#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4otb s ILE 2 N 0.00 0.28 -0.12 4.25 1.01 -1.26 -2.19 121.20 123.17 4otb s ILE 2 Ca 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 4otb s ILE 2 Cb 0.00 -0.63 -0.03 0.00 0.01 0.00 0.00 42.46 41.81 4otb s ILE 2 CO 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 174.94 174.94 4otb s ALA 3 N 1.99 3.07 -0.23 9.38 0.00 -0.28 -5.01 121.76 130.69 4otb s ALA 3 Ca 0.03 -0.83 0.02 0.00 0.00 0.00 0.00 51.96 51.18 4otb s ALA 3 Cb -0.14 -1.48 0.04 0.00 0.00 0.00 0.00 23.12 21.55 4otb s ALA 3 CO -0.06 0.38 -0.14 -1.14 0.00 0.00 0.00 175.76 174.80 4otb s GLN 4 N -0.19 2.48 -0.18 0.00 0.74 -1.26 -0.52 119.66 120.74 4otb s GLN 4 Ca 0.04 -1.12 -0.06 0.00 0.05 0.00 0.00 55.36 54.26 4otb s GLN 4 Cb -0.13 -2.74 -0.04 0.00 1.10 0.00 0.00 33.01 31.21 4otb s GLN 4 CO 0.02 -0.43 0.03 0.42 -0.55 0.00 0.00 175.29 174.78 4otb s ILE 5 N 1.19 4.47 -0.35 -2.34 1.01 0.05 -4.98 121.20 120.26 4otb s ILE 5 Ca -0.03 -0.15 -0.12 0.00 0.00 0.00 0.00 60.65 60.35 4otb s ILE 5 Cb -0.17 -3.00 0.00 0.00 0.01 0.00 0.00 42.46 39.30 4otb s ILE 5 CO -0.08 0.47 0.21 -1.00 0.00 0.00 0.00 174.94 174.54 4otb s HIS 6 N 0.41 3.21 0.18 3.97 3.76 -1.26 -0.90 115.29 124.67 4otb s HIS 6 Ca 0.01 -0.56 0.09 0.00 -0.15 0.00 0.00 55.06 54.44 4otb s HIS 6 Cb -0.13 -2.44 -0.04 0.00 1.11 0.00 0.00 32.58 31.08 4otb s HIS 6 CO 0.01 -0.49 -0.18 0.96 -0.85 0.00 0.00 174.74 174.20 4otb s ILE 7 N 1.64 1.86 0.38 0.60 -4.36 -0.17 -4.98 121.20 116.17 4otb s ILE 7 Ca 0.04 -2.01 -0.25 0.00 -0.26 0.00 0.00 60.65 58.17 4otb s ILE 7 Cb -0.18 -1.92 -0.09 0.00 1.25 0.00 0.00 42.46 41.52 4otb s ILE 7 CO 0.08 -0.37 1.04 -0.76 0.24 0.00 0.00 174.94 175.17 4otb s LEU 8 N -2.85 4.21 0.60 0.37 1.43 -1.26 0.42 118.68 121.59 4otb s LEU 8 Ca 0.18 2.03 -0.20 0.00 -1.03 0.00 0.00 54.13 55.11 4otb s LEU 8 Cb -0.05 -4.11 -0.03 0.00 0.03 0.00 0.00 46.19 42.04 4otb s LEU 8 CO 0.07 -0.39 1.34 -1.83 0.23 0.00 0.00 176.35 175.77 4otb s GLU 9 N -2.33 2.84 0.00 1.70 -1.05 0.22 -4.44 118.70 115.64 4otb s GLU 9 Ca 0.55 2.17 0.00 0.00 -0.15 0.00 0.00 54.97 57.55 4otb s GLU 9 Cb -0.22 -2.06 0.00 0.00 -0.44 0.00 0.00 34.13 31.41 4otb s GLU 9 CO 0.28 -1.41 0.00 0.41 0.95 0.00 0.00 175.26 175.50 4otb n GLY 10 N 0.82 1.16 3.88 -3.83 0.00 -1.26 -4.90 105.19 101.06 4otb n GLY 10 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 4otb n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 4otb s ARG 11 N 0.00 3.57 0.59 1.61 1.81 -1.26 -5.07 118.95 120.19 4otb s ARG 11 Ca 0.00 0.58 -0.07 0.00 -1.72 0.00 0.00 55.73 54.52 4otb s ARG 11 Cb 0.00 -2.17 0.00 0.00 -0.45 0.00 0.00 