 -0.36 0.00 0.00 55.97 56.25 2odh s LYS 109 Cb -0.11 0.12 0.12 0.00 -1.51 0.00 0.00 37.83 36.45 2odh s LYS 109 CO 0.11 -0.06 0.17 -1.17 -0.36 0.00 0.00 175.35 174.03 2odh s LEU 110 N 0.38 1.08 -0.35 5.43 2.96 -0.00 -1.20 118.68 126.97 2odh s LEU 110 Ca -0.02 -1.78 -0.01 0.00 -0.22 0.00 0.00 54.13 52.11 2odh s LEU 110 Cb -0.04 -0.48 0.08 0.00 0.50 0.00 0.00 46.19 46.26 2odh s LEU 110 CO -0.02 -0.37 0.08 -0.36 -1.32 0.00 0.00 176.35 174.36 2odh s PHE 111 N 1.51 3.49 0.02 5.38 0.40 -1.26 -1.58 117.98 125.95 2odh s PHE 111 Ca 0.13 -2.34 -0.04 0.00 -0.60 0.00 0.00 56.93 54.08 2odh s PHE 111 Cb -0.19 -2.70 -0.01 0.00 0.51 0.00 0.00 43.02 40.62 2odh s PHE 111 CO -0.18 -0.90 0.06 -0.08 0.70 0.00 0.00 175.22 174.81 2odh s THR 112 N 1.13 0.11 -0.06 0.64 -1.32 -0.48 -5.02 115.64 110.64 2odh s THR 112 Ca 0.03 -0.92 0.05 0.00 -1.21 0.00 0.00 61.69 59.65 2odh s THR 112 Cb -0.21 -0.53 -0.01 0.00 -1.51 0.00 0.00 72.50 70.24 2odh s THR 112 CO -0.04 -0.51 -0.22 -0.89 -2.21 0.00 0.00 174.62 170.75 2odh s THR 113 N -1.82 2.33 -0.03 5.08 2.01 -1.26 -1.45 115.64 120.50 2odh s THR 113 Ca -0.12 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 60.92 2odh s THR 113 Cb -0.06 -1.87 0.02 0.00 0.01 0.00 0.00 72.50 70.60 2odh s THR 113 CO -0.01 0.57 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.81 2odh s ILE 114 N -0.26 0.53 0.17 1.82 1.01 0.42 -4.90 121.20 120.00 2odh s ILE 114 Ca -0.00 -0.16 0.04 0.00 0.00 0.00 0.00 60.65 60.52 2odh s ILE 114 Cb -0.13 -0.53 -0.05 0.00 0.01 0.00 0.00 42.46 41.76 2odh s ILE 114 CO 0.03 0.21 -0.07 -0.54 0.00 0.00 0.00 174.94 174.56 2odh s LYS 115 N 0.64 1.12 0.56 2.79 1.02 -1.26 -1.02 119.74 123.59 2odh s LYS 115 Ca -0.08 -1.50 -0.13 0.00 0.02 0.00 0.00 55.97 54.27 2odh s LYS 115 Cb -0.12 -0.60 -0.06 0.00 -0.52 0.00 0.00 37.83 36.54 2odh s LYS 115 CO 0.00 0.02 0.99 0.20 -0.92 0.00 0.00 175.35 175.65 2odh s GLY 116 N -3.20 1.86 0.00 -3.33 0.00 -1.13 -1.72 107.32 99.80 2odh s GLY 116 Ca 0.20 0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.94 2odh s GLY 116 CO 0.02 0.29 0.00 0.61 0.00 0.00 0.00 173.10 174.03 2odh n GLY 117 N -2.14 1.91 3.57 0.20 0.00 -1.08 -2.80 105.19 104.85 2odh n GLY 117 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.93 2odh n GLY 117 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2odh s ARG 118 N -0.67 0.91 0.30 1.61 1.70 -1.26 -5.05 118.95 116.49 2odh s ARG 118 Ca 0.00 0.68 -0.19 0.00 -0.47 0.00 0.00 55.73 55.75 2odh s ARG 118 Cb 0.00 0.44 -0.09 0.00 -0.57 0.00 0.00 34.95 34.72 2odh s ARG 118 CO 0.00 -0.19 0.79 -0.51 -1.08 0.00 0.00 175.30 174.31 2odh s LEU 119 N -0.26 4.18 0.00 -1.89 1.02 -1.26 -4.54 118.68 115.93 2odh s LEU 119 Ca -0.04 1.46 0.00 0.00 0.02 0.00 0.00 54.13 55.57 2odh s LEU 119 Cb -0.03 -3.97 0.02 0.00 0.02 0.00 0.00 46.19 42.24 2odh s LEU 119 CO 0.04 -0.13 0.14 -0.46 0.02 0.00 0.00 176.35 175.97 2odh n ASN 120 N 0.10 0.20 0.29 2.29 0.23 0.47 -4.91 115.26 113.93 2odh n ASN 120 Ca 0.02 -1.17 0.15 0.00 -0.53 0.00 0.00 54.58 53.05 2odh n ASN 120 Cb 0.52 -0.09 0.89 0.00 -2.08 0.00 0.00 39.78 39.02 2odh n ASN 120 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 2odh h ASN 121 N -0.08 0.00 -0.09 0.53 -1.07 -1.92 -2.05 115.58 110.89 2odh h ASN 121 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.32 2odh h ASN 121 Cb 0.18 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.43 2odh h ASN 121 CO 0.05 0.04 0.00 0.18 0.07 0.00 0.00 177.43 177.77 2odh n LEU 122 N -3.66 1.56 0.00 6.14 4.77 -1.26 -4.91 117.00 119.63 2odh n LEU 122 Ca -0.03 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 2odh n LEU 122 Cb 0.14 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2odh n LEU 122 CO 0.27 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 2odh n GLY 123 N 1.15 0.70 3.85 -0.72 0.00 -0.77 -4.95 105.19 104.45 2odh n GLY 123 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 2odh n GLY 123 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2odh s LEU 124 N 0.00 4.04 0.26 0.99 1.43 -1.26 -0.32 118.68 123.81 2odh s LEU 124 Ca 0.00 1.27 -0.21 0.00 -1.03 0.00 0.00 54.13 54.17 2odh s LEU 124 Cb 0.00 -4.09 0.03 0.00 0.03 0.00 0.00 46.19 42.16 2odh s LEU 124 CO 0.00 -0.23 0.68 0.28 0.23 0.00 0.00 176.35 177.31 2odh s THR 125 N -2.03 0.00 0.11 5.49 -1.32 -0.59 -0.40 115.64 116.91 2odh s THR 125 Ca 0.54 -0.86 0.07 0.00 -1.21 0.00 0.00 61.69 60.23 2odh s THR 125 Cb -0.10 -1.84 -0.04 0.00 -1.51 0.00 0.00 72.50 69.01 2odh s THR 125 CO 0.19 -0.01 -0.10 -0.76 -2.21 0.00 0.00 174.62 171.73 2odh s LEU 126 N -2.90 3.04 -0.00 9.08 1.43 -0.70 -1.63 118.68 127.00 2odh s LEU 126 Ca 0.10 -0.41 -0.03 0.00 -1.03 0.00 0.00 54.13 52.77 2odh s LEU 126 Cb -0.05 -1.82 -0.00 0.00 0.03 0.00 0.00 46.19 44.35 2odh s LEU 126 CO 0.04 0.17 0.05 0.21 0.23 0.00 0.00 176.35 177.04 2odh s ASN 127 N -2.28 0.07 0.03 2.29 3.84 -0.46 -4.08 114.94 114.34 2odh s ASN 127 Ca 0.22 -0.19 0.05 0.00 0.21 0.00 0.00 52.86 53.15 2odh s ASN 127 Cb -0.11 0.14 -0.02 0.00 -0.55 0.00 0.00 41.25 40.71 2odh s ASN 127 CO 0.14 -0.22 -0.16 0.00 -2.79 0.00 0.00 177.10 174.07 2odh s ALA 128 N -0.89 1.35 -0.26 1.71 0.00 -1.26 -0.84 121.76 121.58 2odh s ALA 128 Ca -0.10 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.04 2odh s ALA 128 Cb -0.06 -0.26 -0.17 0.00 0.00 0.00 0.00 23.12 22.63 2odh s ALA 128 CO 0.00 0.29 -0.22 1.63 0.00 0.00 0.00 175.76 177.46 2odh n LYS 129 N 2.09 0.65 -4.38 0.00 5.02 -1.26 -4.96 118.16 115.32 2odh n LYS 129 Ca -0.17 0.15 -0.20 0.00 -2.02 0.00 0.00 58.31 56.07 2odh n LYS 129 Cb 0.54 -1.52 -0.10 0.00 -0.02 0.00 0.00 35.03 33.93 2odh n LYS 129 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 2odh s HIS 130 N -2.52 1.85 0.52 2.13 -3.43 -1.26 -5.01 115.29 107.57 2odh s HIS 130 Ca -0.34 -0.57 0.30 0.00 -0.80 0.00 0.00 55.06 53.65 2odh s HIS 130 Cb 0.09 -0.89 1.43 0.00 -1.43 0.00 0.00 32.58 31.78 2odh s HIS 130 CO 0.61 0.39 1.88 0.00 -2.00 0.00 0.00 174.74 175.62 2odh h ALA 131 N 2.45 2.77 0.00 -1.38 0.00 -1.93 -2.15 119.26 119.03 2odh h ALA 131 Ca -0.39 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2odh h ALA 131 Cb 1.23 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2odh h ALA 131 CO 0.63 -1.03 0.00 0.45 0.00 0.00 0.00 179.25 179.29 2odh n SER 132 N -4.30 0.61 -3.70 0.00 2.88 -1.26 -4.61 113.62 103.24 2odh n SER 132 Ca 0.19 0.66 -0.11 0.00 -1.33 0.00 0.00 58.87 58.28 2odh n SER 132 Cb 0.94 -0.79 -0.11 0.00 -0.75 0.00 0.00 64.21 63.50 2odh n SER 132 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2odh s GLU 133 N -3.31 0.33 -0.20 -1.46 2.12 -0.81 -1.19 118.70 114.18 2odh s GLU 133 Ca 0.04 0.72 -0.02 0.00 0.36 0.00 0.00 54.97 56.07 2odh s GLU 133 Cb 0.09 -0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.44 2odh s GLU 133 CO 0.37 -0.17 -0.10 0.42 -0.54 0.00 0.00 175.26 175.24 2odh s ILE 134 N 1.42 2.90 -0.18 -3.70 1.01 -0.01 -4.27 121.20 118.37 2odh s ILE 134 Ca -0.09 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 59.87 2odh s ILE 134 Cb -0.09 -2.29 -0.02 0.00 0.01 0.00 0.00 42.46 40.07 2odh s ILE 134 CO -0.11 0.47 -0.04 0.20 0.00 0.00 0.00 174.94 175.46 2odh s ASN 135 N 1.35 4.59 -0.10 3.58 0.01 -0.02 -0.87 114.94 123.48 2odh s ASN 135 Ca 0.05 -0.24 -0.21 0.00 -0.71 0.00 0.00 52.86 51.75 2odh s ASN 135 Cb -0.14 -1.76 -0.04 0.00 0.41 0.00 0.00 41.25 39.72 2odh s ASN 135 CO -0.06 0.09 0.60 -0.22 -1.51 0.00 0.00 177.10 176.01 2odh s LEU 136 N 0.82 4.28 0.10 0.60 2.96 0.68 -1.35 118.68 126.76 2odh s LEU 136 Ca -0.01 1.00 0.09 0.00 -0.22 0.00 0.00 54.13 54.99 2odh s LEU 136 Cb -0.15 -2.91 -0.03 0.00 0.50 0.00 0.00 46.19 43.60 2odh s LEU 136 CO 0.02 -0.09 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.43 2odh s TYR 137 N 0.85 1.91 -0.29 5.38 1.51 -0.64 -0.50 117.35 125.56 2odh s TYR 137 Ca 0.32 -0.41 -0.10 0.00 -1.01 0.00 0.00 57.07 55.87 2odh s TYR 137 Cb -0.16 -1.05 -0.03 0.00 -0.11 0.00 0.00 41.96 40.60 2odh s TYR 137 CO 0.14 0.22 0.16 -0.47 -1.11 0.00 0.00 175.55 174.49 2odh s TYR 138 N -1.10 3.18 0.00 2.71 5.04 0.08 -1.53 117.35 125.72 2odh s TYR 138 Ca 0.08 -0.19 0.00 0.00 -2.44 0.00 0.00 57.07 54.52 2odh s TYR 138 Cb -0.10 -2.35 0.00 0.00 0.35 0.00 0.00 41.96 39.86 2odh s TYR 138 CO 0.04 -0.29 0.00 1.04 -1.34 0.00 0.00 175.55 175.00 2odh n GLN 139 N 5.02 0.00 0.00 4.97 6.02 0.56 -1.04 117.38 132.90 2odh n GLN 139 Ca -0.14 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 56.97 2odh n GLN 139 Cb 0.51 0.00 0.17 0.00 1.02 0.00 0.00 30.24 31.94 2odh n GLN 139 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2odh n ASP 140 N 4.61 2.24 -4.68 1.08 8.00 -1.26 -4.90 116.55 121.63 2odh n ASP 140 Ca 0.00 -1.65 -0.42 0.00 0.71 0.00 0.00 54.79 53.43 2odh n ASP 140 Cb 0.00 0.16 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 2odh n ASP 140 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2odh s GLU 141 N -2.20 4.37 0.47 -1.24 2.12 -0.21 -5.05 118.70 116.95 2odh s GLU 141 Ca 0.26 1.52 -0.22 0.00 0.36 0.00 0.00 54.97 