#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4otc s ILE 2 N 0.00 1.24 -0.07 4.25 1.01 -1.26 -1.77 121.20 124.61 4otc s ILE 2 Ca 0.00 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.26 4otc s ILE 2 Cb 0.00 -1.21 -0.02 0.00 0.01 0.00 0.00 42.46 41.24 4otc s ILE 2 CO 0.00 0.40 -0.18 0.00 0.00 0.00 0.00 174.94 175.16 4otc s ALA 3 N 1.56 2.47 -0.15 9.38 0.00 -0.14 -5.01 121.76 129.87 4otc s ALA 3 Ca 0.04 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.02 4otc s ALA 3 Cb -0.13 -0.90 0.01 0.00 0.00 0.00 0.00 23.12 22.11 4otc s ALA 3 CO -0.08 0.45 -0.20 -1.14 0.00 0.00 0.00 175.76 174.79 4otc s GLN 4 N -0.34 2.87 -0.18 0.00 0.74 -1.26 -0.28 119.66 121.22 4otc s GLN 4 Ca 0.02 -0.79 -0.02 0.00 0.05 0.00 0.00 55.36 54.62 4otc s GLN 4 Cb -0.13 -2.40 -0.01 0.00 1.10 0.00 0.00 33.01 31.58 4otc s GLN 4 CO 0.02 -0.10 -0.09 0.42 -0.55 0.00 0.00 175.29 174.99 4otc s ILE 5 N 1.04 3.16 -0.31 -2.34 1.01 0.99 -4.97 121.20 119.78 4otc s ILE 5 Ca -0.02 -0.59 -0.13 0.00 0.00 0.00 0.00 60.65 59.91 4otc s ILE 5 Cb -0.14 -2.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 4otc s ILE 5 CO -0.06 0.48 0.27 -1.00 0.00 0.00 0.00 174.94 174.62 4otc s HIS 6 N 0.96 3.22 0.06 3.97 3.76 -1.26 0.15 115.29 126.16 4otc s HIS 6 Ca -0.01 0.03 0.04 0.00 -0.15 0.00 0.00 55.06 54.97 4otc s HIS 6 Cb -0.15 -2.50 -0.03 0.00 1.11 0.00 0.00 32.58 31.01 4otc s HIS 6 CO -0.00 -0.29 -0.12 0.96 -0.85 0.00 0.00 174.74 174.43 4otc s ILE 7 N 1.85 0.92 0.43 0.60 -4.36 -0.46 -4.98 121.20 115.19 4otc s ILE 7 Ca 0.09 -1.23 -0.24 0.00 -0.26 0.00 0.00 60.65 59.00 4otc s ILE 7 Cb -0.17 -0.91 -0.08 0.00 1.25 0.00 0.00 42.46 42.55 4otc s ILE 7 CO 0.11 -0.28 1.22 -0.76 0.24 0.00 0.00 174.94 175.47 4otc s LEU 8 N -1.69 4.12 0.74 0.37 1.43 -1.26 -0.28 118.68 122.11 4otc s LEU 8 Ca -0.05 2.46 -0.14 0.00 -1.03 0.00 0.00 54.13 55.37 4otc s LEU 8 Cb -0.10 -4.07 0.05 0.00 0.03 0.00 0.00 46.19 42.10 4otc s LEU 8 CO 0.02 -0.87 1.17 -1.83 0.23 0.00 0.00 176.35 175.07 4otc s GLU 9 N -2.44 2.14 0.00 1.70 -1.05 -0.22 -4.44 118.70 114.39 4otc s GLU 9 Ca 0.60 1.62 0.00 0.00 -0.15 0.00 0.00 54.97 57.04 4otc s GLU 9 Cb -0.33 -1.85 0.00 0.00 -0.44 0.00 0.00 34.13 31.51 4otc s GLU 9 CO 0.41 -1.80 0.00 0.41 0.95 0.00 0.00 175.26 175.23 4otc n GLY 10 N 0.09 1.34 3.85 -3.83 0.00 -1.26 -4.92 105.19 100.46 4otc n GLY 10 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 4otc n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 4otc s ARG 11 N 0.00 3.93 0.74 1.61 3.00 -1.26 -5.07 118.95 121.91 4otc s ARG 11 Ca 0.00 0.72 -0.11 0.00 0.00 0.00 0.00 55.73 56.34 4otc s ARG 11 Cb 0.00 -2.31 0.03 0.00 0.00 0.00 0.00 34.95 32.68 