#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 0.51 -0.10 4.25 1.01 -1.26 -1.81 121.20 123.81 4otb s ILE 2 Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 4otb s ILE 2 Cb 0.00 -0.81 -0.03 0.00 0.01 0.00 0.00 42.46 41.63 4otb s ILE 2 CO 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 174.94 174.96 4otb s ALA 3 N 1.89 3.03 -0.22 9.38 0.00 -0.09 -5.01 121.76 130.75 4otb s ALA 3 Ca 0.02 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.14 4otb s ALA 3 Cb -0.14 -1.37 0.05 0.00 0.00 0.00 0.00 23.12 21.66 4otb s ALA 3 CO -0.07 0.46 -0.09 -1.14 0.00 0.00 0.00 175.76 174.92 4otb s GLN 4 N -0.44 2.00 -0.18 0.00 0.74 -1.26 -0.75 119.66 119.77 4otb s GLN 4 Ca 0.07 -1.01 -0.07 0.00 0.05 0.00 0.00 55.36 54.40 4otb s GLN 4 Cb -0.12 -2.59 -0.04 0.00 1.10 0.00 0.00 33.01 31.36 4otb s GLN 4 CO 0.02 -0.50 0.06 0.42 -0.55 0.00 0.00 175.29 174.74 4otb s ILE 5 N 1.32 4.76 -0.33 -2.34 1.01 -0.13 -4.98 121.20 120.51 4otb s ILE 5 Ca -0.04 -0.04 -0.11 0.00 0.00 0.00 0.00 60.65 60.45 4otb s ILE 5 Cb -0.18 -3.14 -0.00 0.00 0.01 0.00 0.00 42.46 39.15 4otb s ILE 5 CO -0.07 0.47 0.20 -1.00 0.00 0.00 0.00 174.94 174.54 4otb s HIS 6 N 0.28 3.21 0.14 3.97 3.76 -1.26 -0.90 115.29 124.49 4otb s HIS 6 Ca 0.03 -0.50 0.08 0.00 -0.15 0.00 0.00 55.06 54.52 4otb s HIS 6 Cb -0.12 -2.42 -0.04 0.00 1.11 0.00 0.00 32.58 31.11 4otb s HIS 6 CO 0.00 -0.45 -0.18 0.96 -0.85 0.00 0.00 174.74 174.22 4otb s ILE 7 N 1.65 1.66 0.31 0.60 -4.36 -0.34 -4.99 121.20 115.73 4otb s ILE 7 Ca 0.05 -1.77 -0.28 0.00 -0.26 0.00 0.00 60.65 58.38 4otb s ILE 7 Cb -0.18 -1.68 -0.10 0.00 1.25 0.00 0.00 42.46 41.75 4otb s ILE 7 CO 0.08 -0.28 1.14 -0.76 0.24 0.00 0.00 174.94 175.36 4otb s LEU 8 N -2.42 4.47 0.57 0.37 1.43 -1.26 0.14 118.68 121.97 4otb s LEU 8 Ca 0.12 2.34 -0.20 0.00 -1.03 0.00 0.00 54.13 55.35 4otb s LEU 8 Cb -0.07 -3.71 -0.05 0.00 0.03 0.00 0.00 46.19 42.39 4otb s LEU 8 CO 0.05 -0.29 1.10 -1.84 0.23 0.00 0.00 176.35 175.60 4otb n GLU 9 N 0.92 1.18 0.00 1.70 0.28 0.32 -4.42 120.64 120.62 4otb n GLU 9 Ca 0.00 0.45 0.00 0.00 -0.16 0.00 0.00 57.16 57.45 4otb n GLU 9 Cb 0.45 -2.29 0.00 0.00 1.43 0.00 0.00 31.44 31.03 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 1.11 1.11 3.89 -1.84 0.00 -1.26 -4.90 105.19 103.29 4otb n GLY 10 Ca 0.12 0.00 -0.29 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 3.14 0.63 1.61 1.81 -1.26 -5.07 118.95 119.81 4otb s ARG 11 Ca 0.00 0.43 -0.06 0.00 -1.72 0.00 0.00 55.73 54.39 4otb s ARG 11 Cb 0.00 -2.12 0.03 0.00 -0.45 0.00 0.00 34.95 32.41 4otb s ARG 11 CO 0.00 -0.77 0.93 -1.54 -0.68 0.00 0.00 175.30 173.25 4otb s SER 12 N -4.28 5.32 0.26 0.23 1.04 -1.26 -4.93 113.70 110.07 4otb s SER 12 Ca 0.55 0.59 -0.03 0.00 0.48 0.00 0.00 55.95 57.54 4otb s SER 12 Cb -0.11 -1.46 0.32 0.00 0.10 0.00 0.00 66.02 64.86 4otb s SER 12 CO 0.51 -1.24 1.80 0.44 0.98 0.00 0.00 173.24 175.72 4otb h ASP 13 N -0.30 0.88 -0.15 7.02 5.19 -1.99 -1.80 116.42 125.26 4otb h ASP 13 Ca -0.45 -0.16 -0.11 0.00 -0.62 0.00 0.00 57.03 55.69 4otb h ASP 13 Cb 1.28 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 40.55 4otb h ASP 13 CO 0.60 0.84 -0.26 -0.33 -3.12 0.00 0.00 179.24 176.97 4otb h GLU 14 N 0.91 0.61 -0.54 3.56 3.07 -1.98 -0.17 114.58 120.03 4otb h GLU 14 Ca 0.20 -0.25 -0.11 0.00 -0.50 0.00 0.00 59.36 58.70 4otb h GLU 14 Cb 0.29 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 4otb h GLU 14 CO -0.00 0.82 -0.08 1.96 -1.40 0.00 0.00 179.01 180.30 4otb h GLN 15 N 0.53 1.00 0.00 2.33 4.20 -1.82 -1.45 115.11 119.91 4otb h GLN 15 Ca 0.07 -0.35 -0.16 0.00 0.06 0.00 0.00 58.65 58.28 4otb h GLN 15 Cb 0.73 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 4otb h GLN 15 CO 0.06 1.03 -0.75 0.87 -0.67 0.00 0.00 178.83 179.36 4otb h LYS 16 N 0.90 0.00 -0.20 1.46 1.57 -1.17 -1.95 116.57 117.19 4otb h LYS 16 Ca 0.15 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.78 4otb h LYS 16 Cb 0.63 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 4otb h LYS 16 CO 0.04 0.75 -0.48 1.49 -0.57 0.00 0.00 179.45 180.69 4otb h GLU 17 N 0.00 0.53 -0.19 3.15 4.81 -0.86 -1.78 114.58 120.24 4otb h GLU 17 Ca -0.01 -0.30 -0.07 0.00 -0.13 0.00 0.00 59.36 58.85 4otb h GLU 17 Cb 1.49 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.89 4otb h GLU 17 CO 0.10 0.89 -0.15 1.15 -0.73 0.00 0.00 179.01 180.27 4otb h THR 18 N 0.42 1.33 -0.50 0.32 2.02 -1.22 -2.46 112.91 112.82 4otb h THR 18 Ca 0.02 -1.29 0.05 0.00 0.77 0.00 0.00 66.41 65.97 4otb h THR 18 Cb 1.00 1.76 -0.05 0.00 -1.74 0.00 0.00 68.15 69.11 4otb h THR 18 CO 0.09 0.39 0.22 0.25 0.37 0.00 0.00 175.52 176.84 4otb h LEU 19 N 0.10 0.29 -1.19 2.58 5.85 -1.24 0.11 115.31 121.81 4otb h LEU 19 Ca 0.03 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 4otb h LEU 19 Cb 0.68 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 4otb h LEU 19 CO 0.04 0.20 0.19 0.40 -0.34 0.00 0.00 178.44 178.93 4otb h ILE 20 N 0.44 1.20 -0.00 4.05 2.04 -1.27 -1.36 117.51 122.60 4otb h ILE 20 Ca 0.23 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 4otb h ILE 20 Cb 0.18 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 4otb h ILE 