#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 0.18 1.12 -2.24 -1.26 -4.88 114.28 107.20 1ozo n THR 2 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 1ozo n THR 2 Cb 0.00 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.15 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 -0.37 -0.21 -0.78 4.81 -2.05 0.31 114.58 116.28 1ozo h GLU 3 Ca 0.00 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.31 1ozo h GLU 3 Cb 0.00 0.08 -0.07 0.00 0.63 0.00 0.00 28.75 29.39 1ozo h GLU 3 CO 0.00 -0.22 -0.33 1.25 -0.73 0.00 0.00 179.01 178.98 1ozo h LEU 4 N -0.42 -1.04 -0.38 1.64 5.85 -1.99 -1.06 115.31 117.90 1ozo h LEU 4 Ca -0.04 0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 1ozo h LEU 4 Cb 0.32 0.46 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 1ozo h LEU 4 CO 0.06 -0.35 -0.34 -0.33 -0.34 0.00 0.00 178.44 177.15 1ozo h GLU 5 N -0.35 0.00 -0.22 1.25 5.08 -1.91 -1.32 114.58 117.10 1ozo h GLU 5 Ca 0.12 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.31 1ozo h GLU 5 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1ozo h GLU 5 CO -0.41 0.34 -0.51 0.00 -1.00 0.00 0.00 179.01 177.42 1ozo h ALA 6 N 1.66 0.36 -0.76 3.43 0.00 -0.17 0.22 119.26 124.00 1ozo h ALA 6 Ca -0.00 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.42 1ozo h ALA 6 Cb 1.11 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1ozo h ALA 6 CO 0.04 0.55 0.50 0.00 0.00 0.00 0.00 179.25 180.34 1ozo h ALA 7 N 0.61 0.98 -0.31 0.00 0.00 -1.11 -1.69 119.26 117.73 1ozo h ALA 7 Ca -0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1ozo h ALA 7 Cb 1.13 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1ozo h ALA 7 CO 0.11 0.36 0.01 0.52 0.00 0.00 0.00 179.25 180.25 1ozo h MET 8 N 1.01 0.48 -0.98 0.00 2.07 -1.15 -0.18 114.93 116.18 1ozo h MET 8 Ca 0.29 -0.09 0.28 0.00 -2.07 0.00 0.00 59.70 58.11 1ozo h MET 8 Cb -0.08 -0.07 -0.04 0.00 -1.87 0.00 0.00 31.60 29.53 1ozo h MET 8 CO -0.07 0.50 0.76 0.78 1.07 0.00 0.00 176.91 179.95 1ozo h GLY 9 N 0.78 0.00 1.93 8.32 0.00 0.35 0.22 103.07 114.67 1ozo h GLY 9 Ca 0.10 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.28 1ozo h GLY 9 CO 0.01 0.00 -0.77 -0.33 0.00 0.00 0.00 176.54 175.44 1ozo h MET 10 N 0.00 0.00 0.00 4.80 2.86 -0.47 0.20 114.93 122.32 1ozo h MET 10 Ca 0.46 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.93 1ozo h MET 10 Cb 1.99 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.62 1ozo h MET 10 CO -0.00 0.70 -1.46 0.44 1.06 0.00 0.00 176.91 177.65 1ozo n ILE 11 N -3.26 1.17 0.11 -1.22 -0.00 -0.47 -0.97 119.36 114.73 1ozo n ILE 11 Ca 0.00 -0.69 0.02 0.00 -0.00 0.00 0.00 62.75 62.08 1ozo n ILE 11 Cb 0.83 -0.72 0.38 0.00 -0.00 0.00 0.00 39.64 40.13 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 1.19 -0.06 7.28 2.04 -0.73 -2.58 117.51 124.64 1ozo h ILE 12 Ca -0.17 -0.82 -0.09 0.00 1.00 0.00 0.00 64.86 64.77 1ozo h ILE 12 Cb 1.59 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.89 1ozo h ILE 12 CO 0.04 0.26 -0.38 -0.78 0.00 0.00 0.00 178.15 177.29 1ozo h ASP 13 N 0.23 0.13 -0.30 1.72 3.58 -0.36 0.35 116.42 121.78 1ozo h ASP 13 Ca 0.05 -0.05 