#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ohw h ASP 4 N 0.00 0.00 -0.02 1.62 3.32 -2.06 -0.95 116.42 118.33 2ohw h ASP 4 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 2ohw h ASP 4 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2ohw h ASP 4 CO 0.00 0.07 -0.17 0.07 -1.72 0.00 0.00 179.24 177.49 2ohw h LYS 5 N 0.00 0.36 -0.29 3.56 2.10 -2.05 -1.74 116.57 118.51 2ohw h LYS 5 Ca -0.00 -0.10 -0.17 0.00 -2.00 0.00 0.00 60.65 58.37 2ohw h LYS 5 Cb 0.12 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.42 2ohw h LYS 5 CO 0.01 0.53 -0.50 1.98 -2.00 0.00 0.00 179.45 179.47 2ohw h MET 6 N 0.33 0.85 -0.88 0.07 4.05 -1.63 -1.74 114.93 115.99 2ohw h MET 6 Ca 0.06 -0.53 0.02 0.00 -0.28 0.00 0.00 59.70 58.98 2ohw h MET 6 Cb 0.50 0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.31 2ohw h MET 6 CO 0.03 1.16 0.58 -0.44 0.23 0.00 0.00 176.91 178.47 2ohw h ASP 7 N 0.63 0.98 -0.31 1.39 3.32 -1.19 -0.32 116.42 120.93 2ohw h ASP 7 Ca 0.02 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 2ohw h ASP 7 Cb 1.10 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 2ohw h ASP 7 CO 0.11 0.69 -0.22 0.25 -1.72 0.00 0.00 179.24 178.35 2ohw h LEU 8 N 1.14 0.73 -0.45 1.55 5.85 -1.15 0.64 115.31 123.63 2ohw h LEU 8 Ca 0.34 -0.44 0.07 0.00 0.84 0.00 0.00 57.88 58.69 2ohw h LEU 8 Cb -0.05 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.71 2ohw h LEU 8 CO -0.09 1.01 0.09 0.22 -0.34 0.00 0.00 178.44 179.33 2ohw h TYR 9 N 0.45 0.14 -0.20 1.25 3.20 -0.82 -0.90 116.97 120.10 2ohw h TYR 9 Ca 0.06 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2ohw h TYR 9 Cb 0.77 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 2ohw h TYR 9 CO 0.07 0.01 0.08 -0.07 -1.64 0.00 0.00 178.16 176.60 2ohw h LEU 10 N 0.22 0.28 -1.33 2.82 3.38 -0.91 0.06 115.31 119.83 2ohw h LEU 10 Ca 0.22 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2ohw h LEU 10 Cb 0.28 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2ohw h LEU 10 CO -0.29 0.37 0.36 -0.61 0.09 0.00 0.00 178.44 178.36 2ohw h GLN 11 N 0.16 0.81 -0.09 1.13 4.15 -0.41 -2.08 115.11 118.78 2ohw h GLN 11 Ca 0.07 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2ohw h GLN 11 Cb 0.18 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.70 2ohw h GLN 11 CO -0.00 0.57 0.00 1.04 -1.93 0.00 0.00 178.83 178.51 2ohw n GLN 12 N -4.41 1.62 0.00 1.69 6.02 -0.38 -4.92 117.38 117.00 2ohw n GLN 12 Ca 0.06 -0.92 0.00 0.00 -0.01 0.00 0.00 57.00 56.12 2ohw n GLN 12 Cb 0.08 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 29.91 2ohw n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ohw n GLY 13 N 1.12 1.04 2.56 1.08 0.00 -0.78 -4.61 105.19 105.60 2ohw n GLY 13 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 2ohw n GLY 13 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ohw n MET 14 N -1.87 -4.21 -2.57 1.61 2.81 -0.01 -4.49 117.12 108.38 2ohw n MET 14 Ca 0.00 0.47 -0.43 0.00 -1.81 0.00 0.00 57.70 55.93 2ohw n MET 14 Cb 0.00 -4.39 -0.02 0.00 -0.71 0.00 0.00 33.22 28.10 2ohw n MET 14 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 2ohw s TYR 15 N -3.19 3.29 0.00 2.03 2.02 -1.26 -4.85 117.35 115.39 2ohw s TYR 15 Ca 0.22 1.37 0.00 0.00 -0.37 0.00 0.00 57.07 58.29 2ohw s TYR 15 Cb -0.10 -3.32 0.00 0.00 -0.40 0.00 0.00 41.96 38.14 2ohw s TYR 15 CO 0.41 -0.83 0.00 0.41 -1.57 0.00 0.00 175.55 173.97 2ohw n GLY 16 N 3.28 -2.65 3.89 0.71 0.00 -1.26 -4.98 105.19 104.18 2ohw n GLY 16 Ca 0.11 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.18 2ohw n GLY 16 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ohw s PRO 17 N -0.85 2.76 0.63 1.61 0.04 -1.26 -5.03 135.00 132.90 2ohw s PRO 17 Ca 0.00 0.31 0.05 0.00 0.04 0.00 0.00 61.00 61.40 2ohw s PRO 17 Cb 0.00 -2.07 0.10 0.00 0.04 0.00 0.00 34.50 32.57 2ohw s PRO 17 CO 0.00 -1.03 0.87 -0.51 0.04 0.00 0.00 177.00 176.37 2ohw s LEU 18 N -5.30 3.08 0.23 -3.56 1.43 -1.26 -5.03 118.68 108.25 2ohw s LEU 18 Ca 0.58 -0.61 -0.06 0.00 -1.03 0.00 0.00 54.13 53.00 2ohw s LEU 18 Cb -0.11 -1.84 0.21 0.00 0.03 0.00 0.00 46.19 44.48 2ohw s LEU 18 CO 0.50 -1.54 1.76 1.05 0.23 0.00 0.00 176.35 178.35 2ohw h GLU 19 N -0.11 1.07 -5.31 1.70 4.11 -1.99 -3.45 114.58 110.60 2ohw h GLU 19 Ca -0.33 -0.23 -0.39 0.00 0.07 0.00 0.00 59.36 58.48 2ohw h GLU 19 Cb 1.28 -0.15 -0.16 0.00 0.50 0.00 0.00 28.75 30.21 2ohw h GLU 19 CO 0.41 0.92 -0.74 0.95 0.07 0.00 0.00 179.01 