4otc s ARG 11 CO 0.00 -0.05 1.08 -1.54 0.00 0.00 0.00 175.30 174.79 4otc s SER 12 N -2.80 5.03 0.39 0.23 1.04 -1.26 -4.90 113.70 111.43 4otc s SER 12 Ca 0.55 1.38 0.08 0.00 0.48 0.00 0.00 55.95 58.44 4otc s SER 12 Cb -0.10 -2.19 0.78 0.00 0.10 0.00 0.00 66.02 64.62 4otc s SER 12 CO 0.26 -1.63 1.96 0.44 0.98 0.00 0.00 173.24 175.25 4otc h ASP 13 N -0.85 0.37 -0.45 7.02 5.19 -1.99 -2.02 116.42 123.69 4otc h ASP 13 Ca -0.45 -0.05 -0.09 0.00 -0.62 0.00 0.00 57.03 55.82 4otc h ASP 13 Cb 1.24 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.64 4otc h ASP 13 CO 0.59 0.40 -0.06 -0.08 -3.12 0.00 0.00 179.24 176.98 4otc h GLU 14 N 0.40 0.84 -0.68 3.56 4.81 -1.99 -0.07 114.58 121.44 4otc h GLU 14 Ca 0.09 -0.30 -0.07 0.00 -0.13 0.00 0.00 59.36 58.96 4otc h GLU 14 Cb 0.20 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 4otc h GLU 14 CO -0.00 0.92 0.14 1.96 -0.73 0.00 0.00 179.01 181.30 4otc h GLN 15 N 0.67 1.11 -0.14 1.92 4.20 -1.81 -1.33 115.11 119.72 4otc h GLN 15 Ca 0.12 -0.28 -0.12 0.00 0.06 0.00 0.00 58.65 58.44 4otc h GLN 15 Cb 0.58 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 4otc h GLN 15 CO 0.03 0.99 -0.43 0.87 -0.67 0.00 0.00 178.83 179.63 4otc h LYS 16 N 1.04 0.34 -0.42 1.46 1.57 -1.13 -0.65 116.57 118.79 4otc h LYS 16 Ca 0.21 -0.17 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 4otc h LYS 16 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 4otc h LYS 16 CO 0.01 0.71 -0.02 0.93 -0.57 0.00 0.00 179.45 180.51 4otc h GLU 17 N 0.28 0.75 -0.28 3.15 5.08 -0.66 -1.55 114.58 121.34 4otc h GLU 17 Ca 0.02 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 4otc h GLU 17 Cb 0.87 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 4otc h GLU 17 CO 0.07 0.84 0.10 1.15 -1.00 0.00 0.00 179.01 180.17 4otc h THR 18 N 0.58 1.19 -0.35 1.13 2.02 -1.06 -1.87 112.91 114.55 4otc h THR 18 Ca 0.12 -0.59 0.07 0.00 0.77 0.00 0.00 66.41 66.77 4otc h THR 18 Cb 0.51 1.05 -0.07 0.00 -1.74 0.00 0.00 68.15 67.90 4otc h THR 18 CO 0.02 0.20 -0.08 0.25 0.37 0.00 0.00 175.52 176.28 4otc h LEU 19 N 0.30 -0.32 -0.97 2.58 5.85 -0.94 0.16 115.31 121.97 4otc h LEU 19 Ca 0.09 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.95 4otc h LEU 19 Cb 0.21 0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.40 4otc h LEU 19 CO -0.01 -0.11 0.63 0.40 -0.34 0.00 0.00 178.44 179.02 4otc h ILE 20 N 0.00 1.17 0.08 4.05 2.04 -1.10 -0.97 117.51 122.78 4otc h ILE 20 Ca 0.17 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.60 4otc h ILE 20 Cb 0.26 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.17 4otc h ILE 20 CO -0.36 0.22 -0.04 -0.09 0.00 0.00 0.00 178.15 177.89 