0.06 0.00 0.42 0.00 0.00 57.03 57.50 1ozo h ASP 13 Cb 0.40 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 1ozo h ASP 13 CO 0.02 0.50 0.21 0.58 -2.88 0.00 0.00 179.24 177.67 1ozo h VAL 14 N 0.11 0.93 0.00 2.25 2.07 -0.67 0.43 116.25 121.37 1ozo h VAL 14 Ca 0.01 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1ozo h VAL 14 Cb 0.72 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1ozo h VAL 14 CO 0.05 0.03 -0.12 0.33 0.02 0.00 0.00 177.57 177.88 1ozo n PHE 15 N -4.48 0.12 0.02 1.57 7.35 -0.61 -3.69 117.46 117.74 1ozo n PHE 15 Ca 0.03 0.03 0.05 0.00 -0.76 0.00 0.00 57.45 56.81 1ozo n PHE 15 Cb 0.26 -0.50 -0.10 0.00 0.35 0.00 0.00 39.48 39.49 1ozo n PHE 15 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1ozo n SER 16 N -1.60 0.47 0.21 -2.13 2.88 0.72 -2.55 113.62 111.62 1ozo n SER 16 Ca 0.06 0.20 -0.11 0.00 -1.33 0.00 0.00 58.87 57.69 1ozo n SER 16 Cb 0.35 0.92 -0.06 0.00 -0.75 0.00 0.00 64.21 64.67 1ozo n SER 16 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1ozo h ARG 17 N 0.00 -0.63 0.00 -1.46 -0.00 -0.42 -3.10 114.38 108.78 1ozo h ARG 17 Ca -0.12 0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.40 1ozo h ARG 17 Cb 1.35 0.14 0.00 0.00 0.00 0.00 0.00 29.97 31.46 1ozo h ARG 17 CO 0.02 -0.42 -0.14 1.88 0.00 0.00 0.00 179.97 181.31 1ozo h TYR 18 N -0.65 0.00 0.00 3.04 -1.99 -1.75 -3.38 116.97 112.24 1ozo h TYR 18 Ca -0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.68 1ozo h TYR 18 Cb 0.55 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.28 1ozo h TYR 18 CO -0.12 0.00 0.00 -1.13 -0.00 0.00 0.00 178.16 176.91 1ozo n SER 19 N -2.93 0.00 -0.21 3.88 3.41 -1.21 -4.87 113.62 111.70 1ozo n SER 19 Ca -0.02 -0.59 -0.03 0.00 -0.26 0.00 0.00 58.87 57.97 1ozo n SER 19 Cb 0.07 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.01 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 -0.14 0.40 0.00 5.00 0.00 -1.17 -0.81 105.19 108.47 1ozo n GLY 20 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ozo n GLY 20 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ozo n SER 21 N -0.66 0.00 -3.21 1.61 2.88 -1.06 -4.55 113.62 108.64 1ozo n SER 21 Ca -0.03 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.27 1ozo n SER 21 Cb 0.38 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.77 1ozo n SER 21 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1ozo n GLU 22 N 0.00 0.84 0.00 -1.46 4.71 -1.23 -4.67 120.64 118.83 1ozo n GLU 22 Ca 0.00 -3.33 0.05 0.00 -0.01 0.00 0.00 57.16 53.88 1ozo n GLU 22 Cb 0.00 -1.30 0.27 0.00 -1.01 0.00 0.00 31.44 29.40 1ozo n GLU 22 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ozo n GLY 23 N 1.39 -0.73 0.01 0.62 0.00 0.01 -4.86 105.19 101.64 1ozo n GLY 23 Ca 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1ozo n GLY 23 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ozo n SER 24 N -1.36 0.00 0.10 1.61 7.64 -1.26 -2.39 113.62 117.97 1ozo n SER 24 Ca 0.04 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.85 1ozo n SER 24 Cb 0.10 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.26 1ozo n SER 24 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1ozo