180.62 2ohw s THR 20 N -5.34 1.33 0.14 -1.06 -4.23 -1.26 -5.06 115.64 100.16 2ohw s THR 20 Ca -0.11 -1.91 -0.17 0.00 -1.18 0.00 0.00 61.69 58.32 2ohw s THR 20 Cb 0.15 -1.71 -0.01 0.00 1.34 0.00 0.00 72.50 72.27 2ohw s THR 20 CO 0.83 -0.56 1.80 0.11 -0.54 0.00 0.00 174.62 176.27 2ohw h LYS 21 N 3.13 0.43 -0.87 3.99 6.56 -2.01 -2.91 116.57 124.90 2ohw h LYS 21 Ca -0.38 -0.03 0.08 0.00 -1.06 0.00 0.00 60.65 59.26 2ohw h LYS 21 Cb 1.20 -0.10 -0.06 0.00 -0.57 0.00 0.00 32.23 32.70 2ohw h LYS 21 CO 0.57 0.29 0.57 -1.35 -2.06 0.00 0.00 179.45 177.46 2ohw h PRO 22 N 0.45 0.89 -0.46 3.15 0.11 -1.99 -0.94 132.00 133.21 2ohw h PRO 22 Ca 0.13 -0.05 0.06 0.00 0.11 0.00 0.00 66.00 66.24 2ohw h PRO 22 Cb -0.04 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 30.82 2ohw h PRO 22 CO -0.04 0.59 0.17 -0.44 -0.21 0.00 0.00 178.00 178.07 2ohw h ASP 23 N 0.91 0.19 -0.39 -2.05 3.32 -1.94 0.19 116.42 116.66 2ohw h ASP 23 Ca 0.39 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.45 2ohw h ASP 23 Cb 0.31 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 2ohw h ASP 23 CO -0.15 0.14 0.08 -0.33 -1.72 0.00 0.00 179.24 177.26 2ohw h GLU 24 N 0.35 0.63 -0.60 3.56 5.08 -1.15 -2.28 114.58 120.18 2ohw h GLU 24 Ca 0.22 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 2ohw h GLU 24 Cb 0.21 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 2ohw h GLU 24 CO -0.21 0.67 0.17 0.00 -1.00 0.00 0.00 179.01 178.64 2ohw h ARG 25 N 0.49 0.92 0.00 2.33 3.08 -0.82 0.12 114.38 120.50 2ohw h ARG 25 Ca 0.12 -0.18 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 2ohw h ARG 25 Cb 0.33 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2ohw h ARG 25 CO 0.00 0.80 -0.29 0.45 -1.07 0.00 0.00 179.97 179.87 2ohw h HIS 26 N 0.89 0.00 0.04 3.04 3.86 -0.76 0.12 115.15 122.34 2ohw h HIS 26 Ca 0.20 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.29 2ohw h HIS 26 Cb 0.28 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.74 2ohw h HIS 26 CO 0.02 0.29 -0.60 1.25 0.86 0.00 0.00 177.93 179.75 2ohw h LEU 27 N 0.00 0.13 -3.58 2.43 5.85 -0.82 -3.41 115.31 115.91 2ohw h LEU 27 Ca -0.00 -0.86 -0.43 0.00 0.84 0.00 0.00 57.88 57.42 2ohw h LEU 27 Cb 0.64 -0.04 -0.22 0.00 0.37 0.00 0.00 40.66 41.41 2ohw h LEU 27 CO 0.04 1.26 0.55 0.49 -0.34 0.00 0.00 178.44 180.44 2ohw n PHE 28 N -4.40 2.29 -3.34 1.25 3.72 0.36 -4.63 117.46 112.71 2ohw n PHE 28 Ca -0.18 -1.94 -0.24 0.00 -0.05 0.00 0.00 57.45 55.04 2ohw n PHE 28 Cb 0.64 -0.96 0.03 0.00 -0.94 0.00 0.00 39.48 38.25 2ohw n PHE 28 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2ohw n LEU 29 N -0.49 -2.47 0.00 4.37 4.77 -1.17 -1.92 117.00 120.09 2ohw n LEU 29 Ca 0.45 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2ohw n LEU 29 Cb 1.02 -2.70 0.00 0.00 -2.33 0.00 0.00 43.42 39.40 2ohw n LEU 29 CO 0.51 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 2ohw n GLY 30 N -1.53 1.01 3.87 -0.72 0.00 0.43 -4.98 105.19 103.26 2ohw n GLY 30 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 2ohw n GLY 30 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ohw s SER 31 N -1.75 6.63 0.46 1.61 0.15 -0.81 -4.75 113.70 115.24 2ohw s SER 31 Ca 0.00 1.10 -0.20 0.00 0.70 0.00 0.00 55.95 57.55 2ohw s SER 31 Cb 0.00 -2.30 -0.10 0.00 -1.71 0.00 0.00 66.02 61.91 2ohw s SER 31 CO 0.00 -0.24 0.98 -0.76 1.20 0.00 0.00 173.24 174.43 2ohw s LEU 32 N -3.27 3.87 0.38 3.45 1.43 -1.26 -3.32 118.68 119.96 2ohw s LEU 32 Ca 0.51 1.76 0.08 0.00 -1.03 0.00 0.00 54.13 55.44 2ohw s LEU 32 Cb -0.10 -4.54 0.81 0.00 0.03 0.00 0.00 46.19 42.39 2ohw s LEU 32 CO 0.24 -0.53 1.95 -0.09 0.23 0.00 0.00 176.35 178.14 2ohw h ARG 33 N 1.68 0.65 0.00 1.70 9.65 -1.93 -1.15 114.38 124.98 2ohw h ARG 33 Ca -0.49 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.35 2ohw h ARG 33 Cb 1.19 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 29.63 2ohw h ARG 33 CO 0.60 0.43 0.00 1.05 2.80 0.00 0.00 179.97 184.86 2ohw h GLU 34 N 0.67 0.00 -0.01 0.20 4.11 -1.96 -2.21 114.58 115.39 2ohw h GLU 34 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.76 2ohw h GLU 34 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2ohw h GLU 34 CO -0.11 0.00 -0.53 0.54 0.07 0.00 0.00 179.01 178.98 2ohw n ARG 35 N -2.63 1.04 -2.62 1.06 1.74 -0.44 -0.70 116.66 114.12 2ohw n ARG 35 Ca -0.01 -0.85 -0.42 0.00 -0.77 0.00 0.00 57.85 55.80 2ohw n ARG 35 Cb 0.14 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.07 