#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 0.46 -0.12 4.25 1.01 -1.26 -2.12 121.20 123.42 4otb s ILE 2 Ca 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 60.65 60.46 4otb s ILE 2 Cb 0.00 -0.76 -0.03 0.00 0.01 0.00 0.00 42.46 41.69 4otb s ILE 2 CO 0.00 0.07 -0.06 0.00 0.00 0.00 0.00 174.94 174.95 4otb s ALA 3 N 1.92 2.96 -0.23 9.38 0.00 -0.23 -5.00 121.76 130.55 4otb s ALA 3 Ca 0.03 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.15 4otb s ALA 3 Cb -0.14 -1.39 0.04 0.00 0.00 0.00 0.00 23.12 21.63 4otb s ALA 3 CO -0.07 0.36 -0.14 -1.14 0.00 0.00 0.00 175.76 174.78 4otb s GLN 4 N -0.11 2.57 -0.18 0.00 0.74 -1.26 -0.71 119.66 120.71 4otb s GLN 4 Ca 0.01 -1.13 -0.07 0.00 0.05 0.00 0.00 55.36 54.22 4otb s GLN 4 Cb -0.13 -2.79 -0.04 0.00 1.10 0.00 0.00 33.01 31.15 4otb s GLN 4 CO 0.03 -0.43 0.07 0.42 -0.55 0.00 0.00 175.29 174.83 4otb s ILE 5 N 1.19 4.88 -0.30 -2.34 1.01 0.10 -4.98 121.20 120.76 4otb s ILE 5 Ca -0.03 -0.01 -0.10 0.00 0.00 0.00 0.00 60.65 60.52 4otb s ILE 5 Cb -0.17 -3.19 -0.02 0.00 0.01 0.00 0.00 42.46 39.09 4otb s ILE 5 CO -0.08 0.48 0.16 -1.00 0.00 0.00 0.00 174.94 174.49 4otb s HIS 6 N 0.22 3.18 0.11 3.97 3.76 -1.26 -0.98 115.29 124.29 4otb s HIS 6 Ca 0.05 -0.36 0.07 0.00 -0.15 0.00 0.00 55.06 54.66 4otb s HIS 6 Cb -0.12 -2.35 -0.04 0.00 1.11 0.00 0.00 32.58 31.18 4otb s HIS 6 CO 0.00 -0.37 -0.16 0.96 -0.85 0.00 0.00 174.74 174.32 4otb s ILE 7 N 1.66 1.44 0.35 0.60 -4.36 -0.14 -4.98 121.20 115.76 4otb s ILE 7 Ca 0.06 -1.61 -0.27 0.00 -0.26 0.00 0.00 60.65 58.57 4otb s ILE 7 Cb -0.17 -1.47 -0.09 0.00 1.25 0.00 0.00 42.46 41.98 4otb s ILE 7 CO 0.07 -0.27 1.16 -0.76 0.24 0.00 0.00 174.94 175.38 4otb s LEU 8 N -2.18 4.33 0.59 0.37 1.43 -1.26 0.09 118.68 122.05 4otb s LEU 8 Ca 0.07 2.35 -0.20 0.00 -1.03 0.00 0.00 54.13 55.32 4otb s LEU 8 Cb -0.07 -3.86 -0.04 0.00 0.03 0.00 0.00 46.19 42.24 4otb s LEU 8 CO 0.04 -0.48 1.16 -1.84 0.23 0.00 0.00 176.35 175.46 4otb n GLU 9 N 0.51 1.19 0.00 1.70 0.28 0.06 -4.44 120.64 119.94 4otb n GLU 9 Ca 0.02 0.45 0.00 0.00 -0.16 0.00 0.00 57.16 57.47 4otb n GLU 9 Cb 0.45 -2.36 0.00 0.00 1.43 0.00 0.00 31.44 30.96 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 1.05 1.15 3.89 -1.84 0.00 -1.26 -4.90 105.19 103.29 4otb n GLY 10 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 3.36 0.65 1.61 1.81 -1.26 -5.07 118.95 120.04 4otb s ARG 11 Ca 0.00 0.40 -0.07 0.00 -1.72 0.00 0.00 55.73 54.34 4otb s ARG 11 Cb 0.00 -2.20 0.03 0.00 -0.45 0.00 0.00 34.95 32.33 4otb s ARG 11 CO 0.00 -0.54 