#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 0.22 1.12 -2.24 -1.26 -4.54 114.28 107.58 1ozo n THR 2 Ca 0.00 -0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.62 1ozo n THR 2 Cb 0.00 -0.93 -0.08 0.00 -2.10 0.00 0.00 70.33 67.22 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 -0.76 -0.30 -0.78 4.81 -2.05 0.34 114.58 115.84 1ozo h GLU 3 Ca -0.00 0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1ozo h GLU 3 Cb 0.00 0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 1ozo h GLU 3 CO 0.00 -0.51 0.12 1.37 -0.73 0.00 0.00 179.01 179.26 1ozo h LEU 4 N -0.79 0.16 -1.59 1.64 8.10 -2.00 -1.38 115.31 119.44 1ozo h LEU 4 Ca -0.02 0.02 -0.04 0.00 0.11 0.00 0.00 57.88 57.95 1ozo h LEU 4 Cb 0.73 -0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.94 1ozo h LEU 4 CO -0.11 0.13 -0.21 -0.33 -4.11 0.00 0.00 178.44 173.81 1ozo h GLU 5 N 0.27 0.00 0.06 0.17 5.08 -1.86 -1.71 114.58 116.59 1ozo h GLU 5 Ca 0.13 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.25 1ozo h GLU 5 Cb 0.08 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.35 1ozo h GLU 5 CO -0.11 0.21 -0.98 0.00 -1.00 0.00 0.00 179.01 177.12 1ozo h ALA 6 N 1.79 0.04 -0.17 3.43 0.00 -0.02 0.68 119.26 125.00 1ozo h ALA 6 Ca -0.00 -0.69 0.04 0.00 0.00 0.00 0.00 54.91 54.26 1ozo h ALA 6 Cb 0.39 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1ozo h ALA 6 CO 0.03 0.56 -0.10 0.00 0.00 0.00 0.00 179.25 179.75 1ozo h ALA 7 N 0.30 0.05 -0.85 0.00 0.00 -0.95 0.10 119.26 117.90 1ozo h ALA 7 Ca -0.14 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1ozo h ALA 7 Cb 1.68 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 19.65 1ozo h ALA 7 CO 0.19 -0.53 0.56 0.52 0.00 0.00 0.00 179.25 179.99 1ozo h MET 8 N -0.09 1.10 -0.82 0.00 2.07 -1.38 -0.76 114.93 115.05 1ozo h MET 8 Ca 0.10 -0.07 0.20 0.00 -2.07 0.00 0.00 59.70 57.86 1ozo h MET 8 Cb 0.23 -0.25 -0.14 0.00 -1.87 0.00 0.00 31.60 29.57 1ozo h MET 8 CO -0.23 0.73 0.07 0.78 1.07 0.00 0.00 176.91 179.33 1ozo h GLY 9 N 1.13 1.03 2.00 8.32 0.00 0.16 0.23 103.07 115.94 1ozo h GLY 9 Ca 0.32 0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.73 1ozo h GLY 9 CO -0.08 -0.33 0.00 -0.33 0.00 0.00 0.00 176.54 175.80 1ozo h MET 10 N 0.12 0.00 0.12 4.80 2.86 0.56 0.14 114.93 123.53 1ozo h MET 10 Ca 0.47 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.94 1ozo h MET 10 Cb 0.88 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.56 1ozo h MET 10 CO -0.70 0.00 -0.79 0.82 1.06 0.00 0.00 176.91 177.30 1ozo h ILE 11 N 0.00 1.49 -1.00 -1.22 2.04 -0.10 0.26 117.51 118.97 1ozo h ILE 11 Ca 0.00 -2.50 0.11 0.00 1.00 0.00 0.00 64.86 63.47 1ozo h ILE 11 Cb 0.81 3.16 -0.08 0.00 -0.74 0.00 0.00 36.82 39.97 1ozo h ILE 11 CO 0.00 0.70 0.64 0.40 0.00 0.00 0.00 178.15 179.88 1ozo h ILE 12 N -0.45 0.96 0.56 -0.67 1.08 -0.68 0.80 117.51 119.12 1ozo h ILE 12 Ca -0.15 -0.36 -0.03 0.00 -0.39 0.00 0.00 64.86 63.94 1ozo h ILE 12 Cb 1.58 -0.17 0.01 0.00 -3.07 0.00 0.00 36.82 35.17 1ozo h ILE 12 CO 0.12 0.19 -0.27 -0.78 -0.69 0.00 0.00 178.15 176.72 1ozo h ASP 13 N 1.04 -0.63 -0.64 1.72 1.82 -0.65 0.16 