#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ozo n THR 2 N 0.00 0.00 0.08 2.03 -2.24 -1.26 -4.90 114.28 107.99 1ozo n THR 2 Ca 0.00 -1.06 -0.12 0.00 -2.27 0.00 0.00 64.05 60.60 1ozo n THR 2 Cb 0.00 0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 68.82 1ozo n THR 2 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1ozo h GLU 3 N 0.00 -0.30 -0.36 -0.78 4.81 -2.05 0.15 114.58 116.03 1ozo h GLU 3 Ca -0.16 0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 58.99 1ozo h GLU 3 Cb 0.69 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1ozo h GLU 3 CO 0.21 -0.20 -0.21 1.37 -0.73 0.00 0.00 179.01 179.45 1ozo h LEU 4 N -0.32 0.71 -0.45 1.64 8.10 -1.99 -2.92 115.31 120.09 1ozo h LEU 4 Ca 0.04 -0.25 -0.14 0.00 0.11 0.00 0.00 57.88 57.64 1ozo h LEU 4 Cb 0.35 -0.19 -0.02 0.00 -0.44 0.00 0.00 40.66 40.36 1ozo h LEU 4 CO -0.12 0.92 -0.67 -0.33 -4.11 0.00 0.00 178.44 174.12 1ozo h GLU 5 N 0.62 0.00 -0.19 0.17 5.08 -1.89 0.62 114.58 118.99 1ozo h GLU 5 Ca 0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1ozo h GLU 5 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 1ozo h GLU 5 CO 0.05 0.67 0.09 0.00 -1.00 0.00 0.00 179.01 178.82 1ozo h ALA 6 N 1.33 0.25 -0.08 3.43 0.00 -0.70 0.21 119.26 123.69 1ozo h ALA 6 Ca -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ozo h ALA 6 Cb 1.31 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1ozo h ALA 6 CO 0.09 -0.18 0.05 0.00 0.00 0.00 0.00 179.25 179.20 1ozo h ALA 7 N 0.94 0.11 -0.31 0.00 0.00 -1.36 -2.66 119.26 115.99 1ozo h ALA 7 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1ozo h ALA 7 Cb 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1ozo h ALA 7 CO -0.01 -0.37 0.06 0.52 0.00 0.00 0.00 179.25 179.46 1ozo h MET 8 N 0.06 0.45 -1.00 0.00 2.07 -0.87 0.11 114.93 115.75 1ozo h MET 8 Ca 0.03 -0.07 0.37 0.00 -2.07 0.00 0.00 59.70 57.96 1ozo h MET 8 Cb 0.06 -0.08 -0.16 0.00 -1.87 0.00 0.00 31.60 29.55 1ozo h MET 8 CO -0.01 0.42 0.55 0.78 1.07 0.00 0.00 176.91 179.73 1ozo h GLY 9 N 0.68 2.17 2.00 8.32 0.00 -0.24 0.15 103.07 116.16 1ozo h GLY 9 Ca 0.10 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1ozo h GLY 9 CO -0.00 -0.65 0.00 -0.33 0.00 0.00 0.00 176.54 175.56 1ozo h MET 10 N 0.17 0.00 0.00 4.80 2.86 -0.47 0.20 114.93 122.49 1ozo h MET 10 Ca 0.79 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 58.30 1ozo h MET 10 Cb 1.95 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.59 1ozo h MET 10 CO -0.69 0.00 -1.87 0.44 1.06 0.00 0.00 176.91 175.85 1ozo n ILE 11 N -2.82 0.50 0.25 -1.22 -0.00 -0.32 -1.20 119.36 114.56 1ozo n ILE 11 Ca 0.03 -0.50 0.11 0.00 -0.00 0.00 0.00 62.75 62.40 1ozo n ILE 11 Cb 0.42 -0.23 0.74 0.00 -0.00 0.00 0.00 39.64 40.57 1ozo n ILE 11 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 1ozo h ILE 12 N 0.00 0.81 -0.11 7.28 1.08 -0.85 -1.85 117.51 123.86 1ozo h ILE 12 Ca -0.20 0.00 -0.18 0.00 -0.39 0.00 0.00 64.86 64.09 1ozo h ILE 12 Cb 1.31 0.97 0.01 0.00 -3.07 0.00 0.00 36.82 36.05 1ozo h ILE 12 CO 0.01 0.00 -0.63 -0.78 -0.69 0.00 0.00 178.15 176.06 1ozo h ASP 13 N 0.00 0.74 -0.50 1.72 3.58 -0.50 0.11 116.42 121.58 1ozo h ASP 13 Ca 0.02 -0.65 -0.00 0.00 0.42 0.00 0.00 57.03 56.82 1ozo