#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4ota s ILE 2 N 0.00 1.16 -0.06 4.25 1.01 -1.26 -1.39 121.20 124.91 4ota s ILE 2 Ca 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.29 4ota s ILE 2 Cb 0.00 -1.16 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 4ota s ILE 2 CO 0.00 0.38 -0.13 0.00 0.00 0.00 0.00 174.94 175.19 4ota s ALA 3 N 1.65 2.71 -0.14 9.38 0.00 0.76 -4.99 121.76 131.13 4ota s ALA 3 Ca 0.05 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.06 4ota s ALA 3 Cb -0.13 -1.05 0.02 0.00 0.00 0.00 0.00 23.12 21.97 4ota s ALA 3 CO -0.09 0.51 -0.15 -1.14 0.00 0.00 0.00 175.76 174.90 4ota s GLN 4 N -0.59 2.30 -0.14 0.00 0.74 -1.26 -0.47 119.66 120.24 4ota s GLN 4 Ca 0.08 -0.57 -0.01 0.00 0.05 0.00 0.00 55.36 54.92 4ota s GLN 4 Cb -0.11 -2.08 -0.02 0.00 1.10 0.00 0.00 33.01 31.90 4ota s GLN 4 CO 0.01 -0.20 -0.10 0.42 -0.55 0.00 0.00 175.29 174.87 4ota s ILE 5 N 1.39 3.27 -0.32 -2.34 1.01 0.08 -4.97 121.20 119.31 4ota s ILE 5 Ca 0.03 -0.58 -0.12 0.00 0.00 0.00 0.00 60.65 59.98 4ota s ILE 5 Cb -0.13 -2.40 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 4ota s ILE 5 CO -0.09 0.51 0.22 -1.00 0.00 0.00 0.00 174.94 174.58 4ota s HIS 6 N 0.43 3.22 0.14 3.97 3.76 -1.26 -1.01 115.29 124.53 4ota s HIS 6 Ca -0.08 -0.13 0.06 0.00 -0.15 0.00 0.00 55.06 54.76 4ota s HIS 6 Cb -0.15 -2.44 -0.04 0.00 1.11 0.00 0.00 32.58 31.05 4ota s HIS 6 CO 0.04 -0.31 -0.13 0.96 -0.85 0.00 0.00 174.74 174.46 4ota s ILE 7 N 1.73 1.34 0.43 0.60 -4.36 -0.79 -5.00 121.20 115.14 4ota s ILE 7 Ca 0.06 -1.84 -0.23 0.00 -0.26 0.00 0.00 60.65 58.38 4ota s ILE 7 Cb -0.17 -1.64 -0.08 0.00 1.25 0.00 0.00 42.46 41.81 4ota s ILE 7 CO 0.10 -0.50 1.10 -0.76 0.24 0.00 0.00 174.94 175.12 4ota s LEU 8 N -2.69 4.07 0.77 0.37 1.43 -1.26 -0.96 118.68 120.41 4ota s LEU 8 Ca 0.12 2.16 -0.13 0.00 -1.03 0.00 0.00 54.13 55.24 4ota s LEU 8 Cb -0.03 -4.23 0.06 0.00 0.03 0.00 0.00 46.19 42.02 4ota s LEU 8 CO 0.03 -0.70 1.16 -1.83 0.23 0.00 0.00 176.35 175.23 4ota s GLU 9 N -2.63 2.02 0.00 1.70 -1.05 -0.40 -4.44 118.70 113.90 4ota s GLU 9 Ca 0.61 1.55 0.00 0.00 -0.15 0.00 0.00 54.97 56.97 4ota s GLU 9 Cb -0.25 -1.84 0.00 0.00 -0.44 0.00 0.00 34.13 31.60 4ota s GLU 9 CO 0.30 -1.88 0.00 0.41 0.95 0.00 0.00 175.26 175.04 4ota n GLY 10 N -0.08 1.24 3.88 -3.83 0.00 -1.26 -4.94 105.19 100.19 4ota n GLY 10 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 4ota n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 4ota s ARG 11 N 0.00 3.75 0.69 1.61 3.00 -1.26 -5.07 118.95 121.68 4ota s ARG 11 Ca 0.00 0.40 -0.10 0.00 0.00 0.00 0.00 55.73 56.04 4ota s ARG 11 Cb 0.00 -2.42 0.03 0.00 0.00 0.00 0.00 34.95 32.55 4ota s ARG 