116.42 119.24 1ozo h ASP 13 Ca 0.48 -0.00 0.12 0.00 -0.39 0.00 0.00 57.03 57.23 1ozo h ASP 13 Cb 0.41 0.16 -0.12 0.00 0.68 0.00 0.00 39.33 40.46 1ozo h ASP 13 CO -0.24 -0.41 -0.29 0.58 -1.61 0.00 0.00 179.24 177.27 1ozo h VAL 14 N -0.81 0.20 -0.80 2.25 2.07 -0.18 0.29 116.25 119.27 1ozo h VAL 14 Ca -0.08 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.53 1ozo h VAL 14 Cb 0.60 0.20 -0.07 0.00 -1.52 0.00 0.00 31.29 30.50 1ozo h VAL 14 CO 0.13 0.00 0.45 0.15 0.02 0.00 0.00 177.57 178.32 1ozo h PHE 15 N -0.11 0.82 0.00 1.57 3.57 -0.80 0.17 116.94 122.16 1ozo h PHE 15 Ca 0.27 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1ozo h PHE 15 Cb 0.54 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.04 1ozo h PHE 15 CO -0.62 0.34 0.00 0.43 -2.23 0.00 0.00 178.31 176.22 1ozo n SER 16 N -4.76 0.00 -0.02 0.41 7.64 0.74 -0.19 113.62 117.44 1ozo n SER 16 Ca 0.13 0.08 -0.21 0.00 1.01 0.00 0.00 58.87 59.88 1ozo n SER 16 Cb 0.27 -0.31 -0.13 0.00 -1.01 0.00 0.00 64.21 63.03 1ozo n SER 16 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ozo n ARG 17 N -1.31 0.73 -0.12 1.43 1.74 0.42 -3.09 116.66 116.47 1ozo n ARG 17 Ca 0.08 0.28 -0.24 0.00 -0.77 0.00 0.00 57.85 57.20 1ozo n ARG 17 Cb 0.14 -1.69 -0.11 0.00 -1.02 0.00 0.00 32.46 29.78 1ozo n ARG 17 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1ozo n TYR 18 N -3.56 0.30 0.30 -1.55 4.01 -0.69 -3.39 117.16 112.58 1ozo n TYR 18 Ca -0.34 0.10 0.19 0.00 -0.16 0.00 0.00 57.90 57.69 1ozo n TYR 18 Cb 1.01 -1.03 0.88 0.00 -0.31 0.00 0.00 39.34 39.88 1ozo n TYR 18 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1ozo h SER 19 N -0.59 0.00 0.00 7.72 4.64 -0.81 -3.46 113.55 121.05 1ozo h SER 19 Ca -0.58 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 1ozo h SER 19 Cb 1.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.79 1ozo h SER 19 CO -0.24 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.35 1ozo n GLY 20 N -0.42 1.98 0.00 -0.77 0.00 -1.15 -1.86 105.19 102.97 1ozo n GLY 20 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 0.00 -3.96 1.61 7.64 -1.24 -4.75 113.62 112.92 1ozo n SER 21 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 1ozo n SER 21 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 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 0.34 0.00 1.43 0.41 -0.78 -4.53 118.70 115.58 1ozo s GLU 22 Ca 0.00 -0.56 0.00 0.00 -0.41 0.00 0.00 54.97 54.00 1ozo s GLU 22 Cb 0.00 0.13 0.00 0.00 -1.78 0.00 0.00 34.13 32.48 1ozo s GLU 22 CO 0.00 -0.06 0.67 0.41 -0.49 0.00 0.00 175.26 175.78 1ozo n GLY 23 N 1.58 0.84 0.00 -1.39 0.00 -1.12 -4.92 105.19 100.17 1ozo n GLY 23 Ca -0.24 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.81 113.62 112.05 1ozo n SER 24 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1ozo n SER 24 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1ozo n SER 24 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1ozo n THR 25 N 0.00 0.00 -2.08 2.46 5.66 -1.26 -4.95 114.28 114.11 1ozo n THR 25 Ca 0.00 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.59 1ozo n THR 25 Cb 0.00 