56.89 2odh s GLU 141 Cb 0.20 -3.57 -0.08 0.00 0.26 0.00 0.00 34.13 30.94 2odh s GLU 141 CO 0.41 -0.42 1.12 -0.47 -0.54 0.00 0.00 175.26 175.36 2odh s TYR 142 N 2.31 2.93 0.03 5.30 5.04 -1.26 -0.74 117.35 130.95 2odh s TYR 142 Ca 0.51 1.56 0.00 0.00 -2.44 0.00 0.00 57.07 56.71 2odh s TYR 142 Cb -0.21 -3.28 0.00 0.00 0.35 0.00 0.00 41.96 38.83 2odh s TYR 142 CO 0.18 -1.27 0.00 1.28 -1.34 0.00 0.00 175.55 174.40 2odh n LEU 143 N -0.61 0.23 -4.05 6.97 4.77 0.34 -4.81 117.00 119.84 2odh n LEU 143 Ca 0.08 0.04 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 2odh n LEU 143 Cb 0.49 -0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 2odh n LEU 143 CO 0.45 -0.56 -0.01 -0.44 -1.33 0.00 0.00 177.39 175.50 2odh s SER 144 N -5.14 0.03 -0.02 -1.43 0.01 -1.07 -1.56 113.70 104.52 2odh s SER 144 Ca 0.00 -1.05 0.02 0.00 1.31 0.00 0.00 55.95 56.23 2odh s SER 144 Cb 0.00 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.71 2odh s SER 144 CO 0.00 -0.97 -0.08 -0.89 0.41 0.00 0.00 173.24 171.71 2odh s THR 145 N -4.05 0.71 -0.03 1.44 2.01 -0.47 -0.23 115.64 115.03 2odh s THR 145 Ca 0.26 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 61.97 2odh s THR 145 Cb 0.03 -0.63 -0.03 0.00 0.01 0.00 0.00 72.50 71.88 2odh s THR 145 CO 0.07 0.22 -0.17 0.26 -0.69 0.00 0.00 174.62 174.32 2odh s TRP 146 N 0.14 2.62 0.05 4.92 0.51 -0.05 -0.87 118.94 126.25 2odh s TRP 146 Ca -0.02 -0.22 -0.22 0.00 -2.12 0.00 0.00 56.10 53.52 2odh s TRP 146 Cb -0.07 -1.58 -0.06 0.00 -0.81 0.00 0.00 33.47 30.95 2odh s TRP 146 CO 0.00 0.16 0.67 -0.51 -0.51 0.00 0.00 176.95 176.76 2odh s ASP 147 N -0.84 7.11 -0.30 2.95 1.01 -1.26 -0.83 116.67 124.51 2odh s ASP 147 Ca 0.12 1.33 -0.09 0.00 0.71 0.00 0.00 52.55 54.62 2odh s ASP 147 Cb -0.10 -2.41 -0.01 0.00 1.01 0.00 0.00 42.92 41.40 2odh s ASP 147 CO 0.01 0.12 0.13 -0.22 0.21 0.00 0.00 175.17 175.42 2odh s LEU 148 N -0.42 3.95 -0.94 1.23 2.96 -0.33 -4.93 118.68 120.20 2odh s LEU 148 Ca 0.34 -0.50 -0.21 0.00 -0.22 0.00 0.00 54.13 53.53 2odh s LEU 148 Cb -0.20 -1.97 0.09 0.00 0.50 0.00 0.00 46.19 44.61 2odh s LEU 148 CO 0.20 -0.17 1.26 0.21 -1.32 0.00 0.00 176.35 176.54 2odh s ASN 149 N 1.59 6.51 0.45 3.68 3.84 -1.26 -4.60 114.94 125.16 2odh s ASN 149 Ca 0.05 -1.62 0.20 0.00 0.21 0.00 0.00 52.86 51.69 2odh s ASN 149 Cb -0.17 -2.48 1.17 0.00 -0.55 0.00 0.00 41.25 39.22 2odh s ASN 149 CO 0.05 -1.33 1.91 -0.07 -2.79 0.00 0.00 177.10 174.87 2odh h LEU 150 N 11.66 0.29 -0.81 3.21 3.38 -1.92 -1.12 115.31 129.99 2odh h LEU 150 Ca 0.12 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 2odh h LEU 150 Cb 1.02 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 2odh h LEU 150 CO 1.26 0.13 -0.06 0.28 0.09 0.00 0.00 178.44 180.14 2odh h SER 151 N 0.30 0.81 -0.28 -0.43 0.02 -2.00 -1.01 113.55 110.96 2odh h SER 151 Ca 0.39 -0.23 -0.16 0.00 -0.84 0.00 0.00 61.79 60.95 2odh h SER 151 Cb 1.07 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 2odh h SER 151 CO -0.10 0.91 -0.42 0.11 -1.14 0.00 0.00 176.83 176.19 2odh h LYS 152 N 0.76 0.84 -0.21 3.45 1.57 -1.60 -3.27 116.57 118.11 2odh h LYS 152 Ca 0.13 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 2odh h LYS 152 Cb 0.55 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2odh h LYS 152 CO 0.03 1.09 0.00 0.44 -0.57 0.00 0.00 179.45 180.44 2odh n ILE 153 N -4.04 0.26 0.05 1.86 -5.35 -1.12 -4.35 119.36 106.66 2odh n ILE 153 Ca -0.02 -0.52 0.03 0.00 -0.27 0.00 0.00 62.75 61.97 2odh n ILE 153 Cb 0.55 0.83 0.41 0.00 -1.74 0.00 0.00 39.64 39.69 2odh n ILE 153 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2odh h GLU 154 N 3.56 0.42 -3.76 6.28 4.81 -1.23 -3.41 114.58 121.24 2odh h GLU 154 Ca 0.00 -0.05 -0.43 0.00 -0.13 0.00 0.00 59.36 58.75 2odh h GLU 154 Cb 0.78 -0.08 -0.37 0.00 0.63 0.00 0.00 28.75 29.71 2odh h GLU 154 CO 0.00 0.38 -0.77 0.15 -0.73 0.00 0.00 179.01 178.04 2odh s LYS 155 N -5.16 0.63 0.02 1.92 1.02 -1.26 -3.75 119.74 113.17 2odh s LYS 155 Ca -0.07 0.07 0.05 0.00 0.02 0.00 0.00 55.97 56.03 2odh s LYS 155 Cb 0.16 -0.92 -0.02 0.00 -0.52 0.00 0.00 37.83 36.54 2odh s LYS 155 CO 0.73 -0.25 -0.14 -0.51 -0.92 0.00 0.00 175.35 174.26 2odh s LEU 156 N 1.72 2.12 -0.27 3.17 1.43 -0.13 -1.17 118.68 125.55 2odh s LEU 156 Ca 0.01 -0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 52.71 2odh s LEU 156 Cb -0.13 -0.64 0.03 0.00 0.03 0.00 0.00 46.19 45.48 2odh s LEU 156 CO -0.04 0.08 -0.02 -0.69 0.23 0.00 0.00 176.35 175.91 2odh s VAL 157 N -0.66 