#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 1.40 -0.11 4.25 1.01 -1.26 -1.23 121.20 125.25 4ota s ILE 2 Ca 0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 60.65 59.90 4ota s ILE 2 Cb 0.00 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.98 4ota s ILE 2 CO 0.00 0.23 -0.07 0.00 0.00 0.00 0.00 174.94 175.10 4ota s ALA 3 N 1.52 2.93 -0.19 9.38 0.00 0.60 -4.99 121.76 131.01 4ota s ALA 3 Ca 0.01 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.12 4ota s ALA 3 Cb -0.15 -1.34 0.03 0.00 0.00 0.00 0.00 23.12 21.66 4ota s ALA 3 CO -0.09 0.40 -0.19 -1.14 0.00 0.00 0.00 175.76 174.75 4ota s GLN 4 N -0.23 2.87 -0.16 0.00 0.74 -1.26 -0.34 119.66 121.28 4ota s GLN 4 Ca 0.03 -0.89 -0.03 0.00 0.05 0.00 0.00 55.36 54.52 4ota s GLN 4 Cb -0.13 -2.60 -0.02 0.00 1.10 0.00 0.00 33.01 31.36 4ota s GLN 4 CO 0.03 -0.26 -0.06 0.42 -0.55 0.00 0.00 175.29 174.87 4ota s ILE 5 N 1.27 3.64 -0.30 -2.34 1.01 0.38 -4.97 121.20 119.88 4ota s ILE 5 Ca 0.03 -0.44 -0.11 0.00 0.00 0.00 0.00 60.65 60.13 4ota s ILE 5 Cb -0.14 -2.59 -0.03 0.00 0.01 0.00 0.00 42.46 39.71 4ota s ILE 5 CO -0.12 0.49 0.19 -1.00 0.00 0.00 0.00 174.94 174.51 4ota s HIS 6 N 0.47 3.21 0.17 3.97 3.76 -1.26 -0.72 115.29 124.89 4ota s HIS 6 Ca -0.05 -0.12 0.06 0.00 -0.15 0.00 0.00 55.06 54.80 4ota s HIS 6 Cb -0.15 -2.40 -0.04 0.00 1.11 0.00 0.00 32.58 31.10 4ota s HIS 6 CO 0.03 -0.28 -0.13 0.96 -0.85 0.00 0.00 174.74 174.48 4ota s ILE 7 N 1.72 1.44 0.42 0.60 -4.36 -0.94 -5.00 121.20 115.08 4ota s ILE 7 Ca 0.06 -2.08 -0.23 0.00 -0.26 0.00 0.00 60.65 58.14 4ota s ILE 7 Cb -0.17 -1.89 -0.09 0.00 1.25 0.00 0.00 42.46 41.56 4ota s ILE 7 CO 0.10 -0.64 1.03 -0.76 0.24 0.00 0.00 174.94 174.91 4ota s LEU 8 N -3.14 4.05 0.79 0.37 1.43 -1.26 -0.61 118.68 120.31 4ota s LEU 8 Ca 0.18 1.97 -0.12 0.00 -1.03 0.00 0.00 54.13 55.13 4ota s LEU 8 Cb 0.00 -4.31 0.07 0.00 0.03 0.00 0.00 46.19 41.99 4ota s LEU 8 CO 0.04 -0.54 1.15 -1.83 0.23 0.00 0.00 176.35 175.39 4ota s GLU 9 N -2.73 1.87 0.00 1.70 -1.05 -0.36 -4.44 118.70 113.69 4ota s GLU 9 Ca 0.60 1.51 0.00 0.00 -0.15 0.00 0.00 54.97 56.94 4ota s GLU 9 Cb -0.19 -1.83 0.00 0.00 -0.44 0.00 0.00 34.13 31.67 4ota s GLU 9 CO 0.24 -1.99 0.00 0.41 0.95 0.00 0.00 175.26 174.87 4ota n GLY 10 N -0.14 1.32 3.88 -3.83 0.00 -1.26 -4.94 105.19 100.22 4ota n GLY 10 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 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 3.77 0.71 1.61 3.00 -1.26 -5.07 118.95 121.71 4ota s ARG 11 Ca 0.00 0.44 -0.11 0.00 0.00 0.00 0.00 55.73 56.06 4ota s ARG 11 Cb 0.00 -2.41 0.03 0.00 0.00 0.00 0.00 34.95 