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1ozo n THR 25 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ozo n GLN 26 N 0.58 3.99 -3.98 1.09 10.64 -1.26 -4.58 117.38 123.85 1ozo n GLN 26 Ca 0.00 -3.35 -0.08 0.00 -1.83 0.00 0.00 57.00 51.74 1ozo n GLN 26 Cb 0.00 -2.81 -0.09 0.00 -0.86 0.00 0.00 30.24 26.48 1ozo n GLN 26 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 1ozo s THR 27 N 0.04 0.18 -0.49 -0.39 -4.23 -1.26 -4.38 115.64 105.11 1ozo s THR 27 Ca 0.48 -1.49 -0.29 0.00 -1.18 0.00 0.00 61.69 59.22 1ozo s THR 27 Cb 0.14 -1.38 0.03 0.00 1.34 0.00 0.00 72.50 72.62 1ozo s THR 27 CO -0.05 -0.82 1.19 -0.76 -0.54 0.00 0.00 174.62 173.64 1ozo s LEU 28 N -2.82 3.60 0.76 4.79 1.02 0.51 -4.49 118.68 122.04 1ozo s LEU 28 Ca 0.05 0.46 -0.13 0.00 0.02 0.00 0.00 54.13 54.53 1ozo s LEU 28 Cb 0.06 -3.49 0.05 0.00 0.02 0.00 0.00 46.19 42.83 1ozo s LEU 28 CO -0.10 -1.32 1.14 0.28 0.02 0.00 0.00 176.35 176.37 1ozo s THR 29 N 4.69 2.73 0.35 5.49 -1.32 -1.26 -0.56 115.64 125.76 1ozo s THR 29 Ca 0.49 0.30 0.16 0.00 -1.21 0.00 0.00 61.69 61.43 1ozo s THR 29 Cb -0.08 -2.73 0.34 0.00 -1.51 0.00 0.00 72.50 68.52 1ozo s THR 29 CO 0.31 -0.25 1.64 0.50 -2.21 0.00 0.00 174.62 174.61 1ozo h LYS 30 N -0.71 0.22 0.00 7.08 3.64 -1.93 0.44 116.57 125.32 1ozo h LYS 30 Ca -0.46 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1ozo h LYS 30 Cb 1.26 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1ozo h LYS 30 CO 0.50 0.15 0.00 0.78 -2.27 0.00 0.00 179.45 178.60 1ozo h GLY 31 N 0.23 0.00 0.00 5.01 0.00 -1.94 -3.21 103.07 103.16 1ozo h GLY 31 Ca 0.77 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 48.03 1ozo h GLY 31 CO -0.66 0.00 -0.55 -2.09 0.00 0.00 0.00 176.54 173.25 1ozo h GLU 32 N 0.00 0.00 -0.80 4.80 4.57 -1.35 -3.40 114.58 118.40 1ozo h GLU 32 Ca 0.00 0.00 0.33 0.00 -1.18 0.00 0.00 59.36 58.51 1ozo h GLU 32 Cb 0.78 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 29.23 1ozo h GLU 32 CO 0.00 0.44 0.44 -0.11 -1.18 0.00 0.00 179.01 178.60 1ozo n LEU 33 N -4.60 0.27 -0.26 1.64 0.00 -0.28 -0.90 117.00 112.87 1ozo n LEU 33 Ca -0.13 1.30 0.03 0.00 0.00 0.00 0.00 56.01 57.20 1ozo n LEU 33 Cb 0.36 -0.63 0.25 0.00 0.00 0.00 0.00 43.42 43.40 1ozo n LEU 33 CO 0.14 -1.45 1.25 0.07 0.00 0.00 0.00 177.39 177.40 1ozo h LYS 34 N 0.00 0.98 0.00 1.96 2.10 -1.77 -2.81 116.57 117.04 1ozo h LYS 34 Ca 0.67 -0.06 -0.15 0.00 -2.00 0.00 0.00 60.65 59.11 1ozo h LYS 34 Cb 1.79 -0.22 -0.02 0.00 -0.90 0.00 0.00 32.23 32.88 1ozo h LYS 34 CO -0.59 0.65 -0.71 -0.39 -2.00 0.00 0.00 179.45 176.40 1ozo h VAL 35 N 1.01 1.34 -0.71 0.07 -1.51 -1.30 -2.49 116.25 112.66 1ozo h VAL 35 Ca 0.34 -2.60 -0.02 0.00 -1.23 0.00 0.00 66.70 63.19 1ozo h VAL 35 Cb 0.07 2.48 -0.03 0.00 -2.13 0.00 0.00 31.29 31.67 1ozo h VAL 35 CO -0.10 0.70 0.38 0.25 -1.23 0.00 0.00 177.57 177.57 1ozo h LEU 36 N 0.00 0.89 -0.20 4.19 5.85 -1.68 -3.38 115.31 120.98 1ozo h LEU 36 Ca -0.01 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1ozo h LEU 36 Cb 1.42 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1ozo h LEU 36 CO 0.09 0.73 0.09 0.24 -0.34 0.00 0.00 178.44 179.26 