#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 1.21 -0.10 4.25 1.01 -1.26 -1.45 121.20 124.85 4ota s ILE 2 Ca 0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 4ota s ILE 2 Cb 0.00 -1.31 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 4ota s ILE 2 CO 0.00 0.22 -0.06 0.00 0.00 0.00 0.00 174.94 175.10 4ota s ALA 3 N 1.60 2.96 -0.18 9.38 0.00 0.92 -4.99 121.76 131.45 4ota s ALA 3 Ca 0.02 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.13 4ota s ALA 3 Cb -0.14 -1.35 0.03 0.00 0.00 0.00 0.00 23.12 21.65 4ota s ALA 3 CO -0.08 0.42 -0.17 -1.14 0.00 0.00 0.00 175.76 174.79 4ota s GLN 4 N -0.30 2.68 -0.16 0.00 0.74 -1.26 -0.17 119.66 121.18 4ota s GLN 4 Ca 0.04 -0.80 -0.02 0.00 0.05 0.00 0.00 55.36 54.63 4ota s GLN 4 Cb -0.13 -2.46 -0.02 0.00 1.10 0.00 0.00 33.01 31.50 4ota s GLN 4 CO 0.02 -0.26 -0.08 0.42 -0.55 0.00 0.00 175.29 174.85 4ota s ILE 5 N 1.33 3.43 -0.34 -2.34 1.01 0.28 -4.97 121.20 119.60 4ota s ILE 5 Ca 0.03 -0.51 -0.14 0.00 0.00 0.00 0.00 60.65 60.03 4ota s ILE 5 Cb -0.14 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.82 4ota s ILE 5 CO -0.11 0.49 0.31 -1.00 0.00 0.00 0.00 174.94 174.62 4ota s HIS 6 N 0.65 3.22 0.15 3.97 3.76 -1.26 -1.08 115.29 124.69 4ota s HIS 6 Ca -0.04 -0.09 0.06 0.00 -0.15 0.00 0.00 55.06 54.84 4ota s HIS 6 Cb -0.15 -2.59 -0.04 0.00 1.11 0.00 0.00 32.58 30.91 4ota s HIS 6 CO 0.02 -0.39 -0.13 0.96 -0.85 0.00 0.00 174.74 174.35 4ota s ILE 7 N 1.89 1.40 0.36 0.60 -4.36 -0.90 -4.99 121.20 115.20 4ota s ILE 7 Ca 0.09 -1.90 -0.26 0.00 -0.26 0.00 0.00 60.65 58.32 4ota s ILE 7 Cb -0.17 -1.72 -0.09 0.00 1.25 0.00 0.00 42.46 41.74 4ota s ILE 7 CO 0.11 -0.52 1.10 -0.76 0.24 0.00 0.00 174.94 175.12 4ota s LEU 8 N -2.79 4.30 0.77 0.37 1.43 -1.26 -0.34 118.68 121.16 4ota s LEU 8 Ca 0.14 2.22 -0.14 0.00 -1.03 0.00 0.00 54.13 55.31 4ota s LEU 8 Cb -0.02 -3.94 0.06 0.00 0.03 0.00 0.00 46.19 42.31 4ota s LEU 8 CO 0.03 -0.43 1.19 -1.83 0.23 0.00 0.00 176.35 175.54 4ota s GLU 9 N -2.07 1.95 0.00 1.70 -1.05 -0.51 -4.42 118.70 114.29 4ota s GLU 9 Ca 0.53 1.68 0.00 0.00 -0.15 0.00 0.00 54.97 57.03 4ota s GLU 9 Cb -0.28 -1.82 0.00 0.00 -0.44 0.00 0.00 34.13 31.59 4ota s GLU 9 CO 0.36 -1.96 0.00 0.41 0.95 0.00 0.00 175.26 175.01 4ota n GLY 10 N 0.25 1.25 3.87 -3.83 0.00 -1.26 -4.94 105.19 100.54 4ota n GLY 10 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 3.76 0.76 1.61 3.00 -1.26 -5.07 118.95 121.75 4ota s ARG 11 Ca 0.00 0.51 -0.10 0.00 0.00 0.00 0.00 55.73 56.14 4ota s ARG 11 Cb 0.00 -2.34 0.06 0.00 0.00 0.00 0.00 34.95 32.67 4ota s ARG 11 CO 0.00 -0.11 1.11 -1.54 0.00 0.00 0.00 175.30 174.76 4ota s SER 12 N -3.31 4.79 0.32 0.23 1.04 -1.26 -4.93 113.70 110.58 4ota s SER 12 Ca 0.52 0.76 0.02 0.00 0.48 0.00 0.00 55.95 57.73 4ota s SER 12 Cb -0.10 -1.36 0.54 0.00 0.10 0.00 0.00 66.02 65.19 4ota s SER 12 CO 0.34 -1.70 1.87 0.44 0.98 0.00 0.00 173.24 175.17 4ota h ASP 13 N -0.84 0.62 -0.14 7.02 5.19 -1.99 -2.65 116.42 123.63 4ota h ASP 13 Ca -0.45 -0.10 -0.00 0.00 -0.62 