11 CO 0.00 -0.01 1.05 -1.54 0.00 0.00 0.00 175.30 174.80 4ota s SER 12 N -3.18 5.27 0.34 0.23 1.04 -1.26 -4.93 113.70 111.21 4ota s SER 12 Ca 0.50 0.90 0.02 0.00 0.48 0.00 0.00 55.95 57.84 4ota s SER 12 Cb -0.10 -1.68 0.60 0.00 0.10 0.00 0.00 66.02 64.94 4ota s SER 12 CO 0.31 -1.39 2.00 0.44 0.98 0.00 0.00 173.24 175.59 4ota h ASP 13 N -0.59 0.76 0.13 7.02 5.19 -1.99 -2.64 116.42 124.29 4ota h ASP 13 Ca -0.45 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 55.93 4ota h ASP 13 Cb 1.27 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 40.59 4ota h ASP 13 CO 0.63 0.56 -0.06 -0.33 -3.12 0.00 0.00 179.24 176.91 4ota h GLU 14 N 0.89 -0.17 -0.74 3.56 3.07 -1.99 -0.85 114.58 118.36 4ota h GLU 14 Ca 0.24 0.01 0.07 0.00 -0.50 0.00 0.00 59.36 59.18 4ota h GLU 14 Cb -0.09 0.04 -0.06 0.00 -0.84 0.00 0.00 28.75 27.80 4ota h GLU 14 CO -0.05 -0.08 0.41 1.96 -1.40 0.00 0.00 179.01 179.85 4ota h GLN 15 N -0.21 0.70 -0.08 2.33 4.20 -1.88 -0.61 115.11 119.57 4ota h GLN 15 Ca -0.02 -0.04 -0.11 0.00 0.06 0.00 0.00 58.65 58.54 4ota h GLN 15 Cb 0.16 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 4ota h GLN 15 CO 0.03 0.47 -0.46 0.87 -0.67 0.00 0.00 178.83 179.06 4ota h LYS 16 N 0.73 0.18 -0.24 1.46 1.57 -1.31 -0.35 116.57 118.61 4ota h LYS 16 Ca 0.34 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.91 4ota h LYS 16 Cb 0.26 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 4ota h LYS 16 CO -0.21 0.61 -0.33 1.49 -0.57 0.00 0.00 179.45 180.44 4ota h GLU 17 N 0.15 0.50 -0.14 3.15 4.81 -0.06 -1.81 114.58 121.18 4ota h GLU 17 Ca 0.01 -0.22 -0.19 0.00 -0.13 0.00 0.00 59.36 58.84 4ota h GLU 17 Cb 0.88 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.25 4ota h GLU 17 CO 0.07 0.76 -0.64 1.15 -0.73 0.00 0.00 179.01 179.63 4ota h THR 18 N 0.42 1.32 -0.35 0.32 2.02 -0.87 -2.82 112.91 112.95 4ota h THR 18 Ca 0.05 -1.89 0.03 0.00 0.77 0.00 0.00 66.41 65.37 4ota h THR 18 Cb 0.78 2.05 -0.03 0.00 -1.74 0.00 0.00 68.15 69.21 4ota h THR 18 CO 0.06 0.59 0.17 0.25 0.37 0.00 0.00 175.52 176.95 4ota h LEU 19 N 0.36 0.24 -1.13 2.58 5.85 -0.88 0.20 115.31 122.53 4ota h LEU 19 Ca -0.04 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.70 4ota h LEU 19 Cb 1.27 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.24 4ota h LEU 19 CO 0.13 0.18 0.54 0.40 -0.34 0.00 0.00 178.44 179.35 4ota h ILE 20 N 0.35 1.22 0.02 4.05 2.04 -1.34 -1.48 117.51 122.37 4ota h ILE 20 Ca 0.15 -0.44 -0.12 0.00 1.00 0.00 0.00 64.86 65.45 4ota h ILE 20 Cb 0.07 -0.00 0.01 0.00 -0.74 0.00 0.00 36.82 36.16 4ota h ILE 20 CO -0.11 0.22 -0.47 -0.09 0.00 0.00 0.00 178.15 177.71 4ota h ARG 21 N 1.15 0.29 -0.16 2.37 2.43 -1.16 -2.47 