0.96 -1.54 -0.68 0.00 0.00 175.30 173.50 4otb s SER 12 N -4.20 5.25 0.22 0.23 1.04 -1.26 -4.93 113.70 110.05 4otb s SER 12 Ca 0.53 0.64 -0.08 0.00 0.48 0.00 0.00 55.95 57.51 4otb s SER 12 Cb -0.11 -1.47 0.19 0.00 0.10 0.00 0.00 66.02 64.73 4otb s SER 12 CO 0.49 -1.31 1.85 0.44 0.98 0.00 0.00 173.24 175.69 4otb h ASP 13 N -0.39 1.05 -0.53 7.02 5.19 -1.99 -1.94 116.42 124.84 4otb h ASP 13 Ca -0.45 -0.09 -0.07 0.00 -0.62 0.00 0.00 57.03 55.80 4otb h ASP 13 Cb 1.28 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 40.50 4otb h ASP 13 CO 0.61 0.84 0.08 -0.33 -3.12 0.00 0.00 179.24 177.32 4otb h GLU 14 N 1.18 0.92 -0.65 3.56 3.07 -1.98 0.01 114.58 120.70 4otb h GLU 14 Ca 0.30 -0.23 -0.09 0.00 -0.50 0.00 0.00 59.36 58.84 4otb h GLU 14 Cb 0.01 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 4otb h GLU 14 CO -0.05 0.87 0.07 1.96 -1.40 0.00 0.00 179.01 180.45 4otb h GLN 15 N 0.87 1.09 0.00 2.33 4.20 -1.84 -1.27 115.11 120.50 4otb h GLN 15 Ca 0.18 -0.31 -0.14 0.00 0.06 0.00 0.00 58.65 58.44 4otb h GLN 15 Cb 0.40 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 4otb h GLN 15 CO 0.01 1.02 -0.64 0.87 -0.67 0.00 0.00 178.83 179.42 4otb h LYS 16 N 1.01 0.00 -0.16 1.46 1.57 -1.04 -1.68 116.57 117.74 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 0.49 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 4otb h LYS 16 CO 0.02 0.64 -0.57 1.49 -0.57 0.00 0.00 179.45 180.47 4otb h GLU 17 N 0.00 0.49 -0.20 3.15 4.81 -0.75 -1.68 114.58 120.40 4otb h GLU 17 Ca -0.01 -0.31 -0.08 0.00 -0.13 0.00 0.00 59.36 58.83 4otb h GLU 17 Cb 1.39 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.81 4otb h GLU 17 CO 0.08 0.92 -0.17 1.15 -0.73 0.00 0.00 179.01 180.26 4otb h THR 18 N 0.37 1.33 -0.57 0.32 2.02 -1.15 -2.39 112.91 112.83 4otb h THR 18 Ca 0.00 -1.32 0.05 0.00 0.77 0.00 0.00 66.41 65.91 4otb h THR 18 Cb 1.10 1.75 -0.05 0.00 -1.74 0.00 0.00 68.15 69.21 4otb h THR 18 CO 0.10 0.40 0.29 0.25 0.37 0.00 0.00 175.52 176.94 4otb h LEU 19 N 0.14 0.42 -1.06 2.58 5.85 -1.20 0.93 115.31 122.98 4otb h LEU 19 Ca 0.03 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 4otb h LEU 19 Cb 0.71 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 4otb h LEU 19 CO 0.04 0.28 0.17 0.40 -0.34 0.00 0.00 178.44 179.00 4otb h ILE 20 N 0.56 1.22 0.03 4.05 2.04 -1.25 -1.46 117.51 122.70 4otb h ILE 20 Ca 0.25 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 4otb h ILE 20 Cb 0.16 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 4otb h ILE 20 CO -0.17 0.29 -0.01 -0.09 