2ohw n ARG 35 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2ohw s VAL 36 N -2.54 4.61 -0.21 1.55 1.01 -0.83 -0.42 120.40 123.56 2ohw s VAL 36 Ca 0.17 1.88 0.00 0.00 0.00 0.00 0.00 61.98 64.03 2ohw s VAL 36 Cb 0.18 -4.20 -0.20 0.00 0.00 0.00 0.00 36.38 32.15 2ohw s VAL 36 CO 0.61 0.12 -0.01 0.52 0.00 0.00 0.00 175.10 176.33 2ohw n VAL 37 N 4.03 1.58 -3.58 2.92 0.31 0.29 -4.42 118.33 119.45 2ohw n VAL 37 Ca 0.07 -0.62 -0.15 0.00 -0.01 0.00 0.00 64.34 63.64 2ohw n VAL 37 Cb 0.49 -1.46 -0.06 0.00 -0.91 0.00 0.00 33.84 31.90 2ohw n VAL 37 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2ohw s LEU 38 N -6.62 -0.65 -0.00 7.52 2.96 -1.16 -4.62 118.68 116.10 2ohw s LEU 38 Ca -0.29 0.99 0.02 0.00 -0.22 0.00 0.00 54.13 54.63 2ohw s LEU 38 Cb 0.08 2.40 -0.01 0.00 0.50 0.00 0.00 46.19 49.17 2ohw s LEU 38 CO 0.67 -0.41 -0.06 0.00 -1.32 0.00 0.00 176.35 175.22 2ohw s ALA 39 N -0.46 0.51 -0.00 5.97 0.00 0.38 -0.68 121.76 127.48 2ohw s ALA 39 Ca -0.05 -0.31 0.08 0.00 0.00 0.00 0.00 51.96 51.69 2ohw s ALA 39 Cb -0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 2ohw s ALA 39 CO 0.05 0.11 -0.25 -0.51 0.00 0.00 0.00 175.76 175.16 2ohw s LEU 40 N -0.27 2.15 0.80 0.00 1.43 -0.31 -4.43 118.68 118.05 2ohw s LEU 40 Ca 0.01 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.52 2ohw s LEU 40 Cb -0.03 -1.35 0.07 0.00 0.03 0.00 0.00 46.19 44.92 2ohw s LEU 40 CO -0.00 0.30 1.09 0.42 0.23 0.00 0.00 176.35 178.39 2ohw s THR 41 N -0.68 3.21 0.27 5.49 -4.23 -1.26 -0.19 115.64 118.24 2ohw s THR 41 Ca 0.11 0.39 -0.01 0.00 -1.18 0.00 0.00 61.69 61.00 2ohw s THR 41 Cb -0.10 -2.95 0.25 0.00 1.34 0.00 0.00 72.50 71.04 2ohw s THR 41 CO 0.00 -0.51 1.81 0.11 -0.54 0.00 0.00 174.62 175.49 2ohw h LYS 42 N -1.18 0.84 -0.87 3.99 1.57 -1.17 -0.68 116.57 119.06 2ohw h LYS 42 Ca -0.46 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2ohw h LYS 42 Cb 1.25 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 33.33 2ohw h LYS 42 CO 0.54 0.56 0.55 0.78 -0.57 0.00 0.00 179.45 181.31 2ohw h GLY 43 N 0.86 1.24 1.00 3.86 0.00 -1.88 -1.03 103.07 107.13 2ohw h GLY 43 Ca 0.46 -0.49 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 2ohw h GLY 43 CO -0.27 0.47 0.06 1.46 0.00 0.00 0.00 176.54 178.26 2ohw h GLN 44 N 1.18 0.87 -0.22 4.80 4.20 -1.67 -2.82 115.11 121.47 2ohw h GLN 44 Ca 0.31 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2ohw h GLN 44 Cb -0.10 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 2ohw h GLN 44 CO -0.06 0.87 0.06 0.28 -0.67 0.00 0.00 178.83 179.30 2ohw h VAL 45 N 0.75 1.10 0.00 -0.54 2.07 -0.54 -1.83 116.25 117.26 2ohw h VAL 45 Ca 0.15 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2ohw h VAL 45 Cb 0.43 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2ohw h VAL 45 CO 0.01 0.13 0.00 0.18 0.02 0.00 0.00 177.57 177.91 2ohw n LEU 46 N -4.42 0.00 -4.74 2.57 4.77 -0.45 -4.77 117.00 109.96 2ohw n LEU 46 Ca 0.00 0.38 -0.41 0.00 -0.03 0.00 0.00 56.01 55.95 2ohw n LEU 46 Cb 0.14 -0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 40.83 2ohw n LEU 46 CO 0.36 -0.10 1.16 -0.60 -1.33 0.00 0.00 177.39 176.88 2ohw s ARG 47 N -2.77 4.22 0.14 3.23 3.52 -0.69 -4.92 118.95 121.68 2ohw s ARG 47 Ca 0.16 2.39 -0.20 0.00 -0.13 0.00 0.00 55.73 57.96 2ohw s ARG 47 Cb 0.14 -3.09 0.02 0.00 -1.56 0.00 0.00 34.95 30.47 2ohw s ARG 47 CO 0.36 -0.50 1.68 0.77 -0.81 0.00 0.00 175.30 176.80 2ohw h SER 48 N 5.12 -0.35 -3.32 -2.12 0.02 -1.89 -3.38 113.55 107.63 2ohw h SER 48 Ca -0.46 0.09 -0.57 0.00 -0.84 0.00 0.00 61.79 60.01 2ohw h SER 48 Cb 1.22 0.21 -0.06 0.00 0.14 0.00 0.00 62.40 63.90 2ohw h SER 48 CO 0.79 -0.13 0.36 -0.75 -1.14 0.00 0.00 176.83 175.96 2ohw s LYS 49 N -6.19 4.35 0.64 3.45 2.47 -1.26 -5.04 119.74 118.15 2ohw s LYS 49 Ca -0.14 1.05 -0.17 0.00 -1.56 0.00 0.00 55.97 55.16 2ohw s LYS 49 Cb 0.12 -3.54 -0.01 0.00 -1.46 0.00 0.00 37.83 32.94 2ohw s LYS 49 CO 0.69 -0.25 1.17 -1.25 0.16 0.00 0.00 175.35 175.87 2ohw s PRO 50 N 1.85 2.75 -0.18 4.03 0.04 -1.26 -4.95 135.00 137.28 2ohw s PRO 50 Ca 0.40 1.66 -0.29 0.00 0.04 0.00 0.00 61.00 62.80 2ohw s PRO 50 Cb -0.17 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 2ohw s PRO 50 CO 0.15 -1.34 1.17 0.71 0.04 0.00 0.00 177.00 177.73 2ohw s TYR 51 N -1.93 3.07 0.54 0.56 2.02 -1.26 -4.91 117.35 115.44 2ohw s TYR 51 Ca 0.73 1.21 0.25 0.00 -0.37 0.00 0.00 57.07 58.89 2ohw s TYR 