114.38 116.82 4ota h ARG 21 Ca 0.31 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 4ota h ARG 21 Cb -0.10 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 4ota h ARG 21 CO -0.06 1.05 0.11 0.93 -1.51 0.00 0.00 179.97 180.48 4ota h GLU 22 N -0.33 0.21 -0.55 0.20 4.39 -0.91 -1.01 114.58 116.59 4ota h GLU 22 Ca -0.06 -0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.55 4ota h GLU 22 Cb 1.22 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.80 4ota h GLU 22 CO 0.09 0.14 0.05 0.28 -1.16 0.00 0.00 179.01 178.42 4ota h VAL 23 N 0.22 1.25 -0.46 3.13 2.07 -1.40 -1.59 116.25 119.47 4ota h VAL 23 Ca 0.06 -0.99 -0.05 0.00 0.82 0.00 0.00 66.70 66.54 4ota h VAL 23 Cb -0.02 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 4ota h VAL 23 CO -0.01 0.36 0.10 0.28 0.02 0.00 0.00 177.57 178.32 4ota h SER 24 N 0.85 0.64 -0.12 0.57 0.02 -1.01 -1.38 113.55 113.13 4ota h SER 24 Ca 0.17 -0.11 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 4ota h SER 24 Cb 0.43 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 4ota h SER 24 CO 0.01 0.65 -0.16 -0.33 -1.14 0.00 0.00 176.83 175.87 4ota h GLU 25 N 0.67 0.31 -0.61 3.45 4.39 -0.84 -2.24 114.58 119.72 4ota h GLU 25 Ca 0.15 -0.18 0.07 0.00 0.34 0.00 0.00 59.36 59.74 4ota h GLU 25 Cb 0.27 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.88 4ota h GLU 25 CO -0.00 0.75 0.30 0.00 -1.16 0.00 0.00 179.01 178.89 4ota h ALA 26 N 0.56 0.81 -0.04 3.43 0.00 -1.09 0.40 119.26 123.33 4ota h ALA 26 Ca 0.01 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 4ota h ALA 26 Cb 0.71 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 4ota h ALA 26 CO 0.04 -0.07 0.01 0.82 0.00 0.00 0.00 179.25 180.05 4ota h ILE 27 N 0.55 1.19 -0.90 0.00 2.04 -1.27 -1.36 117.51 117.76 4ota h ILE 27 Ca 0.29 -0.56 0.02 0.00 1.00 0.00 0.00 64.86 65.61 4ota h ILE 27 Cb 0.25 1.49 -0.05 0.00 -0.74 0.00 0.00 36.82 37.77 4ota h ILE 27 CO -0.22 0.15 0.59 -1.28 0.00 0.00 0.00 178.15 177.39 4ota h SER 28 N -0.15 1.00 0.43 1.72 0.87 -0.90 -2.35 113.55 114.17 4ota h SER 28 Ca 0.01 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 4ota h SER 28 Cb 0.24 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 4ota h SER 28 CO 0.00 0.71 -0.21 -0.09 -0.53 0.00 0.00 176.83 176.71 4ota h ARG 29 N 1.18 -0.56 -0.98 2.24 2.43 -0.15 -1.14 114.38 117.39 4ota h ARG 29 Ca 0.34 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.63 4ota h ARG 29 Cb -0.08 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 29.53 4ota h ARG 29 CO -0.09 -0.26 0.63 0.77 -1.51 0.00 0.00 179.97 179.51 4ota h SER 30 N -0.86 0.97 -0.02 -3.80 0.02 -1.17 -2.87 113.55 105.82 4ota h SER 30 Ca -0.06 