20 CO -0.19 0.25 -0.04 -0.09 0.00 0.00 0.00 178.15 178.07 4otb h ARG 21 N 0.75 0.04 0.38 2.37 2.43 -0.83 -2.80 114.38 116.71 4otb h ARG 21 Ca 0.18 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 4otb h ARG 21 Cb 0.17 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 4otb h ARG 21 CO -0.01 0.76 -0.32 0.93 -1.51 0.00 0.00 179.97 179.82 4otb h GLU 22 N -0.68 -0.67 -0.45 0.20 4.39 -0.72 -1.78 114.58 114.87 4otb h GLU 22 Ca -0.00 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.74 4otb h GLU 22 Cb 0.77 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.55 4otb h GLU 22 CO 0.01 -0.45 0.29 0.28 -1.16 0.00 0.00 179.01 177.98 4otb h VAL 23 N -0.70 1.12 -0.36 3.13 2.07 -1.40 -1.29 116.25 118.82 4otb h VAL 23 Ca -0.03 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.16 4otb h VAL 23 Cb 0.61 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 4otb h VAL 23 CO -0.02 0.12 -0.14 0.28 0.02 0.00 0.00 177.57 177.82 4otb h SER 24 N 0.61 0.63 -0.02 0.57 0.02 -1.18 -2.11 113.55 112.07 4otb h SER 24 Ca 0.16 -0.19 -0.18 0.00 -0.84 0.00 0.00 61.79 60.75 4otb h SER 24 Cb -0.05 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 62.33 4otb h SER 24 CO -0.03 0.79 -0.67 -0.33 -1.14 0.00 0.00 176.83 175.45 4otb h GLU 25 N 0.58 0.49 -1.00 3.45 5.08 -0.74 -2.58 114.58 119.86 4otb h GLU 25 Ca 0.10 -0.50 0.13 0.00 -1.00 0.00 0.00 59.36 58.09 4otb h GLU 25 Cb 0.58 0.14 -0.09 0.00 0.50 0.00 0.00 28.75 29.88 4otb h GLU 25 CO 0.04 1.14 0.63 0.00 -1.00 0.00 0.00 179.01 179.82 4otb h ALA 26 N 0.36 1.56 -0.10 3.43 0.00 -1.11 0.75 119.26 124.16 4otb h ALA 26 Ca -0.08 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 4otb h ALA 26 Cb 1.36 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.96 4otb h ALA 26 CO 0.13 0.18 -0.23 0.82 0.00 0.00 0.00 179.25 180.15 4otb h ILE 27 N 0.95 1.40 0.05 0.00 2.04 -1.42 -1.69 117.51 118.83 4otb h ILE 27 Ca 0.50 -1.54 0.02 0.00 1.00 0.00 0.00 64.86 64.84 4otb h ILE 27 Cb 0.55 2.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.75 4otb h ILE 27 CO -0.27 0.44 -0.21 -1.28 0.00 0.00 0.00 178.15 176.83 4otb h SER 28 N -0.13 -0.60 0.42 1.72 0.87 -0.90 -1.56 113.55 113.37 4otb h SER 28 Ca -0.00 0.08 -0.15 0.00 -1.23 0.00 0.00 61.79 60.49 4otb h SER 28 Cb 0.83 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 63.02 4otb h SER 28 CO 0.05 -0.28 -0.62 0.08 -0.53 0.00 0.00 176.83 175.52 4otb h ARG 29 N -0.36 0.19 -0.23 2.24 0.11 -0.97 0.25 114.38 115.62 4otb h ARG 29 Ca 0.05 -0.14 -0.11 0.00 0.10 0.00 0.00 59.98 59.88 4otb h ARG 29 Cb 0.41 