#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 0.54 -0.13 4.25 1.01 -1.26 -2.10 121.20 123.51 4otb s ILE 2 Ca 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 60.65 60.35 4otb s ILE 2 Cb 0.00 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.59 4otb s ILE 2 CO 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 174.94 174.96 4otb s ALA 3 N 1.88 3.09 -0.24 9.38 0.00 -0.26 -5.01 121.76 130.59 4otb s ALA 3 Ca 0.02 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.17 4otb s ALA 3 Cb -0.15 -1.51 0.04 0.00 0.00 0.00 0.00 23.12 21.51 4otb s ALA 3 CO -0.07 0.35 -0.11 -1.14 0.00 0.00 0.00 175.76 174.80 4otb s GLN 4 N -0.10 2.55 -0.18 0.00 0.74 -1.26 -0.62 119.66 120.79 4otb s GLN 4 Ca 0.03 -1.15 -0.06 0.00 0.05 0.00 0.00 55.36 54.23 4otb s GLN 4 Cb -0.13 -2.88 -0.04 0.00 1.10 0.00 0.00 33.01 31.07 4otb s GLN 4 CO 0.02 -0.46 0.03 0.42 -0.55 0.00 0.00 175.29 174.76 4otb s ILE 5 N 1.21 4.49 -0.34 -2.34 1.01 0.01 -4.98 121.20 120.26 4otb s ILE 5 Ca -0.04 -0.14 -0.12 0.00 0.00 0.00 0.00 60.65 60.36 4otb s ILE 5 Cb -0.18 -3.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.27 4otb s ILE 5 CO -0.06 0.47 0.21 -1.00 0.00 0.00 0.00 174.94 174.55 4otb s HIS 6 N 0.42 3.21 0.14 3.97 3.76 -1.26 -0.75 115.29 124.78 4otb s HIS 6 Ca 0.01 -0.44 0.08 0.00 -0.15 0.00 0.00 55.06 54.55 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 -0.44 -0.17 0.96 -0.85 0.00 0.00 174.74 174.25 4otb s ILE 7 N 1.66 1.65 0.35 0.60 -4.36 -0.06 -4.98 121.20 116.05 4otb s ILE 7 Ca 0.05 -1.78 -0.27 0.00 -0.26 0.00 0.00 60.65 58.39 4otb s ILE 7 Cb -0.18 -1.69 -0.09 0.00 1.25 0.00 0.00 42.46 41.75 4otb s ILE 7 CO 0.09 -0.30 1.10 -0.76 0.24 0.00 0.00 174.94 175.31 4otb s LEU 8 N -2.45 4.33 0.57 0.37 1.43 -1.26 0.16 118.68 121.83 4otb s LEU 8 Ca 0.12 2.22 -0.20 0.00 -1.03 0.00 0.00 54.13 55.24 4otb s LEU 8 Cb -0.06 -3.91 -0.05 0.00 0.03 0.00 0.00 46.19 42.20 4otb s LEU 8 CO 0.05 -0.39 1.10 -1.84 0.23 0.00 0.00 176.35 175.50 4otb n GLU 9 N 0.50 1.17 0.00 1.70 0.28 0.15 -4.44 120.64 120.00 4otb n GLU 9 Ca 0.02 0.44 0.00 0.00 -0.16 0.00 0.00 57.16 57.47 4otb n GLU 9 Cb 0.47 -2.29 0.00 0.00 1.43 0.00 0.00 31.44 31.05 4otb n GLU 9 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 4otb n GLY 10 N 1.10 1.30 3.88 -1.84 0.00 -1.26 -4.91 105.19 103.46 4otb n GLY 10 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 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 3.18 0.69 1.61 1.81 -1.26 -5.06 118.95 119.92 4otb s ARG 11 Ca 0.00 0.59 -0.07 0.00 -1.72 0.00 0.00 55.73 54.53 4otb s ARG 11 Cb 