1ozo h MET 37 N 0.97 0.29 0.00 1.25 2.86 -1.17 0.68 114.93 119.82 1ozo h MET 37 Ca 0.25 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1ozo h MET 37 Cb 0.05 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1ozo h MET 37 CO -0.04 0.33 0.01 0.93 1.06 0.00 0.00 176.91 179.20 1ozo h GLU 38 N 0.19 0.00 0.00 1.72 5.08 -1.74 0.74 114.58 120.57 1ozo h GLU 38 Ca 0.07 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 1ozo h GLU 38 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1ozo h GLU 38 CO -0.01 0.00 -0.87 1.63 -1.00 0.00 0.00 179.01 178.76 1ozo n LYS 39 N -2.52 0.32 0.00 2.33 4.76 -0.94 -4.66 118.16 117.45 1ozo n LYS 39 Ca -0.02 0.13 0.07 0.00 -2.87 0.00 0.00 58.31 55.62 1ozo n LYS 39 Cb 0.06 -1.05 -0.07 0.00 -1.84 0.00 0.00 35.03 32.12 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 -3.99 2.36 -2.45 1.97 -0.58 0.19 -4.55 120.64 113.58 1ozo n GLU 40 Ca -0.13 -0.10 -0.14 0.00 -0.42 0.00 0.00 57.16 56.36 1ozo n GLU 40 Cb 0.40 -1.16 0.03 0.00 -0.57 0.00 0.00 31.44 30.14 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 -1.17 3.28 -4.32 -4.62 4.77 0.23 -5.01 117.00 110.17 1ozo n LEU 41 Ca 0.03 -4.08 -0.44 0.00 -0.03 0.00 0.00 56.01 51.50 1ozo n LEU 41 Cb 0.23 0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 1ozo n LEU 41 CO 0.27 1.68 -0.29 -2.65 -1.33 0.00 0.00 177.39 175.06 1ozo n PRO 42 N -0.56 0.00 0.00 3.23 -0.02 -1.09 -2.68 135.00 133.88 1ozo n PRO 42 Ca 0.26 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1ozo n PRO 42 Cb 0.85 -1.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.33 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 2.22 2.11 0.00 -1.23 0.00 -1.26 -4.69 105.19 102.34 1ozo n GLY 43 Ca 0.13 -0.27 0.08 0.00 0.00 0.00 0.00 46.02 45.97 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 0.00 0.00 1.95 1.61 3.72 -1.09 -3.12 117.46 120.53 1ozo n PHE 44 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1ozo n PHE 44 Cb 0.00 -0.34 0.01 0.00 -0.94 0.00 0.00 39.48 38.21 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 -1.34 0.09 -0.15 4.37 4.77 -1.25 -4.25 117.00 119.24 1ozo n LEU 45 Ca 0.07 -0.05 0.21 0.00 -0.03 0.00 0.00 56.01 56.21 1ozo n LEU 45 Cb 0.14 -0.01 0.60 0.00 -2.33 0.00 0.00 43.42 41.82 1ozo n LEU 45 CO 0.13 0.02 1.22 1.56 -1.33 0.00 0.00 177.39 178.99 1ozo h GLN 46 N 0.10 0.21 0.00 3.23 4.20 -1.93 -0.66 115.11 120.25 1ozo h GLN 46 Ca 0.00 -0.01 -0.25 0.00 0.06 0.00 0.00 58.65 58.44 1ozo h GLN 46 Cb 0.02 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.71 1ozo h GLN 46 CO 0.00 0.14 -1.97 0.43 -0.67 0.00 0.00 178.83 176.76 1ozo n SER 47 N -4.41 0.37 0.00 1.46 7.64 -1.26 -5.03 113.62 112.38 1ozo n SER 47 Ca 0.15 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.20 1ozo n SER 47 Cb 0.69 0.74 0.00 0.00 -1.01 0.00 0.00 64.21 64.63 1ozo n SER 47 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ozo n GLY 48 N 1.56 2.55 0.00 0.23 0.00 -0.26 -4.27 105.19 105.01 1ozo n GLY 48 Ca -0.20 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 0.00 0.00 1.61 2.85 -1.26 -4.93 118.16 116.43 1ozo n LYS 49 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1ozo