h THR 25 N 0.00 0.00 -0.09 0.44 1.35 -1.97 -3.35 112.91 109.29 1ozo h THR 25 Ca 0.00 0.00 -0.69 0.00 -0.55 0.00 0.00 66.41 65.17 1ozo h THR 25 Cb 0.00 0.00 -0.03 0.00 -1.73 0.00 0.00 68.15 66.39 1ozo h THR 25 CO 0.00 0.00 2.90 0.00 -0.25 0.00 0.00 175.52 178.17 1ozo n GLN 26 N -3.72 2.67 -0.62 4.72 6.02 -1.00 -4.90 117.38 120.54 1ozo n GLN 26 Ca -0.05 -2.55 -0.29 0.00 -0.01 0.00 0.00 57.00 54.10 1ozo n GLN 26 Cb 0.20 -3.26 0.25 0.00 1.02 0.00 0.00 30.24 28.45 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 3.68 1.79 -1.16 5.09 -4.23 -1.26 -3.94 115.64 115.61 1ozo s THR 27 Ca 0.49 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.80 1ozo s THR 27 Cb 0.13 -2.15 -0.05 0.00 1.34 0.00 0.00 72.50 71.77 1ozo s THR 27 CO -0.04 0.00 1.91 0.18 -0.54 0.00 0.00 174.62 176.12 1ozo n LEU 28 N -5.02 4.00 -4.72 4.79 4.32 -0.01 -4.79 117.00 115.57 1ozo n LEU 28 Ca 0.06 -3.38 -0.35 0.00 -0.02 0.00 0.00 56.01 52.32 1ozo n LEU 28 Cb 0.56 -1.62 0.10 0.00 -1.62 0.00 0.00 43.42 40.84 1ozo n LEU 28 CO 0.54 -0.86 0.82 0.28 -1.22 0.00 0.00 177.39 176.95 1ozo s THR 29 N 7.70 2.13 0.48 -5.08 -1.32 -1.26 -2.75 115.64 115.54 1ozo s THR 29 Ca 0.61 0.07 0.32 0.00 -1.21 0.00 0.00 61.69 61.48 1ozo s THR 29 Cb 0.04 -2.71 0.51 0.00 -1.51 0.00 0.00 72.50 68.83 1ozo s THR 29 CO 0.10 -0.03 1.72 0.50 -2.21 0.00 0.00 174.62 174.71 1ozo h LYS 30 N -0.22 0.13 0.00 7.08 3.64 -1.92 0.70 116.57 125.97 1ozo h LYS 30 Ca -0.48 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 58.76 1ozo h LYS 30 Cb 1.31 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.08 1ozo h LYS 30 CO 0.50 0.09 -0.73 0.78 -2.27 0.00 0.00 179.45 177.81 1ozo h GLY 31 N 0.13 0.00 0.01 5.01 0.00 -1.97 -3.24 103.07 103.01 1ozo h GLY 31 Ca 0.68 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 48.01 1ozo h GLY 31 CO -0.19 0.00 -0.00 -2.09 0.00 0.00 0.00 176.54 174.26 1ozo h GLU 32 N 0.00 -0.00 -0.95 4.80 4.57 -1.28 -3.39 114.58 118.33 1ozo h GLU 32 Ca -0.03 0.00 0.21 0.00 -1.18 0.00 0.00 59.36 58.36 1ozo h GLU 32 Cb 1.49 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 30.00 1ozo h GLU 32 CO 0.07 0.82 0.62 1.25 -1.18 0.00 0.00 179.01 180.59 1ozo h LEU 33 N -0.99 0.49 -0.20 1.64 6.46 -1.14 -3.21 115.31 118.35 1ozo h LEU 33 Ca -0.00 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.81 1ozo h LEU 33 Cb 0.82 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.71 1ozo h LEU 33 CO 0.00 0.18 0.11 0.07 -0.62 0.00 0.00 178.44 178.17 1ozo h LYS 34 N 0.48 0.28 -0.37 1.25 2.10 -1.74 -3.13 116.57 115.43 1ozo h LYS 34 Ca 0.51 -0.03 -0.09 0.00 -2.00 0.00 0.00 60.65 59.04 1ozo h LYS 34 Cb 1.18 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 32.45 1ozo h LYS 34 CO -0.24 0.27 -0.13 0.28 -2.00 0.00 0.00 179.45 177.64 1ozo h VAL 35 N 0.21 1.28 -1.17 0.07 2.07 -1.82 -1.05 116.25 115.83 1ozo h VAL 35 Ca 0.07 -1.23 0.35 0.00 0.82 0.00 0.00 66.70 66.71 1ozo h VAL 35 Cb 0.08 1.30 -0.11 0.00 -1.52 0.00 0.00 31.29 31.04 1ozo h VAL 35 CO -0.01 0.41 0.75 0.25 0.02 0.00 0.00 177.57 178.99 1ozo h LEU 36 N 0.54 0.34 0.00 2.57 5.85 -1.72 -1.96 115.31 120.92 1ozo h LEU 36 Ca 0.09 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 1ozo h LEU 36 Cb 0.65 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.76 1ozo h LEU 36 CO 0.04 -0.06 -0.06 0.24 -0.34 0.00 0.00 178.44 178.27 1ozo h MET 37 N 0.23 0.00 0.00 1.25 2.86 -1.13 0.35 114.93 118.50 1ozo h MET 37 Ca 0.71 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.35 1ozo h MET 37 Cb 2.