0.00 -2.05 0.05 0.00 -0.45 0.00 0.00 34.95 32.50 4otb s ARG 11 CO 0.00 -0.83 1.01 -1.54 -0.68 0.00 0.00 175.30 173.26 4otb s SER 12 N -4.28 5.00 0.30 0.23 1.04 -1.26 -4.93 113.70 109.80 4otb s SER 12 Ca 0.57 0.59 0.01 0.00 0.48 0.00 0.00 55.95 57.59 4otb s SER 12 Cb -0.11 -1.31 0.47 0.00 0.10 0.00 0.00 66.02 65.17 4otb s SER 12 CO 0.53 -1.49 1.83 0.44 0.98 0.00 0.00 173.24 175.53 4otb h ASP 13 N -0.55 0.66 -0.22 7.02 5.19 -1.99 -2.17 116.42 124.36 4otb h ASP 13 Ca -0.45 -0.13 -0.13 0.00 -0.62 0.00 0.00 57.03 55.71 4otb h ASP 13 Cb 1.30 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.63 4otb h ASP 13 CO 0.61 0.69 -0.32 -0.33 -3.12 0.00 0.00 179.24 176.78 4otb h GLU 14 N 0.67 0.73 -0.62 3.56 3.07 -1.98 -1.18 114.58 118.84 4otb h GLU 14 Ca 0.14 -0.34 -0.07 0.00 -0.50 0.00 0.00 59.36 58.60 4otb h GLU 14 Cb 0.34 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.21 4otb h GLU 14 CO 0.01 0.95 0.13 1.96 -1.40 0.00 0.00 179.01 180.65 4otb h GLN 15 N 0.62 1.00 0.00 2.33 4.20 -1.85 -1.07 115.11 120.34 4otb h GLN 15 Ca 0.07 -0.25 -0.14 0.00 0.06 0.00 0.00 58.65 58.39 4otb h GLN 15 Cb 0.84 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 4otb h GLN 15 CO 0.07 0.92 -0.66 0.87 -0.67 0.00 0.00 178.83 179.37 4otb h LYS 16 N 0.91 0.00 -0.18 1.46 1.57 -1.31 -1.52 116.57 117.50 4otb h LYS 16 Ca 0.19 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.81 4otb h LYS 16 Cb 0.39 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 4otb h LYS 16 CO 0.01 0.66 -0.54 1.49 -0.57 0.00 0.00 179.45 180.49 4otb h GLU 17 N 0.00 0.53 -0.17 3.15 4.81 -0.99 -1.63 114.58 120.29 4otb h GLU 17 Ca -0.01 -0.33 -0.07 0.00 -0.13 0.00 0.00 59.36 58.83 4otb h GLU 17 Cb 1.30 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.72 4otb h GLU 17 CO 0.09 0.94 -0.16 1.15 -0.73 0.00 0.00 179.01 180.30 4otb h THR 18 N 0.41 1.34 -0.49 0.32 2.02 -1.06 -2.44 112.91 113.00 4otb h THR 18 Ca 0.01 -1.30 0.07 0.00 0.77 0.00 0.00 66.41 65.95 4otb h THR 18 Cb 1.08 1.81 -0.06 0.00 -1.74 0.00 0.00 68.15 69.24 4otb h THR 18 CO 0.10 0.39 0.18 0.25 0.37 0.00 0.00 175.52 176.81 4otb h LEU 19 N 0.06 0.18 -1.13 2.58 5.85 -1.15 0.85 115.31 122.54 4otb h LEU 19 Ca 0.03 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 4otb h LEU 19 Cb 0.69 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 4otb h LEU 19 CO 0.04 0.13 0.33 0.40 -0.34 0.00 0.00 178.44 179.00 4otb h ILE 20 N 0.35 1.21 -0.03 4.05 2.04 -1.24 -1.08 117.51 122.81 4otb h ILE 20 Ca 0.24 -0.58 -0.04 0.00 1.00 0.00 0.00 64.86 65.48 4otb h ILE 20 Cb 0.25 