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.50 4otb h ARG 29 CO -0.16 0.75 -0.31 0.77 0.10 0.00 0.00 179.97 181.12 4otb h SER 30 N 0.14 0.47 -0.09 0.08 0.02 -1.13 -3.16 113.55 109.87 4otb h SER 30 Ca -0.01 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 4otb h SER 30 Cb 1.13 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.54 4otb h SER 30 CO 0.09 0.76 0.00 0.18 -1.14 0.00 0.00 176.83 176.73 4otb n LEU 31 N -4.08 2.32 -3.33 5.07 4.77 -0.60 -4.97 117.00 116.18 4otb n LEU 31 Ca -0.01 -1.18 -0.24 0.00 -0.03 0.00 0.00 56.01 54.55 4otb n LEU 31 Cb 0.44 -0.05 0.03 0.00 -2.33 0.00 0.00 43.42 41.51 4otb n LEU 31 CO 0.43 0.46 0.04 -0.67 -1.33 0.00 0.00 177.39 176.32 4otb n ASP 32 N 0.77 -5.31 -4.85 -1.43 -0.08 0.75 -4.97 116.55 101.43 4otb n ASP 32 Ca 0.09 -0.42 -0.33 0.00 -1.51 0.00 0.00 54.79 52.62 4otb n ASP 32 Cb 0.37 -4.28 -0.06 0.00 2.34 0.00 0.00 41.12 39.48 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 3.78 0.18 -1.67 0.00 -0.39 -5.02 121.76 115.49 4otb s ALA 33 Ca 0.42 -0.82 -0.32 0.00 0.00 0.00 0.00 51.96 51.24 4otb s ALA 33 Cb -0.20 -1.73 -0.11 0.00 0.00 0.00 0.00 23.12 21.07 4otb s ALA 33 CO 0.52 0.73 1.74 -1.25 0.00 0.00 0.00 175.76 177.50 4otb s PRO 34 N -1.89 4.14 0.36 0.00 0.04 -1.26 -4.59 135.00 131.80 4otb s PRO 34 Ca 0.26 2.58 0.13 0.00 0.04 0.00 0.00 61.00 64.00 4otb s PRO 34 Cb -0.12 -3.24 0.94 0.00 0.04 0.00 0.00 34.50 32.12 4otb s PRO 34 CO 0.17 -0.76 1.79 1.25 0.04 0.00 0.00 177.00 179.49 4otb h LEU 35 N 7.35 0.58 -2.65 -3.56 5.85 -1.92 0.35 115.31 121.32 4otb h LEU 35 Ca -0.44 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.36 4otb h LEU 35 Cb 1.21 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.22 4otb h LEU 35 CO 0.95 0.18 0.00 0.71 -0.34 0.00 0.00 178.44 179.94 4otb h THR 36 N 0.55 0.00 0.00 1.05 1.35 -1.98 -1.57 112.91 112.31 4otb h THR 36 Ca 0.56 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 66.41 4otb h THR 36 Cb 1.17 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 4otb h THR 36 CO -0.31 0.00 -0.81 -1.54 -0.25 0.00 0.00 175.52 172.61 4otb n SER 37 N -2.91 0.70 -4.72 5.36 3.41 0.11 -4.91 113.62 110.65 4otb n SER 37 Ca -0.03 0.07 -0.42 0.00 -0.26 0.00 0.00 58.87 58.24 4otb n SER 37 Cb 0.07 0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 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 -3.21 3.79 -0.12 -3.33 1.01 -0.59 -3.87 120.40 114.08 4otb s VAL 38 Ca 0.04 1.38 0.00 0.00 0.00 0.00 0.00 61.98 63.40 4otb s VAL 38 Cb 0.13 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.65 4otb s VAL 