51 Cb -0.26 -3.40 1.60 0.00 -0.40 0.00 0.00 41.96 39.49 2ohw s TYR 51 CO 0.38 -1.18 2.19 -0.22 -1.57 0.00 0.00 175.55 175.15 2ohw h LYS 52 N 7.85 0.00 -0.26 -0.62 1.63 -2.00 -1.85 116.57 121.33 2ohw h LYS 52 Ca -0.24 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.51 2ohw h LYS 52 Cb 1.09 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.71 2ohw h LYS 52 CO 0.97 0.03 -0.07 0.93 -3.45 0.00 0.00 179.45 177.86 2ohw h GLU 53 N 0.00 0.41 -0.28 1.90 3.07 -2.00 -0.10 114.58 117.59 2ohw h GLU 53 Ca -0.00 -0.09 -0.17 0.00 -0.50 0.00 0.00 59.36 58.59 2ohw h GLU 53 Cb 0.07 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 2ohw h GLU 53 CO 0.00 0.49 -0.50 0.00 -1.40 0.00 0.00 179.01 177.61 2ohw h ALA 54 N 1.55 0.43 -0.90 3.43 0.00 -1.75 -2.84 119.26 119.19 2ohw h ALA 54 Ca 0.08 -0.50 0.03 0.00 0.00 0.00 0.00 54.91 54.52 2ohw h ALA 54 Cb 0.37 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 2ohw h ALA 54 CO 0.02 0.61 0.59 1.49 0.00 0.00 0.00 179.25 181.96 2ohw h GLU 55 N 0.59 1.12 -0.56 0.00 4.81 -1.20 -1.24 114.58 118.10 2ohw h GLU 55 Ca 0.02 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 2ohw h GLU 55 Cb 1.11 -0.25 -0.04 0.00 0.63 0.00 0.00 28.75 30.19 2ohw h GLU 55 CO 0.11 0.74 0.31 1.25 -0.73 0.00 0.00 179.01 180.69 2ohw h HIS 56 N 1.16 0.57 -0.38 0.92 2.76 -0.93 -0.05 115.15 119.20 2ohw h HIS 56 Ca 0.35 0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.43 2ohw h HIS 56 Cb -0.03 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.74 2ohw h HIS 56 CO -0.01 0.29 -0.23 0.93 -1.30 0.00 0.00 177.93 177.61 2ohw h GLU 57 N 0.59 0.74 -0.49 5.26 4.39 -1.19 -1.66 114.58 122.23 2ohw h GLU 57 Ca 0.24 -0.30 -0.11 0.00 0.34 0.00 0.00 59.36 59.54 2ohw h GLU 57 Cb 0.12 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 2ohw h GLU 57 CO -0.15 0.90 -0.12 -0.07 -1.16 0.00 0.00 179.01 178.42 2ohw h LEU 58 N 0.65 0.91 -1.06 1.33 3.38 -0.84 -2.54 115.31 117.15 2ohw h LEU 58 Ca 0.09 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 2ohw h LEU 58 Cb 0.73 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2ohw h LEU 58 CO 0.06 1.04 -0.33 0.50 0.09 0.00 0.00 178.44 179.80 2ohw h LYS 59 N 0.82 0.25 -0.52 1.13 3.64 -0.84 -3.18 116.57 117.88 2ohw h LYS 59 Ca 0.13 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2ohw h LYS 59 Cb 0.65 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 2ohw h LYS 59 CO 0.04 0.56 0.00 0.09 -2.27 0.00 0.00 179.45 177.87 2ohw n ASN 60 N -4.10 3.64 -4.85 4.20 3.02 -0.64 -4.99 115.26 111.55 2ohw n ASN 60 Ca -0.01 -2.15 -0.32 0.00 -0.03 0.00 0.00 54.58 52.07 2ohw n ASN 60 Cb 0.42 -0.40 -0.01 0.00 -0.61 0.00 0.00 39.78 39.19 2ohw n ASN 60 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2ohw s SER 61 N -1.06 6.31 -0.05 6.41 1.04 -0.96 -5.04 113.70 120.35 2ohw s SER 61 Ca 0.38 1.53 -0.00 0.00 0.48 0.00 0.00 55.95 58.33 2ohw s SER 61 Cb 0.22 -2.49 0.03 0.00 0.10 0.00 0.00 66.02 63.87 2ohw s SER 61 CO 0.22 -0.81 -0.01 -1.38 0.98 0.00 0.00 173.24 172.25 2ohw s HIS 62 N -2.88 0.57 -1.22 5.02 -3.43 -1.26 -4.92 115.29 107.16 2ohw s HIS 62 Ca 0.57 -0.12 -0.09 0.00 -0.80 0.00 0.00 55.06 54.63 2ohw s HIS 62 Cb -0.11 -0.65 -0.01 0.00 -1.43 0.00 0.00 32.58 30.37 2ohw s HIS 62 CO 0.43 -0.24 0.73 0.09 -2.00 0.00 0.00 174.74 173.75 2ohw n ASN 63 N 4.62 -3.32 -4.66 7.38 5.03 -1.26 -4.76 115.26 118.29 2ohw n ASN 63 Ca -0.16 -0.90 -0.24 0.00 0.87 0.00 0.00 54.58 54.15 2ohw n ASN 63 Cb 0.50 -3.84 -0.07 0.00 -1.02 0.00 0.00 39.78 35.35 2ohw n ASN 63 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 2ohw s VAL 64 N -3.59 2.98 0.03 2.41 -7.23 -1.26 -1.74 120.40 112.00 2ohw s VAL 64 Ca 0.24 -1.88 0.07 0.00 -1.81 0.00 0.00 61.98 58.60 2ohw s VAL 64 Cb -0.07 -2.85 -0.02 0.00 0.56 0.00 0.00 36.38 34.00 2ohw s VAL 64 CO 0.83 -0.25 -0.21 -0.89 -0.31 0.00 0.00 175.10 174.27 2ohw s THR 65 N -2.43 1.68 -0.44 5.32 2.01 0.07 -4.26 115.64 117.59 2ohw s THR 65 Ca 0.35 -1.12 -0.22 0.00 0.31 0.00 0.00 61.69 61.00 2ohw s THR 65 Cb -0.03 -1.44 0.02 0.00 0.01 0.00 0.00 72.50 71.06 2ohw s THR 65 CO 0.20 0.28 0.73 -0.22 -0.69 0.00 0.00 174.62 174.92 2ohw s LEU 66 N -1.00 4.33 -0.14 4.42 2.96 -0.29 -1.68 118.68 127.28 2ohw s LEU 66 Ca 0.08 -0.15 -0.14 0.00 -0.22 0.00 0.00 54.13 53.70 2ohw s LEU 66 Cb -0.09 -2.88 -0.05 0.00 0.50 0.00 0.00 46.19 43.68 2ohw s LEU 66 CO 0.01 -0.84 0.31 -0.76 -1.32 0.00 0.00 176.35 173.75 2ohw s LEU 67 N 3.09 