4otc h ARG 21 N 1.23 -0.10 -0.58 2.37 2.43 -0.36 -2.54 114.38 116.83 4otc h ARG 21 Ca 0.38 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.57 4otc h ARG 21 Cb -0.00 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 4otc h ARG 21 CO -0.12 0.37 0.38 0.93 -1.51 0.00 0.00 179.97 180.02 4otc h GLU 22 N -0.62 0.75 -0.62 0.20 4.39 -0.65 -1.57 114.58 116.46 4otc h GLU 22 Ca -0.01 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.58 4otc h GLU 22 Cb 0.52 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 4otc h GLU 22 CO 0.02 0.49 0.13 0.28 -1.16 0.00 0.00 179.01 178.77 4otc h VAL 23 N 0.77 1.25 -0.56 3.13 2.07 -1.27 -0.11 116.25 121.53 4otc h VAL 23 Ca 0.21 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.75 4otc h VAL 23 Cb -0.08 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 4otc h VAL 23 CO -0.05 0.35 0.14 0.28 0.02 0.00 0.00 177.57 178.31 4otc h SER 24 N 0.93 0.84 -0.48 0.57 0.02 -1.14 -1.27 113.55 113.02 4otc h SER 24 Ca 0.19 -0.23 -0.11 0.00 -0.84 0.00 0.00 61.79 60.81 4otc h SER 24 Cb 0.36 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 4otc h SER 24 CO 0.00 0.85 -0.13 -0.33 -1.14 0.00 0.00 176.83 176.08 4otc h GLU 25 N 0.79 0.95 -0.60 3.45 5.08 -0.98 -1.27 114.58 122.00 4otc h GLU 25 Ca 0.18 -0.37 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 4otc h GLU 25 Cb 0.33 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 4otc h GLU 25 CO 0.00 1.03 0.25 0.00 -1.00 0.00 0.00 179.01 179.29 4otc h ALA 26 N 0.88 1.31 -0.07 3.43 0.00 -0.75 -0.21 119.26 123.85 4otc h ALA 26 Ca 0.12 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 4otc h ALA 26 Cb 0.69 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.24 4otc h ALA 26 CO 0.05 0.51 -0.23 0.82 0.00 0.00 0.00 179.25 180.40 4otc h ILE 27 N 0.85 1.42 -0.46 0.00 2.04 -1.06 -1.19 117.51 119.11 4otc h ILE 27 Ca 0.20 -1.61 -0.00 0.00 1.00 0.00 0.00 64.86 64.46 4otc h ILE 27 Cb 0.15 2.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.48 4otc h ILE 27 CO -0.02 0.46 0.28 -1.28 0.00 0.00 0.00 178.15 177.59 4otc h SER 28 N -0.21 0.56 -0.40 1.72 0.87 -1.06 -2.45 113.55 112.57 4otc h SER 28 Ca -0.01 -0.06 -0.13 0.00 -1.23 0.00 0.00 61.79 60.36 4otc h SER 28 Cb 0.86 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 4otc h SER 28 CO 0.05 0.45 -0.27 -0.09 -0.53 0.00 0.00 176.83 176.44 4otc h ARG 29 N 0.62 0.89 -0.84 2.24 2.43 -1.10 -0.17 114.38 118.46 4otc h ARG 29 Ca 0.17 -0.42 -0.01 0.00 -0.81 0.00 0.00 59.98 58.91 4otc h ARG 29 Cb -0.01 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.49 4otc h ARG 29 CO -0.03 1.07 0.48 0.77 -1.51 0.00 0.00 179.97 180.75 4otc h SER 30 N 0.71 