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 4otb h ILE 20 CO -0.24 0.25 -0.12 -0.09 0.00 0.00 0.00 178.15 177.94 4otb h ARG 21 N 0.94 0.13 0.55 2.37 2.43 -0.73 -2.62 114.38 117.45 4otb h ARG 21 Ca 0.23 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 4otb h ARG 21 Cb 0.08 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 4otb h ARG 21 CO -0.03 0.76 -0.36 0.93 -1.51 0.00 0.00 179.97 179.75 4otb h GLU 22 N -0.46 -0.84 -0.62 0.20 4.39 -0.78 -1.83 114.58 114.63 4otb h GLU 22 Ca -0.01 0.06 0.05 0.00 0.34 0.00 0.00 59.36 59.80 4otb h GLU 22 Cb 0.78 0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 29.59 4otb h GLU 22 CO 0.03 -0.56 0.41 0.28 -1.16 0.00 0.00 179.01 178.01 4otb h VAL 23 N -0.87 1.04 -0.28 3.13 2.07 -1.33 -1.19 116.25 118.81 4otb h VAL 23 Ca -0.06 -0.23 -0.09 0.00 0.82 0.00 0.00 66.70 67.13 4otb h VAL 23 Cb 0.72 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 4otb h VAL 23 CO 0.05 0.12 -0.22 0.28 0.02 0.00 0.00 177.57 177.82 4otb h SER 24 N 0.67 0.52 0.01 0.57 0.02 -1.11 -2.27 113.55 111.95 4otb h SER 24 Ca 0.26 -0.17 -0.18 0.00 -0.84 0.00 0.00 61.79 60.86 4otb h SER 24 Cb 0.19 -0.14 0.02 0.00 0.14 0.00 0.00 62.40 62.60 4otb h SER 24 CO -0.08 0.75 -0.72 -0.33 -1.14 0.00 0.00 176.83 175.31 4otb h GLU 25 N 0.46 0.48 -0.92 3.45 5.08 -0.54 -2.53 114.58 120.06 4otb h GLU 25 Ca 0.07 -0.52 0.14 0.00 -1.00 0.00 0.00 59.36 58.05 4otb h GLU 25 Cb 0.64 0.15 -0.07 0.00 0.50 0.00 0.00 28.75 29.97 4otb h GLU 25 CO 0.05 1.16 0.59 0.00 -1.00 0.00 0.00 179.01 179.81 4otb h ALA 26 N 0.33 1.75 -0.03 3.43 0.00 -1.14 0.52 119.26 124.12 4otb h ALA 26 Ca -0.09 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 4otb h ALA 26 Cb 1.42 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.07 4otb h ALA 26 CO 0.14 0.01 -0.28 0.82 0.00 0.00 0.00 179.25 179.94 4otb h ILE 27 N 0.77 1.49 0.11 0.00 2.04 -1.45 -2.20 117.51 118.28 4otb h ILE 27 Ca 0.46 -1.83 0.02 0.00 1.00 0.00 0.00 64.86 64.51 4otb h ILE 27 Cb 0.65 2.57 -0.04 0.00 -0.74 0.00 0.00 36.82 39.26 4otb h ILE 27 CO -0.22 0.51 -0.32 -1.28 0.00 0.00 0.00 178.15 176.84 4otb h SER 28 N -0.35 -0.93 0.37 1.72 0.87 -0.91 -1.43 113.55 112.88 4otb h SER 28 Ca -0.03 0.11 -0.11 0.00 -1.23 0.00 0.00 61.79 60.54 4otb h SER 28 Cb 0.98 0.36 -0.01 0.00 -0.44 0.00 0.00 62.40 63.29 4otb h SER 28 CO 0.06 -0.41 -0.46 0.08 -0.53 0.00 0.00 176.83 175.57 4otb h ARG 29 N -0.54 0.11 -0.09 2.24 0.11 -1.03 0.29 114.38 115.47 4otb h ARG 29 Ca 0.03 -0.06 -0.13 0.00 0.10 0.00 0.00 59.98 59.92 4otb h ARG 29 Cb 0.58 