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.70 1ozo h MET 37 CO -0.36 0.02 0.00 0.39 1.06 0.00 0.00 176.91 178.01 1ozo n GLU 38 N -3.09 0.12 0.00 1.72 1.02 -0.74 -1.76 120.64 117.91 1ozo n GLU 38 Ca 0.04 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 1ozo n GLU 38 Cb 0.54 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 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 -2.00 0.00 0.00 3.49 3.00 -1.06 -4.63 118.16 116.96 1ozo n LYS 39 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1ozo n LYS 39 Cb 0.15 -0.56 0.00 0.00 0.00 0.00 0.00 35.03 34.62 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 -2.32 2.51 -1.89 1.64 1.02 0.12 -4.76 120.64 116.96 1ozo n GLU 40 Ca 0.00 -0.13 -0.10 0.00 -0.02 0.00 0.00 57.16 56.90 1ozo n GLU 40 Cb 0.26 -0.54 0.06 0.00 -0.02 0.00 0.00 31.44 31.21 1ozo n GLU 40 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1ozo n LEU 41 N -0.40 3.39 -4.67 -4.62 4.32 -1.06 -4.97 117.00 108.98 1ozo n LEU 41 Ca 0.00 -3.95 -0.39 0.00 -0.02 0.00 0.00 56.01 51.65 1ozo n LEU 41 Cb 0.03 -0.16 0.04 0.00 -1.62 0.00 0.00 43.42 41.71 1ozo n LEU 41 CO 0.00 1.59 0.76 -0.81 -1.22 0.00 0.00 177.39 177.70 1ozo n PRO 42 N -0.66 1.38 0.00 3.23 -0.04 -0.72 -2.53 135.00 135.66 1ozo n PRO 42 Ca 0.27 0.51 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 1ozo n PRO 42 Cb 0.89 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.03 1ozo n PRO 42 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ozo n GLY 43 N 1.02 2.87 0.25 0.55 0.00 -1.26 -4.77 105.19 103.84 1ozo n GLY 43 Ca 0.11 -0.73 0.17 0.00 0.00 0.00 0.00 46.02 45.57 1ozo n GLY 43 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1ozo h PHE 44 N 0.00 0.00 0.00 1.61 -1.00 -1.85 -1.23 116.94 114.47 1ozo h PHE 44 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1ozo h PHE 44 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1ozo h PHE 44 CO 0.00 0.00 0.00 1.28 -1.61 0.00 0.00 178.31 177.98 1ozo n LEU 45 N -2.67 0.00 0.31 1.54 7.99 -1.26 -2.18 117.00 120.74 1ozo n LEU 45 Ca -0.02 0.05 0.18 0.00 -0.01 0.00 0.00 56.01 56.21 1ozo n LEU 45 Cb 0.06 -0.05 1.04 0.00 -0.11 0.00 0.00 43.42 44.35 1ozo n LEU 45 CO 0.15 -0.01 1.14 0.06 -1.51 0.00 0.00 177.39 177.22 1ozo h GLN 46 N 0.00 0.00 0.00 3.23 -0.00 -1.61 -3.17 115.11 113.56 1ozo h GLN 46 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 58.65 58.28 1ozo h GLN 46 Cb 0.04 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 27.46 1ozo h GLN 46 CO 0.00 0.01 -2.32 0.43 -0.00 0.00 0.00 178.83 176.94 1ozo n SER 47 N -3.49 2.02 0.00 0.06 7.64 -0.93 -5.01 113.62 113.92 1ozo n SER 47 Ca -0.03 0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1ozo n SER 47 Cb 0.09 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 