#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 -0.10 2.03 -2.24 -1.26 -4.89 114.28 107.82 1ozo n THR 2 Ca 0.00 -0.54 -0.13 0.00 -2.27 0.00 0.00 64.05 61.12 1ozo n THR 2 Cb 0.00 0.41 -0.04 0.00 -2.10 0.00 0.00 70.33 68.60 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 0.67 -0.33 -0.78 4.81 -2.04 0.20 114.58 117.12 1ozo h GLU 3 Ca -0.12 -0.32 0.05 0.00 -0.13 0.00 0.00 59.36 58.83 1ozo h GLU 3 Cb 0.48 -0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.78 1ozo h GLU 3 CO 0.16 0.93 -0.53 1.25 -0.73 0.00 0.00 179.01 180.08 1ozo h LEU 4 N 0.42 -1.75 -0.34 1.64 6.46 -1.98 0.18 115.31 119.94 1ozo h LEU 4 Ca 0.06 0.23 -0.16 0.00 -0.12 0.00 0.00 57.88 57.89 1ozo h LEU 4 Cb 0.76 0.71 -0.02 0.00 -0.73 0.00 0.00 40.66 41.38 1ozo h LEU 4 CO 0.06 -0.42 -0.75 -0.33 -0.62 0.00 0.00 178.44 176.37 1ozo h GLU 5 N -0.44 0.00 -0.14 1.25 5.08 -1.92 -0.73 114.58 117.68 1ozo h GLU 5 Ca 0.07 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.21 1ozo h GLU 5 Cb 0.62 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.88 1ozo h GLU 5 CO -0.55 0.75 -0.79 0.00 -1.00 0.00 0.00 179.01 177.42 1ozo h ALA 6 N 1.25 0.32 -0.49 3.43 0.00 -0.45 0.38 119.26 123.69 1ozo h ALA 6 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1ozo h ALA 6 Cb 1.42 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 1ozo h ALA 6 CO 0.10 0.69 0.33 0.00 0.00 0.00 0.00 179.25 180.37 1ozo h ALA 7 N 0.58 0.62 0.00 0.00 0.00 -0.63 -0.04 119.26 119.80 1ozo h ALA 7 Ca -0.06 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1ozo h ALA 7 Cb 1.42 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1ozo h ALA 7 CO 0.16 0.07 -0.39 0.52 0.00 0.00 0.00 179.25 179.62 1ozo h MET 8 N 0.67 0.00 -0.87 0.00 2.07 -1.08 0.07 114.93 115.79 1ozo h MET 8 Ca 0.18 0.00 0.21 0.00 -2.07 0.00 0.00 59.70 58.02 1ozo h MET 8 Cb -0.08 0.00 -0.16 0.00 -1.87 0.00 0.00 31.60 29.50 1ozo h MET 8 CO -0.04 0.39 -0.04 0.78 1.07 0.00 0.00 176.91 179.07 1ozo h GLY 9 N 1.40 0.93 1.99 8.32 0.00 0.33 0.15 103.07 116.20 1ozo h GLY 9 Ca -0.00 0.17 -0.06 0.00 0.00 0.00 0.00 47.33 47.43 1ozo h GLY 9 CO 0.05 -0.37 -0.30 -0.33 0.00 0.00 0.00 176.54 175.58 1ozo h MET 10 N 0.05 0.01 0.00 4.80 2.86 0.95 0.44 114.93 124.04 1ozo h MET 10 Ca 0.48 -0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.98 1ozo h MET 10 Cb 0.87 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.51 1ozo h MET 10 CO -0.81 0.31 -1.07 -0.84 1.06 0.00 0.00 176.91 175.56 1ozo h ILE 11 N 0.01 0.58 -0.52 -1.22 -2.65 -1.20 0.96 117.51 113.47 1ozo h ILE 11 Ca -0.00 -1.98 0.00 0.00 1.03 0.00 0.00 64.86 63.90 1ozo h ILE 11 Cb 0.54 2.12 -0.03 0.00 -2.05 0.00 0.00 36.82 37.41 1ozo h ILE 11 CO 0.04 0.33 0.32 0.40 0.03 0.00 0.00 178.15 179.27 1ozo h ILE 12 N 0.00 1.14 0.00 0.16 1.08 -0.85 -2.91 117.51 116.13 1ozo h ILE 12 Ca -0.10 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.08 1ozo h ILE 12 Cb 1.47 0.40 0.00 0.00 -3.07 0.00 0.00 36.82 35.62 1ozo h ILE 12 CO 0.05 0.14 0.00 -0.78 -0.69 0.00 0.00 178.15 176.87 1ozo h ASP 13 N 0.70 0.00 1.32 1.72 3.58 0.57 0.17 116.42 124.48 1ozo h ASP 13 Ca 