34.95 32.33 4otb s ARG 11 CO 0.00 -0.47 0.91 -1.54 -0.68 0.00 0.00 175.30 173.52 4otb s SER 12 N -4.16 5.71 0.29 0.23 1.04 -1.26 -4.92 113.70 110.62 4otb s SER 12 Ca 0.53 0.82 -0.02 0.00 0.48 0.00 0.00 55.95 57.75 4otb s SER 12 Cb -0.11 -1.84 0.42 0.00 0.10 0.00 0.00 66.02 64.59 4otb s SER 12 CO 0.51 -1.01 1.94 0.44 0.98 0.00 0.00 173.24 176.10 4otb h ASP 13 N -0.17 0.94 -0.19 7.02 5.19 -1.99 -1.60 116.42 125.63 4otb h ASP 13 Ca -0.45 -0.05 -0.11 0.00 -0.62 0.00 0.00 57.03 55.80 4otb h ASP 13 Cb 1.25 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 40.50 4otb h ASP 13 CO 0.61 0.71 -0.23 -0.33 -3.12 0.00 0.00 179.24 176.89 4otb h GLU 14 N 1.09 0.64 -0.57 3.56 3.07 -1.98 -0.69 114.58 119.69 4otb h GLU 14 Ca 0.29 -0.25 -0.11 0.00 -0.50 0.00 0.00 59.36 58.79 4otb h GLU 14 Cb -0.06 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.79 4otb h GLU 14 CO -0.06 0.82 -0.05 1.96 -1.40 0.00 0.00 179.01 180.28 4otb h GLN 15 N 0.57 1.05 0.00 2.33 4.20 -1.76 -1.76 115.11 119.73 4otb h GLN 15 Ca 0.08 -0.36 -0.14 0.00 0.06 0.00 0.00 58.65 58.29 4otb h GLN 15 Cb 0.70 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 4otb h GLN 15 CO 0.05 1.06 -0.67 0.87 -0.67 0.00 0.00 178.83 179.47 4otb h LYS 16 N 0.94 0.00 -0.19 1.46 1.57 -1.16 -1.72 116.57 117.47 4otb h LYS 16 Ca 0.16 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.79 4otb h LYS 16 Cb 0.62 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 4otb h LYS 16 CO 0.04 0.67 -0.47 1.49 -0.57 0.00 0.00 179.45 180.61 4otb h GLU 17 N 0.00 0.50 -0.16 3.15 4.81 -0.98 -1.76 114.58 120.14 4otb h GLU 17 Ca -0.01 -0.28 -0.10 0.00 -0.13 0.00 0.00 59.36 58.84 4otb h GLU 17 Cb 1.40 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.79 4otb h GLU 17 CO 0.09 0.87 -0.30 1.15 -0.73 0.00 0.00 179.01 180.08 4otb h THR 18 N 0.40 1.35 -0.42 0.32 2.02 -1.25 -2.49 112.91 112.84 4otb h THR 18 Ca 0.02 -1.54 0.05 0.00 0.77 0.00 0.00 66.41 65.71 4otb h THR 18 Cb 0.98 1.94 -0.04 0.00 -1.74 0.00 0.00 68.15 69.28 4otb h THR 18 CO 0.09 0.46 0.18 0.25 0.37 0.00 0.00 175.52 176.87 4otb h LEU 19 N 0.13 0.22 -1.22 2.58 5.85 -1.22 0.17 115.31 121.81 4otb h LEU 19 Ca 0.01 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 4otb h LEU 19 Cb 0.89 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.89 4otb h LEU 19 CO 0.07 0.16 0.30 0.40 -0.34 0.00 0.00 178.44 179.03 4otb h ILE 20 N 0.36 1.19 0.02 4.05 2.04 -1.29 -1.45 117.51 122.43 4otb h ILE 20 Ca 0.19 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 4otb h ILE 20 Cb 0.15 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 4otb h ILE 20 CO -0.17 0.22 -0.01 -0.09 0.00 0.00 0.00 178.15 178.10 4otb h ARG 21 N 0.84 -0.02 0.31 2.37 2.43 -0.88 -2.76 114.38 116.66 4otb h ARG 21 Ca 0.21 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 4otb h ARG 21 Cb 0.07 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 4otb h ARG 21 CO -0.03 0.66 -0.35 0.93 -1.51 0.00 0.00 179.97 179.67 4otb h GLU 22 N -0.74 -0.67 -0.77 0.20 4.39 -0.60 -1.80 114.58 114.59 4otb h GLU 22 Ca -0.00 0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.78 4otb h GLU 22 Cb 0.69 0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 29.45 4otb h GLU 22 CO 0.00 -0.45 0.51 0.28 -1.16 0.00 0.00 179.01 178.19 4otb h VAL 23 N -0.70 1.11 -0.71 3.13 2.07 -1.41 -1.31 116.25 118.44 4otb h VAL 23 Ca -0.01 -0.32 -0.05 0.00 0.82 0.00 0.00 66.70 67.14 4otb h VAL 23 Cb 0.65 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 4otb h VAL 23 CO -0.09 0.17 0.26 0.28 0.02 0.00 0.00 177.57 178.21 4otb h SER 24 N 0.93 0.98 -0.12 0.57 0.02 -1.15 -1.78 113.55 113.00 4otb h SER 24 Ca 0.31 -0.15 -0.14 0.00 -0.84 0.00 0.00 61.79 60.97 4otb h SER 24 Cb 0.06 -0.25 0.01 0.00 0.14 0.00 0.00 62.40 62.35 4otb h SER 24 CO -0.09 0.88 -0.47 -0.33 -1.14 0.00 0.00 176.83 175.69 4otb h GLU 25 N 1.03 0.52 -0.92 3.45 5.08 -0.72 -2.42 114.58 120.59 4otb h GLU 25 Ca 0.23 -0.41 0.13 0.00 -1.00 0.00 0.00 59.36 58.32 4otb h GLU 25 Cb 0.23 0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.47 4otb h GLU 25 CO -0.02 1.03 0.55 0.00 -1.00 0.00 0.00 179.01 179.57 4otb h ALA 26 N 0.50 1.39 -0.12 3.43 0.00 -1.04 0.13 119.26 123.55 4otb h ALA 26 Ca -0.02 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 4otb h ALA 26 Cb 1.10 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.76 4otb h ALA 26 CO 0.10 0.09 -0.22 0.82 0.00 0.00 0.00 179.25 180.05 4otb h ILE 27 N 0.84 1.38 -0.08 0.00 2.04 -1.34 -1.63 117.51 118.72 4otb h ILE 27 Ca 0.47 -1.48 0.03 0.00 1.00 0.00 0.00 64.86 64.88 4otb h ILE 27 Cb 0.54 2.06 -0.03 0.00 -0.74 0.00 0.00 36.82 38.65 4otb h ILE 27 CO -0.29 0.43 -0.12 -1.28 0.00 0.00 0.00 178.15 176.89 4otb h SER 28 N -0.07 -0.37 0.66 1.72 0.87 -0.76 -1.57 113.55 114.03 4otb h SER 28 Ca 0.01 0.07 -0.16 0.00 -1.23 0.00 0.00 61.79 60.47 4otb h SER 28 Cb 0.80 0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.91 4otb h SER 28 CO 0.05 -0.16 -0.73 0.08 -0.53 0.00 0.00 176.83 175.53 4otb h ARG 29 N -0.17 0.06 -0.19 2.24 0.11 -0.85 0.94 114.38 116.52 4otb h ARG 29 Ca 0.07 -0.05 -0.10 0.00 0.10 0.00 0.00 59.98 59.99 4otb h ARG 29 Cb 0.26 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.34 4otb h ARG 29 CO -0.18 0.76 -0.33 0.77 0.10 0.00 0.00 179.97 181.09 