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.65 4otb h ARG 29 CO -0.20 0.55 -0.52 0.77 0.10 0.00 0.00 179.97 180.67 4otb h SER 30 N 0.09 0.28 -0.03 0.08 0.02 -1.16 -3.16 113.55 109.67 4otb h SER 30 Ca 0.00 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 4otb h SER 30 Cb 0.85 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.31 4otb h SER 30 CO 0.06 0.75 0.00 0.18 -1.14 0.00 0.00 176.83 176.69 4otb n LEU 31 N -3.94 2.16 -3.52 5.07 4.77 -0.56 -4.97 117.00 116.02 4otb n LEU 31 Ca -0.02 -1.03 -0.25 0.00 -0.03 0.00 0.00 56.01 54.68 4otb n LEU 31 Cb 0.56 -0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.69 4otb n LEU 31 CO 0.43 0.40 0.12 -0.67 -1.33 0.00 0.00 177.39 176.34 4otb n ASP 32 N 0.76 -5.61 -4.82 -1.43 -0.08 0.88 -4.98 116.55 101.28 4otb n ASP 32 Ca 0.08 -0.53 -0.32 0.00 -1.51 0.00 0.00 54.79 52.51 4otb n ASP 32 Cb 0.34 -4.48 -0.06 0.00 2.34 0.00 0.00 41.12 39.26 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 -3.24 3.70 0.17 -1.67 0.00 -0.37 -5.02 121.76 115.33 4otb s ALA 33 Ca 0.52 -0.87 -0.32 0.00 0.00 0.00 0.00 51.96 51.30 4otb s ALA 33 Cb -0.25 -1.64 -0.11 0.00 0.00 0.00 0.00 23.12 21.13 4otb s ALA 33 CO 0.64 0.72 1.67 -1.25 0.00 0.00 0.00 175.76 177.55 4otb s PRO 34 N -1.95 4.17 0.38 0.00 0.04 -1.26 -4.61 135.00 131.77 4otb s PRO 34 Ca 0.26 2.49 0.15 0.00 0.04 0.00 0.00 61.00 63.94 4otb s PRO 34 Cb -0.12 -3.22 1.01 0.00 0.04 0.00 0.00 34.50 32.21 4otb s PRO 34 CO 0.17 -0.71 1.80 1.25 0.04 0.00 0.00 177.00 179.55 4otb h LEU 35 N 7.19 0.51 -1.70 -3.56 5.85 -1.92 0.13 115.31 121.81 4otb h LEU 35 Ca -0.43 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.36 4otb h LEU 35 Cb 1.20 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.22 4otb h LEU 35 CO 0.94 0.15 0.00 0.71 -0.34 0.00 0.00 178.44 179.90 4otb h THR 36 N 0.48 0.00 0.00 1.05 1.35 -1.98 -1.34 112.91 112.47 4otb h THR 36 Ca 0.55 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 66.35 4otb h THR 36 Cb 1.26 0.72 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 4otb h THR 36 CO -0.28 0.00 -0.94 -1.54 -0.25 0.00 0.00 175.52 172.51 4otb n SER 37 N -2.49 0.63 -4.73 5.36 3.41 0.45 -4.92 113.62 111.32 4otb n SER 37 Ca -0.01 -0.21 -0.41 0.00 -0.26 0.00 0.00 58.87 57.98 4otb n SER 37 Cb 0.08 0.69 -0.04 0.00 -0.26 0.00 0.00 64.21 64.68 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 -3.17 3.88 -0.12 -3.33 1.01 -0.51 -3.81 120.40 114.35 4otb s VAL 38 Ca 0.05 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.58 4otb s VAL 38 Cb 0.15 -3.99 0.02 0.00 0.00 0.00 0.00 36.38 32.56 4otb s VAL 38 