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 2.03 0.81 0.00 0.23 0.00 -1.04 -2.13 105.19 105.09 1ozo n GLY 48 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.49 1.61 2.85 -1.26 -4.74 118.16 115.13 1ozo n LYS 49 Ca 0.00 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 56.99 1ozo n LYS 49 Cb 0.00 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.31 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 6.67 0.00 -5.58 -0.08 -0.90 -4.66 116.55 111.99 1ozo n ASP 50 Ca 0.00 -3.03 0.00 0.00 -1.51 0.00 0.00 54.79 50.25 1ozo n ASP 50 Cb 0.00 -1.31 0.00 0.00 2.34 0.00 0.00 41.12 42.15 1ozo n ASP 50 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1ozo n LYS 51 N 1.47 0.00 0.06 -0.67 4.01 -1.26 -4.67 118.16 117.10 1ozo n LYS 51 Ca 0.52 0.00 0.06 0.00 -0.51 0.00 0.00 58.31 58.38 1ozo n LYS 51 Cb 0.54 -2.49 -0.05 0.00 -0.51 0.00 0.00 35.03 32.52 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 0.00 0.76 -3.27 4.39 5.75 -1.26 -4.61 116.55 118.30 1ozo n ASP 52 Ca 0.00 0.31 -0.18 0.00 -0.01 0.00 0.00 54.79 54.90 1ozo n ASP 52 Cb 0.00 0.49 -0.07 0.00 -1.03 0.00 0.00 41.12 40.51 1ozo n ASP 52 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ozo s ALA 53 N -3.18 1.60 0.00 2.12 0.00 -1.26 -4.43 121.76 116.60 1ozo s ALA 53 Ca -0.02 -1.95 0.00 0.00 0.00 0.00 0.00 51.96 49.99 1ozo s ALA 53 Cb 0.09 1.39 0.00 0.00 0.00 0.00 0.00 23.12 24.61 1ozo s ALA 53 CO 0.81 -0.70 0.00 0.28 0.00 0.00 0.00 175.76 176.15 1ozo n VAL 54 N -0.62 0.00 -0.34 0.00 0.31 -1.26 -4.02 118.33 112.40 1ozo n VAL 54 Ca 0.06 0.00 0.17 0.00 -0.01 0.00 0.00 64.34 64.56 1ozo n VAL 54 Cb 0.62 0.00 0.37 0.00 -0.91 0.00 0.00 33.84 33.92 1ozo n VAL 54 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1ozo h ASP 55 N 0.00 0.63 0.50 4.52 3.58 -1.87 -2.32 116.42 121.46 1ozo h ASP 55 Ca 0.00 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.59 1ozo h ASP 55 Cb 0.00 0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.09 1ozo h ASP 55 CO 0.00 0.10 -1.01 0.29 -2.88 0.00 0.00 179.24 175.74 1ozo n LYS 56 N -4.90 0.32 0.00 0.28 4.76 -1.26 -0.31 118.16 117.05 1ozo n LYS 56 Ca 0.26 0.01 0.12 0.00 -2.87 0.00 0.00 58.31 55.83 1ozo n LYS 56 Cb 0.72 -1.61 0.71 0.00 -1.84 0.00 0.00 35.03 33.01 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 -2.03 0.00 -0.00 -0.35 7.99 -0.91 -3.32 117.00 118.38 1ozo n LEU 57 Ca 0.02 0.00 -0.02 0.00 -0.01 0.00 0.00 56.01 55.99 1ozo n LEU 57 Cb 0.45 0.00 -0.01 0.00 -0.11 0.00 0.00 43.42 43.75 1ozo n LEU 57 CO 0.40 0.00 -0.18 -0.11 -1.51 0.00 0.00 177.39 175.99 1ozo n LEU 58 N -0.93 0.94 0.11 2.23 0.00 -0.99 -4.79 117.00 113.57 1ozo n LEU 58 Ca 0.18 0.14 0.20 0.00 0.00 0.00 0.00 56.01 56.53 1ozo n LEU 58 Cb 0.08 -0.40 0.76 0.00 0.00 0.00 0.00 43.42 43.87 1ozo n LEU 58 CO 0.14 -0.54 1.17 0.11 0.00 0.00 0.00 177.39 178.27 1ozo h LYS 59 N -0.26 0.00 -0.28 1.96 1.79 -0.77 0.63 116.57 119.64 1ozo h LYS 59 Ca 0.00 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.31 1ozo h LYS 59 Cb 0.26 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1ozo h LYS 59 CO 0.00 0.00 -0.48 -0.44 -1.08 0.00 0.00 179.45 