0.19 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.60 1ozo h ASP 13 Cb -0.05 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 1ozo h ASP 13 CO -0.04 0.00 -0.19 0.58 -2.88 0.00 0.00 179.24 176.72 1ozo h VAL 14 N 0.00 0.38 0.00 2.25 2.07 -0.70 0.31 116.25 120.56 1ozo h VAL 14 Ca 0.00 -1.21 -0.21 0.00 0.82 0.00 0.00 66.70 66.10 1ozo h VAL 14 Cb 0.74 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 32.40 1ozo h VAL 14 CO 0.00 0.18 -1.00 0.15 0.02 0.00 0.00 177.57 176.92 1ozo h PHE 15 N 0.00 0.00 -0.10 1.57 3.57 -1.04 -3.11 116.94 117.83 1ozo h PHE 15 Ca -0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 1ozo h PHE 15 Cb 0.90 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 1ozo h PHE 15 CO 0.00 0.97 -0.08 1.03 -2.23 0.00 0.00 178.31 178.00 1ozo h SER 16 N 0.00 0.13 0.58 0.41 0.87 -0.52 -2.47 113.55 112.55 1ozo h SER 16 Ca -0.02 -0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.49 1ozo h SER 16 Cb 1.76 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.68 1ozo h SER 16 CO 0.12 0.24 -0.31 0.03 -0.53 0.00 0.00 176.83 176.38 1ozo h ARG 17 N 0.14 -0.79 0.01 2.24 -0.00 -0.91 -3.07 114.38 112.01 1ozo h ARG 17 Ca 0.03 0.05 -0.42 0.00 -0.50 0.00 0.00 59.98 59.15 1ozo h ARG 17 Cb 0.23 0.18 -0.06 0.00 0.00 0.00 0.00 29.97 30.32 1ozo h ARG 17 CO 0.01 -0.52 -2.35 0.66 0.00 0.00 0.00 179.97 177.77 1ozo n TYR 18 N -4.31 0.19 0.47 3.04 4.01 -1.14 -3.26 117.16 116.15 1ozo n TYR 18 Ca -0.10 0.07 0.05 0.00 -0.16 0.00 0.00 57.90 57.76 1ozo n TYR 18 Cb 0.33 -1.02 0.25 0.00 -0.31 0.00 0.00 39.34 38.59 1ozo n TYR 18 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1ozo n SER 19 N -3.99 0.00 0.00 7.72 3.41 -1.00 -4.88 113.62 114.89 1ozo n SER 19 Ca -0.49 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.27 1ozo n SER 19 Cb 0.90 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 1ozo n SER 19 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ozo n GLY 20 N -0.44 0.41 0.00 5.00 0.00 -1.18 -2.33 105.19 106.65 1ozo n GLY 20 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.23 0.00 -3.60 1.61 7.64 -0.96 -4.80 113.62 113.28 1ozo n SER 21 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 1ozo n SER 21 Cb 0.11 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.27 1ozo n SER 21 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1ozo s GLU 22 N 0.00 1.06 0.00 1.43 2.02 -0.98 -4.61 118.70 117.61 1ozo s GLU 22 Ca 0.00 -0.52 0.00 0.00 0.02 0.00 0.00 54.97 54.47 1ozo s GLU 22 Cb 0.00 0.47 0.00 0.00 0.10 0.00 0.00 34.13 34.70 1ozo s GLU 22 CO 0.00 -0.41 0.00 0.41 0.02 0.00 0.00 175.26 175.28 1ozo n GLY 23 N 0.02 0.73 0.00 -1.39 0.00 -1.24 -4.97 105.19 98.35 1ozo n GLY 23 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1ozo n GLY 23 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ozo n SER 24 N 0.00 0.00 0.00 1.61 2.88 -1.26 -4.79 113.62 112.06 1ozo n SER 24 Ca 0.00 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1ozo n SER 24 Cb 0.00 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 63.43 1ozo n SER 24 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1ozo