h ASP 13 Cb 0.09 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 40.89 1ozo h ASP 13 CO -0.00 1.28 0.32 -0.37 -2.88 0.00 0.00 179.24 177.58 1ozo h VAL 14 N 0.27 1.14 -0.37 2.25 -1.51 -0.99 0.40 116.25 117.44 1ozo h VAL 14 Ca -0.05 -0.30 0.02 0.00 -1.23 0.00 0.00 66.70 65.14 1ozo h VAL 14 Cb 1.28 0.41 -0.03 0.00 -2.13 0.00 0.00 31.29 30.83 1ozo h VAL 14 CO 0.13 0.14 0.21 0.15 -1.23 0.00 0.00 177.57 176.97 1ozo h PHE 15 N 0.70 0.39 0.00 5.19 3.57 -1.32 -2.39 116.94 123.08 1ozo h PHE 15 Ca 0.18 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1ozo h PHE 15 Cb -0.04 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.57 1ozo h PHE 15 CO 0.00 0.22 -0.06 0.77 -2.23 0.00 0.00 178.31 177.01 1ozo h SER 16 N 0.43 0.00 -0.12 0.41 0.02 0.15 0.24 113.55 114.67 1ozo h SER 16 Ca 0.15 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.04 1ozo h SER 16 Cb 0.02 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 1ozo h SER 16 CO -0.08 0.06 -0.16 0.03 -1.14 0.00 0.00 176.83 175.55 1ozo h ARG 17 N 0.00 0.33 0.00 3.45 2.47 -0.01 -1.31 114.38 119.30 1ozo h ARG 17 Ca -0.00 -0.18 -0.12 0.00 -1.26 0.00 0.00 59.98 58.41 1ozo h ARG 17 Cb 0.20 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.51 1ozo h ARG 17 CO 0.01 0.75 -1.91 0.66 0.56 0.00 0.00 179.97 180.03 1ozo n TYR 18 N -4.56 0.00 0.91 3.04 4.01 -0.71 -2.59 117.16 117.26 1ozo n TYR 18 Ca -0.07 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.79 1ozo n TYR 18 Cb 0.37 -0.56 0.53 0.00 -0.31 0.00 0.00 39.34 39.38 1ozo n TYR 18 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1ozo n SER 19 N -2.30 0.00 0.00 7.72 7.64 0.76 -4.78 113.62 122.66 1ozo n SER 19 Ca -0.13 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1ozo n SER 19 Cb 0.69 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 1ozo n SER 19 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ozo n GLY 20 N 0.83 0.18 0.00 0.23 0.00 -1.07 -2.29 105.19 103.08 1ozo n GLY 20 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1ozo n GLY 20 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ozo n SER 21 N -0.53 0.00 -3.59 1.61 7.64 -0.50 -4.84 113.62 113.41 1ozo n SER 21 Ca 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ozo n SER 21 Cb 0.26 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.48 1ozo n SER 21 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1ozo s GLU 22 N 0.00 0.85 0.00 1.43 1.03 -0.97 -4.71 118.70 116.33 1ozo s GLU 22 Ca 0.00 -0.54 0.00 0.00 0.03 0.00 0.00 54.97 54.46 1ozo s GLU 22 Cb 0.00 0.24 0.00 0.00 -0.80 0.00 0.00 34.13 33.57 1ozo s GLU 22 CO 0.00 -0.40 0.00 0.41 -1.33 0.00 0.00 175.26 173.94 1ozo n GLY 23 N -0.77 0.83 0.36 -3.83 0.00 -1.26 -4.90 105.19 95.63 1ozo n GLY 23 Ca -0.01 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.20 1ozo n GLY 23 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1ozo h SER 24 N 1.92 0.00 0.00 1.61 0.87 -1.82 -3.47 113.55 112.66 1ozo h SER 24 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1ozo h SER 24 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1ozo h SER 24 CO 0.00 0.00 0.00 0.41 -0.53 0.00 0.00 176.83 176.71 1ozo n THR 25 N -3.57 0.00 -2.32 2.23 -1.04 -1.26 -4.73 114.28 103.58 1ozo