3.07 -0.20 -1.59 1.01 0.63 -0.82 120.40 121.85 2odh s VAL 157 Ca 0.03 -1.09 -0.02 0.00 0.00 0.00 0.00 61.98 60.90 2odh s VAL 157 Cb -0.07 -2.63 -0.00 0.00 0.00 0.00 0.00 36.38 33.68 2odh s VAL 157 CO 0.01 0.09 -0.10 -0.22 0.00 0.00 0.00 175.10 174.88 2odh s LEU 158 N 1.33 2.66 -0.08 3.92 2.96 -0.17 -1.30 118.68 127.99 2odh s LEU 158 Ca -0.01 -0.46 0.05 0.00 -0.22 0.00 0.00 54.13 53.49 2odh s LEU 158 Cb -0.18 -1.65 -0.00 0.00 0.50 0.00 0.00 46.19 44.86 2odh s LEU 158 CO -0.02 0.01 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.08 2odh s VAL 159 N 1.30 2.00 -0.12 1.68 1.01 -0.05 -1.06 120.40 125.17 2odh s VAL 159 Ca 0.04 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 2odh s VAL 159 Cb -0.14 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 2odh s VAL 159 CO -0.05 0.55 0.01 -0.36 0.00 0.00 0.00 175.10 175.26 2odh s PHE 160 N 0.15 3.18 -0.10 5.22 0.08 0.09 -1.23 117.98 125.37 2odh s PHE 160 Ca -0.13 0.10 0.02 0.00 0.12 0.00 0.00 56.93 57.04 2odh s PHE 160 Cb -0.16 -1.89 -0.02 0.00 -0.57 0.00 0.00 43.02 40.38 2odh s PHE 160 CO 0.07 0.33 -0.15 0.00 -0.10 0.00 0.00 175.22 175.37 2odh s ALA 161 N -0.41 2.59 0.40 5.36 0.00 0.12 -1.99 121.76 127.82 2odh s ALA 161 Ca 0.08 -0.93 -0.21 0.00 0.00 0.00 0.00 51.96 50.90 2odh s ALA 161 Cb -0.12 -1.08 -0.10 0.00 0.00 0.00 0.00 23.12 21.82 2odh s ALA 161 CO 0.02 0.37 0.91 -1.21 0.00 0.00 0.00 175.76 175.85 2odh s GLU 162 N -0.06 4.23 0.11 0.00 2.02 0.11 -0.52 118.70 124.59 2odh s GLU 162 Ca -0.03 1.07 0.05 0.00 0.02 0.00 0.00 54.97 56.08 2odh s GLU 162 Cb -0.14 -2.30 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 2odh s GLU 162 CO 0.04 0.04 -0.13 0.95 0.02 0.00 0.00 175.26 176.18 2odh s THR 163 N -2.07 1.20 0.17 3.63 -4.23 -1.26 -0.41 115.64 112.66 2odh s THR 163 Ca 0.59 -1.64 0.09 0.00 -1.18 0.00 0.00 61.69 59.55 2odh s THR 163 Cb -0.10 -1.42 -0.04 0.00 1.34 0.00 0.00 72.50 72.27 2odh s THR 163 CO 0.15 -0.43 -0.18 0.27 -0.54 0.00 0.00 174.62 173.89 2odh s ILE 164 N -2.09 1.82 0.00 2.99 -4.36 -0.70 -4.99 121.20 113.87 2odh s ILE 164 Ca 0.06 -1.93 0.00 0.00 -0.26 0.00 0.00 60.65 58.53 2odh s ILE 164 Cb -0.05 -1.85 0.00 0.00 1.25 0.00 0.00 42.46 41.81 2odh s ILE 164 CO 0.02 -0.32 0.00 0.61 0.24 0.00 0.00 174.94 175.49 2odh n GLY 165 N 0.27 -1.48 3.76 6.27 0.00 -1.26 -1.59 105.19 111.16 2odh n GLY 165 Ca -0.13 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 43.93 2odh n GLY 165 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2odh s ARG 166 N -1.94 4.52 0.23 1.61 3.52 -1.26 -4.88 118.95 120.76 2odh s ARG 166 Ca 0.00 1.71 -0.32 0.00 -0.13 0.00 0.00 55.73 57.00 2odh s ARG 166 Cb 0.00 -3.02 -0.13 0.00 -1.56 0.00 0.00 34.95 30.25 2odh s ARG 166 CO 0.00 0.13 1.57 0.00 -0.81 0.00 0.00 175.30 176.19 2odh n ALA 167 N 0.86 1.98 -1.21 6.12 0.00 -1.26 -2.03 120.51 124.97 2odh n ALA 167 Ca 0.00 0.40 -0.07 0.00 0.00 0.00 0.00 53.44 53.78 2odh n ALA 167 Cb 0.46 -2.40 -0.03 0.00 0.00 0.00 0.00 19.45 17.48 2odh n ALA 167 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2odh n ASN 168 N 2.79 -4.93 -4.91 0.00 3.02 -1.26 -5.02 115.26 104.96 2odh n ASN 168 Ca 0.13 0.18 -0.28 0.00 -0.03 0.00 0.00 54.58 54.58 2odh n ASN 168 Cb 0.33 -3.07 0.01 0.00 -0.61 0.00 0.00 39.78 36.44 2odh n ASN 168 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2odh s SER 169 N -2.42 6.06 0.53 6.41 1.04 -0.86 -4.98 113.70 119.48 2odh s SER 169 Ca 0.00 0.93 0.28 0.00 0.48 0.00 0.00 55.95 57.64 2odh s SER 169 Cb 0.00 -2.12 1.48 0.00 0.10 0.00 0.00 66.02 65.49 2odh s SER 169 CO 0.00 -0.76 2.08 -0.65 0.98 0.00 0.00 173.24 174.90 2odh h PRO 170 N 0.04 0.00 -0.02 4.02 0.11 -1.95 -2.80 132.00 131.40 2odh h PRO 170 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2odh h PRO 170 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2odh h PRO 170 CO 0.61 0.11 -0.12 -0.85 -0.21 0.00 0.00 178.00 177.54 2odh n GLU 171 N -3.61 1.60 -1.72 1.05 0.00 -1.26 -4.53 120.64 112.17 2odh n GLU 171 Ca -0.02 -1.11 -0.41 0.00 0.00 0.00 0.00 57.16 55.62 2odh n GLU 171 Cb 0.23 -1.48 0.01 0.00 0.00 0.00 0.00 31.44 30.20 2odh n GLU 171 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2odh n GLU 172 N 0.27 2.08 -4.21 3.44 2.13 -1.06 -4.77 120.64 118.52 2odh n GLU 172 Ca 0.15 0.74 -0.20 0.00 0.66 0.00 0.00 57.16 58.51 2odh n GLU 172 Cb 0.43 -2.45 -0.12 0.00 0.27 0.00 0.00 31.44 29.57 2odh n GLU 172 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2odh s GLN 173 N -2.22 0.93 -0.06 5.31 -0.21 -0.62 -3.85 119.66 118.94 2odh s GLN 173 Ca 0.60 -1.05 0.01 0.00 0.02 0.00 0.00 55.36 54.94 2odh s GLN 173 Cb -0.50 -1.00 0.02 0.00 1.00 0.00 0.00 33.01 32.53 2odh s GLN 173 CO 0.59 0.22 -0.08 -0.06 -2.12 0.00 0.00 175.29 173.84 2odh s PHE 174 N -1.35 1.17 -0.26 0.91 0.08 -0.09 -1.71 117.98 116.73 2odh s PHE 174 Ca 0.02 -0.43 0.03 0.00 0.12 0.00 0.00 56.93 56.66 2odh s PHE 174 Cb -0.09 -0.94 0.06 0.00 -0.57 0.00 0.00 43.02 41.48 2odh s PHE 174 CO 0.03 -0.28 -0.10 -1.58 -0.10 0.00 0.00 175.22 173.19 2odh s HIS 175 N 0.95 3.18 -0.53 0.36 5.65 0.45 -0.39 115.29 124.97 2odh s HIS 175 Ca -0.10 -2.28 -0.27 0.00 0.25 0.00 0.00 55.06 52.65 2odh s HIS 175 Cb -0.15 -1.92 0.03 0.00 -1.18 0.00 0.00 32.58 29.36 2odh s HIS 175 CO 0.00 -0.87 1.10 -0.06 -0.65 0.00 0.00 174.74 174.26 2odh s PHE 176 N 1.13 2.75 -0.16 3.88 0.08 -1.26 -0.71 117.98 123.68 2odh s PHE 176 Ca -0.08 0.43 0.05 0.00 0.12 0.00 0.00 56.93 57.45 2odh s PHE 176 Cb -0.20 -4.34 -0.06 0.00 -0.57 0.00 0.00 43.02 37.86 2odh s PHE 176 CO -0.05 -1.38 0.17 0.25 -0.10 0.00 0.00 175.22 174.11 2odh n THR 177 N 6.62 0.00 -3.90 0.64 -2.24 -0.84 -3.86 114.28 110.69 2odh n THR 177 Ca 0.08 -0.32 -0.11 0.00 -2.27 0.00 0.00 64.05 61.44 2odh n THR 177 Cb 0.49 0.84 -0.10 0.00 -2.10 0.00 0.00 70.33 69.45 2odh n THR 177 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2odh s LYS 178 N -1.66 0.41 0.05 -0.78 -2.85 -1.20 -4.92 119.74 108.77 2odh s LYS 178 Ca 0.01 -0.43 -0.17 0.00 -1.00 0.00 0.00 55.97 54.38 2odh s LYS 178 Cb 0.03 0.16 0.03 0.00 -2.06 0.00 0.00 37.83 36.00 2odh s LYS 178 CO 0.19 -0.09 0.38 0.00 0.10 0.00 0.00 175.35 175.93 2odh s ALA 179 N -1.31 -0.92 0.04 0.59 0.00 -1.26 -0.73 121.76 118.17 2odh s ALA 179 Ca -0.14 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.04 2odh s ALA 179 Cb -0.08 0.36 -0.03 0.00 0.00 0.00 0.00 23.12 23.37 2odh s ALA 179 CO 0.01 -0.45 -0.05 0.71 0.00 0.00 0.00 175.76 175.97 2odh s TYR 180 N -2.56 0.48 -0.22 0.00 2.02 -0.22 -0.36 117.35 116.48 2odh s TYR 180 Ca -0.05 -0.60 -0.05 0.00 -0.37 0.00 0.00 57.07 56.00 2odh s TYR 180 Cb -0.01 -0.31 -0.02 0.00 -0.40 0.00 0.00 41.96 41.23 2odh s TYR 180 CO -0.03 -0.17 -0.00 1.41 -1.57 0.00 0.00 175.55 175.19 2odh s MET 181 N -1.92 3.52 -0.17 -0.62 -2.45 0.37 -1.00 119.30 117.04 2odh s MET 181 Ca -0.10 -0.56 -0.00 0.00 -1.25 0.00 0.00 55.69 53.79 2odh s MET 181 Cb -0.07 -3.10 0.00 0.00 1.25 0.00 0.00 34.83 32.91 2odh s MET 181 CO -0.02 -0.12 -0.15 -0.51 1.05 0.00 0.00 175.02 175.28 2odh s LEU 182 N 1.33 2.46 0.31 4.11 1.02 0.00 -0.92 118.68 126.99 2odh s LEU 182 Ca 0.04 -0.49 -0.01 0.00 0.02 0.00 0.00 54.13 53.69 2odh s LEU 182 Cb -0.15 -1.57 -0.01 0.00 0.02 0.00 0.00 46.19 44.49 2odh s LEU 182 CO 0.00 0.06 0.37 0.42 0.02 0.00 0.00 176.35 177.23 2odh s THR 183 N 0.96 0.00 -0.32 5.49 -4.23 -0.29 -0.96 115.64 116.28 2odh s THR 183 Ca -0.03 -1.74 -0.03 0.00 -1.18 0.00 0.00 61.69 58.72 2odh s THR 183 Cb -0.15 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.16 2odh s THR 183 CO -0.02 0.00 0.34 -0.62 -0.54 0.00 0.00 174.62 173.78 2odh n GLU 184 N -0.51 -0.87 -2.70 3.99 1.02 -1.25 -1.87 120.64 118.44 2odh n GLU 184 Ca 0.02 1.13 -0.41 0.00 -0.02 0.00 0.00 57.16 57.88 2odh n GLU 184 Cb 0.62 -3.67 -0.04 0.00 -0.02 0.00 0.00 31.44 28.33 2odh n GLU 184 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2odh s ILE 185 N -2.57 4.55 0.75 -3.67 2.07 -1.26 -0.61 121.20 120.46 2odh s ILE 185 Ca 0.05 2.03 -0.11 0.00 -1.41 0.00 0.00 60.65 61.21 2odh s ILE 185 Cb -0.01 -4.30 0.04 0.00 0.13 0.00 0.00 42.46 38.32 2odh s ILE 185 CO 0.39 0.27 1.08 0.20 -1.91 0.00 0.00 174.94 174.97 2odh s ASN 186 N 0.28 4.90 0.05 4.50 0.01 0.10 -4.94 114.94 119.84 2odh s ASN 186 Ca 0.49 1.44 -0.30 0.00 -0.71 0.00 0.00 52.86 53.77 2odh s ASN 186 Cb -0.23 -2.24 -0.09 0.00 0.41 0.00 0.00 41.25 39.10 2odh s ASN 186 CO 0.30 -1.72 1.95 -0.62 -1.51 0.00 0.00 177.10 175.49 2odh s ASP 187 N -3.87 6.45 0.09 -1.22 -1.08 -1.26 -4.86 116.67 110.91 2odh s ASP 187 Ca 0.59 2.68 0.25 0.00 -0.52 0.00 0.00 52.55 55.56 2odh s ASP 187 Cb -0.14 -2.53 0.58 0.00 -1.46 0.00 0.00 42.92 39.37 2odh s ASP 187 CO 0.54 -1.05 1.50 0.00 0.52 0.00 0.00 175.17 176.69 2odh n ILE 188 N 5.47 0.27 -0.19 4.11 3.06 -1.26 -3.99 119.36 126.82 2odh n ILE 188 Ca 0.20 -0.17 -0.02 0.00 -2.50 0.00 0.00 62.75 60.25 2odh n ILE 188 Cb 0.41 -0.17 0.04 0.00 0.54 0.00 0.00 39.64 40.46 2odh n ILE 188 CO 0.00 0.00 0.00 0.74 -2.50 0.00 0.00 176.55 174.79 2odh h THR 189 N 0.00 0.34 -0.09 9.51 2.02 -1.89 -0.06 112.91 122.75 2odh h THR 189 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 2odh h THR 189 Cb 0.65 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2odh h THR 189 CO 0.00 0.00 -0.28 0.77 0.37 0.00 0.00 175.52 176.38 2odh h SER 190 N -0.05 0.17 -0.12 4.18 4.64 -1.97 -1.30 113.55 119.09 2odh h SER 190 Ca 0.27 -0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 61.41 2odh h SER 190 Cb 0.47 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 2odh h SER 190 CO -0.62 0.45 -0.38 -0.07 -0.87 0.00 0.00 176.83 175.35 2odh h LEU 191 N 0.15 0.68 0.40 5.97 3.38 -1.28 0.14 115.31 124.76 2odh h LEU 191 Ca 0.02 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2odh h LEU 191 Cb 0.58 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2odh h LEU 191 CO 0.04 0.99 -0.19 0.40 0.09 0.00 0.00 178.44 179.76 2odh h ILE 192 N 0.53 0.48 0.00 1.22 2.04 -0.95 0.32 117.51 121.15 2odh h ILE 192 Ca 0.05 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.35 2odh h ILE 192 Cb 0.89 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 2odh h ILE 192 CO 0.08 0.08 0.00 0.78 0.00 0.00 0.00 178.15 179.09 2odh h ASN 193 N -0.92 0.00 -0.51 1.72 2.35 -1.22 -1.89 115.58 115.11 2odh h ASN 193 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2odh h ASN 193 Cb 0.55 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.92 2odh h ASN 193 CO 0.09 0.00 0.00 0.47 -1.65 0.00 0.00 177.43 176.34 2odh n ASP 194 N -2.70 3.18 -0.43 5.81 10.43 0.49 -2.64 116.55 130.69 2odh n ASP 194 Ca 0.01 -1.97 -0.05 0.00 2.57 0.00 0.00 54.79 55.35 2odh n ASP 194 Cb 0.28 -0.34 -0.02 0.00 1.84 0.00 0.00 41.12 42.88 2odh n ASP 194 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2odh n GLY 195 N 1.46 0.77 0.09 0.44 0.00 -0.72 -4.94 105.19 102.28 2odh n GLY 195 Ca 0.20 -0.81 -0.16 0.00 0.00 0.00 0.00 46.02 45.25 2odh n GLY 195 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2odh h VAL 196 N 0.00 1.66 -3.53 1.61 2.07 -1.15 -3.45 116.25 113.47 2odh h VAL 196 Ca -0.11 -2.28 -0.53 0.00 0.82 0.00 0.00 66.70 64.60 2odh h VAL 196 Cb 0.39 3.18 -0.03 0.00 -1.52 0.00 0.00 31.29 33.31 2odh h VAL 196 CO 0.16 0.61 0.21 -0.76 0.02 0.00 0.00 177.57 177.81 2odh s LEU 197 N -8.23 4.56 -0.06 2.57 1.43 -1.04 -4.54 118.68 113.39 2odh s LEU 197 Ca -0.17 1.65 0.02 0.00 -1.03 0.00 0.00 54.13 54.60 2odh s LEU 197 Cb -0.01 -3.33 0.01 0.00 0.03 0.00 0.00 46.19 42.88 2odh s LEU 197 CO 0.74 0.15 -0.12 -0.69 0.23 0.00 0.00 176.35 176.65 2odh s VAL 198 N -0.85 1.09 0.00 -1.59 1.01 -0.28 -4.51 120.40 115.28 2odh s VAL 198 Ca 0.38 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.87 2odh s VAL 198 Cb -0.23 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 2odh s VAL 198 CO 0.26 0.34 0.17 -0.32 0.00 0.00 0.00 175.10 175.55 2odh s MET 199 N 0.54 3.37 -0.02 2.72 1.75 -0.19 -0.81 119.30 126.65 2odh s MET 199 Ca -0.12 -0.37 0.05 0.00 -1.25 0.00 0.00 55.69 54.00 2odh s MET 199 Cb -0.14 -3.04 -0.01 0.00 2.84 0.00 0.00 34.83 34.48 2odh s MET 199 CO 0.03 0.66 -0.16 0.16 -0.65 0.00 0.00 175.02 175.05 2odh s ASP 200 N -2.01 1.94 -0.04 1.11 -4.77 -0.53 -0.43 116.67 111.94 2odh s ASP 200 Ca 0.28 -0.30 0.05 0.00 -3.30 0.00 0.00 52.55 49.28 2odh s ASP 200 Cb -0.13 -0.28 -0.02 0.00 -1.09 0.00 0.00 42.92 41.40 2odh s ASP 200 CO 0.19 0.19 -0.19 -0.76 0.70 0.00 0.00 175.17 175.30 2odh s LEU 201 N -0.30 2.44 -0.31 2.11 1.43 -0.53 -2.38 118.68 121.14 2odh s LEU 201 Ca 0.04 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.83 2odh s LEU 201 Cb -0.07 -1.47 0.14 0.00 0.03 0.00 0.00 46.19 44.82 2odh s LEU 201 CO -0.00 0.32 0.32 0.00 0.23 0.00 0.00 176.35 177.22 2odh s ILE 203 N 2.09 -0.02 0.26 0.00 1.09 -0.61 -1.87 121.20 122.14 2odh s ILE 203 Ca 0.12 0.09 -0.04 0.00 -1.10 0.00 0.00 60.65 59.71 2odh s ILE 203 Cb -0.14 -0.05 -0.02 0.00 -1.06 0.00 0.00 42.46 41.19 2odh s ILE 203 CO -0.24 0.04 0.32 1.51 -0.10 0.00 0.00 174.94 176.47 2odh s ASP 204 N 0.45 0.40 -0.27 3.58 1.47 -1.04 -0.82 116.67 120.44 2odh s ASP 204 Ca -0.04 -1.31 -0.21 0.00 1.18 0.00 0.00 52.55 52.17 2odh s ASP 204 Cb -0.06 0.52 0.07 0.00 -0.34 0.00 0.00 42.92 43.12 2odh s ASP 204 CO -0.01 -1.05 0.70 -1.58 0.68 0.00 0.00 175.17 173.91 2odh s GLN 205 N -3.80 0.78 -0.72 2.11 0.74 -0.49 -1.36 119.66 116.92 2odh s GLN 205 Ca 0.32 1.09 -0.27 0.00 0.05 0.00 0.00 55.36 56.55 2odh s GLN 205 Cb 0.03 0.30 0.03 0.00 1.10 0.00 0.00 33.01 34.47 2odh s GLN 205 CO 0.15 -0.12 1.25 0.34 -0.55 0.00 0.00 