n THR 25 N -0.96 0.00 -2.29 2.46 -1.04 -1.26 -4.67 114.28 106.52 1ozo n THR 25 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 1ozo n THR 25 Cb 0.01 0.00 0.07 0.00 -1.82 0.00 0.00 70.33 68.58 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 0.47 -4.33 -2.82 6.02 -1.26 -4.89 117.38 110.57 1ozo n GLN 26 Ca 0.00 -2.38 -0.19 0.00 -0.01 0.00 0.00 57.00 54.42 1ozo n GLN 26 Cb 0.00 -0.46 -0.09 0.00 1.02 0.00 0.00 30.24 30.71 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 -0.93 0.27 -0.33 5.09 -4.23 -1.26 -3.96 115.64 110.29 1ozo s THR 27 Ca 0.35 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.76 1ozo s THR 27 Cb 0.38 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.73 1ozo s THR 27 CO -0.14 0.00 0.16 -0.76 -0.54 0.00 0.00 174.62 173.34 1ozo s LEU 28 N -3.37 4.27 0.78 4.79 1.02 0.12 -4.34 118.68 121.94 1ozo s LEU 28 Ca 0.36 -0.67 -0.12 0.00 0.02 0.00 0.00 54.13 53.73 1ozo s LEU 28 Cb 0.05 -2.00 0.06 0.00 0.02 0.00 0.00 46.19 44.31 1ozo s LEU 28 CO 0.18 -0.25 1.11 0.28 0.02 0.00 0.00 176.35 177.70 1ozo s THR 29 N 1.59 2.97 0.44 5.49 -1.32 -1.26 -0.82 115.64 122.72 1ozo s THR 29 Ca 0.04 0.31 0.16 0.00 -1.21 0.00 0.00 61.69 60.99 1ozo s THR 29 Cb -0.18 -3.19 0.35 0.00 -1.51 0.00 0.00 72.50 67.97 1ozo s THR 29 CO 0.06 -0.41 1.96 0.50 -2.21 0.00 0.00 174.62 174.52 1ozo h LYS 30 N -0.96 0.36 -0.00 7.08 3.64 -1.92 0.14 116.57 124.90 1ozo h LYS 30 Ca -0.46 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1ozo h LYS 30 Cb 1.28 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1ozo h LYS 30 CO 0.62 0.24 -0.33 0.41 -2.27 0.00 0.00 179.45 178.12 1ozo n GLY 31 N -1.53 -1.19 0.12 5.01 0.00 -1.26 -3.11 105.19 103.23 1ozo n GLY 31 Ca 0.12 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.33 0.68 -0.26 1.61 2.13 -0.18 -4.28 120.64 119.01 1ozo n GLU 32 Ca 0.08 0.10 0.02 0.00 0.66 0.00 0.00 57.16 58.02 1ozo n GLU 32 Cb 0.33 -1.49 0.14 0.00 0.27 0.00 0.00 31.44 30.69 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 0.00 0.52 -0.31 4.31 6.46 -0.95 -3.29 115.31 122.05 1ozo h LEU 33 Ca -0.54 0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 57.25 1ozo h LEU 33 Cb 1.94 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 41.82 1ozo h LEU 33 CO -0.06 0.30 0.10 0.07 -0.62 0.00 0.00 178.44 178.23 1ozo h LYS 34 N 0.65 0.49 0.00 1.25 2.10 -1.72 -2.73 116.57 116.61 1ozo h LYS 34 Ca 0.36 -0.11 0.00 0.00 -2.00 0.00 0.00 60.65 58.90 1ozo h LYS 34 Cb 0.36 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.62 1ozo h LYS 34 CO -0.26 0.54 0.00 -0.39 -2.00 0.00 0.00 179.45 177.34 1ozo h VAL 35 N 0.35 0.00 0.03 0.07 -1.51 -1.77 0.14 116.25 113.56 1ozo h VAL 35 Ca 0.10 -0.27 -0.21 0.00 -1.23 0.00 0.00 66.70 65.08 1ozo h VAL 35 Cb 0.25 1.06 -0.01 0.00 -2.13 0.00 0.00 31.29 30.46 1ozo h VAL 35 CO -0.00 0.00 -0.96 0.25 -1.23 0.00 0.00 177.57 175.62 1ozo h LEU 36 N 0.00 0.27 0.09 4.19 5.85 -1.59 -3.38 115.31 120.74 1ozo h LEU 36 Ca 0.00 -0.24 -0.34 0.00 0.84 0.00 0.00 57.88 58.14 1ozo h LEU 36 Cb 0.36 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1ozo h LEU 36 