4otb h SER 30 N 0.04 0.40 -0.11 0.08 0.02 -1.06 -3.15 113.55 109.77 4otb h SER 30 Ca -0.01 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 4otb h SER 30 Cb 1.30 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.73 4otb h SER 30 CO 0.10 0.71 0.00 0.18 -1.14 0.00 0.00 176.83 176.68 4otb n LEU 31 N -4.08 2.25 -3.32 5.07 4.77 -0.61 -4.97 117.00 116.11 4otb n LEU 31 Ca -0.01 -1.28 -0.24 0.00 -0.03 0.00 0.00 56.01 54.45 4otb n LEU 31 Cb 0.45 -0.07 0.03 0.00 -2.33 0.00 0.00 43.42 41.50 4otb n LEU 31 CO 0.42 0.48 0.04 -0.67 -1.33 0.00 0.00 177.39 176.33 4otb n ASP 32 N 0.63 -5.34 -4.86 -1.43 -0.08 0.20 -4.97 116.55 100.71 4otb n ASP 32 Ca 0.08 -0.42 -0.33 0.00 -1.51 0.00 0.00 54.79 52.61 4otb n ASP 32 Cb 0.33 -4.31 -0.05 0.00 2.34 0.00 0.00 41.12 39.43 4otb n ASP 32 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 4otb s ALA 33 N -3.15 3.83 0.18 -1.67 0.00 -0.45 -5.02 121.76 115.47 4otb s ALA 33 Ca 0.42 -0.82 -0.32 0.00 0.00 0.00 0.00 51.96 51.25 4otb s ALA 33 Cb -0.20 -1.76 -0.11 0.00 0.00 0.00 0.00 23.12 21.05 4otb s ALA 33 CO 0.52 0.74 1.68 -1.25 0.00 0.00 0.00 175.76 177.45 4otb s PRO 34 N -1.97 4.16 0.34 0.00 0.04 -1.26 -4.60 135.00 131.71 4otb s PRO 34 Ca 0.27 2.52 0.10 0.00 0.04 0.00 0.00 61.00 63.93 4otb s PRO 34 Cb -0.12 -3.18 0.87 0.00 0.04 0.00 0.00 34.50 32.10 4otb s PRO 34 CO 0.18 -0.72 1.78 1.25 0.04 0.00 0.00 177.00 179.54 4otb h LEU 35 N 7.09 0.66 -2.09 -3.56 5.85 -1.92 0.86 115.31 122.20 4otb h LEU 35 Ca -0.43 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.38 4otb h LEU 35 Cb 1.20 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.21 4otb h LEU 35 CO 0.94 0.21 0.00 0.71 -0.34 0.00 0.00 178.44 179.96 4otb h THR 36 N 0.63 0.00 0.00 1.05 1.35 -1.98 -1.21 112.91 112.74 4otb h THR 36 Ca 0.57 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 66.41 4otb h THR 36 Cb 1.08 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 4otb h THR 36 CO -0.35 0.00 -0.87 -1.54 -0.25 0.00 0.00 175.52 172.52 4otb n SER 37 N -2.64 0.65 -4.73 5.36 3.41 0.30 -4.92 113.62 111.05 4otb n SER 37 Ca -0.02 -0.03 -0.41 0.00 -0.26 0.00 0.00 58.87 58.15 4otb n SER 37 Cb 0.06 0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 64.49 4otb n SER 37 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 4otb s VAL 38 N -3.20 3.77 -0.11 -3.33 1.01 -0.46 -3.90 120.40 114.18 4otb s VAL 38 Ca 0.04 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.47 4otb s VAL 38 Cb 0.14 -3.93 0.02 0.00 0.00 0.00 0.00 36.38 32.61 4otb s VAL 38 CO 0.77 0.21 -0.09 -0.13 0.00 0.00 0.00 175.10 175.86 4otb s ARG 39 N 0.00 1.63 -0.04 2.72 1.81 -0.93 -5.02 118.95 119.12 4otb s ARG 39 Ca 0.53 -0.31 0.05 0.00 -1.72 0.00 0.00 55.73 54.28 4otb s ARG 39 Cb -0.31 -1.61 -0.03 0.00 -0.45 0.00 0.00 34.95 32.56 4otb s ARG 39 CO 0.34 -0.22 -0.16 0.08 -0.68 0.00 0.00 175.30 174.67 4otb s VAL 40 N 1.52 2.91 -0.11 3.52 1.01 -1.26 -1.12 120.40 126.87 4otb s VAL 40 Ca 0.02 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.19 4otb s VAL 40 Cb -0.13 -2.13 0.02 0.00 0.00 0.00 0.00 36.38 34.14 4otb s VAL 40 CO -0.07 0.56 -0.11 -0.63 0.00 0.00 0.00 175.10 174.86 4otb s ILE 41 N -0.74 1.21 -0.16 2.22 1.01 0.32 -4.98 121.20 120.08 4otb s ILE 41 Ca 0.12 -0.44 -0.07 0.00 0.00 0.00 0.00 60.65 60.25 4otb s ILE 41 Cb -0.11 -1.17 -0.04 0.00 0.01 0.00 0.00 42.46 41.15 4otb s ILE 41 CO 0.01 0.39 0.09 -0.63 0.00 0.00 0.00 174.94 174.80 4otb s ILE 42 N 1.37 5.08 -0.17 2.92 1.01 -1.26 -0.77 121.20 129.38 4otb s ILE 42 Ca -0.00 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.71 4otb s ILE 42 Cb -0.14 -3.27 0.04 0.00 0.01 0.00 0.00 42.46 39.11 4otb s ILE 42 CO -0.06 0.51 -0.08 -0.89 0.00 0.00 0.00 174.94 174.42 4otb s THR 43 N -0.09 1.32 0.22 2.92 2.01 -0.08 -4.96 115.64 116.99 4otb s THR 43 Ca 0.08 -0.71 -0.18 0.00 0.31 0.00 0.00 61.69 61.19 4otb s THR 43 Cb -0.12 -1.42 -0.08 0.00 0.01 0.00 0.00 72.50 70.89 4otb s THR 43 CO 0.01 0.21 0.69 -1.61 -0.69 0.00 0.00 174.62 173.23 4otb s GLU 44 N 1.55 4.17 -0.06 4.92 2.02 -1.26 -0.99 118.70 129.05 4otb s GLU 44 Ca 0.01 0.77 0.05 0.00 0.02 0.00 0.00 54.97 55.82 4otb s GLU 44 Cb -0.15 -2.83 -0.02 0.00 0.10 0.00 0.00 34.13 31.23 4otb s GLU 44 CO -0.08 0.38 -0.20 -1.64 0.02 0.00 0.00 175.26 173.74 4otb s MET 45 N -2.11 2.59 0.40 1.61 -1.94 0.17 -4.87 119.30 115.15 4otb s MET 45 Ca 0.44 -0.80 -0.25 0.00 -1.71 0.00 0.00 55.69 53.36 4otb s MET 45 Cb -0.15 -2.29 -0.08 0.00 2.01 0.00 0.00 34.83 34.31 4otb s MET 45 CO 0.20 0.47 1.17 0.00 -0.01 0.00 0.00 175.02 176.85 4otb s ALA 46 N -0.35 3.16 0.60 3.03 0.00 -1.26 -0.61 121.76 126.33 4otb s ALA 46 Ca 0.03 0.97 0.28 0.00 0.00 0.00 0.00 51.96 53.24 4otb s ALA 46 Cb -0.12 -3.38 1.41 0.00 0.00 0.00 0.00 23.12 21.02 4otb s ALA 46 CO 0.02 -0.53 1.82 0.87 0.00 0.00 0.00 175.76 177.94 4otb h LYS 47 N 2.64 0.00 -0.63 0.00 1.79 -1.96 0.49 116.57 118.91 4otb h LYS 47 Ca -0.49 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 4otb h LYS 47 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 4otb h LYS 47 CO 0.62 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.40 4otb n GLY 48 N -1.50 2.11 0.23 3.86 0.00 -1.26 -2.24 105.19 106.39 4otb n GLY 48 Ca 0.09 -0.70 0.02 0.00 0.00 0.00 0.00 46.02 45.43 4otb n GLY 48 