32.57 4ota s ARG 11 CO 0.00 -0.01 1.09 -1.54 0.00 0.00 0.00 175.30 174.84 4ota s SER 12 N -3.14 5.28 0.39 0.23 1.04 -1.26 -4.92 113.70 111.31 4ota s SER 12 Ca 0.51 1.01 0.07 0.00 0.48 0.00 0.00 55.95 58.02 4ota s SER 12 Cb -0.10 -1.77 0.79 0.00 0.10 0.00 0.00 66.02 65.04 4ota s SER 12 CO 0.31 -1.42 1.99 0.44 0.98 0.00 0.00 173.24 175.54 4ota h ASP 13 N -0.68 0.43 -0.08 7.02 5.19 -1.99 -2.57 116.42 123.75 4ota h ASP 13 Ca -0.45 -0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 55.92 4ota h ASP 13 Cb 1.27 -0.11 -0.00 0.00 0.18 0.00 0.00 39.33 40.67 4ota h ASP 13 CO 0.64 0.40 0.04 -0.33 -3.12 0.00 0.00 179.24 176.87 4ota h GLU 14 N 0.48 0.11 -0.71 3.56 3.07 -1.99 -1.37 114.58 117.73 4ota h GLU 14 Ca 0.12 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.99 4ota h GLU 14 Cb 0.11 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 27.96 4ota h GLU 14 CO -0.01 0.17 0.46 1.96 -1.40 0.00 0.00 179.01 180.19 4ota h GLN 15 N 0.02 0.89 0.00 2.33 4.20 -1.88 -1.28 115.11 119.38 4ota h GLN 15 Ca 0.03 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 4ota h GLN 15 Cb 0.09 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 4ota h GLN 15 CO -0.00 0.59 -0.40 0.87 -0.67 0.00 0.00 178.83 179.21 4ota h LYS 16 N 0.92 0.00 -0.12 1.46 1.57 -1.33 -0.37 116.57 118.70 4ota h LYS 16 Ca 0.28 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.90 4ota h LYS 16 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 4ota h LYS 16 CO -0.09 0.40 -0.59 1.49 -0.57 0.00 0.00 179.45 180.10 4ota h GLU 17 N 0.00 0.38 -0.11 3.15 4.81 -0.54 -2.13 114.58 120.14 4ota h GLU 17 Ca -0.00 -0.25 -0.21 0.00 -0.13 0.00 0.00 59.36 58.77 4ota h GLU 17 Cb 0.78 0.03 0.01 0.00 0.63 0.00 0.00 28.75 30.21 4ota h GLU 17 CO 0.05 0.85 -0.74 1.15 -0.73 0.00 0.00 179.01 179.59 4ota h THR 18 N 0.28 1.31 -0.37 0.32 2.02 -0.98 -2.65 112.91 112.85 4ota h THR 18 Ca -0.00 -1.99 0.03 0.00 0.77 0.00 0.00 66.41 65.22 4ota h THR 18 Cb 1.11 2.14 -0.03 0.00 -1.74 0.00 0.00 68.15 69.63 4ota h THR 18 CO 0.10 0.62 0.17 0.25 0.37 0.00 0.00 175.52 177.03 4ota h LEU 19 N 0.37 0.24 -0.86 2.58 5.85 -1.00 0.05 115.31 122.55 4ota h LEU 19 Ca -0.06 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 4ota h LEU 19 Cb 1.39 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.35 4ota h LEU 19 CO 0.15 0.18 0.51 0.40 -0.34 0.00 0.00 178.44 179.34 4ota h ILE 20 N 0.35 1.24 -0.02 4.05 2.04 -1.39 -1.78 117.51 122.00 4ota h ILE 20 Ca 0.16 -0.54 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 4ota h ILE 20 Cb 0.08 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 4ota h ILE 