CO 0.00 1.08 -1.86 0.24 -0.34 0.00 0.00 178.44 177.56 1ozo h MET 37 N 0.09 0.20 -0.69 1.25 2.86 -0.45 0.28 114.93 118.47 1ozo h MET 37 Ca -0.06 -0.34 0.20 0.00 -2.06 0.00 0.00 59.70 57.44 1ozo h MET 37 Cb 1.63 0.13 -0.03 0.00 0.06 0.00 0.00 31.60 33.39 1ozo h MET 37 CO 0.15 1.01 0.62 0.93 1.06 0.00 0.00 176.91 180.68 1ozo h GLU 38 N 0.05 0.00 0.00 1.72 5.08 -1.54 -1.34 114.58 118.55 1ozo h GLU 38 Ca -0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 1ozo h GLU 38 Cb 2.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.28 1ozo h GLU 38 CO 0.10 0.00 -0.83 1.63 -1.00 0.00 0.00 179.01 178.91 1ozo n LYS 39 N -3.87 0.45 -0.01 2.33 4.76 -1.21 -4.69 118.16 115.93 1ozo n LYS 39 Ca 0.14 0.21 0.04 0.00 -2.87 0.00 0.00 58.31 55.82 1ozo n LYS 39 Cb 0.87 -1.32 0.04 0.00 -1.84 0.00 0.00 35.03 32.78 1ozo n LYS 39 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1ozo n GLU 40 N -4.20 0.25 -2.65 1.97 -0.58 1.00 -4.56 120.64 111.88 1ozo n GLU 40 Ca -0.12 -1.02 -0.07 0.00 -0.42 0.00 0.00 57.16 55.53 1ozo n GLU 40 Cb 0.43 -1.15 0.04 0.00 -0.57 0.00 0.00 31.44 30.18 1ozo n GLU 40 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1ozo n LEU 41 N 0.43 2.29 -0.58 -4.62 4.32 -0.55 -4.96 117.00 113.33 1ozo n LEU 41 Ca 0.05 -3.58 0.46 0.00 -0.02 0.00 0.00 56.01 52.91 1ozo n LEU 41 Cb 0.21 0.28 0.76 0.00 -1.62 0.00 0.00 43.42 43.04 1ozo n LEU 41 CO 0.05 1.39 1.38 -0.65 -1.22 0.00 0.00 177.39 178.34 1ozo h PRO 42 N 2.62 0.02 0.00 3.23 0.11 -1.69 -0.41 132.00 135.88 1ozo h PRO 42 Ca -0.02 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1ozo h PRO 42 Cb 1.27 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1ozo h PRO 42 CO 0.38 0.01 0.00 0.78 -0.21 0.00 0.00 178.00 178.97 1ozo h GLY 43 N 0.02 0.00 1.09 -0.55 0.00 -1.95 -2.65 103.07 99.03 1ozo h GLY 43 Ca 0.87 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.20 1ozo h GLY 43 CO -0.19 0.00 -0.57 0.69 0.00 0.00 0.00 176.54 176.48 1ozo n PHE 44 N -3.04 0.26 1.15 5.60 3.01 -0.16 -4.03 117.46 120.25 1ozo n PHE 44 Ca 0.00 0.08 0.09 0.00 1.01 0.00 0.00 57.45 58.63 1ozo n PHE 44 Cb 0.26 -0.45 0.33 0.00 -0.01 0.00 0.00 39.48 39.61 1ozo n PHE 44 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1ozo n LEU 45 N -1.80 1.72 0.27 4.37 7.99 -1.00 -2.88 117.00 125.68 1ozo n LEU 45 Ca 0.04 -0.75 0.18 0.00 -0.01 0.00 0.00 56.01 55.47 1ozo n LEU 45 Cb 0.39 -0.13 0.87 0.00 -0.11 0.00 0.00 43.42 44.44 1ozo n LEU 45 CO 0.36 0.38 1.04 1.56 -1.51 0.00 0.00 177.39 179.21 1ozo h GLN 46 N 2.18 0.00 0.00 3.23 1.08 -1.70 -3.31 115.11 116.59 1ozo h GLN 46 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ozo h GLN 46 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1ozo h GLN 46 CO 0.00 0.00 0.00 0.45 -0.95 0.00 0.00 178.83 178.33 1ozo n SER 47 N -2.89 0.00 0.00 1.46 2.88 -1.14 -5.06 113.62 108.87 1ozo n SER 47 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1ozo n SER 47 Cb 0.17 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 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 2.54 2.40 0.00 0.46 0.00 -1.18 -4.81 105.19 104.60 