CO 0.79 0.23 -0.11 -0.13 0.00 0.00 0.00 175.10 175.89 4otb s ARG 39 N -0.06 1.83 -0.01 2.72 1.81 -0.89 -5.01 118.95 119.34 4otb s ARG 39 Ca 0.52 -0.38 0.06 0.00 -1.72 0.00 0.00 55.73 54.20 4otb s ARG 39 Cb -0.30 -1.77 -0.03 0.00 -0.45 0.00 0.00 34.95 32.41 4otb s ARG 39 CO 0.34 -0.23 -0.19 0.08 -0.68 0.00 0.00 175.30 174.63 4otb s VAL 40 N 1.53 2.70 -0.09 3.52 1.01 -1.26 -1.11 120.40 126.70 4otb s VAL 40 Ca 0.03 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.04 4otb s VAL 40 Cb -0.13 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.22 4otb s VAL 40 CO -0.08 0.50 -0.09 -0.63 0.00 0.00 0.00 175.10 174.80 4otb s ILE 41 N -0.76 1.04 -0.17 2.22 1.01 0.20 -4.99 121.20 119.76 4otb s ILE 41 Ca 0.12 -0.35 -0.08 0.00 0.00 0.00 0.00 60.65 60.35 4otb s ILE 41 Cb -0.10 -1.02 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 4otb s ILE 41 CO 0.02 0.36 0.09 -0.63 0.00 0.00 0.00 174.94 174.77 4otb s ILE 42 N 1.29 5.03 -0.16 2.92 1.01 -1.26 -0.81 121.20 129.22 4otb s ILE 42 Ca -0.03 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.67 4otb s ILE 42 Cb -0.14 -3.25 0.03 0.00 0.01 0.00 0.00 42.46 39.11 4otb s ILE 42 CO -0.04 0.49 -0.12 -0.89 0.00 0.00 0.00 174.94 174.38 4otb s THR 43 N 0.05 1.52 0.14 2.92 2.01 0.07 -4.96 115.64 117.39 4otb s THR 43 Ca 0.07 -0.68 -0.17 0.00 0.31 0.00 0.00 61.69 61.22 4otb s THR 43 Cb -0.12 -1.48 -0.07 0.00 0.01 0.00 0.00 72.50 70.84 4otb s THR 43 CO 0.00 0.37 0.58 -1.61 -0.69 0.00 0.00 174.62 173.28 4otb s GLU 44 N 1.49 4.09 -0.07 4.92 2.02 -1.26 -0.89 118.70 129.01 4otb s GLU 44 Ca 0.03 0.62 0.03 0.00 0.02 0.00 0.00 54.97 55.68 4otb s GLU 44 Cb -0.14 -3.01 -0.02 0.00 0.10 0.00 0.00 34.13 31.06 4otb s GLU 44 CO -0.10 0.51 -0.15 -1.64 0.02 0.00 0.00 175.26 173.90 4otb s MET 45 N -1.72 2.77 0.35 1.61 -1.94 0.12 -4.87 119.30 115.62 4otb s MET 45 Ca 0.36 -0.71 -0.27 0.00 -1.71 0.00 0.00 55.69 53.36 4otb s MET 45 Cb -0.17 -2.43 -0.09 0.00 2.01 0.00 0.00 34.83 34.15 4otb s MET 45 CO 0.19 0.48 1.18 0.00 -0.01 0.00 0.00 175.02 176.86 4otb s ALA 46 N -0.36 3.30 0.59 3.03 0.00 -1.26 -0.67 121.76 126.39 4otb s ALA 46 Ca 0.04 1.00 0.29 0.00 0.00 0.00 0.00 51.96 53.29 4otb s ALA 46 Cb -0.12 -3.38 1.33 0.00 0.00 0.00 0.00 23.12 20.94 4otb s ALA 46 CO 0.02 -0.44 1.70 0.87 0.00 0.00 0.00 175.76 177.92 4otb h LYS 47 N 3.12 0.00 -0.62 0.00 1.79 -1.96 0.91 116.57 119.81 4otb h LYS 47 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 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 0.64 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.42 4otb