4.28 -0.07 -0.68 1.43 0.51 -0.74 118.68 126.49 2ohw s LEU 67 Ca 0.27 0.57 0.04 0.00 -1.03 0.00 0.00 54.13 53.97 2ohw s LEU 67 Cb -0.13 -2.39 0.00 0.00 0.03 0.00 0.00 46.19 43.70 2ohw s LEU 67 CO 0.21 0.13 -0.18 -0.63 0.23 0.00 0.00 176.35 176.11 2ohw s ILE 68 N 0.23 1.58 -0.22 -0.59 1.01 -0.33 -0.81 121.20 122.08 2ohw s ILE 68 Ca 0.18 -0.76 -0.29 0.00 0.00 0.00 0.00 60.65 59.77 2ohw s ILE 68 Cb -0.13 -1.38 -0.03 0.00 0.01 0.00 0.00 42.46 40.93 2ohw s ILE 68 CO 0.05 0.45 1.59 0.21 0.00 0.00 0.00 174.94 177.25 2ohw s ASN 69 N 0.31 6.42 0.00 3.58 3.84 -0.06 -0.26 114.94 128.77 2ohw s ASN 69 Ca -0.12 1.63 0.05 0.00 0.21 0.00 0.00 52.86 54.63 2ohw s ASN 69 Cb -0.15 -2.53 0.24 0.00 -0.55 0.00 0.00 41.25 38.26 2ohw s ASN 69 CO 0.05 -1.22 1.14 0.61 -2.79 0.00 0.00 177.10 174.89 2ohw n GLY 70 N 4.59 -0.64 0.25 1.21 0.00 -0.38 -1.72 105.19 108.51 2ohw n GLY 70 Ca 0.18 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.32 2ohw n GLY 70 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ohw h GLU 71 N 0.00 0.00 -6.96 1.61 5.08 -1.90 -3.44 114.58 108.97 2ohw h GLU 71 Ca 0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 2ohw h GLU 71 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2ohw h GLU 71 CO 0.00 0.13 0.38 -0.51 -1.00 0.00 0.00 179.01 178.01 2ohw s LEU 72 N -6.74 4.16 0.43 1.33 1.43 -0.70 -5.06 118.68 113.53 2ohw s LEU 72 Ca -0.01 1.94 -0.20 0.00 -1.03 0.00 0.00 54.13 54.83 2ohw s LEU 72 Cb 0.11 -4.19 -0.11 0.00 0.03 0.00 0.00 46.19 42.03 2ohw s LEU 72 CO 0.59 -0.37 0.94 -1.10 0.23 0.00 0.00 176.35 176.64 2ohw s GLN 73 N -2.48 4.20 0.24 1.70 -0.21 -1.26 -4.99 119.66 116.85 2ohw s GLN 73 Ca 0.57 1.09 -0.09 0.00 0.02 0.00 0.00 55.36 56.94 2ohw s GLN 73 Cb -0.19 -2.19 0.38 0.00 1.00 0.00 0.00 33.01 32.01 2ohw s GLN 73 CO 0.25 -0.04 1.63 -0.92 -2.12 0.00 0.00 175.29 174.08 2ohw h TYR 74 N 1.84 -0.17 0.00 0.91 3.20 -1.97 -0.87 116.97 119.91 2ohw h TYR 74 Ca -0.49 0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.44 2ohw h TYR 74 Cb 1.18 0.19 -0.00 0.00 1.54 0.00 0.00 36.73 39.64 2ohw h TYR 74 CO 0.62 -0.26 -0.00 -0.56 -1.64 0.00 0.00 178.16 176.31 2ohw h GLN 75 N 0.06 0.00 -0.01 1.82 -0.00 -2.00 -0.12 115.11 114.86 2ohw h GLN 75 Ca 0.38 0.00 -0.20 0.00 -0.00 0.00 0.00 58.65 58.84 2ohw h GLN 75 Cb 0.65 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.12 2ohw h GLN 75 CO -0.69 0.00 -0.85 0.77 -0.00 0.00 0.00 178.83 178.06 2ohw h SER 76 N 0.00 0.31 -0.00 0.06 0.02 -1.51 -3.37 113.55 109.06 2ohw h SER 76 Ca -0.00 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2ohw h SER 76 Cb 0.04 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.48 2ohw h SER 76 CO 0.00 1.03 -0.08 0.00 -1.14 0.00 0.00 176.83 176.64 2ohw n TYR 77 N -3.70 0.00 -0.03 3.45 0.18 -0.71 -4.67 117.16 111.67 2ohw n TYR 77 Ca -0.04 0.00 0.12 0.00 1.88 0.00 0.00 57.90 59.87 2ohw n TYR 77 Cb 0.79 0.00 0.54 0.00 -0.38 0.00 0.00 39.34 40.29 2ohw n TYR 77 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 2ohw h SER 78 N 0.44 0.28 -0.63 9.48 4.64 -1.22 -1.06 113.55 125.48 2ohw h SER 78 Ca 0.00 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2ohw h SER 78 Cb 0.13 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.14 2ohw h SER 78 CO 0.00 0.17 0.42 0.28 -0.87 0.00 0.00 176.83 176.83 2ohw h SER 79 N 0.31 0.72 0.60 4.97 0.02 -1.84 -2.07 113.55 116.27 2ohw h SER 79 Ca 0.24 -0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 61.04 2ohw h SER 79 Cb 0.54 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 2ohw h SER 79 CO -0.05 0.52 -0.62 1.88 -1.14 0.00 0.00 176.83 177.42 2ohw h TYR 80 N 0.86 0.02 -0.53 3.45 0.05 -1.54 -2.20 116.97 117.08 2ohw h TYR 80 Ca 0.23 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.89 2ohw h TYR 80 Cb -0.10 -0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.62 2ohw h TYR 80 CO -0.00 0.63 -0.12 0.82 -1.05 0.00 0.00 178.16 178.44 2ohw h ILE 81 N 0.01 1.27 -0.55 -2.88 2.04 -1.20 -0.40 117.51 115.80 2ohw h ILE 81 Ca -0.01 -1.27 0.00 0.00 1.00 0.00 0.00 64.86 64.58 2ohw h ILE 81 Cb 1.09 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 2ohw h ILE 81 CO 0.08 0.45 0.36 1.56 0.00 0.00 0.00 178.15 180.60 2ohw h GLN 82 N 0.89 0.73 -0.35 2.37 1.08 -1.14 -0.30 115.11 118.39 2ohw h GLN 82 Ca 0.14 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.27 2ohw h GLN 82 Cb 0.68 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.94 