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 -0.70 1.61 0.00 -1.26 -4.80 118.16 111.00 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 0.00 -2.36 -2.93 -5.58 8.00 -1.26 -2.02 116.55 110.40 1ozo n ASP 50 Ca 0.00 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 1ozo n ASP 50 Cb 0.00 -2.85 -0.02 0.00 -0.02 0.00 0.00 41.12 38.24 1ozo n ASP 50 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1ozo n LYS 51 N -0.84 -2.52 -1.19 -1.24 -0.00 -1.26 -4.95 118.16 106.17 1ozo n LYS 51 Ca 0.00 0.04 0.00 0.00 -0.00 0.00 0.00 58.31 58.35 1ozo n LYS 51 Cb 0.20 -4.55 0.00 0.00 -0.00 0.00 0.00 35.03 30.67 1ozo n LYS 51 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1ozo n ASP 52 N -1.71 0.53 0.00 -5.58 8.00 -0.85 -4.78 116.55 112.16 1ozo n ASP 52 Ca 0.02 -0.60 0.00 0.00 0.71 0.00 0.00 54.79 54.93 1ozo n ASP 52 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 1ozo n ASP 52 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ozo n ALA 53 N -3.00 0.00 -0.28 2.24 0.00 -1.26 -0.69 120.51 117.52 1ozo n ALA 53 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1ozo n ALA 53 Cb 0.00 0.00 0.24 0.00 0.00 0.00 0.00 19.45 19.69 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 0.36 0.00 0.00 2.07 -1.87 0.23 116.25 117.04 1ozo h VAL 54 Ca 0.00 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1ozo h VAL 54 Cb 0.00 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 29.91 1ozo h VAL 54 CO 0.00 0.04 -0.10 -0.78 0.02 0.00 0.00 177.57 176.75 1ozo h ASP 55 N 0.21 0.00 0.10 0.57 3.58 -1.17 -2.88 116.42 116.83 1ozo h ASP 55 Ca 0.50 0.00 -0.37 0.00 0.42 0.00 0.00 57.03 57.58 1ozo h ASP 55 Cb 0.95 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.96 1ozo h ASP 55 CO -0.63 0.10 -2.17 0.29 -2.88 0.00 0.00 179.24 173.96 1ozo n LYS 56 N -3.35 0.71 0.00 0.28 4.76 0.02 -0.42 118.16 120.17 1ozo n LYS 56 Ca -0.01 0.21 0.01 0.00 -2.87 0.00 0.00 58.31 55.65 1ozo n LYS 56 Cb 0.29 -1.64 0.04 0.00 -1.84 0.00 0.00 35.03 31.88 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 -3.34 0.00 0.00 -0.35 7.99 0.59 -0.36 117.00 121.54 1ozo n LEU 57 Ca -0.36 0.37 0.00 0.00 -0.01 0.00 0.00 56.01 56.01 1ozo n LEU 57 Cb 1.03 -0.37 0.00 0.00 -0.11 0.00 0.00 43.42 43.98 1ozo n LEU 57 CO 0.37 -0.35 0.00 -0.11 -1.51 0.00 0.00 177.39 175.79 1ozo n LEU 58 N -1.37 1.09 -0.34 2.23 0.00 -1.09 -4.72 117.00 112.81 1ozo n LEU 58 Ca 0.01 0.03 0.17 0.00 0.00 0.00 0.00 56.01 56.21 1ozo n LEU 58 Cb 0.01 -0.06 0.38 0.00 0.00 0.00 0.00 43.42 43.75 1ozo n LEU 58 CO 0.01 -0.06 1.13 0.11 0.00 0.00 0.00 177.39 178.58 1ozo h LYS 59 N 0.00 0.50 -0.25 1.96 1.79 -0.20 0.81 116.57 121.18 1ozo h LYS 59 Ca 0.00 -0.03 -0.07 0.00 -2.18 0.00 0.00 60.65 58.37 1ozo h LYS 59 Cb 0.00 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.52 1ozo h LYS 59 CO 0.00 0.33 -0.13 -0.44 -1.08 0.00 0.00 179.45 178.13 1ozo h ASP 60 N 0.52 0.40 0.03 0.86 5.19 -0.96 -2.75 116.42 119.71 1ozo h ASP 60 Ca 0.64 -0.10 -0.38 0.00 -0.62 0.00 0.00 57.03 56.57 1ozo h ASP 60 Cb 1.24 -0.11 -0.06 0.00 0.18 0.00 0.00 39.33 40.58 1ozo h ASP 60 CO -0.50 0.56 -2.37 0.00 -3.12 