n THR 25 Ca 0.04 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.88 1ozo n THR 25 Cb 0.50 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.03 1ozo n THR 25 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ozo n GLN 26 N 0.00 2.97 -4.45 -2.82 6.02 -1.26 -4.80 117.38 113.05 1ozo n GLN 26 Ca 0.00 -3.98 -0.22 0.00 -0.01 0.00 0.00 57.00 52.79 1ozo n GLN 26 Cb 0.00 -2.05 -0.10 0.00 1.02 0.00 0.00 30.24 29.11 1ozo n GLN 26 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1ozo s THR 27 N -4.41 0.99 -0.35 5.09 -4.23 -1.26 -3.60 115.64 107.87 1ozo s THR 27 Ca 0.43 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.86 1ozo s THR 27 Cb 0.39 -2.68 0.03 0.00 1.34 0.00 0.00 72.50 71.58 1ozo s THR 27 CO -0.01 0.00 0.13 -0.76 -0.54 0.00 0.00 174.62 173.45 1ozo s LEU 28 N -3.49 4.41 0.74 4.79 1.02 0.74 -4.47 118.68 122.42 1ozo s LEU 28 Ca 0.34 -1.07 -0.11 0.00 0.02 0.00 0.00 54.13 53.31 1ozo s LEU 28 Cb 0.07 -1.92 0.04 0.00 0.02 0.00 0.00 46.19 44.40 1ozo s LEU 28 CO 0.15 -0.34 1.08 0.28 0.02 0.00 0.00 176.35 177.54 1ozo s THR 29 N 1.46 3.59 0.44 5.49 -1.32 -1.26 -0.52 115.64 123.52 1ozo s THR 29 Ca -0.00 0.52 0.18 0.00 -1.21 0.00 0.00 61.69 61.18 1ozo s THR 29 Cb -0.19 -3.25 0.38 0.00 -1.51 0.00 0.00 72.50 67.93 1ozo s THR 29 CO 0.04 -0.68 1.89 0.50 -2.21 0.00 0.00 174.62 174.17 1ozo h LYS 30 N -0.89 0.34 0.00 7.08 3.64 -1.94 0.11 116.57 124.91 1ozo h LYS 30 Ca -0.45 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1ozo h LYS 30 Cb 1.24 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1ozo h LYS 30 CO 0.58 0.23 -0.36 0.41 -2.27 0.00 0.00 179.45 178.04 1ozo n GLY 31 N -1.54 -1.38 0.13 5.01 0.00 -1.26 -3.82 105.19 102.33 1ozo n GLY 31 Ca 0.17 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 1ozo n GLY 31 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ozo n GLU 32 N -1.67 0.63 -0.03 1.61 2.13 -0.22 -4.24 120.64 118.85 1ozo n GLU 32 Ca 0.05 0.18 0.24 0.00 0.66 0.00 0.00 57.16 58.30 1ozo n GLU 32 Cb 0.36 -1.51 0.65 0.00 0.27 0.00 0.00 31.44 31.21 1ozo n GLU 32 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1ozo h LEU 33 N -0.32 0.00 0.01 4.31 6.46 -1.01 -3.34 115.31 121.43 1ozo h LEU 33 Ca -0.62 0.00 -0.18 0.00 -0.12 0.00 0.00 57.88 56.96 1ozo h LEU 33 Cb 1.81 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 41.75 1ozo h LEU 33 CO -0.20 0.00 -0.73 0.07 -0.62 0.00 0.00 178.44 176.96 1ozo h LYS 34 N 0.00 0.47 0.00 1.25 2.10 -1.74 -3.24 116.57 115.41 1ozo h LYS 34 Ca 0.31 -0.52 0.00 0.00 -2.00 0.00 0.00 60.65 58.44 1ozo h LYS 34 Cb 1.77 0.15 0.00 0.00 -0.90 0.00 0.00 32.23 33.25 1ozo h LYS 34 CO -0.00 1.17 0.00 0.28 -2.00 0.00 0.00 179.45 178.90 1ozo n VAL 35 N -4.12 0.57 0.12 0.07 0.31 -1.25 -0.59 118.33 113.43 1ozo n VAL 35 Ca -0.11 0.12 -0.03 0.00 -0.01 0.00 0.00 64.34 64.31 1ozo n VAL 35 Cb 0.74 -0.79 0.11 0.00 -0.91 0.00 0.00 33.84 32.98 1ozo n VAL 35 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1ozo h LEU 36 N 0.00 0.01 -0.02 7.52 5.85 -1.77 -3.40 115.31 123.51 1ozo h LEU 36 Ca 0.00 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 1ozo h LEU 36 Cb 0.39 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1ozo h LEU 36 CO 0.00 0.71 -0.24 0.24 -0.34 