n LYS 49 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1ozo n LYS 49 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1ozo n ASP 50 N 0.00 0.00 -1.11 -5.58 2.03 -1.26 -2.28 116.55 108.35 1ozo n ASP 50 Ca 0.00 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 1ozo n ASP 50 Cb 0.00 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.35 1ozo n ASP 50 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1ozo n LYS 51 N 0.00 -1.50 -0.02 -0.67 4.01 -1.26 -4.80 118.16 113.92 1ozo n LYS 51 Ca 0.00 0.79 -0.03 0.00 -0.51 0.00 0.00 58.31 58.56 1ozo n LYS 51 Cb 0.00 -5.01 -0.02 0.00 -0.51 0.00 0.00 35.03 29.49 1ozo n LYS 51 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 1ozo n ASP 52 N -0.59 3.70 0.00 4.39 5.75 -0.97 -4.44 116.55 124.39 1ozo n ASP 52 Ca -0.12 -0.02 0.00 0.00 -0.01 0.00 0.00 54.79 54.64 1ozo n ASP 52 Cb 0.48 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.54 1ozo n ASP 52 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ozo n ALA 53 N -2.59 1.93 -0.21 2.12 0.00 -1.21 -3.87 120.51 116.67 1ozo n ALA 53 Ca -0.07 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.54 1ozo n ALA 53 Cb 0.58 0.27 0.51 0.00 0.00 0.00 0.00 19.45 20.81 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 0.73 0.00 0.00 2.07 -1.85 0.97 116.25 118.17 1ozo h VAL 54 Ca 0.00 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1ozo h VAL 54 Cb 0.92 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1ozo h VAL 54 CO 0.00 0.08 -0.16 -0.78 0.02 0.00 0.00 177.57 176.73 1ozo h ASP 55 N 0.42 0.00 0.24 0.57 3.58 -1.78 -2.17 116.42 117.28 1ozo h ASP 55 Ca 0.43 0.00 -0.34 0.00 0.42 0.00 0.00 57.03 57.54 1ozo h ASP 55 Cb 1.03 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.02 1ozo h ASP 55 CO -0.15 0.16 -2.03 0.29 -2.88 0.00 0.00 179.24 174.63 1ozo n LYS 56 N -3.83 0.67 0.00 0.28 4.76 0.13 -0.06 118.16 120.11 1ozo n LYS 56 Ca -0.02 0.19 0.06 0.00 -2.87 0.00 0.00 58.31 55.67 1ozo n LYS 56 Cb 0.26 -1.68 0.31 0.00 -1.84 0.00 0.00 35.03 32.08 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 -3.06 0.00 0.00 -0.35 7.99 -0.02 -2.15 117.00 119.41 1ozo n LEU 57 Ca -0.27 0.28 0.00 0.00 -0.01 0.00 0.00 56.01 56.02 1ozo n LEU 57 Cb 1.07 -0.28 0.00 0.00 -0.11 0.00 0.00 43.42 44.10 1ozo n LEU 57 CO 0.42 -0.17 0.00 -0.11 -1.51 0.00 0.00 177.39 176.02 1ozo n LEU 58 N -1.28 0.32 -0.39 2.23 7.94 -0.82 -4.70 117.00 120.29 1ozo n LEU 58 Ca 0.06 0.11 0.32 0.00 -1.11 0.00 0.00 56.01 55.39 1ozo n LEU 58 Cb 0.10 -0.33 0.62 0.00 0.53 0.00 0.00 43.42 44.33 1ozo n LEU 58 CO 0.09 -0.33 1.26 0.11 -1.11 0.00 0.00 177.39 177.41 1ozo h LYS 59 N 0.00 0.18 0.03 1.96 1.79 -0.39 0.23 116.57 120.38 1ozo h LYS 59 Ca 0.00 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.48 1ozo h LYS 59 Cb 0.00 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 30.58 1ozo h LYS 59 CO 0.00 0.12 -0.16 -0.44 -1.08 0.00 0.00 179.45 177.89 1ozo h ASP 60 N 0.19 -0.47 0.09 0.86 5.19 -1.69 -3.32 116.42 117.26 1ozo h ASP 60 Ca 0.70 0.07 -0.30 0.00 -0.62 0.00 0.00 57.03 56.88 1ozo h ASP 60 Cb 2.18 0.19 -0.02 0.00 0.18 