0.00 0.00 179.24 173.81 1ozo n LEU 61 N -4.22 2.50 0.00 1.55 -0.00 -0.62 -4.20 117.00 112.02 1ozo n LEU 61 Ca 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 56.01 55.96 1ozo n LEU 61 Cb 0.31 -0.74 0.00 0.00 -0.00 0.00 0.00 43.42 42.99 1ozo n LEU 61 CO 0.40 0.86 0.37 -0.67 -0.00 0.00 0.00 177.39 178.35 1ozo n ASP 62 N -3.23 0.00 0.09 1.45 -0.08 0.18 -1.24 116.55 113.72 1ozo n ASP 62 Ca -0.41 0.24 0.20 0.00 -1.51 0.00 0.00 54.79 53.31 1ozo n ASP 62 Cb 1.02 -0.24 0.70 0.00 2.34 0.00 0.00 41.12 44.93 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 1.97 2.13 0.00 -1.67 0.00 -1.65 0.19 119.26 120.22 1ozo h ALA 63 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ozo h ALA 63 Cb 0.01 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1ozo h ALA 63 CO 0.00 -0.78 -0.02 -0.97 0.00 0.00 0.00 179.25 177.48 1ozo h ASN 64 N 0.00 0.00 0.00 0.00 -1.24 -1.50 -3.46 115.58 109.38 1ozo h ASN 64 Ca 0.21 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.21 1ozo h ASN 64 Cb 1.31 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.36 1ozo h ASN 64 CO -0.00 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.75 1ozo n GLY 65 N 1.24 1.47 0.00 1.57 0.00 0.59 -5.09 105.19 104.97 1ozo n GLY 65 Ca 0.05 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 0.00 -0.90 1.61 2.03 -0.82 -5.03 116.55 113.44 1ozo n ASP 66 Ca 0.00 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.31 1ozo n ASP 66 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 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 -1.38 2.48 -3.62 -1.67 0.00 -1.26 -4.67 120.51 110.39 1ozo n ALA 67 Ca 0.00 -1.11 -0.26 0.00 0.00 0.00 0.00 53.44 52.06 1ozo n ALA 67 Cb 0.00 -0.43 -0.17 0.00 0.00 0.00 0.00 19.45 18.85 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 0.13 -0.27 0.00 -0.21 -1.26 -4.66 119.66 113.39 1ozo s GLN 68 Ca 0.10 -0.13 -0.29 0.00 0.02 0.00 0.00 55.36 55.06 1ozo s GLN 68 Cb 0.11 -1.85 -0.02 0.00 1.00 0.00 0.00 33.01 32.26 1ozo s GLN 68 CO -0.05 -0.68 1.65 0.08 -2.12 0.00 0.00 175.29 174.17 1ozo s VAL 69 N 2.11 3.65 0.88 1.09 1.01 -0.00 -4.66 120.40 124.48 1ozo s VAL 69 Ca 0.02 0.71 -0.12 0.00 0.00 0.00 0.00 61.98 62.59 1ozo s VAL 69 Cb -0.16 -3.74 0.12 0.00 0.00 0.00 0.00 36.38 32.60 1ozo s VAL 69 CO -0.10 -0.38 1.10 -0.62 0.00 0.00 0.00 175.10 175.11 1ozo s ASP 70 N 4.74 3.69 0.39 3.32 2.15 -1.26 0.12 116.67 129.82 1ozo s ASP 70 Ca 0.73 1.26 0.06 0.00 0.43 0.00 0.00 52.55 55.02 1ozo s ASP 70 Cb -0.23 -1.93 0.78 0.00 -0.30 0.00 0.00 42.92 41.24 1ozo s ASP 70 CO 0.31 -2.47 2.02 2.19 -0.17 0.00 0.00 175.17 177.04 1ozo h PHE 71 N -1.44 0.55 0.20 -5.34 -5.15 -1.92 0.13 116.94 103.98 1ozo h PHE 71 Ca -0.50 -0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.26 1ozo h PHE 71 Cb 1.30 -0.18 0.00 0.00 0.22 0.00 0.00 35.95 37.29 1ozo h PHE 71 CO 0.39 0.39 -0.10 0.66 -2.00 0.00 0.00 178.31 177.65 1ozo h SER 72 N 0.58 -0.23 -0.30 -0.68 4.64 -1.94 0.69 113.55 116.31 1ozo h SER 72 Ca 0.15 -0.19 0.07 0.00 -0.47 0.00 0.00 61.79 61.35 1ozo h SER 72 Cb 0.01 0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.10 