2ohw h GLN 82 CO 0.05 0.49 0.15 0.52 -0.95 0.00 0.00 178.83 179.09 2ohw h MET 83 N 0.74 0.51 0.06 1.46 2.86 -1.17 -1.77 114.93 117.62 2ohw h MET 83 Ca 0.20 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2ohw h MET 83 Cb -0.07 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 31.50 2ohw h MET 83 CO -0.04 0.48 -0.03 0.00 1.06 0.00 0.00 176.91 178.38 2ohw h ALA 84 N 1.00 -0.08 -0.42 6.32 0.00 -0.74 -2.79 119.26 122.56 2ohw h ALA 84 Ca 0.12 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2ohw h ALA 84 Cb 0.15 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2ohw h ALA 84 CO -0.01 -0.55 0.14 0.77 0.00 0.00 0.00 179.25 179.60 2ohw h SER 85 N -0.09 0.55 -0.80 0.00 0.02 -0.98 -0.09 113.55 112.16 2ohw h SER 85 Ca -0.00 -0.07 0.16 0.00 -0.84 0.00 0.00 61.79 61.04 2ohw h SER 85 Cb 0.07 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.42 2ohw h SER 85 CO 0.00 0.52 0.53 -0.09 -1.14 0.00 0.00 176.83 176.66 2ohw h ARG 86 N 0.60 0.44 -0.30 3.45 2.43 -1.04 -2.24 114.38 117.71 2ohw h ARG 86 Ca 0.14 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2ohw h ARG 86 Cb 0.17 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2ohw h ARG 86 CO -0.01 0.29 0.00 0.66 -1.51 0.00 0.00 179.97 179.40 2ohw n TYR 87 N -4.50 0.64 -1.74 2.20 4.01 -0.68 -4.97 117.16 112.11 2ohw n TYR 87 Ca 0.16 -0.65 -0.06 0.00 -0.16 0.00 0.00 57.90 57.18 2ohw n TYR 87 Cb 0.55 -0.14 -0.01 0.00 -0.31 0.00 0.00 39.34 39.43 2ohw n TYR 87 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ohw n GLY 88 N 0.08 0.41 3.67 2.72 0.00 -0.83 -4.98 105.19 106.27 2ohw n GLY 88 Ca 0.15 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 45.12 2ohw n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ohw s VAL 89 N -2.28 5.30 0.68 1.61 1.01 -0.13 -5.00 120.40 121.58 2ohw s VAL 89 Ca 0.00 0.37 -0.13 0.00 0.00 0.00 0.00 61.98 62.22 2ohw s VAL 89 Cb 0.00 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.80 2ohw s VAL 89 CO 0.00 0.31 1.08 -2.16 0.00 0.00 0.00 175.10 174.33 2ohw s PRO 90 N 1.13 2.86 0.19 2.72 0.04 -1.26 -3.99 135.00 136.69 2ohw s PRO 90 Ca 0.12 1.17 0.08 0.00 0.04 0.00 0.00 61.00 62.40 2ohw s PRO 90 Cb -0.14 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 2ohw s PRO 90 CO 0.06 -1.17 -0.16 -0.59 0.04 0.00 0.00 177.00 175.17 2ohw s PHE 91 N -2.69 1.73 -0.03 0.56 -0.12 -1.26 -1.14 117.98 115.04 2ohw s PHE 91 Ca 0.62 -0.53 0.01 0.00 -0.05 0.00 0.00 56.93 56.98 2ohw s PHE 91 Cb -0.17 -0.83 0.02 0.00 -0.63 0.00 0.00 43.02 41.42 2ohw s PHE 91 CO 0.47 0.34 -0.01 0.15 -0.05 0.00 0.00 175.22 176.13 2ohw s LYS 92 N -3.27 0.35 -0.36 1.99 1.02 0.08 -4.94 119.74 114.62 2ohw s LYS 92 Ca 0.19 0.05 -0.20 0.00 0.02 0.00 0.00 55.97 56.02 2ohw s LYS 92 Cb -0.03 -0.50 0.00 0.00 -0.52 0.00 0.00 37.83 36.78 2ohw s LYS 92 CO 0.07 -0.12 0.64 0.42 -0.92 0.00 0.00 175.35 175.44 2ohw s ILE 93 N 0.94 4.89 -0.37 2.17 1.01 -1.26 -1.19 121.20 127.39 2ohw s ILE 93 Ca -0.10 0.59 -0.24 0.00 0.00 0.00 0.00 60.65 60.90 2ohw s ILE 93 Cb -0.13 -4.08 0.01 0.00 0.01 0.00 0.00 42.46 38.27 2ohw s ILE 93 CO -0.01 -0.31 0.83 -0.69 0.00 0.00 0.00 174.94 174.76 2ohw s VAL 94 N 2.71 4.68 -0.02 2.92 1.01 0.64 -4.87 120.40 127.47 2ohw s VAL 94 Ca 0.24 0.99 0.07 0.00 0.00 0.00 0.00 61.98 63.28 2ohw s VAL 94 Cb -0.14 -4.26 -0.10 0.00 0.00 0.00 0.00 36.38 31.88 2ohw s VAL 94 CO 0.15 -0.47 0.13 -1.54 0.00 0.00 0.00 175.10 173.36 2ohw n SER 95 N 6.55 3.40 -4.43 3.32 3.41 -1.26 -1.24 113.62 123.36 2ohw n SER 95 Ca 0.04 0.00 -0.44 0.00 -0.26 0.00 0.00 58.87 58.21 2ohw n SER 95 Cb 0.48 1.20 -0.02 0.00 -0.26 0.00 0.00 64.21 65.61 2ohw n SER 95 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2ohw s ASP 96 N -2.99 6.81 -0.22 4.04 2.15 -1.26 -4.99 116.67 120.21 2ohw s ASP 96 Ca -0.03 -2.49 -0.06 0.00 0.43 0.00 0.00 52.55 50.41 2ohw s ASP 96 Cb 0.04 -2.36 -0.02 0.00 -0.30 0.00 0.00 42.92 40.28 2ohw s ASP 96 CO 0.29 -0.86 0.02 -0.76 -0.17 0.00 0.00 175.17 173.69 2ohw s LEU 97 N 1.78 3.27 0.01 -1.34 1.43 -1.26 -4.95 118.68 117.62 2ohw s LEU 97 Ca 0.33 -0.23 0.05 0.00 -1.03 0.00 0.00 54.13 53.25 2ohw s LEU 97 Cb -0.05 -1.85 -0.24 0.00 0.03 0.00 0.00 46.19 44.07 2ohw s LEU 97 CO -0.07 0.01 0.88 1.56 0.23 0.00 0.00 176.35 178.96 2ohw h GLN 98 N 7.90 0.10 -6.08 1.70 4.20 -1.95 -3.47 115.11 117.50 2ohw h GLN 98 Ca -0.38 -0.16 -0.69 0.00 0.06 0.00 0.00 58.65 57.48 2ohw h GLN 98 Cb 1.17 0.06 -0.31 0.00 0.30 0.00 0.00 