20 CO -0.12 0.26 -0.12 -0.09 0.00 0.00 0.00 178.15 178.07 4ota h ARG 21 N 1.18 0.13 -0.33 2.37 2.43 -1.09 -2.29 114.38 116.78 4ota h ARG 21 Ca 0.31 -0.10 0.04 0.00 -0.81 0.00 0.00 59.98 59.41 4ota h ARG 21 Cb -0.03 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.50 4ota h ARG 21 CO -0.06 0.76 0.11 0.93 -1.51 0.00 0.00 179.97 180.21 4ota h GLU 22 N -0.48 0.24 -0.51 0.20 4.39 -0.97 -0.73 114.58 116.72 4ota h GLU 22 Ca -0.01 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.60 4ota h GLU 22 Cb 0.79 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.36 4ota h GLU 22 CO 0.03 0.16 0.01 0.28 -1.16 0.00 0.00 179.01 178.32 4ota h VAL 23 N 0.24 1.25 -0.45 3.13 2.07 -1.43 -1.77 116.25 119.30 4ota h VAL 23 Ca 0.15 -1.03 -0.06 0.00 0.82 0.00 0.00 66.70 66.58 4ota h VAL 23 Cb 0.13 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 4ota h VAL 23 CO -0.16 0.37 0.01 0.28 0.02 0.00 0.00 177.57 178.08 4ota h SER 24 N 0.79 0.69 -0.16 0.57 0.02 -0.75 -1.57 113.55 113.14 4ota h SER 24 Ca 0.15 -0.15 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 4ota h SER 24 Cb 0.46 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 4ota h SER 24 CO 0.02 0.75 -0.25 -0.33 -1.14 0.00 0.00 176.83 175.88 4ota h GLU 25 N 0.68 0.46 -0.66 3.45 4.39 -0.83 -2.31 114.58 119.75 4ota h GLU 25 Ca 0.14 -0.28 0.07 0.00 0.34 0.00 0.00 59.36 59.63 4ota h GLU 25 Cb 0.40 0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 29.02 4ota h GLU 25 CO 0.01 0.87 0.35 0.00 -1.16 0.00 0.00 179.01 179.09 4ota h ALA 26 N 0.58 0.89 -0.13 3.43 0.00 -1.11 0.43 119.26 123.35 4ota h ALA 26 Ca 0.01 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 4ota h ALA 26 Cb 0.83 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 4ota h ALA 26 CO 0.06 0.01 -0.00 0.82 0.00 0.00 0.00 179.25 180.13 4ota h ILE 27 N 0.64 1.25 -0.76 0.00 2.04 -1.29 -1.28 117.51 118.12 4ota h ILE 27 Ca 0.31 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.35 4ota h ILE 27 Cb 0.23 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.82 4ota h ILE 27 CO -0.21 0.24 0.48 -1.28 0.00 0.00 0.00 178.15 177.38 4ota h SER 28 N -0.04 0.89 0.56 1.72 0.87 -0.87 -2.16 113.55 114.52 4ota h SER 28 Ca 0.04 -0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 4ota h SER 28 Cb 0.36 -0.22 0.01 0.00 -0.44 0.00 0.00 62.40 62.11 4ota h SER 28 CO 0.01 0.66 -0.27 -0.09 -0.53 0.00 0.00 176.83 176.61 4ota h ARG 29 N 1.03 -0.73 -1.00 2.24 2.43 -0.10 -0.80 114.38 117.44 4ota h ARG 29 Ca 0.27 0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.59 4ota h ARG 29 Cb -0.08 0.17 -0.08 0.00 -0.42 0.00 0.00 