175.29 176.35 2odh s ASP 206 N 0.89 6.19 0.00 6.67 -1.08 -1.26 -1.41 116.67 126.68 2odh s ASP 206 Ca -0.04 -0.42 0.16 0.00 -0.52 0.00 0.00 52.55 51.72 2odh s ASP 206 Cb -0.05 -2.55 0.79 0.00 -1.46 0.00 0.00 42.92 39.65 2odh s ASP 206 CO -0.08 -1.77 1.44 0.18 0.52 0.00 0.00 175.17 175.47 2odh n LEU 207 N 9.14 0.00 0.02 -1.34 4.77 -0.72 -2.08 117.00 126.79 2odh n LEU 207 Ca 0.03 0.28 -0.19 0.00 -0.03 0.00 0.00 56.01 56.10 2odh n LEU 207 Cb 0.49 -0.28 -0.13 0.00 -2.33 0.00 0.00 43.42 41.17 2odh n LEU 207 CO 0.71 -0.13 0.15 0.77 -1.33 0.00 0.00 177.39 177.55 2odh h SER 208 N 0.00 0.45 -4.39 -1.43 4.64 -1.91 -3.48 113.55 107.42 2odh h SER 208 Ca 0.00 -0.88 -0.48 0.00 -0.47 0.00 0.00 61.79 59.96 2odh h SER 208 Cb 0.14 -0.14 0.11 0.00 -0.31 0.00 0.00 62.40 62.20 2odh h SER 208 CO 0.00 1.29 0.36 -0.54 -0.87 0.00 0.00 176.83 177.07 2odh s LYS 209 N -2.71 2.01 -0.38 4.77 1.02 -0.89 -4.98 119.74 118.59 2odh s LYS 209 Ca -0.14 0.40 0.07 0.00 0.02 0.00 0.00 55.97 56.32 2odh s LYS 209 Cb 0.01 -1.93 0.71 0.00 -0.52 0.00 0.00 37.83 36.11 2odh s LYS 209 CO 0.81 -1.62 1.86 -1.13 -0.92 0.00 0.00 175.35 174.35 2odh n SER 210 N -3.39 4.39 -4.85 2.83 3.41 -1.26 -4.94 113.62 109.81 2odh n SER 210 Ca 0.07 -3.38 -0.35 0.00 -0.26 0.00 0.00 58.87 54.96 2odh n SER 210 Cb 0.58 -0.79 -0.06 0.00 -0.26 0.00 0.00 64.21 63.69 2odh n SER 210 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2odh s LYS 211 N -3.10 3.94 1.16 4.33 3.01 -1.26 -5.09 119.74 122.73 2odh s LYS 211 Ca 0.56 0.44 -0.16 0.00 -1.01 0.00 0.00 55.97 55.80 2odh s LYS 211 Cb 0.46 -2.91 0.27 0.00 -1.01 0.00 0.00 37.83 34.63 2odh s LYS 211 CO 0.12 0.47 1.05 0.20 0.51 0.00 0.00 175.35 177.71 2odh s GLY 212 N -1.78 1.54 0.50 -3.33 0.00 -1.26 -4.86 107.32 98.12 2odh s GLY 212 Ca 0.38 -0.52 -0.23 0.00 0.00 0.00 0.00 44.72 44.35 2odh s GLY 212 CO 0.19 0.25 1.30 -4.14 0.00 0.00 0.00 173.10 170.71 2odh s PRO 213 N -4.94 3.45 -0.51 2.90 0.02 -1.26 -4.88 135.00 129.78 2odh s PRO 213 Ca 0.68 2.11 -0.15 0.00 0.02 0.00 0.00 61.00 63.66 2odh s PRO 213 Cb -0.18 -2.39 0.11 0.00 0.02 0.00 0.00 34.50 32.06 2odh s PRO 213 CO 0.59 -0.90 0.45 -1.58 -0.33 0.00 0.00 177.00 175.23 2odh s HIS 214 N -1.36 3.26 -0.32 6.54 2.46 -0.47 -4.98 115.29 120.42 2odh s HIS 214 Ca 0.67 -1.17 -0.14 0.00 0.47 0.00 0.00 55.06 54.89 2odh s HIS 214 Cb -0.37 -3.53 -0.02 0.00 -0.13 0.00 0.00 32.58 28.53 2odh s HIS 214 CO 0.45 -0.93 0.29 0.34 -2.47 0.00 0.00 174.74 172.42 2odh s ASP 215 N 3.15 6.12 0.14 9.88 2.15 -1.26 -2.51 116.67 134.34 2odh s ASP 215 Ca 0.03 -0.17 0.22 0.00 0.43 0.00 0.00 52.55 53.06 2odh s ASP 215 Cb -0.27 -2.17 0.87 0.00 -0.30 0.00 0.00 42.92 41.05 2odh s ASP 215 CO 0.04 -0.23 1.67 0.54 -0.17 0.00 0.00 175.17 177.03 2odh n ARG 216 N 5.23 0.12 -0.06 4.34 5.12 -0.78 -4.98 116.66 125.66 2odh n ARG 216 Ca -0.11 0.29 0.00 0.00 -1.93 0.00 0.00 57.85 56.10 2odh n ARG 216 Cb 0.50 -1.70 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 2odh n ARG 216 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2odh n GLY 217 N 0.39 0.67 3.69 -0.13 0.00 -1.26 -5.00 105.19 103.54 2odh n GLY 217 Ca 0.04 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 2odh n GLY 217 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2odh n PRO 218 N 2.52 2.10 -4.33 1.61 -0.02 -1.25 -4.76 135.00 130.86 2odh n PRO 218 Ca 0.00 0.74 -0.30 0.00 -2.02 0.00 0.00 63.50 61.92 2odh n PRO 218 Cb 0.00 -2.33 -0.11 0.00 -0.02 0.00 0.00 33.50 31.04 2odh n PRO 218 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2odh s HIS 219 N -0.90 2.56 -0.13 6.00 3.76 -1.00 -1.66 115.29 123.92 2odh s HIS 219 Ca 0.58 -0.25 -0.00 0.00 -0.15 0.00 0.00 55.06 55.24 2odh s HIS 219 Cb -0.58 -1.37 -0.01 0.00 1.11 0.00 0.00 32.58 31.72 2odh s HIS 219 CO 0.60 0.38 -0.13 -1.17 -0.85 0.00 0.00 174.74 173.56 2odh s LEU 220 N -2.08 2.69 0.09 0.89 2.96 -0.78 -1.46 118.68 121.01 2odh s LEU 220 Ca 0.18 -0.35 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 2odh s LEU 220 Cb -0.11 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 2odh s LEU 220 CO 0.10 0.15 -0.08 -0.13 -1.32 0.00 0.00 176.35 175.07 2odh s ARG 221 N 0.43 0.81 -0.02 1.98 0.52 0.01 -0.05 118.95 122.64 2odh s ARG 221 Ca -0.10 -1.23 0.01 0.00 -0.52 0.00 0.00 55.73 53.90 2odh s ARG 221 Cb -0.16 -0.32 0.01 0.00 0.52 0.00 0.00 34.95 34.99 2odh s ARG 221 CO 0.05 0.02 -0.04 -1.50 0.02 0.00 0.00 175.30 173.85 2odh s ILE 222 N -3.03 0.36 0.35 1.52 2.07 -0.45 -1.13 121.20 120.91 2odh s ILE 222 Ca 