177.45 1ozo h ASP 60 N 0.00 0.82 0.08 0.86 5.19 -1.82 -3.38 116.42 118.17 1ozo h ASP 60 Ca 0.18 -0.41 -0.37 0.00 -0.62 0.00 0.00 57.03 55.81 1ozo h ASP 60 Cb 0.93 -0.23 -0.05 0.00 0.18 0.00 0.00 39.33 40.15 1ozo h ASP 60 CO -0.00 1.16 -2.24 0.00 -3.12 0.00 0.00 179.24 175.04 1ozo n LEU 61 N -4.01 2.39 -0.07 1.55 -0.00 0.02 -4.33 117.00 112.55 1ozo n LEU 61 Ca -0.03 0.04 0.06 0.00 -0.00 0.00 0.00 56.01 56.08 1ozo n LEU 61 Cb 0.58 -0.76 0.11 0.00 -0.00 0.00 0.00 43.42 43.35 1ozo n LEU 61 CO 0.48 0.82 0.19 -0.67 -0.00 0.00 0.00 177.39 178.21 1ozo n ASP 62 N -3.27 0.03 0.17 1.45 -0.08 -0.09 -0.58 116.55 114.19 1ozo n ASP 62 Ca -0.37 0.22 0.18 0.00 -1.51 0.00 0.00 54.79 53.31 1ozo n ASP 62 Cb 1.03 -0.11 0.80 0.00 2.34 0.00 0.00 41.12 45.19 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 0.25 1.89 -0.00 -1.67 0.00 -1.76 -1.40 119.26 116.57 1ozo h ALA 63 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ozo h ALA 63 Cb 0.44 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1ozo h ALA 63 CO -0.08 -0.41 -0.33 -1.71 0.00 0.00 0.00 179.25 176.72 1ozo n ASN 64 N -3.74 0.33 0.00 0.00 4.05 0.26 -4.86 115.26 111.30 1ozo n ASN 64 Ca 0.03 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.06 1ozo n ASN 64 Cb 0.42 -0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.43 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 1.50 -1.19 2.17 8.20 0.00 -0.73 -4.89 105.19 110.25 1ozo n GLY 65 Ca 0.06 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 -2.38 -3.03 0.00 1.61 2.03 -0.61 -5.02 116.55 109.15 1ozo n ASP 66 Ca 0.00 0.76 0.00 0.00 0.52 0.00 0.00 54.79 56.07 1ozo n ASP 66 Cb 0.00 2.89 0.00 0.00 -0.72 0.00 0.00 41.12 43.29 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 -3.41 0.00 -1.67 -1.67 0.00 -1.25 -4.82 120.51 107.69 1ozo n ALA 67 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1ozo n ALA 67 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 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 1.81 -0.23 0.00 -0.21 -1.26 -4.61 119.66 115.16 1ozo s GLN 68 Ca 0.00 0.33 -0.29 0.00 0.02 0.00 0.00 55.36 55.42 1ozo s GLN 68 Cb 0.00 -4.84 -0.02 0.00 1.00 0.00 0.00 33.01 29.15 1ozo s GLN 68 CO 0.00 -4.21 1.58 0.08 -2.12 0.00 0.00 175.29 170.62 1ozo s VAL 69 N 13.77 3.74 0.83 1.09 1.01 -1.11 -4.83 120.40 134.89 1ozo s VAL 69 Ca 0.88 0.83 -0.10 0.00 0.00 0.00 0.00 61.98 63.59 1ozo s VAL 69 Cb -0.12 -3.76 0.13 0.00 0.00 0.00 0.00 36.38 32.63 1ozo s VAL 69 CO 0.06 -0.32 1.16 -0.62 0.00 0.00 0.00 175.10 175.39 1ozo s ASP 70 N 4.10 4.03 0.29 3.32 2.15 -1.26 -0.83 116.67 128.47 1ozo s ASP 70 Ca 0.70 0.32 -0.01 0.00 0.43 0.00 0.00 52.55 53.99 1ozo s ASP 70 Cb -0.24 -0.67 0.44 0.00 -0.30 0.00 0.00 42.92 42.15 1ozo s ASP 70 CO 0.29 -2.14 1.85 2.19 -0.17 0.00 0.00 175.17 177.19 1ozo h PHE 71 N -1.08 0.83 -0.18 -5.34 -0.00 -1.96 -0.76 116.94 108.45 1ozo h PHE 71 Ca -0.43 -0.07 -0.04 0.00 -0.00 0.00 0.00 57.97 57.43 1ozo h PHE 71 Cb 1.28 -0.25 -0.01 0.00 -0.00 0.00 0.00 35.95 36.98 1ozo h PHE 71 CO -0.32 0.68 -0.05 0.77 -0.00 0.00 0.00 178.31 179.39 1ozo h SER 72 N 0.79 0.35 -0.21 -0.68 0.02 -1.98 0.80 113.55 112.64 