0.00 0.00 57.03 55.85 4ota h ASP 13 Cb 1.31 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.65 4ota h ASP 13 CO 0.64 0.63 0.08 -0.33 -3.12 0.00 0.00 179.24 177.14 4ota h GLU 14 N 0.65 0.19 -0.82 3.56 3.07 -1.99 -0.96 114.58 118.28 4ota h GLU 14 Ca 0.15 -0.02 0.03 0.00 -0.50 0.00 0.00 59.36 59.02 4ota h GLU 14 Cb 0.27 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 28.09 4ota h GLU 14 CO -0.00 0.20 0.53 1.96 -1.40 0.00 0.00 179.01 180.29 4ota h GLN 15 N 0.13 0.99 -0.05 2.33 4.20 -1.89 -1.22 115.11 119.60 4ota h GLN 15 Ca 0.05 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.58 4ota h GLN 15 Cb 0.06 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 4ota h GLN 15 CO -0.01 0.66 -0.51 0.87 -0.67 0.00 0.00 178.83 179.16 4ota h LYS 16 N 1.02 0.13 -0.27 1.46 1.57 -1.28 -0.30 116.57 118.90 4ota h LYS 16 Ca 0.33 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.93 4ota h LYS 16 Cb 0.02 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 4ota h LYS 16 CO -0.12 0.61 -0.28 1.49 -0.57 0.00 0.00 179.45 180.59 4ota h GLU 17 N 0.10 0.54 -0.10 3.15 4.81 -0.30 -1.96 114.58 120.81 4ota h GLU 17 Ca 0.00 -0.22 -0.14 0.00 -0.13 0.00 0.00 59.36 58.87 4ota h GLU 17 Cb 0.94 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.31 4ota h GLU 17 CO 0.07 0.77 -0.48 1.15 -0.73 0.00 0.00 179.01 179.79 4ota h THR 18 N 0.47 1.37 -0.30 0.32 2.02 -0.95 -2.70 112.91 113.14 4ota h THR 18 Ca 0.06 -1.81 0.05 0.00 0.77 0.00 0.00 66.41 65.49 4ota h THR 18 Cb 0.73 2.20 -0.05 0.00 -1.74 0.00 0.00 68.15 69.29 4ota h THR 18 CO 0.06 0.54 -0.02 0.25 0.37 0.00 0.00 175.52 176.71 4ota h LEU 19 N 0.09 -0.17 -1.00 2.58 5.85 -0.94 0.95 115.31 122.67 4ota h LEU 19 Ca -0.03 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.80 4ota h LEU 19 Cb 1.12 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.23 4ota h LEU 19 CO 0.10 -0.05 0.65 0.40 -0.34 0.00 0.00 178.44 179.20 4ota h ILE 20 N 0.06 1.16 -0.02 4.05 2.04 -1.35 -1.08 117.51 122.38 4ota h ILE 20 Ca 0.14 -0.43 -0.11 0.00 1.00 0.00 0.00 64.86 65.46 4ota h ILE 20 Cb 0.20 -0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.09 4ota h ILE 20 CO -0.26 0.23 -0.44 -0.09 0.00 0.00 0.00 178.15 177.59 4ota h ARG 21 N 1.25 0.32 -0.42 2.37 2.43 -1.06 -2.40 114.38 116.88 4ota h ARG 21 Ca 0.40 -0.33 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 4ota h ARG 21 Cb 0.02 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 4ota h ARG 21 CO -0.13 1.01 0.24 0.93 -1.51 0.00 0.00 179.97 180.51 4ota h GLU 22 N -0.23 0.57 -0.49 0.20 4.39 -0.70 -1.14 114.58 117.19 4ota h GLU 22 Ca -0.05 -0.06 -0.11 0.00 0.34 0.00 0.00 59.36 59.48 4ota h GLU 22 Cb 1.15 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.67 4ota h GLU 22 CO 0.09 0.44 -0.13 0.28 -1.16 0.00 0.00 179.01 178.52 4ota h VAL 23 N 0.55 1.27 -0.55 3.13 2.07 -1.31 -1.91 116.25 119.49 4ota h VAL 23 Ca 0.15 -1.