29.97 29.56 4ota h ARG 29 CO -0.06 -0.43 0.64 0.77 -1.51 0.00 0.00 179.97 179.39 4ota h SER 30 N -0.94 0.99 -0.03 -3.80 0.02 -1.15 -2.76 113.55 105.88 4ota h SER 30 Ca -0.08 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 4ota h SER 30 Cb 0.64 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.00 4ota h SER 30 CO 0.13 0.58 -0.10 0.18 -1.14 0.00 0.00 176.83 176.48 4ota n LEU 31 N -4.55 2.70 -3.71 5.07 4.77 -0.82 -4.97 117.00 115.49 4ota n LEU 31 Ca 0.17 -0.95 -0.26 0.00 -0.03 0.00 0.00 56.01 54.94 4ota n LEU 31 Cb 0.26 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.41 4ota n LEU 31 CO 0.30 0.46 0.19 -0.67 -1.33 0.00 0.00 177.39 176.34 4ota n ASP 32 N 0.99 -5.82 -4.80 -1.43 -0.08 -0.36 -4.99 116.55 100.07 4ota n ASP 32 Ca 0.12 -0.63 -0.31 0.00 -1.51 0.00 0.00 54.79 52.47 4ota n ASP 32 Cb 0.54 -4.60 -0.06 0.00 2.34 0.00 0.00 41.12 39.35 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 -3.31 3.63 0.19 -1.67 0.00 -0.89 -5.05 121.76 114.67 4ota s ALA 33 Ca 0.62 -0.98 -0.32 0.00 0.00 0.00 0.00 51.96 51.28 4ota s ALA 33 Cb -0.29 -1.50 -0.11 0.00 0.00 0.00 0.00 23.12 21.22 4ota s ALA 33 CO 0.76 0.76 1.66 -1.25 0.00 0.00 0.00 175.76 177.70 4ota s PRO 34 N -2.39 4.16 0.31 0.00 0.04 -1.26 -4.64 135.00 131.22 4ota s PRO 34 Ca 0.30 2.52 0.07 0.00 0.04 0.00 0.00 61.00 63.93 4ota s PRO 34 Cb -0.12 -3.10 0.84 0.00 0.04 0.00 0.00 34.50 32.16 4ota s PRO 34 CO 0.23 -0.70 1.69 1.25 0.04 0.00 0.00 177.00 179.51 4ota h LEU 35 N 6.79 0.43 0.00 -3.56 5.85 -1.92 0.01 115.31 122.91 4ota h LEU 35 Ca -0.43 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.45 4ota h LEU 35 Cb 1.20 0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.35 4ota h LEU 35 CO 0.94 -0.01 0.00 0.35 -0.34 0.00 0.00 178.44 179.38 4ota n THR 36 N -5.02 1.58 0.94 1.05 -2.24 -1.26 -1.65 114.28 107.68 4ota n THR 36 Ca 0.25 0.40 0.11 0.00 -2.27 0.00 0.00 64.05 62.54 4ota n THR 36 Cb 0.75 -1.32 0.06 0.00 -2.10 0.00 0.00 70.33 67.73 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 -1.47 0.72 -4.72 3.42 3.41 -0.01 -4.91 113.62 110.06 4ota n SER 37 Ca 0.01 -0.56 -0.42 0.00 -0.26 0.00 0.00 58.87 57.65 4ota n SER 37 Cb 0.05 0.64 -0.03 0.00 -0.26 0.00 0.00 64.21 64.61 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 -3.03 4.56 -0.10 -3.33 1.01 -0.66 -3.25 120.40 115.60 4ota s VAL 38 Ca 0.09 1.90 0.03 0.00 0.00 0.00 0.00 61.98 63.99 4ota s VAL 38 Cb 0.16 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.34 4ota s VAL 38 CO 0.78 0.18 -0.19 -0.13 0.00 0.00 0.00 175.10 175.74 4ota s ARG 39 N 0.79 2.58 -0.06 2.72 3.00 -0.37 -4.99 118.95 122.62 4ota