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 4ota h SER 30 Cb 0.56 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.91 4ota h SER 30 CO 0.10 0.59 -0.24 0.18 -1.14 0.00 0.00 176.83 176.32 4ota n LEU 31 N -4.53 2.45 -3.65 5.07 4.77 -0.89 -4.97 117.00 115.25 4ota n LEU 31 Ca 0.16 -0.88 -0.25 0.00 -0.03 0.00 0.00 56.01 55.02 4ota n LEU 31 Cb 0.24 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.40 4ota n LEU 31 CO 0.31 0.43 0.21 -0.67 -1.33 0.00 0.00 177.39 176.34 4ota n ASP 32 N 0.62 -5.66 -4.75 -1.43 -0.08 -0.48 -4.99 116.55 99.78 4ota n ASP 32 Ca 0.11 -0.60 -0.30 0.00 -1.51 0.00 0.00 54.79 52.49 4ota n ASP 32 Cb 0.52 -4.80 -0.07 0.00 2.34 0.00 0.00 41.12 39.11 4ota n ASP 32 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 4ota s ALA 33 N -3.33 3.49 0.14 -1.67 0.00 -0.89 -5.05 121.76 114.45 4ota s ALA 33 Ca 0.55 -1.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.15 4ota s ALA 33 Cb -0.25 -1.36 -0.10 0.00 0.00 0.00 0.00 23.12 21.40 4ota s ALA 33 CO 0.75 0.74 1.71 -1.25 0.00 0.00 0.00 175.76 177.71 4ota s PRO 34 N -2.36 4.16 0.33 0.00 0.04 -1.26 -4.62 135.00 131.29 4ota s PRO 34 Ca 0.28 2.50 0.11 0.00 0.04 0.00 0.00 61.00 63.93 4ota s PRO 34 Cb -0.12 -3.37 0.97 0.00 0.04 0.00 0.00 34.50 32.02 4ota s PRO 34 CO 0.21 -0.75 1.68 1.25 0.04 0.00 0.00 177.00 179.43 4ota h LEU 35 N 7.76 0.49 -0.23 -3.56 5.85 -1.92 0.63 115.31 124.34 4ota h LEU 35 Ca -0.44 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.46 4ota h LEU 35 Cb 1.21 0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.36 4ota h LEU 35 CO 0.94 -0.07 0.00 0.35 -0.34 0.00 0.00 178.44 179.32 4ota n THR 36 N -5.03 1.48 0.92 1.05 -2.24 -1.26 -1.73 114.28 107.47 4ota n THR 36 Ca 0.29 0.43 0.11 0.00 -2.27 0.00 0.00 64.05 62.61 4ota n THR 36 Cb 0.87 -1.34 0.14 0.00 -2.10 0.00 0.00 70.33 67.89 4ota n THR 36 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 4ota n SER 37 N -1.65 0.63 -4.73 3.42 3.41 0.22 -4.91 113.62 110.01 4ota n SER 37 Ca 0.01 -0.38 -0.41 0.00 -0.26 0.00 0.00 58.87 57.83 4ota n SER 37 Cb 0.08 0.48 -0.04 0.00 -0.26 0.00 0.00 64.21 64.47 4ota n SER 37 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 4ota s VAL 38 N -3.04 4.47 -0.10 -3.33 1.01 -0.70 -3.33 120.40 115.38 4ota s VAL 38 Ca 0.09 2.02 0.02 0.00 0.00 0.00 0.00 61.98 64.11 4ota s VAL 38 Cb 0.17 -4.29 0.01 0.00 0.00 0.00 0.00 36.38 32.27 4ota s VAL 38 CO 0.75 0.29 -0.14 -0.13 0.00 0.00 0.00 175.10 175.87 4ota s ARG 39 N 0.08 2.10 -0.04 2.72 3.00 -0.49 -4.99 118.95 121.33 4ota s ARG 39 Ca 0.48 -0.52 0.06 0.00 0.00 0.00 0.00 55.73 55.75 4ota s ARG 39 Cb -0.24 -1.78 -0.01 0.00 0.00 0.00 0.00 34.95 32.92 4ota s ARG 39 CO 0.30 -0.05 -0.24 0.08 