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.37 4ota h VAL 23 Cb 0.02 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 4ota h VAL 23 CO -0.03 0.44 0.21 0.28 0.02 0.00 0.00 177.57 178.49 4ota h SER 24 N 0.81 0.73 -0.13 0.57 0.02 -1.03 -1.17 113.55 113.36 4ota h SER 24 Ca 0.13 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 4ota h SER 24 Cb 0.67 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 4ota h SER 24 CO 0.05 0.66 -0.14 -0.33 -1.14 0.00 0.00 176.83 175.93 4ota h GLU 25 N 0.79 0.32 -0.67 3.45 4.39 -0.95 -2.28 114.58 119.62 4ota h GLU 25 Ca 0.19 -0.17 0.09 0.00 0.34 0.00 0.00 59.36 59.81 4ota h GLU 25 Cb 0.17 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.76 4ota h GLU 25 CO -0.02 0.73 0.32 0.00 -1.16 0.00 0.00 179.01 178.88 4ota h ALA 26 N 0.59 0.91 -0.11 3.43 0.00 -1.08 0.36 119.26 123.36 4ota h ALA 26 Ca 0.02 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 4ota h ALA 26 Cb 0.67 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 4ota h ALA 26 CO 0.03 -0.09 0.01 0.82 0.00 0.00 0.00 179.25 180.02 4ota h ILE 27 N 0.54 1.24 -0.69 0.00 2.04 -1.21 -1.50 117.51 117.93 4ota h ILE 27 Ca 0.33 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.45 4ota h ILE 27 Cb 0.36 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 4ota h ILE 27 CO -0.27 0.22 0.44 -1.28 0.00 0.00 0.00 178.15 177.25 4ota h SER 28 N -0.06 0.81 0.41 1.72 0.87 -0.80 -2.46 113.55 114.05 4ota h SER 28 Ca 0.03 -0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 4ota h SER 28 Cb 0.32 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 4ota h SER 28 CO 0.00 0.61 -0.20 -0.09 -0.53 0.00 0.00 176.83 176.62 4ota h ARG 29 N 0.94 -0.54 -0.95 2.24 2.43 -0.27 -0.74 114.38 117.50 4ota h ARG 29 Ca 0.25 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.54 4ota h ARG 29 Cb -0.07 0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 29.53 4ota h ARG 29 CO -0.05 -0.27 0.60 0.77 -1.51 0.00 0.00 179.97 179.51 4ota h SER 30 N -0.73 0.93 -0.07 -3.80 0.02 -1.21 -2.85 113.55 105.85 4ota h SER 30 Ca -0.06 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 4ota h SER 30 Cb 0.51 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.88 4ota h SER 30 CO 0.09 0.57 0.00 0.18 -1.14 0.00 0.00 176.83 176.54 4ota n LEU 31 N -4.58 2.86 -3.78 5.07 4.77 -0.93 -4.97 117.00 115.45 4ota n LEU 31 Ca 0.15 -1.06 -0.26 0.00 -0.03 0.00 0.00 56.01 54.81 4ota n LEU 31 Cb 0.22 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.33 4ota n LEU 31 CO 0.30 0.50 0.10 -0.67 -1.33 0.00 0.00 177.39 176.30 4ota n ASP 32 N 1.23 -4.25 -4.71 -1.43 -0.08 -0.34 -4.98 116.55 102.00 4ota n ASP 32 Ca 0.13 -0.73 -0.31 0.00 -1.51 0.00 0.00 54.79 52.37 4ota n ASP 32 Cb 0.54 -4.24 -0.08 0.00 2.34 0.00 0.00 41.12 39.69 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 -3.38 3.36 0.22 -1.67 0.00 -0.87 -5.05 121.76 114.37 4ota s ALA 33 Ca 0.48 -1.03 -0.32 0.00 0.00 0.00 0.00 51.96 51.09 4ota s ALA 33 Cb -0.23 -1.31 -0.12 0.00 0.00 0.00 0.00 23.12 21.46 4ota s ALA 33 CO 0.80 0.70 1.68 -0.35 0.00 0.00 0.00 175.76 178.59 4ota n PRO 34 N 0.82 2.69 -0.35 0.00 -0.04 -1.26 -4.60 135.00 