27.48 28.71 2ohw h GLN 98 CO 0.60 0.87 -0.87 0.12 -0.67 0.00 0.00 178.83 178.87 2ohw s PHE 99 N -2.63 2.45 -0.03 2.96 5.36 -1.26 -5.09 117.98 119.74 2ohw s PHE 99 Ca -0.05 -0.66 -0.30 0.00 -0.96 0.00 0.00 56.93 54.96 2ohw s PHE 99 Cb 0.08 -1.60 -0.05 0.00 -0.34 0.00 0.00 43.02 41.11 2ohw s PHE 99 CO 0.83 -0.17 1.44 -1.58 -1.46 0.00 0.00 175.22 174.27 2ohw s HIS 100 N -0.23 2.69 0.00 10.12 5.65 -1.26 -5.01 115.29 127.25 2ohw s HIS 100 Ca -0.01 0.71 0.04 0.00 0.25 0.00 0.00 55.06 56.05 2ohw s HIS 100 Cb -0.13 -3.70 -0.03 0.00 -1.18 0.00 0.00 32.58 27.54 2ohw s HIS 100 CO 0.03 -2.65 -0.11 -0.08 -0.65 0.00 0.00 174.74 171.27 2ohw s THR 101 N 2.81 3.31 -1.48 0.89 -1.32 -1.26 -5.01 115.64 113.59 2ohw s THR 101 Ca 0.65 -0.86 0.30 0.00 -1.21 0.00 0.00 61.69 60.56 2ohw s THR 101 Cb -0.31 -2.40 0.54 0.00 -1.51 0.00 0.00 72.50 68.83 2ohw s THR 101 CO 0.26 0.42 2.04 -0.81 -2.21 0.00 0.00 174.62 174.32 2ohw n PRO 102 N 1.72 0.46 -2.85 7.08 -0.04 -1.26 -4.83 135.00 135.28 2ohw n PRO 102 Ca -0.16 0.01 -0.40 0.00 -0.04 0.00 0.00 63.50 62.90 2ohw n PRO 102 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.44 2ohw n PRO 102 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ohw s LEU 103 N -2.52 4.49 -0.21 1.53 1.43 -1.26 -0.72 118.68 121.41 2ohw s LEU 103 Ca 0.29 1.64 0.01 0.00 -1.03 0.00 0.00 54.13 55.05 2ohw s LEU 103 Cb 0.20 -3.42 -0.20 0.00 0.03 0.00 0.00 46.19 42.80 2ohw s LEU 103 CO 0.44 -0.01 -0.03 0.61 0.23 0.00 0.00 176.35 177.59 2ohw n GLY 104 N 2.24 -0.47 2.87 -3.19 0.00 0.73 -4.59 105.19 102.78 2ohw n GLY 104 Ca -0.00 -0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.68 2ohw n GLY 104 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ohw s ILE 105 N -2.53 0.05 -0.07 -0.61 1.01 -1.08 -0.88 121.20 117.08 2ohw s ILE 105 Ca -0.29 0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.37 2ohw s ILE 105 Cb 0.08 -0.07 0.02 0.00 0.01 0.00 0.00 42.46 42.50 2ohw s ILE 105 CO 0.66 0.03 -0.07 -0.69 0.00 0.00 0.00 174.94 174.87 2ohw s VAL 106 N 0.17 0.82 -0.32 2.92 1.01 0.01 -1.16 120.40 123.84 2ohw s VAL 106 Ca -0.01 -0.25 -0.16 0.00 0.00 0.00 0.00 61.98 61.56 2ohw s VAL 106 Cb -0.02 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.52 2ohw s VAL 106 CO -0.00 0.30 0.41 -0.63 0.00 0.00 0.00 175.10 175.17 2ohw s ILE 107 N 1.10 5.13 -0.06 2.22 1.01 0.15 -0.36 121.20 130.38 2ohw s ILE 107 Ca -0.07 0.31 0.05 0.00 0.00 0.00 0.00 60.65 60.94 2ohw s ILE 107 Cb -0.14 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 2ohw s ILE 107 CO -0.01 -0.04 -0.22 0.00 0.00 0.00 0.00 174.94 174.67 2ohw s ALA 108 N 2.14 1.96 0.66 9.38 0.00 -0.68 -0.55 121.76 134.67 2ohw s ALA 108 Ca 0.15 -0.91 -0.11 0.00 0.00 0.00 0.00 51.96 51.09 2ohw s ALA 108 Cb -0.16 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.30 2ohw s ALA 108 CO 0.11 0.35 1.05 0.00 0.00 0.00 0.00 175.76 177.27 2ohw s ALA 109 N 0.01 3.01 -1.62 0.00 0.00 0.44 -0.75 121.76 122.86 2ohw s ALA 109 Ca -0.07 -0.26 0.28 0.00 0.00 0.00 0.00 51.96 51.91 2ohw s ALA 109 Cb -0.14 -3.01 1.07 0.00 0.00 0.00 0.00 23.12 21.04 2ohw s ALA 109 CO 0.04 -0.92 1.77 -0.40 0.00 0.00 0.00 175.76 176.25 2ohw n ASP 110 N -2.86 0.59 -4.26 0.00 5.75 -0.71 -4.86 116.55 110.20 2ohw n ASP 110 Ca 0.06 -0.59 -0.17 0.00 -0.01 0.00 0.00 54.79 54.08 2ohw n ASP 110 Cb 0.56 -0.02 -0.10 0.00 -1.03 0.00 0.00 41.12 40.53 2ohw n ASP 110 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 2ohw s ILE 111 N -2.53 0.50 -0.02 2.12 -4.36 -1.26 -5.12 121.20 110.53 2ohw s ILE 111 Ca 0.26 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.35 2ohw s ILE 111 Cb 0.20 -2.61 -0.06 0.00 1.25 0.00 0.00 42.46 41.24 2ohw s ILE 111 CO 0.50 0.00 1.58 0.00 0.24 0.00 0.00 174.94 177.26 2ohw s ALA 112 N -3.74 3.63 -0.09 2.27 0.00 -1.26 -4.54 121.76 118.02 2ohw s ALA 112 Ca 0.37 0.96 0.09 0.00 0.00 0.00 0.00 51.96 53.39 2ohw s ALA 112 Cb 0.07 -3.70 -0.13 0.00 0.00 0.00 0.00 23.12 19.37 2ohw s ALA 112 CO 0.14 -1.21 0.23 1.33 0.00 0.00 0.00 175.76 176.25 2ohw n VAL 113 N 5.12 0.00 -3.90 0.00 0.24 0.13 -4.99 118.33 114.93 2ohw n VAL 113 Ca 0.16 -0.22 -0.33 0.00 -2.04 0.00 0.00 64.34 61.91 2ohw n VAL 113 Cb 0.43 0.44 0.01 0.00 -1.47 0.00 0.00 33.84 33.25 2ohw n VAL 113 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2ohw n ASN 114 N -1.68 -2.97 -4.71 -1.34 4.13 -0.52 -4.92 115.26 103.25 2ohw n ASN 114 Ca -0.01 -1.09 -0.39 0.00 1.68 0.00 0.00 54.58 