38 CO 0.76 0.16 -0.11 -0.13 0.00 0.00 0.00 175.10 175.77 4otb s ARG 39 N 0.49 1.86 0.01 2.72 1.81 -0.75 -5.02 118.95 120.08 4otb s ARG 39 Ca 0.56 -0.40 0.06 0.00 -1.72 0.00 0.00 55.73 54.23 4otb s ARG 39 Cb -0.31 -1.76 -0.03 0.00 -0.45 0.00 0.00 34.95 32.39 4otb s ARG 39 CO 0.32 -0.20 -0.16 0.08 -0.68 0.00 0.00 175.30 174.66 4otb s VAL 40 N 1.45 2.94 -0.10 3.52 1.01 -1.26 -0.91 120.40 127.06 4otb s VAL 40 Ca 0.02 -1.03 -0.00 0.00 0.00 0.00 0.00 61.98 60.97 4otb s VAL 40 Cb -0.13 -2.22 0.02 0.00 0.00 0.00 0.00 36.38 34.05 4otb s VAL 40 CO -0.07 0.41 -0.07 -0.63 0.00 0.00 0.00 175.10 174.74 4otb s ILE 41 N -0.88 0.92 -0.16 2.22 1.01 0.07 -4.97 121.20 119.40 4otb s ILE 41 Ca 0.14 -0.25 -0.08 0.00 0.00 0.00 0.00 60.65 60.45 4otb s ILE 41 Cb -0.11 -0.94 -0.05 0.00 0.01 0.00 0.00 42.46 41.38 4otb s ILE 41 CO 0.04 0.34 0.13 -0.63 0.00 0.00 0.00 174.94 174.83 4otb s ILE 42 N 1.52 5.41 -0.15 2.92 1.01 -1.26 -0.95 121.20 129.70 4otb s ILE 42 Ca 0.01 0.18 -0.00 0.00 0.00 0.00 0.00 60.65 60.84 4otb s ILE 42 Cb -0.13 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 38.95 4otb s ILE 42 CO -0.05 0.52 -0.07 -0.89 0.00 0.00 0.00 174.94 174.44 4otb s THR 43 N -0.25 1.17 0.18 2.92 2.01 -0.08 -4.96 115.64 116.62 4otb s THR 43 Ca 0.11 -0.53 -0.17 0.00 0.31 0.00 0.00 61.69 61.40 4otb s THR 43 Cb -0.11 -1.25 -0.08 0.00 0.01 0.00 0.00 72.50 71.07 4otb s THR 43 CO 0.01 0.25 0.64 -1.61 -0.69 0.00 0.00 174.62 173.22 4otb s GLU 44 N 1.63 4.13 -0.06 4.92 2.02 -1.26 -1.20 118.70 128.88 4otb s GLU 44 Ca 0.03 0.70 0.04 0.00 0.02 0.00 0.00 54.97 55.75 4otb s GLU 44 Cb -0.14 -2.94 -0.02 0.00 0.10 0.00 0.00 34.13 31.13 4otb s GLU 44 CO -0.08 0.45 -0.18 -1.64 0.02 0.00 0.00 175.26 173.83 4otb s MET 45 N -1.88 2.64 0.45 1.61 -1.94 0.12 -4.87 119.30 115.42 4otb s MET 45 Ca 0.39 -0.77 -0.23 0.00 -1.71 0.00 0.00 55.69 53.37 4otb s MET 45 Cb -0.16 -2.34 -0.08 0.00 2.01 0.00 0.00 34.83 34.26 4otb s MET 45 CO 0.20 0.48 1.15 0.00 -0.01 0.00 0.00 175.02 176.84 4otb s ALA 46 N -0.38 3.00 0.62 3.03 0.00 -1.26 -0.52 121.76 126.24 4otb s ALA 46 Ca 0.04 0.91 0.28 0.00 0.00 0.00 0.00 51.96 53.18 4otb s ALA 46 Cb -0.12 -3.37 1.48 0.00 0.00 0.00 0.00 23.12 21.11 4otb s ALA 46 CO 0.02 -0.59 1.87 0.87 0.00 0.00 0.00 175.76 177.92 4otb h LYS 47 N 2.13 0.00 -0.67 0.00 1.79 -1.96 0.30 116.57 118.16 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 1.