0.00 0.00 178.44 178.81 1ozo h MET 37 N 0.00 0.19 0.00 1.25 2.86 -0.88 0.23 114.93 118.59 1ozo h MET 37 Ca -0.01 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1ozo h MET 37 Cb 1.24 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.95 1ozo h MET 37 CO 0.09 0.89 0.07 0.39 1.06 0.00 0.00 176.91 179.41 1ozo n GLU 38 N -4.52 0.00 0.05 1.72 1.02 -1.24 -1.45 120.64 116.23 1ozo n GLU 38 Ca -0.09 0.19 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1ozo n GLU 38 Cb 0.48 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.34 1ozo n GLU 38 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1ozo n LYS 39 N -1.13 0.00 -0.02 3.49 3.00 -1.23 -4.73 118.16 117.54 1ozo n LYS 39 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.37 1ozo n LYS 39 Cb 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 35.03 34.96 1ozo n LYS 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1ozo n GLU 40 N -2.85 0.67 -3.03 1.64 -0.58 0.81 -4.74 120.64 112.57 1ozo n GLU 40 Ca 0.00 -0.14 -0.18 0.00 -0.42 0.00 0.00 57.16 56.42 1ozo n GLU 40 Cb 0.00 -1.42 -0.03 0.00 -0.57 0.00 0.00 31.44 29.42 1ozo n GLU 40 CO 0.00 0.00 0.00 1.47 -0.48 0.00 0.00 177.13 178.12 1ozo n LEU 41 N -2.20 -0.94 0.00 -4.62 -0.00 -0.53 -5.01 117.00 103.70 1ozo n LEU 41 Ca -0.07 -4.20 0.00 0.00 -0.00 0.00 0.00 56.01 51.74 1ozo n LEU 41 Cb 0.56 0.71 0.00 0.00 -0.00 0.00 0.00 43.42 44.70 1ozo n LEU 41 CO 0.37 2.05 0.30 -2.65 -0.00 0.00 0.00 177.39 177.46 1ozo n PRO 42 N 1.47 0.00 -0.04 1.47 -0.02 -1.01 -2.64 135.00 134.23 1ozo n PRO 42 Ca 0.17 0.05 0.12 0.00 -2.02 0.00 0.00 63.50 61.82 1ozo n PRO 42 Cb 0.57 -1.73 0.50 0.00 -0.02 0.00 0.00 33.50 32.82 1ozo n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ozo n GLY 43 N -0.88 -0.16 0.08 -1.23 0.00 -1.26 -3.64 105.19 98.10 1ozo n GLY 43 Ca 0.00 -0.35 0.01 0.00 0.00 0.00 0.00 46.02 45.68 1ozo n GLY 43 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ozo n PHE 44 N -0.06 0.04 0.55 1.61 3.72 -1.08 -4.77 117.46 117.47 1ozo n PHE 44 Ca 0.17 -0.34 0.11 0.00 -0.05 0.00 0.00 57.45 57.34 1ozo n PHE 44 Cb 0.26 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.77 1ozo n PHE 44 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1ozo n LEU 45 N -0.22 0.60 0.28 4.37 7.99 -1.24 -1.20 117.00 127.57 1ozo n LEU 45 Ca 0.01 -0.04 0.14 0.00 -0.01 0.00 0.00 56.01 56.11 1ozo n LEU 45 Cb 0.20 -0.08 0.81 0.00 -0.11 0.00 0.00 43.42 44.23 1ozo n LEU 45 CO 0.01 0.05 1.03 1.56 -1.51 0.00 0.00 177.39 178.53 1ozo h GLN 46 N 0.00 0.00 0.00 3.23 7.50 -1.86 -2.98 115.11 121.00 1ozo h GLN 46 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1ozo h GLN 46 Cb 0.74 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.27 1ozo h GLN 46 CO 0.00 0.08 0.00 0.45 -1.50 0.00 0.00 178.83 177.86 1ozo n SER 47 N -3.62 0.00 0.00 1.46 2.88 -1.23 -5.03 113.62 108.09 1ozo n SER 47 Ca -0.02 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1ozo n SER 47 Cb 0.19 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.16 1ozo n SER 47 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ozo n GLY 48 N 1.73 1.88 2.04 0.46 0.00 -0.34 -4.50 105.19 106.46 1ozo n GLY 48 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ozo n