54.76 2ohw n ASN 114 Cb 0.21 -2.79 -0.05 0.00 -1.54 0.00 0.00 39.78 35.61 2ohw n ASN 114 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2ohw s ARG 115 N -6.57 4.38 -0.00 3.52 0.52 -1.26 -4.97 118.95 114.56 2ohw s ARG 115 Ca 0.29 0.73 -0.24 0.00 -0.52 0.00 0.00 55.73 56.00 2ohw s ARG 115 Cb -0.12 -3.47 -0.18 0.00 0.52 0.00 0.00 34.95 31.70 2ohw s ARG 115 CO 0.90 0.04 1.28 0.93 0.02 0.00 0.00 175.30 178.47 2ohw h GLU 116 N 6.86 0.16 -4.63 3.54 5.08 -1.93 -3.43 114.58 120.23 2ohw h GLU 116 Ca -0.39 -0.09 -0.70 0.00 -1.00 0.00 0.00 59.36 57.18 2ohw h GLU 116 Cb 1.18 0.01 -0.21 0.00 0.50 0.00 0.00 28.75 30.23 2ohw h GLU 116 CO 0.76 0.63 -0.47 -1.17 -1.00 0.00 0.00 179.01 177.75 2ohw s LEU 117 N -9.12 4.71 -0.03 1.33 2.96 -1.26 -4.58 118.68 112.69 2ohw s LEU 117 Ca -0.15 -0.67 0.04 0.00 -0.22 0.00 0.00 54.13 53.13 2ohw s LEU 117 Cb 0.03 -2.12 0.06 0.00 0.50 0.00 0.00 46.19 44.66 2ohw s LEU 117 CO 0.71 -0.32 0.89 2.30 -1.32 0.00 0.00 176.35 178.61 2ohw n ILE 118 N 5.10 0.70 -4.30 6.68 -5.35 -1.26 -4.91 119.36 116.01 2ohw n ILE 118 Ca -0.12 -0.78 -0.16 0.00 -0.27 0.00 0.00 62.75 61.41 2ohw n ILE 118 Cb 0.48 0.49 -0.10 0.00 -1.74 0.00 0.00 39.64 38.77 2ohw n ILE 118 CO 0.00 0.00 0.00 -0.72 -1.76 0.00 0.00 176.55 174.07 2ohw s TYR 119 N -0.91 1.46 -0.42 4.28 -0.00 -1.26 -0.47 117.35 120.03 2ohw s TYR 119 Ca 0.07 -0.85 -0.10 0.00 -0.00 0.00 0.00 57.07 56.19 2ohw s TYR 119 Cb 0.06 -0.81 0.07 0.00 -0.00 0.00 0.00 41.96 41.29 2ohw s TYR 119 CO 0.01 0.02 0.26 0.42 -0.00 0.00 0.00 175.55 176.26 2ohw s ILE 120 N -3.36 4.34 -0.44 -3.49 1.01 -1.26 -5.02 121.20 112.98 2ohw s ILE 120 Ca 0.24 -1.31 -0.29 0.00 0.00 0.00 0.00 60.65 59.29 2ohw s ILE 120 Cb 0.04 -3.62 0.02 0.00 0.01 0.00 0.00 42.46 38.91 2ohw s ILE 120 CO 0.06 -0.48 1.32 -1.58 0.00 0.00 0.00 174.94 174.26 2ohw s GLN 121 N 1.46 3.61 0.33 2.79 0.74 -1.26 -4.67 119.66 122.66 2ohw s GLN 121 Ca 0.03 0.79 -0.05 0.00 0.05 0.00 0.00 55.36 56.18 2ohw s GLN 121 Cb -0.23 -3.99 0.01 0.00 1.10 0.00 0.00 33.01 29.90 2ohw s GLN 121 CO 0.03 -1.52 0.50 0.16 -0.55 0.00 0.00 175.29 173.91 2ohw s ASP 122 N 3.45 0.66 0.41 6.67 -4.77 -1.26 -5.03 116.67 116.80 2ohw s ASP 122 Ca 0.56 -1.37 0.08 0.00 -3.30 0.00 0.00 52.55 48.52 2ohw s ASP 122 Cb -0.11 0.67 0.85 0.00 -1.09 0.00 0.00 42.92 43.24 2ohw s ASP 122 CO 0.32 -1.31 2.03 -2.24 0.70 0.00 0.00 175.17 174.67 2ohw h ASP 123 N 2.13 0.41 -0.61 2.11 2.03 -2.00 -2.24 116.42 118.24 2ohw h ASP 123 Ca -0.29 -0.03 -0.06 0.00 -0.73 0.00 0.00 57.03 55.92 2ohw h ASP 123 Cb 1.24 -0.10 -0.02 0.00 -0.83 0.00 0.00 39.33 39.62 2ohw h ASP 123 CO 0.39 0.35 0.13 0.40 -1.03 0.00 0.00 179.24 179.47 2ohw h ILE 124 N 0.46 1.26 -0.12 4.15 2.04 -1.97 -1.80 117.51 121.54 2ohw h ILE 124 Ca 0.12 -0.95 0.03 0.00 1.00 0.00 0.00 64.86 65.06 2ohw h ILE 124 Cb 0.04 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 2ohw h ILE 124 CO -0.02 0.35 -0.07 0.22 0.00 0.00 0.00 178.15 178.64 2ohw h TYR 125 N 0.90 -0.17 -0.33 1.37 3.20 -1.69 -0.09 116.97 120.17 2ohw h TYR 125 Ca 0.19 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 2ohw h TYR 125 Cb 0.38 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 2ohw h TYR 125 CO 0.03 -0.11 0.08 -0.91 -1.64 0.00 0.00 178.16 175.60 2ohw h ASN 126 N -0.07 0.43 0.98 -2.11 2.35 -1.29 -1.07 115.58 114.80 2ohw h ASN 126 Ca 0.07 -0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 55.64 2ohw h ASN 126 Cb 0.17 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 2ohw h ASN 126 CO -0.16 0.44 -1.09 0.03 -1.65 0.00 0.00 177.43 175.00 2ohw h ARG 127 N 0.47 0.00 0.00 0.81 3.08 -1.02 -3.39 114.38 114.32 2ohw h ARG 127 Ca 0.11 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.07 2ohw h ARG 127 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2ohw h ARG 127 CO -0.00 0.32 -1.97 -1.13 -1.07 0.00 0.00 179.97 176.11 2ohw n SER 128 N -2.97 0.65 0.22 7.04 3.41 -0.07 -4.66 113.62 117.24 2ohw n SER 128 Ca -0.05 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.63 2ohw n SER 128 Cb 0.78 1.60 0.53 0.00 -0.26 0.00 0.00 64.21 66.85 2ohw n SER 128 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 2ohw h VAL 129 N 0.00 0.97 -0.02 -3.33 3.04 -1.40 -3.45 116.25 112.05 2ohw h VAL 129 Ca -0.14 -0.81 0.00 0.00 -1.01 0.00 0.00 66.70 64.74 2ohw h VAL 129 Cb 1.23 1.46 0.00 0.00 -2.01 0.00 0.00 31.29 31.97 2ohw h VAL 129 CO 0.01 0.22 0.00 0.18 -1.01 0.00 0.00 177.57 176.96