1ozo h SER 72 CO -0.03 0.07 -0.14 -0.33 -0.87 0.00 0.00 176.83 175.53 1ozo h GLU 73 N -0.53 -0.10 0.11 4.77 5.08 -1.83 -0.64 114.58 121.44 1ozo h GLU 73 Ca -0.03 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1ozo h GLU 73 Cb 0.40 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1ozo h GLU 73 CO 0.04 -0.06 -0.14 0.35 -1.00 0.00 0.00 179.01 178.21 1ozo h PHE 74 N -0.10 -0.38 -0.78 4.33 3.57 -0.96 -2.42 116.94 120.20 1ozo h PHE 74 Ca 0.16 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.71 1ozo h PHE 74 Cb 0.34 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 1ozo h PHE 74 CO -0.34 -0.17 0.51 0.97 -2.23 0.00 0.00 178.31 177.04 1ozo h ILE 75 N -0.25 1.07 0.14 1.41 6.09 -0.46 0.45 117.51 125.96 1ozo h ILE 75 Ca -0.01 -0.30 -0.01 0.00 -1.37 0.00 0.00 64.86 63.17 1ozo h ILE 75 Cb 0.22 0.11 0.00 0.00 0.47 0.00 0.00 36.82 37.62 1ozo h ILE 75 CO -0.03 0.16 -0.07 0.58 -3.07 0.00 0.00 178.15 175.72 1ozo h VAL 76 N 0.88 0.87 0.00 2.19 2.07 -1.18 -2.08 116.25 119.00 1ozo h VAL 76 Ca 0.33 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.83 1ozo h VAL 76 Cb 0.16 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1ozo h VAL 76 CO -0.11 0.00 0.00 -0.26 0.02 0.00 0.00 177.57 177.23 1ozo h PHE 77 N -0.20 0.00 -0.27 1.57 -1.00 -0.75 -2.77 116.94 113.53 1ozo h PHE 77 Ca -0.02 0.00 0.02 0.00 2.81 0.00 0.00 57.97 60.79 1ozo h PHE 77 Cb 0.15 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.69 1ozo h PHE 77 CO -0.07 0.00 0.11 0.28 -1.61 0.00 0.00 178.31 177.02 1ozo h VAL 78 N 0.00 0.95 0.00 -0.55 2.07 -0.00 0.28 116.25 119.00 1ozo h VAL 78 Ca 0.00 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1ozo h VAL 78 Cb 0.86 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1ozo h VAL 78 CO 0.00 0.04 0.00 0.00 0.02 0.00 0.00 177.57 177.63 1ozo n ALA 79 N -2.26 1.13 0.08 1.67 0.00 -0.80 -0.55 120.51 119.79 1ozo n ALA 79 Ca -0.01 0.17 0.03 0.00 0.00 0.00 0.00 53.44 53.62 1ozo n ALA 79 Cb 0.08 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 1ozo n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ozo h ALA 80 N 2.04 0.65 -0.18 0.00 0.00 -0.69 -3.30 119.26 117.78 1ozo h ALA 80 Ca 0.00 -0.57 -0.16 0.00 0.00 0.00 0.00 54.91 54.18 1ozo h ALA 80 Cb 0.06 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ozo h ALA 80 CO 0.00 0.66 -0.50 0.82 0.00 0.00 0.00 179.25 180.23 1ozo h ILE 81 N 0.00 1.32 -0.84 0.00 1.08 0.20 0.85 117.51 120.12 1ozo h ILE 81 Ca -0.09 -1.73 0.10 0.00 -0.39 0.00 0.00 64.86 62.74 1ozo h ILE 81 Cb 1.41 1.92 -0.07 0.00 -3.07 0.00 0.00 36.82 37.01 1ozo h ILE 81 CO 0.04 0.54 0.49 0.00 -0.69 0.00 0.00 178.15 178.53 1ozo h THR 82 N 0.35 0.91 0.00 -0.27 1.03 -1.60 -1.25 112.91 112.07 1ozo h THR 82 Ca -0.01 -0.28 -0.01 0.00 -0.01 0.00 0.00 66.41 66.10 1ozo h THR 82 Cb 1.11 0.02 -0.00 0.00 -1.07 0.00 0.00 68.15 68.21 1ozo h THR 82 CO 0.11 0.15 -0.07 0.77 -0.01 0.00 0.00 175.52 176.47 1ozo h SER 83 N 0.81 0.00 0.78 0.00 4.64 -1.46 -1.51 113.55 116.81 1ozo h SER 83 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1ozo h SER 83 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1ozo