0.00 0.00 0.00 178.15 178.17 4otb h ARG 21 N 0.82 -0.03 0.45 2.37 2.43 -0.82 -2.57 114.38 117.03 4otb h ARG 21 Ca 0.19 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 4otb h ARG 21 Cb 0.25 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 4otb h ARG 21 CO -0.01 0.57 -0.36 0.93 -1.51 0.00 0.00 179.97 179.59 4otb h GLU 22 N -0.67 -0.78 -0.64 0.20 4.39 -0.81 -1.56 114.58 114.71 4otb h GLU 22 Ca -0.00 0.05 0.05 0.00 0.34 0.00 0.00 59.36 59.80 4otb h GLU 22 Cb 0.62 0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 29.41 4otb h GLU 22 CO 0.01 -0.52 0.42 0.28 -1.16 0.00 0.00 179.01 178.04 4otb h VAL 23 N -0.80 1.04 -0.36 3.13 2.07 -1.40 -1.13 116.25 118.80 4otb h VAL 23 Ca -0.04 -0.23 -0.09 0.00 0.82 0.00 0.00 66.70 67.15 4otb h VAL 23 Cb 0.69 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 4otb h VAL 23 CO -0.01 0.12 -0.15 0.28 0.02 0.00 0.00 177.57 177.84 4otb h SER 24 N 0.68 0.63 -0.03 0.57 0.02 -1.01 -2.18 113.55 112.23 4otb h SER 24 Ca 0.27 -0.19 -0.15 0.00 -0.84 0.00 0.00 61.79 60.88 4otb h SER 24 Cb 0.19 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 62.57 4otb h SER 24 CO -0.08 0.80 -0.56 -0.33 -1.14 0.00 0.00 176.83 175.52 4otb h GLU 25 N 0.58 0.43 -0.94 3.45 5.08 -0.58 -2.59 114.58 120.01 4otb h GLU 25 Ca 0.10 -0.42 0.14 0.00 -1.00 0.00 0.00 59.36 58.18 4otb h GLU 25 Cb 0.58 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.87 4otb h GLU 25 CO 0.04 1.08 0.60 0.00 -1.00 0.00 0.00 179.01 179.72 4otb h ALA 26 N 0.37 1.72 -0.06 3.43 0.00 -1.12 0.15 119.26 123.76 4otb h ALA 26 Ca -0.06 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 4otb h ALA 26 Cb 1.25 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.89 4otb h ALA 26 CO 0.11 0.02 -0.16 0.82 0.00 0.00 0.00 179.25 180.04 4otb h ILE 27 N 0.79 1.43 -0.04 0.00 2.04 -1.43 -1.91 117.51 118.40 4otb h ILE 27 Ca 0.48 -1.53 0.04 0.00 1.00 0.00 0.00 64.86 64.85 4otb h ILE 27 Cb 0.68 2.29 -0.05 0.00 -0.74 0.00 0.00 36.82 39.00 4otb h ILE 27 CO -0.24 0.42 -0.27 -1.28 0.00 0.00 0.00 178.15 176.78 4otb h SER 28 N -0.30 -0.83 0.44 1.72 0.87 -0.88 -1.41 113.55 113.15 4otb h SER 28 Ca -0.00 0.12 -0.14 0.00 -1.23 0.00 0.00 61.79 60.53 4otb h SER 28 Cb 0.77 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 63.06 4otb h SER 28 CO 0.03 -0.34 -0.61 0.08 -0.53 0.00 0.00 176.83 175.47 4otb h ARG 29 N -0.40 0.17 -0.19 2.24 0.11 -1.10 0.28 114.38 115.48 4otb h ARG 29 Ca 0.07 -0.12 -0.11 0.00 0.10 0.00 0.00 59.98 59.93 4otb h ARG 29 Cb 0.50 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.59 