132.26 4ota n PRO 34 Ca -0.11 0.97 0.14 0.00 -0.04 0.00 0.00 63.50 64.45 4ota n PRO 34 Cb 0.52 -2.79 0.34 0.00 -0.04 0.00 0.00 33.50 31.53 4ota n PRO 34 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 4ota h LEU 35 N 6.26 0.76 0.00 1.53 5.85 -1.93 -0.34 115.31 127.45 4ota h LEU 35 Ca -0.44 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.38 4ota h LEU 35 Cb 1.21 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.21 4ota h LEU 35 CO 0.92 0.25 0.00 0.35 -0.34 0.00 0.00 178.44 179.61 4ota n THR 36 N -4.78 1.29 0.97 1.05 -2.24 -1.26 -1.85 114.28 107.46 4ota n THR 36 Ca 0.24 0.32 0.11 0.00 -2.27 0.00 0.00 64.05 62.45 4ota n THR 36 Cb 0.60 -1.20 0.09 0.00 -2.10 0.00 0.00 70.33 67.72 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 -1.42 0.71 -4.72 3.42 3.41 -0.14 -4.92 113.62 109.96 4ota n SER 37 Ca 0.02 -0.55 -0.42 0.00 -0.26 0.00 0.00 58.87 57.67 4ota n SER 37 Cb 0.07 0.58 -0.04 0.00 -0.26 0.00 0.00 64.21 64.57 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 -3.01 4.54 -0.10 -3.33 1.01 -0.77 -3.41 120.40 115.33 4ota s VAL 38 Ca 0.09 1.97 0.03 0.00 0.00 0.00 0.00 61.98 64.07 4ota s VAL 38 Cb 0.17 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 32.29 4ota s VAL 38 CO 0.77 0.24 -0.18 -0.13 0.00 0.00 0.00 175.10 175.80 4ota s ARG 39 N 0.44 2.47 -0.05 2.72 3.00 -0.53 -5.00 118.95 122.00 4ota s ARG 39 Ca 0.50 -0.67 0.05 0.00 0.00 0.00 0.00 55.73 55.61 4ota s ARG 39 Cb -0.24 -1.96 -0.01 0.00 0.00 0.00 0.00 34.95 32.75 4ota s ARG 39 CO 0.30 0.06 -0.21 0.08 0.00 0.00 0.00 175.30 175.53 4ota s VAL 40 N 0.63 1.72 -0.12 3.52 1.01 -1.26 -0.06 120.40 125.85 4ota s VAL 40 Ca -0.14 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 60.98 4ota s VAL 40 Cb -0.16 -1.47 0.02 0.00 0.00 0.00 0.00 36.38 34.77 4ota s VAL 40 CO 0.04 0.49 -0.16 -0.63 0.00 0.00 0.00 175.10 174.84 4ota s ILE 41 N -0.03 1.57 -0.17 2.22 1.01 0.76 -4.97 121.20 121.58 4ota s ILE 41 Ca -0.04 -0.67 -0.08 0.00 0.00 0.00 0.00 60.65 59.85 4ota s ILE 41 Cb -0.13 -1.44 -0.05 0.00 0.01 0.00 0.00 42.46 40.86 4ota s ILE 41 CO 0.03 0.46 0.12 -0.63 0.00 0.00 0.00 174.94 174.92 4ota s ILE 42 N 1.10 5.32 -0.20 2.92 1.01 -1.26 -0.56 121.20 129.53 4ota s ILE 42 Ca -0.04 0.15 -0.00 0.00 0.00 0.00 0.00 60.65 60.76 4ota s ILE 42 Cb -0.14 -3.38 0.05 0.00 0.01 0.00 0.00 42.46 38.99 4ota s ILE 42 CO -0.04 0.50 -0.05 -0.89 0.00 0.00 0.00 174.94 174.46 4ota s THR 43 N -0.10 1.28 0.24 2.92 2.01 -0.24 -4.95 115.64 116.79 4ota s THR 43 Ca 0.10 -0.89 -0.21 0.00 0.31 0.00 0.00 61.69 61.00 4ota s THR 43 Cb -0.11 -1.51 -0.08 0.00 0.01 0.00 0.00 72.50 70.80 4ota s THR 43 CO 0.00 0.02 0.76 -1.61 -0.69 0.00 0.00 174.62 173.10 4ota s GLU 44 N 1.53 4.30 -0.07 4.92 2.02 -1.26 -2.12 118.70 128.04 4ota s GLU 44 Ca -0.02 0.94 0.03 0.00 0.02 0.00 0.00 54.97 55.94 4ota s GLU 44 Cb -0.17 -2.87 -0.02 0.00 0.10 0.00 0.00 34.13 31.17 4ota s GLU 44 CO -0.07 0.38 -0.13 -1.64 0.02 0.00 0.00 175.26 173.82 4ota s MET 45 N -1.98 2.68 0.49 1.61 -1.94 0.54 -4.88 119.30 115.83 4ota