0.00 0.00 0.00 175.30 175.40 4ota s VAL 40 N 0.94 1.92 -0.11 3.52 1.01 -1.26 -0.17 120.40 126.24 4ota s VAL 40 Ca -0.08 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 60.90 4ota s VAL 40 Cb -0.15 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.63 4ota s VAL 40 CO -0.00 0.54 -0.15 -0.63 0.00 0.00 0.00 175.10 174.85 4ota s ILE 41 N -0.32 1.51 -0.15 2.22 1.01 0.38 -4.97 121.20 120.88 4ota s ILE 41 Ca 0.02 -0.64 -0.07 0.00 0.00 0.00 0.00 60.65 59.95 4ota s ILE 41 Cb -0.12 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 4ota s ILE 41 CO 0.01 0.44 0.10 -0.63 0.00 0.00 0.00 174.94 174.87 4ota s ILE 42 N 1.05 5.19 -0.17 2.92 1.01 -1.26 -0.75 121.20 129.19 4ota s ILE 42 Ca -0.05 0.10 -0.00 0.00 0.00 0.00 0.00 60.65 60.70 4ota s ILE 42 Cb -0.15 -3.30 0.04 0.00 0.01 0.00 0.00 42.46 39.07 4ota s ILE 42 CO -0.03 0.53 -0.06 -0.89 0.00 0.00 0.00 174.94 174.49 4ota s THR 43 N -0.32 1.21 0.20 2.92 2.01 -0.18 -4.95 115.64 116.53 4ota s THR 43 Ca 0.10 -0.70 -0.19 0.00 0.31 0.00 0.00 61.69 61.22 4ota s THR 43 Cb -0.12 -1.37 -0.08 0.00 0.01 0.00 0.00 72.50 70.95 4ota s THR 43 CO 0.01 0.14 0.68 -1.61 -0.69 0.00 0.00 174.62 173.15 4ota s GLU 44 N 1.59 4.19 -0.04 4.92 2.02 -1.26 -1.89 118.70 128.23 4ota s GLU 44 Ca 0.00 0.78 0.05 0.00 0.02 0.00 0.00 54.97 55.83 4ota s GLU 44 Cb -0.15 -2.91 -0.02 0.00 0.10 0.00 0.00 34.13 31.14 4ota s GLU 44 CO -0.08 0.43 -0.18 -1.64 0.02 0.00 0.00 175.26 173.81 4ota s MET 45 N -1.92 2.41 0.46 1.61 -1.94 -0.13 -4.89 119.30 114.91 4ota s MET 45 Ca 0.41 -0.77 -0.22 0.00 -1.71 0.00 0.00 55.69 53.40 4ota s MET 45 Cb -0.17 -2.28 -0.08 0.00 2.01 0.00 0.00 34.83 34.32 4ota s MET 45 CO 0.21 0.59 1.11 0.00 -0.01 0.00 0.00 175.02 176.91 4ota s ALA 46 N -0.65 2.93 0.60 3.03 0.00 -1.26 -1.28 121.76 125.12 4ota s ALA 46 Ca 0.10 0.80 0.29 0.00 0.00 0.00 0.00 51.96 53.15 4ota s ALA 46 Cb -0.11 -3.33 1.58 0.00 0.00 0.00 0.00 23.12 21.27 4ota s ALA 46 CO 0.00 -0.50 2.00 0.87 0.00 0.00 0.00 175.76 178.13 4ota h LYS 47 N 1.92 0.00 -0.63 0.00 1.57 -1.95 0.78 116.57 118.25 4ota h LYS 47 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 4ota h LYS 47 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 4ota h LYS 47 CO 0.60 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.89 4ota n GLY 48 N -1.43 2.22 0.16 3.86 0.00 -1.26 -3.50 105.19 105.24 4ota n GLY 48 Ca 0.04 -0.71 0.02 0.00 0.00 0.00 0.00 46.02 45.36 4ota n GLY 48 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 4ota n HIS 49 N 1.05 0.08 -4.05 1.61 8.25 0.26 -4.97 115.22 117.46 4ota n HIS 49 Ca 0.22 -0.32 -0.27 0.00 -0.26 0.00 0.00 57.72 57.09 4ota n HIS 49 Cb 0.71 -0.03 -0.17 0.00 1.12 0.00 0.00 29.99 31.63 