1ozo h SER 72 Ca 0.18 -0.37 0.04 0.00 -0.84 0.00 0.00 61.79 60.80 1ozo h SER 72 Cb 0.25 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.66 1ozo h SER 72 CO -0.01 0.64 -0.03 -0.33 -1.14 0.00 0.00 176.83 175.97 1ozo h GLU 73 N 0.06 0.03 0.12 3.45 5.08 -1.80 -2.61 114.58 118.91 1ozo h GLU 73 Ca 0.05 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1ozo h GLU 73 Cb 0.49 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 1ozo h GLU 73 CO 0.02 0.02 -0.11 0.35 -1.00 0.00 0.00 179.01 178.29 1ozo h PHE 74 N 0.03 -0.29 -0.97 4.33 3.57 -1.07 -3.02 116.94 119.52 1ozo h PHE 74 Ca 0.10 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.69 1ozo h PHE 74 Cb 0.14 0.11 -0.08 0.00 2.79 0.00 0.00 35.95 38.91 1ozo h PHE 74 CO -0.20 -0.14 0.61 0.97 -2.23 0.00 0.00 178.31 177.32 1ozo h ILE 75 N -0.22 0.98 -0.34 1.41 6.09 -0.80 0.33 117.51 124.97 1ozo h ILE 75 Ca -0.01 -0.35 0.03 0.00 -1.37 0.00 0.00 64.86 63.15 1ozo h ILE 75 Cb 0.19 -0.14 -0.03 0.00 0.47 0.00 0.00 36.82 37.31 1ozo h ILE 75 CO -0.01 0.19 0.15 0.58 -3.07 0.00 0.00 178.15 175.99 1ozo h VAL 76 N 1.03 0.95 0.00 2.19 2.07 -1.55 -2.59 116.25 118.35 1ozo h VAL 76 Ca 0.45 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.87 1ozo h VAL 76 Cb 0.34 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1ozo h VAL 76 CO -0.23 0.06 -0.78 -0.26 0.02 0.00 0.00 177.57 176.38 1ozo h PHE 77 N 0.31 0.00 -0.45 1.57 -1.00 -1.15 -3.14 116.94 113.09 1ozo h PHE 77 Ca 0.15 0.00 0.09 0.00 2.81 0.00 0.00 57.97 61.02 1ozo h PHE 77 Cb 0.09 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 39.57 1ozo h PHE 77 CO -0.12 0.00 -0.04 0.28 -1.61 0.00 0.00 178.31 176.82 1ozo h VAL 78 N 0.00 0.61 0.00 -0.55 2.07 -0.26 0.20 116.25 118.32 1ozo h VAL 78 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1ozo h VAL 78 Cb 0.82 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1ozo h VAL 78 CO 0.00 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.60 1ozo n ALA 79 N -2.68 1.55 0.01 1.67 0.00 -0.99 -0.92 120.51 119.15 1ozo n ALA 79 Ca 0.04 -0.04 -0.13 0.00 0.00 0.00 0.00 53.44 53.30 1ozo n ALA 79 Cb 0.24 -1.16 -0.14 0.00 0.00 0.00 0.00 19.45 18.40 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 2.41 0.55 -0.45 0.00 0.00 -0.78 -3.40 119.26 117.60 1ozo h ALA 80 Ca 0.00 -1.34 0.02 0.00 0.00 0.00 0.00 54.91 53.60 1ozo h ALA 80 Cb 0.12 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1ozo h ALA 80 CO 0.00 1.40 0.26 0.82 0.00 0.00 0.00 179.25 181.73 1ozo h ILE 81 N 0.03 1.03 0.00 0.00 1.08 0.11 0.41 117.51 120.18 1ozo h ILE 81 Ca -0.29 -0.18 0.00 0.00 -0.39 0.00 0.00 64.86 64.00 1ozo h ILE 81 Cb 2.00 0.46 0.00 0.00 -3.07 0.00 0.00 36.82 36.22 1ozo h ILE 81 CO 0.10 0.09 0.14 0.00 -0.69 0.00 0.00 178.15 177.80 1ozo h THR 82 N 0.52 0.00 0.00 -0.27 1.03 -1.72 -0.31 112.91 112.16 1ozo h THR 82 Ca 0.18 0.00 -0.27 0.00 -0.01 0.00 0.00 66.41 66.31 1ozo h THR 82 Cb 0.03 0.67 -0.05 0.00 -1.07 0.00 0.00 68.15 67.73 1ozo h THR 82 CO -0.09 0.00 -2.14 -1.20 -0.01 0.00 0.00 175.52 172.08 1ozo n SER 83 N -2.67 0.74 0.28 0.00 7.64 -0.22 -4.25 113.62 115.15 1ozo n SER 83 Ca -0.02 