s MET 45 Ca 0.44 -0.67 -0.21 0.00 -1.71 0.00 0.00 55.69 53.54 4ota s MET 45 Cb -0.17 -2.45 -0.07 0.00 2.01 0.00 0.00 34.83 34.15 4ota s MET 45 CO 0.21 0.56 1.12 0.00 -0.01 0.00 0.00 175.02 176.91 4ota s ALA 46 N -0.56 2.86 0.58 3.03 0.00 -1.26 -1.43 121.76 124.98 4ota s ALA 46 Ca 0.08 0.82 0.28 0.00 0.00 0.00 0.00 51.96 53.15 4ota s ALA 46 Cb -0.11 -3.35 1.55 0.00 0.00 0.00 0.00 23.12 21.21 4ota s ALA 46 CO 0.01 -0.61 2.01 0.87 0.00 0.00 0.00 175.76 178.04 4ota h LYS 47 N 1.70 0.00 -0.64 0.00 1.57 -1.95 0.12 116.57 117.38 4ota h LYS 47 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 4ota h LYS 47 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 4ota h LYS 47 CO 0.59 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.88 4ota n GLY 48 N -1.47 2.29 0.11 3.86 0.00 -1.26 -3.60 105.19 105.12 4ota n GLY 48 Ca 0.05 -0.71 0.01 0.00 0.00 0.00 0.00 46.02 45.37 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 0.92 0.06 -3.91 1.61 8.25 0.42 -4.97 115.22 117.60 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 0.77 -0.03 -0.17 0.00 1.12 0.00 0.00 29.99 31.68 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 -0.71 1.50 0.07 4.41 5.36 -1.24 -4.87 117.98 122.51 4ota s PHE 50 Ca 0.04 -0.76 0.07 0.00 -0.96 0.00 0.00 56.93 55.33 4ota s PHE 50 Cb 0.02 -1.24 -0.04 0.00 -0.34 0.00 0.00 43.02 41.43 4ota s PHE 50 CO 0.03 -0.52 -0.16 0.20 -1.46 0.00 0.00 175.22 173.31 4ota s GLY 51 N 1.71 1.66 -0.10 13.12 0.00 -1.26 -0.74 107.32 121.71 4ota s GLY 51 Ca 0.05 -1.24 -0.01 0.00 0.00 0.00 0.00 44.72 43.52 4ota s GLY 51 CO -0.08 -1.17 -0.02 -0.42 0.00 0.00 0.00 173.10 171.41 4ota s ILE 52 N -1.04 0.63 -1.47 0.90 1.01 -0.11 -4.75 121.20 116.37 4ota s ILE 52 Ca 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.73 4ota s ILE 52 Cb -0.11 -0.77 0.00 0.00 0.01 0.00 0.00 42.46 41.59 4ota s ILE 52 CO 0.08 0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.89 4ota n GLY 53 N 5.06 0.08 1.67 6.18 0.00 -1.26 -2.17 105.19 114.75 4ota n GLY 53 Ca -0.09 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.00 0.65 3.03 -0.02 0.00 -1.26 -5.04 105.19 101.55 4ota n GLY 54 Ca -0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.22 0.63 0.34 1.61 2.02 -0.92 -5.07 118.70 117.08 4ota s GLU 55 Ca 0.00 -0.46 -0.26 0.00 0.02 0.00 0.00 54.97 54.27 4ota s GLU 55 Cb 0.00 -0.57 -0.13 0.00 0.10 0.00 0.00 34.13 33.53 4ota s GLU 55 CO 0.00 0.14 0.93 1.28 0.02 0.00 0.00 175.26 177.63 4ota n LEU 56 N 2.39 1.63 0.20 1.80 4.77 -1.26 -0.93 117.00 125.59 4ota n LEU 56 Ca -0.16 1.11 0.04 0.00 -0.03 0.00 0.00 56.01 56.97 4ota n LEU 56 Cb 0.56 -1.27 0.40 0.00 -2.33 0.00 0.00 43.42 40.79 4ota n LEU 56 CO 0.24 -1.68 0.75 0.00 -1.33 0.00 0.00 177.39 175.36 4ota h ALA 57 N 1.67 1.32 0.00 -1.18 0.00 -1.06 -3.44 119.26 116.57 4ota h ALA 57 Ca -0.40 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.20 4ota h ALA 57 Cb 1.35 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.09 4ota h ALA 57 CO 0.58 0.42 0.00 -1.13 0.00 0.00 0.00 179.25 179.13