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 4otb h LYS 47 CO 0.61 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.39 4otb n GLY 48 N -1.40 2.44 0.14 3.86 0.00 -1.26 -2.13 105.19 106.84 4otb n GLY 48 Ca 0.04 -0.78 0.01 0.00 0.00 0.00 0.00 46.02 45.29 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 1.22 0.09 -3.96 1.61 8.25 0.10 -4.97 115.22 117.57 4otb n HIS 49 Ca 0.24 -0.46 -0.29 0.00 -0.26 0.00 0.00 57.72 56.95 4otb n HIS 49 Cb 0.76 -0.04 -0.17 0.00 1.12 0.00 0.00 29.99 31.66 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 1.85 -0.04 4.41 5.36 -1.23 -4.87 117.98 122.53 4otb s PHE 50 Ca 0.05 -1.02 0.00 0.00 -0.96 0.00 0.00 56.93 55.00 4otb s PHE 50 Cb 0.03 -1.43 -0.03 0.00 -0.34 0.00 0.00 43.02 41.25 4otb s PHE 50 CO 0.03 -0.60 -0.01 0.20 -1.46 0.00 0.00 175.22 173.39 4otb s GLY 51 N 1.59 1.85 -0.21 13.12 0.00 -1.26 0.51 107.32 122.92 4otb s GLY 51 Ca 0.05 -0.90 -0.03 0.00 0.00 0.00 0.00 44.72 43.84 4otb s GLY 51 CO -0.09 -0.72 0.05 -0.42 0.00 0.00 0.00 173.10 171.91 4otb s ILE 52 N -0.99 0.52 -0.45 0.90 1.01 0.38 -4.76 121.20 117.81 4otb s ILE 52 Ca 0.17 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.18 4otb s ILE 52 Cb -0.11 -1.08 0.00 0.00 0.01 0.00 0.00 42.46 41.28 4otb s ILE 52 CO 0.07 -0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.34 4otb n GLY 53 N 5.04 0.66 0.00 6.18 0.00 -1.26 -2.70 105.19 113.12 4otb n GLY 53 Ca -0.08 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.63 3.20 3.91 -0.02 0.00 -1.26 -5.07 105.19 104.31 4otb n GLY 54 Ca -0.04 0.00 -0.29 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 -0.74 3.62 0.52 1.61 0.41 -1.10 -5.02 118.70 118.00 4otb s GLU 55 Ca 0.00 -0.07 -0.20 0.00 -0.41 0.00 0.00 54.97 54.30 4otb s GLU 55 Cb 0.00 -2.72 -0.07 0.00 -1.78 0.00 0.00 34.13 29.56 4otb s GLU 55 CO 0.00 0.31 1.09 -0.51 -0.49 0.00 0.00 175.26 175.66 4otb s LEU 56 N -3.28 3.80 0.32 1.80 1.02 -1.26 -0.47 118.68 120.60 4otb s LEU 56 Ca 0.42 2.08 -0.00 0.00 0.02 0.00 0.00 54.13 56.65 4otb s LEU 56 Cb -0.11 -4.56 0.51 0.00 0.02 0.00 0.00 46.19 42.05 4otb s LEU 56 CO 0.28 -1.03 1.97 0.00 0.02 0.00 0.00 176.35 177.59 4otb h ALA 57 N 1.38 1.44 -0.27 4.21 0.00 0.10 -2.67 119.26 123.45 4otb h ALA 57 Ca -0.50 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.31 4otb h ALA 57 Cb 1.24 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 4otb h ALA 57 CO 0.58 0.50 0.02 0.66 0.00 0.00 0.00 179.25 181.01 4otb h SER 58 N 1.00 0.37 -0.01 0.00 4.64 -1.69 -3.50 113.55 114.35 4otb h SER 58 Ca 0.27 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 4otb h SER 58 Cb -0.08 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 4otb h SER 58 CO -0.05 0.42 0.00 2.29 -0.87 0.00 0.00 176.83 178.61