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.00 1ozo n SER 83 Cb 0.19 1.06 0.84 0.00 -1.01 0.00 0.00 64.21 65.29 1ozo n SER 83 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ozo h ALA 84 N 0.97 1.44 0.00 -0.43 0.00 0.90 -0.25 119.26 121.90 1ozo h ALA 84 Ca -0.40 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1ozo h ALA 84 Cb 1.89 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.67 1ozo h ALA 84 CO 0.02 0.06 0.00 0.43 0.00 0.00 0.00 179.25 179.76 1ozo n SER 85 N -3.78 0.00 -0.11 0.00 7.64 -0.24 -4.48 113.62 112.66 1ozo n SER 85 Ca -0.03 -0.43 -0.03 0.00 1.01 0.00 0.00 58.87 59.39 1ozo n SER 85 Cb 0.14 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.31 1ozo n SER 85 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ozo n HIS 86 N -0.98 -0.11 0.00 1.43 1.44 -0.11 -3.02 115.22 113.88 1ozo n HIS 86 Ca 0.10 0.31 0.00 0.00 -2.01 0.00 0.00 57.72 56.12 1ozo n HIS 86 Cb 0.04 -0.43 0.00 0.00 0.12 0.00 0.00 29.99 29.72 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 -3.48 0.00 -0.05 -1.40 4.76 -1.26 -0.06 118.16 116.67 1ozo n LYS 87 Ca 0.01 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.39 1ozo n LYS 87 Cb 0.07 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 33.11 1ozo n LYS 87 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1ozo n TYR 88 N 0.00 0.39 -0.84 2.13 4.01 -1.26 -4.94 117.16 116.65 1ozo n TYR 88 Ca 0.00 0.14 -0.01 0.00 -0.16 0.00 0.00 57.90 57.87 1ozo n TYR 88 Cb 0.00 -1.00 -0.00 0.00 -0.31 0.00 0.00 39.34 38.03 1ozo n TYR 88 CO 0.00 0.00 0.00 1.97 -0.46 0.00 0.00 176.86 178.37 1ozo n PHE 89 N -2.78 -0.76 0.28 -0.72 -1.74 0.91 -4.70 117.46 107.96 1ozo n PHE 89 Ca -0.22 0.00 0.16 0.00 -0.56 0.00 0.00 57.45 56.83 1ozo n PHE 89 Cb 1.01 -1.03 0.77 0.00 1.52 0.00 0.00 39.48 41.75 1ozo n PHE 89 CO 0.00 0.00 0.00 1.05 -0.56 0.00 0.00 176.76 177.25 1ozo h GLU 90 N 0.00 0.00 0.00 3.97 9.09 -1.95 -3.44 114.58 122.25 1ozo h GLU 90 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.39 1ozo h GLU 90 Cb 0.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.17 1ozo h GLU 90 CO 0.03 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.72 1ozo n LYS 91 N -2.63 0.00 -3.50 1.06 5.02 -1.26 -5.02 118.16 111.83 1ozo n LYS 91 Ca -0.01 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.01 1ozo n LYS 91 Cb 0.13 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.03 1ozo n LYS 91 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1ozo s THR 92 N 2.81 0.83 0.00 -0.18 -4.23 -1.26 -4.81 115.64 108.80 1ozo s THR 92 Ca 0.00 -2.91 0.00 0.00 -1.18 0.00 0.00 61.69 57.60 1ozo s THR 92 Cb 0.00 -1.57 0.00 0.00 1.34 0.00 0.00 72.50 72.27 1ozo s THR 92 CO 0.00 -1.18 0.00 0.61 -0.54 0.00 0.00 174.62 173.51 1ozo n GLY 93 N 2.76 0.69 0.00 3.99 0.00 0.69 -1.34 105.19 111.97 1ozo n GLY 93 Ca 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 0.00 0.00 0.00 0.99 -0.00 -1.26 -4.84 117.00 111.89 1ozo n LEU 94 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 56.01 55.98 1ozo n LEU 94 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1ozo n LEU 94 CO 0.00 0.12 0.00 1.17 -0.00 0.00 0.00 177.39 178.68