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 4otb n HIS 49 N 1.17 0.16 -3.95 1.61 8.25 0.17 -4.97 115.22 117.67 4otb n HIS 49 Ca 0.22 -0.46 -0.28 0.00 -0.26 0.00 0.00 57.72 56.94 4otb n HIS 49 Cb 0.64 -0.04 -0.17 0.00 1.12 0.00 0.00 29.99 31.54 4otb n HIS 49 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 4otb s PHE 50 N -0.94 1.77 -0.06 4.41 5.36 -1.22 -4.86 117.98 122.43 4otb s PHE 50 Ca 0.08 -0.96 -0.01 0.00 -0.96 0.00 0.00 56.93 55.08 4otb s PHE 50 Cb 0.04 -1.38 -0.03 0.00 -0.34 0.00 0.00 43.02 41.31 4otb s PHE 50 CO 0.06 -0.58 -0.00 0.20 -1.46 0.00 0.00 175.22 173.43 4otb s GLY 51 N 1.62 1.85 -0.19 13.12 0.00 -1.26 0.62 107.32 123.07 4otb s GLY 51 Ca 0.04 -0.85 -0.02 0.00 0.00 0.00 0.00 44.72 43.90 4otb s GLY 51 CO -0.09 -0.64 0.01 -0.42 0.00 0.00 0.00 173.10 171.96 4otb s ILE 52 N -0.94 0.75 -0.84 0.90 1.01 0.70 -4.74 121.20 118.05 4otb s ILE 52 Ca 0.15 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 60.14 4otb s ILE 52 Cb -0.11 -1.18 0.00 0.00 0.01 0.00 0.00 42.46 41.18 4otb s ILE 52 CO 0.04 -0.15 0.00 0.61 0.00 0.00 0.00 174.94 175.45 4otb n GLY 53 N 4.97 0.94 0.00 6.18 0.00 -1.26 -2.39 105.19 113.63 4otb n GLY 53 Ca -0.10 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.60 4otb n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4otb n GLY 54 N -1.27 3.26 3.91 -0.02 0.00 -1.26 -5.06 105.19 104.75 4otb n GLY 54 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 4otb n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4otb s GLU 55 N -0.92 3.58 0.49 1.61 0.41 -1.00 -5.02 118.70 117.84 4otb s GLU 55 Ca 0.00 -0.14 -0.20 0.00 -0.41 0.00 0.00 54.97 54.21 4otb s GLU 55 Cb 0.00 -2.73 -0.08 0.00 -1.78 0.00 0.00 34.13 29.54 4otb s GLU 55 CO 0.00 0.29 1.06 -0.51 -0.49 0.00 0.00 175.26 175.61 4otb s LEU 56 N -3.45 3.86 0.34 1.80 1.02 -1.26 -0.22 118.68 120.77 4otb s LEU 56 Ca 0.42 1.98 0.02 0.00 0.02 0.00 0.00 54.13 56.57 4otb s LEU 56 Cb -0.11 -4.52 0.61 0.00 0.02 0.00 0.00 46.19 42.19 4otb s LEU 56 CO 0.29 -0.83 1.99 0.00 0.02 0.00 0.00 176.35 177.83 4otb h ALA 57 N 1.60 1.51 -0.11 4.21 0.00 0.23 -2.67 119.26 124.02 4otb h ALA 57 Ca -0.49 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 4otb h ALA 57 Cb 1.23 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 4otb h ALA 57 CO 0.59 0.43 -0.14 0.66 0.00 0.00 0.00 179.25 180.80 4otb h SER 58 N 0.84 0.16 -0.01 0.00 4.64 -1.71 -3.50 113.55 113.97 4otb h SER 58 Ca 0.22 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 4otb h SER 58 Cb -0.05 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 4otb h SER 58 CO -0.04 0.32 0.00 2.29 -0.87 0.00 0.00 176.83 178.53