4otb h ARG 29 CO -0.26 0.72 -0.33 0.77 0.10 0.00 0.00 179.97 180.97 4otb h SER 30 N 0.12 0.41 -0.05 0.08 0.02 -1.04 -3.17 113.55 109.92 4otb h SER 30 Ca -0.01 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 4otb h SER 30 Cb 1.10 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.53 4otb h SER 30 CO 0.09 0.73 0.00 0.18 -1.14 0.00 0.00 176.83 176.69 4otb n LEU 31 N -4.07 2.16 -3.38 5.07 4.77 -0.56 -4.97 117.00 116.01 4otb n LEU 31 Ca -0.01 -1.10 -0.24 0.00 -0.03 0.00 0.00 56.01 54.63 4otb n LEU 31 Cb 0.45 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.55 4otb n LEU 31 CO 0.42 0.42 0.08 -0.67 -1.33 0.00 0.00 177.39 176.31 4otb n ASP 32 N 0.71 -5.60 -4.85 -1.43 -0.08 0.84 -4.97 116.55 101.16 4otb n ASP 32 Ca 0.08 -0.45 -0.31 0.00 -1.51 0.00 0.00 54.79 52.59 4otb n ASP 32 Cb 0.33 -4.49 -0.05 0.00 2.34 0.00 0.00 41.12 39.25 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 -3.20 3.80 0.17 -1.67 0.00 -0.33 -5.02 121.76 115.52 4otb s ALA 33 Ca 0.46 -0.89 -0.32 0.00 0.00 0.00 0.00 51.96 51.21 4otb s ALA 33 Cb -0.21 -1.67 -0.11 0.00 0.00 0.00 0.00 23.12 21.13 4otb s ALA 33 CO 0.56 0.77 1.65 -1.25 0.00 0.00 0.00 175.76 177.50 4otb s PRO 34 N -2.29 4.17 0.38 0.00 0.04 -1.26 -4.61 135.00 131.42 4otb s PRO 34 Ca 0.30 2.48 0.14 0.00 0.04 0.00 0.00 61.00 63.96 4otb s PRO 34 Cb -0.13 -3.18 0.96 0.00 0.04 0.00 0.00 34.50 32.20 4otb s PRO 34 CO 0.23 -0.69 1.82 1.25 0.04 0.00 0.00 177.00 179.65 4otb h LEU 35 N 7.02 0.55 -1.98 -3.56 5.85 -1.92 -0.16 115.31 121.11 4otb h LEU 35 Ca -0.43 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.35 4otb h LEU 35 Cb 1.20 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.20 4otb h LEU 35 CO 0.94 0.20 0.00 0.71 -0.34 0.00 0.00 178.44 179.95 4otb h THR 36 N 0.54 0.00 0.00 1.05 1.35 -1.98 -1.69 112.91 112.18 4otb h THR 36 Ca 0.52 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 66.33 4otb h THR 36 Cb 1.11 0.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 4otb h THR 36 CO -0.26 0.00 -0.98 -1.54 -0.25 0.00 0.00 175.52 172.49 4otb n SER 37 N -2.63 0.67 -4.73 5.36 3.41 -0.07 -4.92 113.62 110.71 4otb n SER 37 Ca -0.02 0.07 -0.41 0.00 -0.26 0.00 0.00 58.87 58.25 4otb n SER 37 Cb 0.08 0.60 -0.03 0.00 -0.26 0.00 0.00 64.21 64.59 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 -3.27 3.57 -0.12 -3.33 1.01 -0.64 -3.85 120.40 113.78 4otb s VAL 38 Ca 0.02 1.27 -0.00 0.00 0.00 0.00 0.00 61.98 63.27 4otb s VAL 38 Cb 0.12 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.72 4otb s VAL 