4ota n HIS 49 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 4ota s PHE 50 N -0.73 1.61 0.09 4.41 5.36 -1.24 -4.88 117.98 122.60 4ota s PHE 50 Ca 0.06 -0.79 0.08 0.00 -0.96 0.00 0.00 56.93 55.32 4ota s PHE 50 Cb 0.03 -1.27 -0.04 0.00 -0.34 0.00 0.00 43.02 41.40 4ota s PHE 50 CO 0.04 -0.50 -0.19 0.20 -1.46 0.00 0.00 175.22 173.31 4ota s GLY 51 N 1.48 1.62 -0.10 13.12 0.00 -1.26 -0.71 107.32 121.47 4ota s GLY 51 Ca 0.01 -1.30 -0.01 0.00 0.00 0.00 0.00 44.72 43.42 4ota s GLY 51 CO -0.07 -1.24 -0.02 -0.42 0.00 0.00 0.00 173.10 171.35 4ota s ILE 52 N -1.04 0.64 -1.52 0.90 1.01 0.34 -4.76 121.20 116.78 4ota s ILE 52 Ca 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.69 4ota s ILE 52 Cb -0.10 -0.79 0.00 0.00 0.01 0.00 0.00 42.46 41.57 4ota s ILE 52 CO 0.07 0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.86 4ota n GLY 53 N 5.06 1.00 1.06 6.18 0.00 -1.26 -2.29 105.19 114.94 4ota n GLY 53 Ca -0.09 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.64 4ota n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4ota n GLY 54 N -1.08 0.75 3.05 -0.02 0.00 -1.26 -5.06 105.19 101.57 4ota n GLY 54 Ca -0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.71 4ota n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4ota s GLU 55 N -0.51 0.58 0.34 1.61 2.02 -0.97 -5.08 118.70 116.70 4ota s GLU 55 Ca 0.00 -0.60 -0.27 0.00 0.02 0.00 0.00 54.97 54.12 4ota s GLU 55 Cb 0.00 -0.46 -0.12 0.00 0.10 0.00 0.00 34.13 33.64 4ota s GLU 55 CO 0.00 0.11 1.12 1.28 0.02 0.00 0.00 175.26 177.79 4ota n LEU 56 N 1.97 2.69 0.21 1.80 4.77 -1.26 -0.50 117.00 126.68 4ota n LEU 56 Ca -0.19 1.16 0.05 0.00 -0.03 0.00 0.00 56.01 57.00 4ota n LEU 56 Cb 0.56 -1.38 0.47 0.00 -2.33 0.00 0.00 43.42 40.73 4ota n LEU 56 CO 0.22 -1.06 0.82 0.00 -1.33 0.00 0.00 177.39 176.05 4ota h ALA 57 N 2.10 1.44 -0.62 -1.18 0.00 -1.04 -2.57 119.26 117.39 4ota h ALA 57 Ca -0.43 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.23 4ota h ALA 57 Cb 1.32 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 4ota h ALA 57 CO 0.60 0.33 0.38 0.66 0.00 0.00 0.00 179.25 181.23 4ota h SER 58 N 0.00 0.74 -0.08 0.00 4.64 -1.82 -2.53 113.55 114.51 4ota h SER 58 Ca -0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 4ota h SER 58 Cb 0.51 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 4ota h SER 58 CO 0.03 0.58 0.00 0.29 -0.87 0.00 0.00 176.83 176.87 4ota n LYS 59 N -4.61 1.43 0.00 4.77 5.02 -0.99 -5.16 118.16 118.63 4ota n LYS 59 Ca 0.05 -0.64 0.00 0.00 -2.02 0.00 0.00 58.31 55.69 4ota n LYS 59 Cb 0.05 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 4ota n LYS 59 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43