n GLY 48 N -1.60 2.06 0.24 3.86 0.00 -1.26 -2.26 105.19 106.23 4otb n GLY 48 Ca 0.15 -0.69 0.02 0.00 0.00 0.00 0.00 46.02 45.51 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 1.12 0.16 -3.97 1.61 8.25 0.32 -4.96 115.22 117.75 4otb n HIS 49 Ca 0.21 -0.43 -0.29 0.00 -0.26 0.00 0.00 57.72 56.94 4otb n HIS 49 Cb 0.63 -0.04 -0.16 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 -0.91 2.04 -0.10 4.41 5.36 -1.23 -4.87 117.98 122.69 4otb s PHE 50 Ca 0.09 -1.22 -0.03 0.00 -0.96 0.00 0.00 56.93 54.81 4otb s PHE 50 Cb 0.05 -1.50 -0.03 0.00 -0.34 0.00 0.00 43.02 41.19 4otb s PHE 50 CO 0.06 -0.66 0.01 0.20 -1.46 0.00 0.00 175.22 173.38 4otb s GLY 51 N 1.52 1.88 -0.19 13.12 0.00 -1.26 0.23 107.32 122.62 4otb s GLY 51 Ca 0.03 -0.79 -0.01 0.00 0.00 0.00 0.00 44.72 43.95 4otb s GLY 51 CO -0.09 -0.50 -0.02 -0.42 0.00 0.00 0.00 173.10 172.07 4otb s ILE 52 N -0.78 0.96 -0.33 0.90 1.01 0.56 -4.74 121.20 118.77 4otb s ILE 52 Ca 0.12 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 60.05 4otb s ILE 52 Cb -0.12 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.07 4otb s ILE 52 CO 0.02 -0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.51 4otb n GLY 53 N 4.90 0.53 0.00 6.18 0.00 -1.26 -2.30 105.19 113.24 4otb n GLY 53 Ca -0.11 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.20 2.91 3.91 -0.02 0.00 -1.26 -5.07 105.19 104.45 4otb n GLY 54 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.80 3.61 0.55 1.61 0.41 -0.97 -5.03 118.70 118.07 4otb s GLU 55 Ca 0.00 -0.11 -0.18 0.00 -0.41 0.00 0.00 54.97 54.27 4otb s GLU 55 Cb 0.00 -2.78 -0.05 0.00 -1.78 0.00 0.00 34.13 29.52 4otb s GLU 55 CO 0.00 0.37 1.09 -0.51 -0.49 0.00 0.00 175.26 175.72 4otb s LEU 56 N -3.10 3.68 0.30 1.80 1.02 -1.26 -0.32 118.68 120.79 4otb s LEU 56 Ca 0.42 2.02 -0.00 0.00 0.02 0.00 0.00 54.13 56.58 4otb s LEU 56 Cb -0.11 -4.56 0.46 0.00 0.02 0.00 0.00 46.19 42.00 4otb s LEU 56 CO 0.27 -1.15 1.87 0.00 0.02 0.00 0.00 176.35 177.36 4otb h ALA 57 N 1.00 1.30 -0.24 4.21 0.00 -0.18 -2.86 119.26 122.50 4otb h ALA 57 Ca -0.49 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.23 4otb h ALA 57 Cb 1.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 4otb h ALA 57 CO 0.57 0.51 0.02 0.66 0.00 0.00 0.00 179.25 181.01 4otb h SER 58 N 0.81 0.32 -0.01 0.00 4.64 -1.72 -3.50 113.55 114.08 4otb h SER 58 Ca 0.19 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 4otb h SER 58 Cb 0.20 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 4otb h SER 58 CO -0.01 0.36 0.00 2.29 -0.87 0.00 0.00 176.83 178.60