GLY 48 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ozo n LYS 49 N -2.00 0.00 0.00 1.61 0.00 -1.26 -4.81 118.16 111.70 1ozo n LYS 49 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1ozo n LYS 49 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 1ozo n LYS 49 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1ozo n ASP 50 N -2.73 0.00 0.00 -5.58 8.00 -1.26 -1.60 116.55 113.38 1ozo n ASP 50 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1ozo n ASP 50 Cb 0.00 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 1ozo n ASP 50 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ozo n LYS 51 N 0.15 -0.49 -1.82 -1.24 5.02 -1.26 -4.99 118.16 113.54 1ozo n LYS 51 Ca 0.00 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1ozo n LYS 51 Cb 0.00 -4.08 0.00 0.00 -0.02 0.00 0.00 35.03 30.93 1ozo n LYS 51 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1ozo n ASP 52 N -0.25 1.16 0.00 4.39 -0.08 -0.63 -4.63 116.55 116.52 1ozo n ASP 52 Ca 0.00 -0.91 0.00 0.00 -1.51 0.00 0.00 54.79 52.37 1ozo n ASP 52 Cb 0.12 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.58 1ozo n ASP 52 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ozo n ALA 53 N -3.00 0.00 -0.33 -1.67 0.00 -1.26 -1.14 120.51 113.11 1ozo n ALA 53 Ca 0.00 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.66 1ozo n ALA 53 Cb 0.00 0.00 0.44 0.00 0.00 0.00 0.00 19.45 19.89 1ozo n ALA 53 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ozo h VAL 54 N 0.00 0.31 0.00 0.00 2.07 -1.82 0.15 116.25 116.96 1ozo h VAL 54 Ca 0.00 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 1ozo h VAL 54 Cb 0.00 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.73 1ozo h VAL 54 CO 0.00 0.06 -0.18 -0.78 0.02 0.00 0.00 177.57 176.69 1ozo h ASP 55 N 0.31 0.00 0.34 0.57 3.58 -1.39 -3.18 116.42 116.65 1ozo h ASP 55 Ca 0.70 0.00 -0.32 0.00 0.42 0.00 0.00 57.03 57.83 1ozo h ASP 55 Cb 1.57 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.56 1ozo h ASP 55 CO -0.61 0.18 -1.91 0.29 -2.88 0.00 0.00 179.24 174.30 1ozo n LYS 56 N -4.03 0.65 0.00 0.28 4.76 0.37 0.19 118.16 120.38 1ozo n LYS 56 Ca -0.02 0.22 0.01 0.00 -2.87 0.00 0.00 58.31 55.65 1ozo n LYS 56 Cb 0.26 -1.72 0.07 0.00 -1.84 0.00 0.00 35.03 31.81 1ozo n LYS 56 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1ozo n LEU 57 N -2.99 0.00 -0.00 -0.35 7.99 -0.32 -1.44 117.00 119.88 1ozo n LEU 57 Ca -0.22 0.00 -0.00 0.00 -0.01 0.00 0.00 56.01 55.77 1ozo n LEU 57 Cb 1.08 0.00 -0.00 0.00 -0.11 0.00 0.00 43.42 44.39 1ozo n LEU 57 CO 0.44 0.00 -0.03 -0.11 -1.51 0.00 0.00 177.39 176.18 1ozo n LEU 58 N -0.92 0.17 -0.15 2.23 0.00 -1.11 -4.80 117.00 112.41 1ozo n LEU 58 Ca 0.02 0.02 0.28 0.00 0.00 0.00 0.00 56.01 56.33 1ozo n LEU 58 Cb 0.01 -0.22 0.72 0.00 0.00 0.00 0.00 43.42 43.93 1ozo n LEU 58 CO 0.01 -0.51 1.26 0.11 0.00 0.00 0.00 177.39 178.26 1ozo h LYS 59 N -0.04 0.00 -0.13 1.96 1.79 -0.15 0.12 116.57 120.11 1ozo h LYS 59 Ca 0.00 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.27 1ozo h LYS 59 Cb 0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 1ozo h LYS 59 CO 0.00 0.00 -0.72 -0.44 -1.08 0.00 0.00 179.45 177.21 1ozo h ASP 60 N 0.00 0.71 0.11 0.86 5.19 -1.50 -3.37 116.42 118.41 1ozo h ASP 60 Ca 0.40 -0.45 -0.35 0.00 -0.62 0.00 0.00 57.03 56.01 1ozo h ASP 60 Cb 1.70 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.99 1ozo h ASP 60 CO -0.00 1.21 -1.93 0.00 -3.12 0.00 0.00 179.24 175.39 1ozo n LEU 61 N -3.90 2.56 -0.24 1.55 -0.00 0.01 -4.33 117.00 112.66 1ozo n LEU 61 Ca -0.05 0.23 0.19 0.00 -0.00 0.00 0.00 56.01 56.37 1ozo n LEU 61 Cb 0.71 -1.10 0.30 0.00 -0.00 0.00 0.00 43.42 43.33 1ozo n LEU 61 CO 0.50 0.79 0.55 -0.67 -0.00 0.00 0.00 177.39 178.56 1ozo n ASP 62 N -3.59 0.05 0.26 1.45 -0.08 0.19 -0.52 116.55 114.32 1ozo n ASP 62 Ca -0.32 0.51 0.18 0.00 -1.51 0.00 0.00 54.79 53.64 1ozo n ASP 62 Cb 1.01 -0.25 0.89 0.00 2.34 0.00 0.00 41.12 45.11 1ozo n ASP 62 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ozo h ALA 63 N 0.55 1.54 -0.00 -1.67 0.00 -1.75 -1.63 119.26 116.29 1ozo h ALA 63 Ca 0.37 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1ozo h ALA 63 Cb 1.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1ozo h ALA 63 CO -0.12 -0.30 -0.30 -1.71 0.00 0.00 0.00 179.25 176.82 1ozo n ASN 64 N -3.34 0.55 0.00 0.00 4.05 0.32 -4.89 115.26 111.95 1ozo n ASN 64 Ca 0.00 -0.35 0.00 0.00 0.45 0.00 0.00 54.58 54.68 1ozo n ASN 64 Cb 0.34 0.06 0.00 0.00 1.23 0.00 0.00 39.78 41.41 1ozo n ASN 64 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1ozo n GLY 65 N 1.42 -1.51 2.06 8.20 0.00 -0.67 -4.87 105.19 109.83 1ozo n GLY 65 Ca 0.09 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.52 1ozo n GLY 65 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ozo n ASP 66 N -1.43 -1.17 0.00 1.61 2.03 -0.87 -5.05 116.55 111.67 1ozo n ASP 66 Ca 0.00 0.48 0.00 0.00 0.52 0.00 0.00 54.79 55.79 1ozo n ASP 66 Cb 0.00 1.25 0.00 0.00 -0.72 0.00 0.00 41.12 41.65 1ozo n ASP 66 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ozo n ALA 67 N -3.23 0.00 -1.61 -1.67 0.00 -1.26 -4.83 120.51 107.91 1ozo n ALA 67 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.07 1ozo n ALA 67 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1ozo n ALA 67 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ozo s GLN 68 N 0.00 2.27 -0.49 0.00 -0.21 -1.26 -4.65 119.66 115.33 1ozo s GLN 68 Ca 0.00 1.41 -0.23 0.00 0.02 0.00 0.00 55.36 56.56 1ozo s GLN 68 Cb 0.00 -4.54 0.03 0.00 1.00 0.00 0.00 33.01 29.50 1ozo s GLN 68 CO 0.00 -3.09 0.81 0.08 -2.12 0.00 0.00 175.29 170.98 1ozo s VAL 69 N 11.44 4.60 0.94 1.09 1.01 0.33 -4.73 120.40 135.08 1ozo s VAL 69 Ca 0.95 0.29 -0.11 0.00 0.00 0.00 0.00 61.98 63.11 1ozo s VAL 69 Cb -0.18 -4.38 0.16 0.00 0.00 0.00 0.00 36.38 31.97 1ozo s VAL 69 CO 0.27 -0.84 1.12 -0.62 0.00 0.00 0.00 175.10 175.02 1ozo s ASP 70 N 2.40 2.78 0.42 3.32 2.15 -1.26 -0.19 116.67 126.29 1ozo s ASP 70 Ca 0.28 2.01 0.12 0.00 0.43 0.00 0.00 52.55 55.40 1ozo s ASP 70 Cb -0.13 -2.50 0.98 0.00 -0.30 0.00 0.00 42.92 40.97 1ozo s ASP 70 CO 0.21 -3.16 1.99 2.19 -0.17 0.00 0.00 175.17 176.22 1ozo h PHE 71 N -1.91 0.47 0.21 -5.34 -0.00 -1.96 -0.66 116.94 107.75 1ozo h PHE 71 Ca -0.46 0.01 -0.01 0.00 -0.00 0.00 0.00 57.97 57.51 1ozo h PHE 71 Cb 1.28 -0.15 0.00 0.00 -0.00 0.00 0.00 35.95 37.07 1ozo h PHE 71 CO 0.47 0.24 -0.10 0.66 -0.00 0.00 0.00 178.31 179.58 1ozo h