38 CO 0.78 0.18 -0.09 -0.13 0.00 0.00 0.00 175.10 175.84 4otb s ARG 39 N 0.09 1.68 0.02 2.72 1.81 -0.90 -5.01 118.95 119.36 4otb s ARG 39 Ca 0.55 -0.32 0.05 0.00 -1.72 0.00 0.00 55.73 54.29 4otb s ARG 39 Cb -0.33 -1.66 -0.03 0.00 -0.45 0.00 0.00 34.95 32.48 4otb s ARG 39 CO 0.35 -0.23 -0.13 0.08 -0.68 0.00 0.00 175.30 174.68 4otb s VAL 40 N 1.57 3.14 -0.08 3.52 1.01 -1.26 -1.06 120.40 127.24 4otb s VAL 40 Ca 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.02 4otb s VAL 40 Cb -0.13 -2.33 0.02 0.00 0.00 0.00 0.00 36.38 33.94 4otb s VAL 40 CO -0.08 0.37 -0.07 -0.63 0.00 0.00 0.00 175.10 174.70 4otb s ILE 41 N -0.94 0.81 -0.16 2.22 1.01 0.11 -4.98 121.20 119.28 4otb s ILE 41 Ca 0.15 -0.22 -0.06 0.00 0.00 0.00 0.00 60.65 60.52 4otb s ILE 41 Cb -0.11 -0.83 -0.04 0.00 0.01 0.00 0.00 42.46 41.49 4otb s ILE 41 CO 0.06 0.31 0.06 -0.63 0.00 0.00 0.00 174.94 174.74 4otb s ILE 42 N 1.29 4.76 -0.17 2.92 1.01 -1.26 -0.72 121.20 129.03 4otb s ILE 42 Ca -0.04 -0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.56 4otb s ILE 42 Cb -0.14 -3.12 0.03 0.00 0.01 0.00 0.00 42.46 39.25 4otb s ILE 42 CO -0.03 0.50 -0.12 -0.89 0.00 0.00 0.00 174.94 174.40 4otb s THR 43 N 0.04 1.58 0.20 2.92 2.01 -0.15 -4.96 115.64 117.28 4otb s THR 43 Ca 0.05 -0.80 -0.17 0.00 0.31 0.00 0.00 61.69 61.09 4otb s THR 43 Cb -0.12 -1.57 -0.08 0.00 0.01 0.00 0.00 72.50 70.74 4otb s THR 43 CO 0.01 0.31 0.65 -1.61 -0.69 0.00 0.00 174.62 173.29 4otb s GLU 44 N 1.46 4.10 -0.06 4.92 2.02 -1.25 -0.97 118.70 128.91 4otb s GLU 44 Ca 0.02 0.68 0.04 0.00 0.02 0.00 0.00 54.97 55.73 4otb s GLU 44 Cb -0.14 -2.85 -0.02 0.00 0.10 0.00 0.00 34.13 31.21 4otb s GLU 44 CO -0.09 0.41 -0.19 -1.64 0.02 0.00 0.00 175.26 173.77 4otb s MET 45 N -2.08 2.63 0.34 1.61 -1.94 0.11 -4.87 119.30 115.10 4otb s MET 45 Ca 0.42 -0.78 -0.28 0.00 -1.71 0.00 0.00 55.69 53.34 4otb s MET 45 Cb -0.15 -2.32 -0.09 0.00 2.01 0.00 0.00 34.83 34.27 4otb s MET 45 CO 0.20 0.47 1.19 0.00 -0.01 0.00 0.00 175.02 176.87 4otb s ALA 46 N -0.35 3.34 0.60 3.03 0.00 -1.26 -0.76 121.76 126.36 4otb s ALA 46 Ca 0.03 1.03 0.29 0.00 0.00 0.00 0.00 51.96 53.31 4otb s ALA 46 Cb -0.12 -3.39 1.31 0.00 0.00 0.00 0.00 23.12 20.91 4otb s ALA 46 CO 0.02 -0.43 1.69 0.87 0.00 0.00 0.00 175.76 177.91 4otb h LYS 47 N 3.26 0.00 -0.64 0.00 1.79 -1.96 0.92 116.57 119.94 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 1.22 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 4otb h LYS 47 CO 0.65 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.43 4otb n