0.00 0.00 39.33 41.86 1ozo h ASP 60 CO -0.29 -0.23 -1.57 0.17 -3.12 0.00 0.00 179.24 174.20 1ozo h LEU 61 N -0.28 0.30 -0.75 1.55 -0.00 -0.91 -3.37 115.31 111.84 1ozo h LEU 61 Ca 0.04 -0.81 0.24 0.00 -0.00 0.00 0.00 57.88 57.36 1ozo h LEU 61 Cb 0.34 -0.10 -0.05 0.00 -0.00 0.00 0.00 40.66 40.85 1ozo h LEU 61 CO -0.14 1.67 0.51 -0.67 -0.00 0.00 0.00 178.44 179.81 1ozo n ASP 62 N -3.90 0.06 -0.07 0.17 -0.08 0.13 -0.38 116.55 112.48 1ozo n ASP 62 Ca -0.29 0.58 0.25 0.00 -1.51 0.00 0.00 54.79 53.82 1ozo n ASP 62 Cb 0.90 -0.28 0.71 0.00 2.34 0.00 0.00 41.12 44.79 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 0.63 2.55 -0.00 -1.67 0.00 -1.73 -0.29 119.26 118.75 1ozo h ALA 63 Ca 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1ozo h ALA 63 Cb 1.50 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1ozo h ALA 63 CO -0.14 -0.98 -0.24 -1.71 0.00 0.00 0.00 179.25 176.19 1ozo n ASN 64 N -3.94 0.57 0.00 0.00 4.05 0.49 -4.84 115.26 111.59 1ozo n ASN 64 Ca 0.14 -0.44 0.00 0.00 0.45 0.00 0.00 54.58 54.73 1ozo n ASN 64 Cb 0.87 0.02 0.00 0.00 1.23 0.00 0.00 39.78 41.90 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 1.38 0.79 0.00 8.20 0.00 -0.20 -4.94 105.19 110.42 1ozo n GLY 65 Ca 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1ozo n GLY 65 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ozo n ASP 66 N 0.00 0.00 0.00 1.61 5.75 -0.70 -4.99 116.55 118.22 1ozo n ASP 66 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1ozo n ASP 66 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1ozo n ASP 66 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ozo n ALA 67 N -1.38 0.00 -3.44 2.12 0.00 -1.26 -4.86 120.51 111.69 1ozo n ALA 67 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 1ozo n ALA 67 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 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 3.07 -0.47 0.00 -0.21 -1.26 -3.86 119.66 116.93 1ozo s GLN 68 Ca 0.00 -2.20 -0.27 0.00 0.02 0.00 0.00 55.36 52.91 1ozo s GLN 68 Cb 0.00 -4.18 -0.02 0.00 1.00 0.00 0.00 33.01 29.81 1ozo s GLN 68 CO 0.00 -1.26 1.83 0.08 -2.12 0.00 0.00 175.29 173.82 1ozo s VAL 69 N 0.63 3.43 1.04 1.09 1.01 0.27 -4.80 120.40 123.07 1ozo s VAL 69 Ca 0.12 0.36 -0.12 0.00 0.00 0.00 0.00 61.98 62.35 1ozo s VAL 69 Cb -0.19 -3.79 0.21 0.00 0.00 0.00 0.00 36.38 32.62 1ozo s VAL 69 CO -0.04 -0.64 1.08 -0.62 0.00 0.00 0.00 175.10 174.87 1ozo s ASP 70 N 7.13 2.05 0.45 3.32 2.15 -1.26 -0.36 116.67 130.14 1ozo s ASP 70 Ca 0.74 1.71 0.12 0.00 0.43 0.00 0.00 52.55 55.55 1ozo s ASP 70 Cb -0.17 -2.35 1.02 0.00 -0.30 0.00 0.00 42.92 41.12 1ozo s ASP 70 CO 0.27 -3.57 2.04 2.19 -0.17 0.00 0.00 175.17 175.94 1ozo h PHE 71 N -2.19 0.37 0.50 -5.34 -5.15 -1.96 -1.19 116.94 101.98 1ozo h PHE 71 Ca -0.54 0.01 -0.02 0.00 -0.20 0.00 0.00 57.97 57.22 1ozo h PHE 71 Cb 1.30 -0.12 0.00 0.00 0.22 0.00 0.00 35.95 37.36 1ozo h PHE 71 CO 0.37 0.21 -0.24 0.77 -2.00 0.00 0.00 178.31 177.41 1ozo h SER 72 N 0.37 -0.57 -0.26 -0.68 0.02 -1.96 0.14 113.55 110.61 1ozo h SER 72 Ca 0.18 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.16 1ozo h SER 