SER 72 N 0.46 -0.23 -0.35 -0.68 4.64 -1.93 0.18 113.55 115.63 1ozo h SER 72 Ca 0.26 -0.20 0.07 0.00 -0.47 0.00 0.00 61.79 61.45 1ozo h SER 72 Cb 0.43 0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.51 1ozo h SER 72 CO -0.07 0.08 -0.13 -0.33 -0.87 0.00 0.00 176.83 175.51 1ozo h GLU 73 N -0.57 -0.06 0.42 4.77 5.08 -1.78 -1.28 114.58 121.17 1ozo h GLU 73 Ca -0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1ozo h GLU 73 Cb 0.42 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1ozo h GLU 73 CO 0.05 -0.04 -0.27 0.35 -1.00 0.00 0.00 179.01 178.09 1ozo h PHE 74 N -0.07 -0.73 -0.57 4.33 3.57 -1.08 -2.49 116.94 119.90 1ozo h PHE 74 Ca 0.18 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.68 1ozo h PHE 74 Cb 0.33 0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 1ozo h PHE 74 CO -0.36 -0.40 0.38 0.97 -2.23 0.00 0.00 178.31 176.67 1ozo h ILE 75 N -0.65 1.14 0.24 1.41 6.09 -0.47 0.40 117.51 125.67 1ozo h ILE 75 Ca -0.06 -0.26 0.00 0.00 -1.37 0.00 0.00 64.86 63.17 1ozo h ILE 75 Cb 0.53 0.31 -0.02 0.00 0.47 0.00 0.00 36.82 38.11 1ozo h ILE 75 CO 0.05 0.14 -0.23 0.58 -3.07 0.00 0.00 178.15 175.62 1ozo h VAL 76 N 0.76 0.50 0.00 2.19 2.07 -1.29 -2.81 116.25 117.68 1ozo h VAL 76 Ca 0.21 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.73 1ozo h VAL 76 Cb -0.07 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1ozo h VAL 76 CO -0.05 0.00 0.00 -0.26 0.02 0.00 0.00 177.57 177.28 1ozo h PHE 77 N -0.50 0.00 -0.05 1.57 -1.00 -0.79 -2.81 116.94 113.36 1ozo h PHE 77 Ca -0.01 0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.80 1ozo h PHE 77 Cb 0.46 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.99 1ozo h PHE 77 CO -0.16 0.00 -0.12 0.28 -1.61 0.00 0.00 178.31 176.71 1ozo h VAL 78 N 0.00 0.69 -0.47 -0.55 2.07 -0.10 0.23 116.25 118.13 1ozo h VAL 78 Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1ozo h VAL 78 Cb 0.72 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1ozo h VAL 78 CO 0.00 0.00 0.31 0.00 0.02 0.00 0.00 177.57 177.90 1ozo h ALA 79 N 0.84 1.91 0.00 1.67 0.00 -1.34 0.79 119.26 123.13 1ozo h ALA 79 Ca 0.06 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1ozo h ALA 79 Cb 0.25 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ozo h ALA 79 CO -0.15 0.02 -0.24 0.00 0.00 0.00 0.00 179.25 178.88 1ozo h ALA 80 N 1.75 1.38 -0.06 0.00 0.00 -0.93 -2.46 119.26 118.94 1ozo h ALA 80 Ca 0.20 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1ozo h ALA 80 Cb 0.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ozo h ALA 80 CO -0.05 0.29 -0.17 0.82 0.00 0.00 0.00 179.25 180.14 1ozo h ILE 81 N 0.00 1.44 -0.80 0.00 1.08 0.19 0.36 117.51 119.78 1ozo h ILE 81 Ca -0.00 -1.56 0.03 0.00 -0.39 0.00 0.00 64.86 62.93 1ozo h ILE 81 Cb 0.49 2.32 -0.04 0.00 -3.07 0.00 0.00 36.82 36.51 1ozo h ILE 81 CO 0.03 0.44 0.53 0.00 -0.69 0.00 0.00 178.15 178.45 1ozo h THR 82 N -0.31 1.15 -0.36 -0.27 1.03 -1.51 -0.95 112.91 111.70 1ozo h THR 82 Ca -0.01 -0.35 0.03 0.00 -0.01 0.00 0.00 66.41 66.07 1ozo h THR 82 Cb 0.79 0.05 -0.03 0.00 -1.07 0.00 0.00 68.15 67.89 1ozo h THR 82 CO 0.04 0.18 0.17 0.77 -0.01 0.00 0.00 175.52 176.68 1ozo h SER 83 N 1.01 0.25 -0.98 0.00 4.64 -1.31 -3.11 113.55 