h SER 83 CO -0.25 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 175.77 1ozo n ALA 84 N -2.20 1.93 -0.14 5.18 0.00 0.23 -0.76 120.51 124.75 1ozo n ALA 84 Ca -0.02 -0.04 -0.12 0.00 0.00 0.00 0.00 53.44 53.26 1ozo n ALA 84 Cb 0.21 -1.35 -0.01 0.00 0.00 0.00 0.00 19.45 18.30 1ozo n ALA 84 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ozo h SER 85 N 0.00 1.01 0.07 0.00 4.64 -1.16 -3.42 113.55 114.69 1ozo h SER 85 Ca 0.00 -0.42 -0.37 0.00 -0.47 0.00 0.00 61.79 60.53 1ozo h SER 85 Cb 0.39 -0.28 -0.06 0.00 -0.31 0.00 0.00 62.40 62.14 1ozo h SER 85 CO 0.00 1.22 -2.30 0.00 -0.87 0.00 0.00 176.83 174.87 1ozo n HIS 86 N -4.10 0.25 -1.48 4.77 1.44 0.06 -4.99 115.22 111.17 1ozo n HIS 86 Ca -0.01 0.07 0.00 0.00 -2.01 0.00 0.00 57.72 55.77 1ozo n HIS 86 Cb 0.49 -1.04 0.00 0.00 0.12 0.00 0.00 29.99 29.56 1ozo n HIS 86 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1ozo n LYS 87 N -3.05 -1.71 -3.61 -1.40 4.01 -0.10 -3.12 118.16 109.17 1ozo n LYS 87 Ca -0.36 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.15 1ozo n LYS 87 Cb 1.07 -3.62 0.05 0.00 -0.51 0.00 0.00 35.03 32.02 1ozo n LYS 87 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 1ozo n TYR 88 N -1.45 -2.01 -3.65 2.13 4.02 -1.26 -4.95 117.16 109.99 1ozo n TYR 88 Ca 0.00 0.52 -0.07 0.00 -0.01 0.00 0.00 57.90 58.34 1ozo n TYR 88 Cb 0.20 -3.52 -0.07 0.00 -0.02 0.00 0.00 39.34 35.92 1ozo n TYR 88 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 176.86 175.26 1ozo s PHE 89 N -3.43 -1.04 0.00 -0.72 -0.12 -1.18 -3.40 117.98 108.09 1ozo s PHE 89 Ca 0.46 2.03 0.00 0.00 -0.05 0.00 0.00 56.93 59.37 1ozo s PHE 89 Cb -0.15 0.60 0.00 0.00 -0.63 0.00 0.00 43.02 42.84 1ozo s PHE 89 CO 0.84 -0.52 0.00 -1.91 -0.05 0.00 0.00 175.22 173.58 1ozo n GLU 90 N 4.51 0.00 -0.08 1.99 2.13 -1.26 -3.95 120.64 123.98 1ozo n GLU 90 Ca -0.19 0.00 0.25 0.00 0.66 0.00 0.00 57.16 57.88 1ozo n GLU 90 Cb 0.57 0.00 0.61 0.00 0.27 0.00 0.00 31.44 32.88 1ozo n GLU 90 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1ozo h LYS 91 N 0.00 0.00 0.00 5.31 6.56 -1.94 -3.41 116.57 123.09 1ozo h LYS 91 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1ozo h LYS 91 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1ozo h LYS 91 CO 0.00 0.00 0.00 2.41 -2.06 0.00 0.00 179.45 179.80 1ozo n THR 92 N -3.49 0.00 0.67 -0.16 -1.04 -1.25 -4.96 114.28 104.05 1ozo n THR 92 Ca 0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 1ozo n THR 92 Cb 1.09 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.60 1ozo n THR 92 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ozo n GLY 93 N -1.16 1.31 0.00 3.41 0.00 -1.22 -1.30 105.19 106.24 1ozo n GLY 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ozo n GLY 93 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ozo n LEU 94 N 0.63 0.00 0.00 0.99 7.94 -1.26 -4.51 117.00 120.78 1ozo n LEU 94 Ca 0.00 -0.19 0.00 0.00 -1.11 0.00 0.00 56.01 54.71 1ozo n LEU 94 Cb 0.32 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.27 1ozo n LEU 94 CO 0.00 0.00 0.05 2.29 -1.11 0.00 0.00 177.39 178.62