72 Cb 0.23 0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 1ozo h SER 72 CO -0.04 -0.38 0.04 -0.33 -1.14 0.00 0.00 176.83 174.98 1ozo h GLU 73 N -0.72 0.13 0.86 3.45 5.08 -1.77 -0.84 114.58 120.77 1ozo h GLU 73 Ca -0.07 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1ozo h GLU 73 Cb 0.54 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1ozo h GLU 73 CO 0.11 0.09 -0.49 0.35 -1.00 0.00 0.00 179.01 178.07 1ozo h PHE 74 N 0.14 -1.29 -0.89 4.33 3.57 -1.18 -1.12 116.94 120.50 1ozo h PHE 74 Ca 0.12 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.64 1ozo h PHE 74 Cb 0.13 0.45 -0.05 0.00 2.79 0.00 0.00 35.95 39.26 1ozo h PHE 74 CO -0.17 -0.75 0.57 0.97 -2.23 0.00 0.00 178.31 176.71 1ozo h ILE 75 N -1.25 1.13 -0.19 1.41 6.09 -0.58 0.35 117.51 124.47 1ozo h ILE 75 Ca -0.12 -0.38 0.03 0.00 -1.37 0.00 0.00 64.86 63.02 1ozo h ILE 75 Cb 0.99 -0.07 -0.03 0.00 0.47 0.00 0.00 36.82 38.18 1ozo h ILE 75 CO 0.15 0.20 0.02 0.58 -3.07 0.00 0.00 178.15 176.03 1ozo h VAL 76 N 1.11 0.90 0.00 2.19 2.07 -1.16 -2.76 116.25 118.59 1ozo h VAL 76 Ca 0.36 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.85 1ozo h VAL 76 Cb 0.03 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1ozo h VAL 76 CO -0.13 0.02 -0.06 0.49 0.02 0.00 0.00 177.57 177.91 1ozo n PHE 77 N -5.10 0.38 -0.07 1.57 3.01 -0.43 -2.57 117.46 114.25 1ozo n PHE 77 Ca -0.03 0.11 -0.03 0.00 1.01 0.00 0.00 57.45 58.52 1ozo n PHE 77 Cb 0.09 -0.66 0.21 0.00 -0.01 0.00 0.00 39.48 39.12 1ozo n PHE 77 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1ozo h VAL 78 N 0.00 1.23 0.00 -4.37 2.07 -0.06 0.41 116.25 115.53 1ozo h VAL 78 Ca 0.00 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.60 1ozo h VAL 78 Cb 0.60 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1ozo h VAL 78 CO 0.00 0.32 0.00 0.00 0.02 0.00 0.00 177.57 177.91 1ozo n ALA 79 N -2.47 2.25 -0.09 1.67 0.00 -1.06 -2.51 120.51 118.30 1ozo n ALA 79 Ca 0.02 -0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.18 1ozo n ALA 79 Cb 0.28 -1.36 -0.13 0.00 0.00 0.00 0.00 19.45 18.24 1ozo n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ozo n ALA 80 N -1.10 1.36 -0.18 0.00 0.00 0.01 -4.36 120.51 116.24 1ozo n ALA 80 Ca 0.14 -1.05 -0.02 0.00 0.00 0.00 0.00 53.44 52.52 1ozo n ALA 80 Cb 0.11 -0.28 0.08 0.00 0.00 0.00 0.00 19.45 19.36 1ozo n ALA 80 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1ozo h ILE 81 N 0.01 0.84 -0.56 0.00 5.03 -0.13 0.15 117.51 122.84 1ozo h ILE 81 Ca -0.52 -0.15 0.10 0.00 -0.12 0.00 0.00 64.86 64.17 1ozo h ILE 81 Cb 2.02 0.37 -0.11 0.00 -3.03 0.00 0.00 36.82 36.07 1ozo h ILE 81 CO -0.02 0.08 -0.33 0.00 -0.68 0.00 0.00 178.15 177.20 1ozo h THR 82 N 0.43 0.18 0.00 -0.27 1.03 -1.73 0.14 112.91 112.69 1ozo h THR 82 Ca 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.67 1ozo h THR 82 Cb 0.28 0.18 0.00 0.00 -1.07 0.00 0.00 68.15 67.54 1ozo h THR 82 CO -0.25 0.00 0.00 -1.54 -0.01 0.00 0.00 175.52 173.72 1ozo n SER 83 N -5.43 0.00 -0.08 0.00 3.41 0.07 -0.86 113.62 110.73 1ozo n SER 83 Ca 0.04 0.22 -0.09 0.00 -0.26 0.00 0.00 58.87 58.78 1ozo n SER 83 Cb 