114.06 1ozo h SER 83 Ca 0.31 0.02 0.06 0.00 -0.47 0.00 0.00 61.79 61.71 1ozo h SER 83 Cb 0.00 -0.03 -0.07 0.00 -0.31 0.00 0.00 62.40 62.00 1ozo h SER 83 CO -0.09 0.19 0.63 0.00 -0.87 0.00 0.00 176.83 176.69 1ozo h ALA 84 N 1.19 1.35 0.00 5.18 0.00 0.11 0.18 119.26 127.27 1ozo h ALA 84 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ozo h ALA 84 Cb 0.06 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1ozo h ALA 84 CO -0.11 0.43 0.00 0.43 0.00 0.00 0.00 179.25 180.00 1ozo n SER 85 N -4.52 0.20 0.17 0.00 7.64 -0.87 -0.85 113.62 115.39 1ozo n SER 85 Ca 0.15 0.59 0.13 0.00 1.01 0.00 0.00 58.87 60.75 1ozo n SER 85 Cb 0.17 -0.62 0.50 0.00 -1.01 0.00 0.00 64.21 63.26 1ozo n SER 85 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 1ozo h HIS 86 N 0.00 0.00 0.00 1.43 3.86 -1.03 -3.47 115.15 115.94 1ozo h HIS 86 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1ozo h HIS 86 Cb 0.01 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.48 1ozo h HIS 86 CO 0.00 0.00 0.00 1.63 0.86 0.00 0.00 177.93 180.42 1ozo n LYS 87 N -2.52 -0.31 0.32 2.45 4.76 -0.03 -4.75 118.16 118.07 1ozo n LYS 87 Ca 0.02 0.00 0.20 0.00 -2.87 0.00 0.00 58.31 55.67 1ozo n LYS 87 Cb 0.31 -1.26 1.05 0.00 -1.84 0.00 0.00 35.03 33.29 1ozo n LYS 87 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 1ozo h TYR 88 N 0.00 0.00 0.00 2.13 0.05 -1.51 -3.45 116.97 114.19 1ozo h TYR 88 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ozo h TYR 88 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1ozo h TYR 88 CO 0.00 0.01 0.00 0.34 -1.05 0.00 0.00 178.16 177.46 1ozo n PHE 89 N -3.21 0.00 -0.25 4.88 7.35 -1.26 -4.56 117.46 120.41 1ozo n PHE 89 Ca -0.02 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.72 1ozo n PHE 89 Cb 0.13 0.00 0.19 0.00 0.35 0.00 0.00 39.48 40.15 1ozo n PHE 89 CO 0.00 0.00 0.00 1.05 -0.76 0.00 0.00 176.76 177.05 1ozo h GLU 90 N 0.00 0.40 0.00 -4.13 9.09 -1.93 -3.42 114.58 114.59 1ozo h GLU 90 Ca 0.00 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.39 1ozo h GLU 90 Cb 0.00 -0.09 0.00 0.00 -1.65 0.00 0.00 28.75 27.01 1ozo h GLU 90 CO 0.00 0.26 0.00 1.17 0.05 0.00 0.00 179.01 180.49 1ozo n LYS 91 N -5.03 0.00 -3.10 1.06 0.00 -1.26 -4.15 118.16 105.68 1ozo n LYS 91 Ca 0.14 0.00 0.04 0.00 0.00 0.00 0.00 58.31 58.49 1ozo n LYS 91 Cb 0.42 -0.01 -0.00 0.00 0.00 0.00 0.00 35.03 35.44 1ozo n LYS 91 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 1ozo s THR 92 N -1.12 -0.62 -0.79 3.15 -1.32 -1.26 -1.32 115.64 112.36 1ozo s THR 92 Ca 0.00 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.71 1ozo s THR 92 Cb 0.00 -0.43 0.22 0.00 -1.51 0.00 0.00 72.50 70.78 1ozo s THR 92 CO 0.00 0.00 1.72 0.61 -2.21 0.00 0.00 174.62 174.74 1ozo n GLY 93 N 4.90 -1.37 0.10 6.08 0.00 -1.26 -3.15 105.19 110.49 1ozo n GLY 93 Ca 0.08 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.09 1ozo n GLY 93 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ozo n LEU 94 N -1.89 0.87 0.00 0.99 -0.00 -1.26 -5.10 117.00 110.61 1ozo n LEU 94 Ca 0.04 0.37 0.00 0.00 -0.00 0.00 0.00 56.01 56.43 1ozo n LEU 94 Cb 0.29 0.05 0.00 0.00 -0.00 0.00 0.00 43.42 43.76 1ozo n LEU 94 CO 0.23 0.10 0.00 1.17 -0.00 0.00 0.00 177.39 178.88