s ARG 39 Ca 0.53 -0.71 0.05 0.00 0.00 0.00 0.00 55.73 55.59 4ota s ARG 39 Cb -0.24 -2.05 -0.00 0.00 0.00 0.00 0.00 34.95 32.66 4ota s ARG 39 CO 0.29 0.06 -0.21 0.08 0.00 0.00 0.00 175.30 175.53 4ota s VAL 40 N 0.62 1.74 -0.15 3.52 1.01 -1.26 -0.29 120.40 125.60 4ota s VAL 40 Ca -0.13 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 60.99 4ota s VAL 40 Cb -0.16 -1.50 0.02 0.00 0.00 0.00 0.00 36.38 34.73 4ota s VAL 40 CO 0.04 0.49 -0.18 -0.63 0.00 0.00 0.00 175.10 174.82 4ota s ILE 41 N 0.13 1.84 -0.15 2.22 1.01 0.53 -4.97 121.20 121.80 4ota s ILE 41 Ca -0.09 -0.82 -0.10 0.00 0.00 0.00 0.00 60.65 59.65 4ota s ILE 41 Cb -0.14 -1.67 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 4ota s ILE 41 CO 0.05 0.50 0.17 -0.63 0.00 0.00 0.00 174.94 175.03 4ota s ILE 42 N 1.19 5.41 -0.19 2.92 1.01 -1.26 -0.47 121.20 129.80 4ota s ILE 42 Ca 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.93 4ota s ILE 42 Cb -0.14 -3.48 0.05 0.00 0.01 0.00 0.00 42.46 38.90 4ota s ILE 42 CO -0.08 0.51 -0.04 -0.89 0.00 0.00 0.00 174.94 174.44 4ota s THR 43 N -0.22 1.15 0.23 2.92 2.01 0.11 -4.94 115.64 116.89 4ota s THR 43 Ca 0.13 -0.82 -0.24 0.00 0.31 0.00 0.00 61.69 61.07 4ota s THR 43 Cb -0.12 -1.41 -0.09 0.00 0.01 0.00 0.00 72.50 70.89 4ota s THR 43 CO 0.02 -0.01 0.81 -1.61 -0.69 0.00 0.00 174.62 173.14 4ota s GLU 44 N 1.59 4.48 -0.07 4.92 2.02 -1.26 -2.21 118.70 128.17 4ota s GLU 44 Ca -0.02 1.12 0.03 0.00 0.02 0.00 0.00 54.97 56.12 4ota s GLU 44 Cb -0.17 -3.01 -0.02 0.00 0.10 0.00 0.00 34.13 31.03 4ota s GLU 44 CO -0.07 0.43 -0.16 -1.64 0.02 0.00 0.00 175.26 173.84 4ota s MET 45 N -1.67 2.72 0.42 1.61 -1.94 0.22 -4.89 119.30 115.77 4ota s MET 45 Ca 0.42 -0.73 -0.25 0.00 -1.71 0.00 0.00 55.69 53.42 4ota s MET 45 Cb -0.20 -2.40 -0.08 0.00 2.01 0.00 0.00 34.83 34.16 4ota s MET 45 CO 0.24 0.48 1.20 0.00 -0.01 0.00 0.00 175.02 176.93 4ota s ALA 46 N -0.37 3.12 0.59 3.03 0.00 -1.26 -1.23 121.76 125.65 4ota s ALA 46 Ca 0.03 1.02 0.29 0.00 0.00 0.00 0.00 51.96 53.30 4ota s ALA 46 Cb -0.12 -3.41 1.50 0.00 0.00 0.00 0.00 23.12 21.09 4ota s ALA 46 CO 0.02 -0.64 1.92 0.87 0.00 0.00 0.00 175.76 177.93 4ota h LYS 47 N 2.48 0.00 -0.61 0.00 1.57 -1.95 0.22 116.57 118.27 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 0.62 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.91 4ota n GLY 48 N -1.48 2.89 0.06 3.86 0.00 -1.26 -3.38 105.19 105.87 4ota n GLY 48 Ca 0.07 -0.90 0.01 0.00 0.00 0.00 0.00 46.02 45.20 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 0.81 0.03 -3.93 1.61 8.25 0.79 -4.96 115.22 117.81 4ota n HIS 49 Ca 0.27 -0.30 -0.28 0.00 -0.26 0.00 0.00 57.72 57.14 4ota n HIS 49 Cb 1.09 -0.03 -0.17 0.00 1.12 0.00 0.00 29.99 32.01 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 -0.65 1.77 0.04 4.41 5.36 -1.23 -4.87 117.98 122.82 4ota s PHE 50 Ca 0.02 -1.02 0.06 0.00 -0.96 0.00 0.00 56.93 55.03 4ota s PHE 50 Cb 0.01 -1.37 -0.03 0.00 -0.34 0.00 0.00 43.02 41.29 4ota s PHE 50 CO 0.02 -0.60 -0.11 0.20 -1.46 0.00 0.00 175.22 173.27 4ota s GLY 51 N 1.61 1.70 -0.13 13.12 0.00 -1.26 -0.72 107.32 121.65 4ota s GLY 51 Ca 0.03 -1.14 -0.01 0.00 0.00 0.00 0.00 44.72 43.61 4ota s GLY 51 CO -0.09 -1.04 -0.04 -0.42 0.00 0.00 0.00 173.10 171.51 4ota s ILE 52 N -1.03 0.89 -1.40 0.90 1.01 0.26 -4.73 121.20 117.09 4ota s ILE 52 Ca 0.17 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.48 4ota s ILE 52 Cb -0.11 -1.02 0.00 0.00 0.01 0.00 0.00 42.46 41.34 4ota s ILE 52 CO 0.08 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.85 4ota n GLY 53 N 4.97 0.33 1.53 6.18 0.00 -1.26 -2.35 105.19 114.59 4ota n GLY 53 Ca -0.11 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.05 0.65 3.05 -0.02 0.00 -1.26 -5.04 105.19 101.52 4ota n GLY 54 Ca -0.17 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.26 0.63 0.30 1.61 2.02 -0.99 -5.07 118.70 116.94 4ota s GLU 55 Ca 0.00 -0.54 -0.28 0.00 0.02 0.00 0.00 54.97 54.17 4ota s GLU 55 Cb 0.00 -0.55 -0.13 0.00 0.10 0.00 0.00 34.13 33.54 4ota s GLU 55 CO 0.00 0.14 1.12 1.28 0.02 0.00 0.00 175.26 177.81 4ota n LEU 56 N 2.18 2.39 0.20 1.80 4.77 -1.26 -0.58 117.00 126.50 4ota n LEU 56 Ca -0.17 1.19 0.05 0.00 -0.03 0.00 0.00 56.01 57.04 4ota n LEU 56 Cb 0.56 -1.35 0.42 0.00 -2.33 0.00 0.00 43.42 40.72 4ota n LEU 56 CO 0.23 -1.07 0.77 0.00 -1.33 0.00 0.00 177.39 175.99 4ota h ALA 57 N 2.30 1.32 0.37 -1.18 0.00 -1.04 -3.14 119.26 117.89 4ota h ALA 57 Ca -0.42 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.18 4ota h ALA 57 Cb 1.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.06 4ota h ALA 57 CO 0.62 0.40 -0.18 0.66 0.00 0.00 0.00 179.25 180.76 4ota h SER 58 N 0.00 -0.42 0.00 0.00 4.64 -1.81 -2.66 113.55 113.30 4ota h SER 58 Ca -0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 4ota h SER 58 Cb 0.63 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 4ota h SER 58 CO 0.04 -0.22 0.00 0.29 -0.87 0.00 0.00 176.83 176.07 4ota n LYS 59 N -5.26 0.82 0.00 4.77 5.02 -1.19 -5.14 118.16 117.17 4ota n LYS 59 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 4ota n LYS 59 Cb 0.24 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 4ota n LYS 59 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43