0.08 -0.14 -0.28 0.00 -1.41 0.00 0.00 60.65 58.90 2odh s ILE 222 Cb 0.01 -0.35 -0.12 0.00 0.13 0.00 0.00 42.46 42.13 2odh s ILE 222 CO -0.03 0.13 1.40 -2.65 -1.91 0.00 0.00 174.94 171.89 2odh n PRO 223 N 3.36 2.41 -0.24 3.50 -0.02 -1.26 -0.84 135.00 141.91 2odh n PRO 223 Ca -0.18 0.85 0.08 0.00 -2.02 0.00 0.00 63.50 62.23 2odh n PRO 223 Cb 0.55 -2.51 0.34 0.00 -0.02 0.00 0.00 33.50 31.86 2odh n PRO 223 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2odh h ILE 224 N 2.79 0.96 0.00 4.25 1.08 -1.58 -1.22 117.51 123.79 2odh h ILE 224 Ca -0.48 -0.27 0.00 0.00 -0.39 0.00 0.00 64.86 63.71 2odh h ILE 224 Cb 1.26 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 2odh h ILE 224 CO 0.64 0.14 0.00 0.77 -0.69 0.00 0.00 178.15 179.02 2odh h SER 225 N 0.79 0.00 -0.40 1.72 4.64 -1.90 -2.62 113.55 115.79 2odh h SER 225 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 2odh h SER 225 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2odh h SER 225 CO -0.15 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.10 2odh n LYS 226 N -2.30 2.93 0.26 4.77 5.02 -0.46 -4.65 118.16 123.72 2odh n LYS 226 Ca -0.00 -2.29 0.09 0.00 -2.02 0.00 0.00 58.31 54.09 2odh n LYS 226 Cb 0.10 -1.43 0.66 0.00 -0.02 0.00 0.00 35.03 34.34 2odh n LYS 226 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2odh h LEU 227 N 2.37 0.00 -0.09 -0.35 3.38 -1.49 -0.97 115.31 118.16 2odh h LEU 227 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2odh h LEU 227 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2odh h LEU 227 CO 0.05 0.06 0.00 -0.90 0.09 0.00 0.00 178.44 177.73 2odh n ASP 228 N -4.30 0.11 0.12 -0.43 5.68 -1.26 -1.10 116.55 115.36 2odh n ASP 228 Ca -0.03 0.52 0.02 0.00 -0.50 0.00 0.00 54.79 54.81 2odh n ASP 228 Cb 0.14 -0.55 0.00 0.00 -1.14 0.00 0.00 41.12 39.57 2odh n ASP 228 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2odh h LYS 229 N 0.00 0.00 0.07 0.11 1.57 -1.53 -3.37 116.57 113.41 2odh h LYS 229 Ca 0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.41 2odh h LYS 229 Cb 0.30 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.57 2odh h LYS 229 CO 0.00 0.44 -2.18 -0.11 -0.57 0.00 0.00 179.45 177.03 2odh n LEU 230 N -3.14 2.53 -4.32 2.94 7.94 -0.61 -4.69 117.00 117.65 2odh n LEU 230 Ca -0.00 0.08 -0.33 0.00 -1.11 0.00 0.00 56.01 54.65 2odh n LEU 230 Cb 0.75 -0.88 -0.15 0.00 0.53 0.00 0.00 43.42 43.67 2odh n LEU 230 CO 0.41 0.84 -0.48 -0.31 -1.11 0.00 0.00 177.39 176.74 2odh s TYR 231 N -2.54 2.75 -0.56 1.96 2.02 -0.26 -0.72 117.35 120.00 2odh s TYR 231 Ca -0.25 -0.79 0.24 0.00 -0.37 0.00 0.00 57.07 55.90 2odh s TYR 231 Cb 0.08 -1.82 0.40 0.00 -0.40 0.00 0.00 41.96 40.21 2odh s TYR 231 CO 0.71 -0.29 1.43 0.00 -1.57 0.00 0.00 175.55 175.83 2odh h ARG 232 N 6.79 0.00 -3.89 -0.62 3.08 -0.68 -3.41 114.38 115.66 2odh h ARG 232 Ca -0.25 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.21 2odh h ARG 232 Cb 1.22 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.87 2odh h ARG 232 CO 0.54 0.00 -0.76 1.21 -1.07 0.00 0.00 179.97 179.89 2odh s ASN 233 N -4.79 3.93 -0.23 7.04 3.84 -0.78 -5.03 114.94 118.92 2odh s ASN 233 Ca 0.06 -1.49 0.02 0.00 0.21 0.00 0.00 52.86 51.66 2odh s ASN 233 Cb 0.11 -1.00 0.04 0.00 -0.55 0.00 0.00 41.25 39.85 2odh s ASN 233 CO 0.70 -0.36 -0.15 -0.63 -2.79 0.00 0.00 177.10 173.87 2odh s ILE 234 N 1.50 2.14 -0.13 -5.21 1.01 -1.26 -1.14 121.20 118.11 2odh s ILE 234 Ca 0.05 -1.33 0.02 0.00 0.00 0.00 0.00 60.65 59.39 2odh s ILE 234 Cb -0.18 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.18 2odh s ILE 234 CO -0.16 0.21 -0.21 -0.70 0.00 0.00 0.00 174.94 174.08 2odh s GLU 235 N 1.18 3.09 -0.03 2.79 2.12 -0.10 -4.97 118.70 122.79 2odh s GLU 235 Ca -0.03 -0.83 -0.30 0.00 0.36 0.00 0.00 54.97 54.17 2odh s GLU 235 Cb -0.17 -2.44 -0.04 0.00 0.26 0.00 0.00 34.13 31.74 2odh s GLU 235 CO -0.08 0.07 1.17 0.50 -0.54 0.00 0.00 175.26 176.38 2odh s ARG 236 N 0.63 4.39 -0.16 4.30 3.52 -1.26 -0.48 118.95 129.89 2odh s ARG 236 Ca -0.11 1.65 0.17 0.00 -0.13 0.00 0.00 55.73 57.31 2odh s ARG 236 Cb -0.16 -3.51 -0.25 0.00 -1.56 0.00 0.00 34.95 29.47 2odh s ARG 236 CO 0.02 -0.37 0.13 1.28 -0.81 0.00 0.00 175.30 175.56 2odh n LEU 237 N 4.84 0.00 0.00 -0.88 4.77 0.51 -4.93 117.00 121.31 2odh n LEU 237 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2odh n LEU 237 Cb 0.47 0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.94 2odh n LEU 237 CO 0.55 0.38 0.00 -0.11 -1.33 0.00 0.00 177.39 176.88