GLY 48 N -1.58 2.26 0.15 3.86 0.00 -1.26 -2.23 105.19 106.38 4otb n GLY 48 Ca 0.14 -0.72 0.01 0.00 0.00 0.00 0.00 46.02 45.45 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 1.06 0.09 -3.98 1.61 8.25 0.32 -4.97 115.22 117.60 4otb n HIS 49 Ca 0.22 -0.42 -0.29 0.00 -0.26 0.00 0.00 57.72 56.97 4otb n HIS 49 Cb 0.72 -0.04 -0.16 0.00 1.12 0.00 0.00 29.99 31.63 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 -0.87 2.03 -0.03 4.41 5.36 -1.22 -4.87 117.98 122.78 4otb s PHE 50 Ca 0.05 -1.17 0.00 0.00 -0.96 0.00 0.00 56.93 54.86 4otb s PHE 50 Cb 0.03 -1.50 -0.03 0.00 -0.34 0.00 0.00 43.02 41.17 4otb s PHE 50 CO 0.04 -0.65 -0.01 0.20 -1.46 0.00 0.00 175.22 173.34 4otb s GLY 51 N 1.53 1.84 -0.17 13.12 0.00 -1.26 0.64 107.32 123.02 4otb s GLY 51 Ca 0.04 -0.90 -0.02 0.00 0.00 0.00 0.00 44.72 43.83 4otb s GLY 51 CO -0.10 -0.73 0.02 -0.42 0.00 0.00 0.00 173.10 171.88 4otb s ILE 52 N -0.99 0.55 -0.56 0.90 1.01 0.26 -4.75 121.20 117.62 4otb s ILE 52 Ca 0.17 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.35 4otb s ILE 52 Cb -0.11 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.38 4otb s ILE 52 CO 0.07 -0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.51 4otb n GLY 53 N 5.05 0.71 0.00 6.18 0.00 -1.26 -2.43 105.19 113.43 4otb n GLY 53 Ca -0.09 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.26 3.26 3.90 -0.02 0.00 -1.26 -5.07 105.19 104.75 4otb n GLY 54 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.85 3.63 0.51 1.61 0.41 -1.02 -5.02 118.70 117.96 4otb s GLU 55 Ca 0.00 -0.05 -0.20 0.00 -0.41 0.00 0.00 54.97 54.31 4otb s GLU 55 Cb 0.00 -2.73 -0.07 0.00 -1.78 0.00 0.00 34.13 29.54 4otb s GLU 55 CO 0.00 0.33 1.08 -0.51 -0.49 0.00 0.00 175.26 175.67 4otb s LEU 56 N -3.19 3.82 0.31 1.80 1.02 -1.26 -0.58 118.68 120.60 4otb s LEU 56 Ca 0.43 2.04 -0.01 0.00 0.02 0.00 0.00 54.13 56.61 4otb s LEU 56 Cb -0.11 -4.55 0.48 0.00 0.02 0.00 0.00 46.19 42.03 4otb s LEU 56 CO 0.27 -0.96 1.96 0.00 0.02 0.00 0.00 176.35 177.65 4otb h ALA 57 N 1.45 1.42 -0.14 4.21 0.00 0.26 -2.69 119.26 123.77 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 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 4otb h ALA 57 CO 0.58 0.52 -0.05 0.66 0.00 0.00 0.00 179.25 180.96 4otb h SER 58 N 1.03 0.18 -0.01 0.00 4.64 -1.71 -3.50 113.55 114.19 4otb h SER 58 Ca 0.27 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 4otb h SER 58 Cb -0.08 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 4otb h SER 58 CO -0.06 0.27 0.00 2.29 -0.87 0.00 0.00 176.83 178.47