0.35 -0.38 -0.04 0.00 -0.26 0.00 0.00 64.21 63.88 1ozo n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ozo h ALA 84 N 2.81 0.07 -0.92 7.33 0.00 0.21 -3.38 119.26 125.37 1ozo h ALA 84 Ca 0.00 -0.67 0.10 0.00 0.00 0.00 0.00 54.91 54.34 1ozo h ALA 84 Cb 0.24 0.54 -0.07 0.00 0.00 0.00 0.00 17.79 18.51 1ozo h ALA 84 CO 0.00 0.53 0.59 0.77 0.00 0.00 0.00 179.25 181.15 1ozo h SER 85 N -1.00 0.85 0.37 0.00 0.02 -0.67 -0.71 113.55 112.41 1ozo h SER 85 Ca -0.09 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1ozo h SER 85 Cb 0.70 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1ozo h SER 85 CO -0.06 0.50 0.00 0.00 -1.14 0.00 0.00 176.83 176.13 1ozo n HIS 86 N -4.54 0.00 -0.02 3.45 1.44 -0.04 -1.36 115.22 114.15 1ozo n HIS 86 Ca 0.16 0.00 -0.00 0.00 -2.01 0.00 0.00 57.72 55.87 1ozo n HIS 86 Cb 0.30 -0.49 0.29 0.00 0.12 0.00 0.00 29.99 30.21 1ozo n HIS 86 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 1ozo h LYS 87 N 0.00 0.58 -0.07 -1.40 1.79 -1.30 -3.33 116.57 112.84 1ozo h LYS 87 Ca 0.00 -0.11 0.29 0.00 -2.18 0.00 0.00 60.65 58.65 1ozo h LYS 87 Cb 0.18 -0.09 -0.21 0.00 -1.58 0.00 0.00 32.23 30.53 1ozo h LYS 87 CO 0.00 0.57 0.28 -0.47 -1.08 0.00 0.00 179.45 178.75 1ozo s TYR 88 N -5.07 -0.12 0.00 -1.35 6.14 -0.88 -4.71 117.35 111.36 1ozo s TYR 88 Ca -0.08 0.12 0.00 0.00 0.64 0.00 0.00 57.07 57.75 1ozo s TYR 88 Cb 0.16 0.04 0.00 0.00 0.42 0.00 0.00 41.96 42.58 1ozo s TYR 88 CO 0.77 -0.06 0.00 0.34 0.64 0.00 0.00 175.55 177.23 1ozo n PHE 89 N 5.49 0.00 -0.05 4.97 7.35 -0.46 -4.74 117.46 130.01 1ozo n PHE 89 Ca -0.09 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.56 1ozo n PHE 89 Cb 0.55 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 40.23 1ozo n PHE 89 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 1ozo n GLU 90 N -0.38 0.67 0.00 -4.13 0.00 -1.26 -4.82 120.64 110.72 1ozo n GLU 90 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 57.16 57.19 1ozo n GLU 90 Cb 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 31.44 29.84 1ozo n GLU 90 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 1ozo n LYS 91 N -2.72 0.85 0.00 3.44 0.00 -1.26 -5.04 118.16 113.43 1ozo n LYS 91 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.09 1ozo n LYS 91 Cb 0.98 -0.65 0.00 0.00 -0.00 0.00 0.00 35.03 35.36 1ozo n LYS 91 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1ozo n THR 92 N -1.20 0.00 -0.04 0.58 -2.24 -1.26 -4.80 114.28 105.32 1ozo n THR 92 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 1ozo n THR 92 Cb 0.15 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.37 1ozo n THR 92 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ozo n GLY 93 N 0.00 -0.39 0.21 3.38 0.00 -1.24 -0.18 105.19 106.98 1ozo n GLY 93 Ca 0.00 0.14 0.04 0.00 0.00 0.00 0.00 46.02 46.20 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 -3.50 1.22 0.00 0.99 -0.00 -1.26 -5.02 117.00 109.43 1ozo n LEU 94 Ca 0.00 -0.82 0.00 0.00 -0.00 0.00 0.00 56.01 55.19 1ozo n LEU 94 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.44 1ozo n LEU 94 CO -0.01 0.25 0.00 1.17 -0.00 0.00 0.00 177.39 178.79