1.02 -0.14 -3.80 0.02 -1.03 -3.18 113.55 107.15 4otc h SER 30 Ca 0.08 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 4otc h SER 30 Cb 0.84 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.12 4otc h SER 30 CO 0.07 0.80 0.00 0.18 -1.14 0.00 0.00 176.83 176.75 4otc n LEU 31 N -4.36 2.39 -3.60 5.07 4.77 -0.94 -4.98 117.00 115.35 4otc n LEU 31 Ca 0.09 -1.34 -0.22 0.00 -0.03 0.00 0.00 56.01 54.51 4otc n LEU 31 Cb 0.08 -0.09 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 4otc n LEU 31 CO 0.38 0.51 0.12 0.47 -1.33 0.00 0.00 177.39 177.54 4otc n ASP 32 N 0.68 -3.57 -4.64 -1.43 8.00 -0.18 -4.99 116.55 110.42 4otc n ASP 32 Ca 0.09 -0.66 -0.31 0.00 0.71 0.00 0.00 54.79 54.63 4otc n ASP 32 Cb 0.36 -4.73 -0.09 0.00 -0.02 0.00 0.00 41.12 36.64 4otc n ASP 32 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 4otc s ALA 33 N -3.40 3.15 0.23 2.24 0.00 -0.55 -5.05 121.76 118.39 4otc s ALA 33 Ca 0.27 -1.07 -0.32 0.00 0.00 0.00 0.00 51.96 50.84 4otc s ALA 33 Cb -0.12 -1.16 -0.12 0.00 0.00 0.00 0.00 23.12 21.71 4otc s ALA 33 CO 0.76 0.65 1.62 -2.30 0.00 0.00 0.00 175.76 176.49 4otc n PRO 34 N 1.08 2.54 -0.27 0.00 -0.02 -1.26 -4.58 135.00 132.49 4otc n PRO 34 Ca -0.13 0.91 0.15 0.00 -2.02 0.00 0.00 63.50 62.41 4otc n PRO 34 Cb 0.52 -2.70 0.43 0.00 -0.02 0.00 0.00 33.50 31.73 4otc n PRO 34 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 4otc h LEU 35 N 5.72 0.57 -0.62 2.45 5.85 -1.93 0.87 115.31 128.22 4otc h LEU 35 Ca -0.45 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.32 4otc h LEU 35 Cb 1.23 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.20 4otc h LEU 35 CO 0.87 0.25 0.00 0.35 -0.34 0.00 0.00 178.44 179.58 4otc n THR 36 N -4.57 0.97 1.18 1.05 -2.24 -1.26 -1.78 114.28 107.63 4otc n THR 36 Ca 0.19 0.33 0.13 0.00 -2.27 0.00 0.00 64.05 62.42 4otc n THR 36 Cb 0.57 -1.24 0.38 0.00 -2.10 0.00 0.00 70.33 67.94 4otc n THR 36 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 4otc n SER 37 N -2.04 0.75 -4.66 3.42 3.41 0.30 -4.84 113.62 109.96 4otc n SER 37 Ca 0.02 -0.60 -0.40 0.00 -0.26 0.00 0.00 58.87 57.63 4otc n SER 37 Cb 0.17 0.12 -0.06 0.00 -0.26 0.00 0.00 64.21 64.19 4otc n SER 37 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 4otc s VAL 38 N -2.67 5.00 -0.10 -3.33 1.01 -0.73 -1.98 120.40 117.59 4otc s VAL 38 Ca 0.20 1.26 0.04 0.00 0.00 0.00 0.00 61.98 63.48 4otc s VAL 38 Cb 0.19 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.59 4otc s VAL 38 CO 0.57 0.10 -0.23 -0.13 0.00 0.00 0.00 175.10 175.41 4otc s ARG 39 N 1.92 2.91 -0.05 2.72 0.52 -0.73 -4.98 118.95 121.27 4otc s ARG 39 Ca 0.30 -0.83 0.06 0.00 -0.52 0.00 0.00 55.73 54.74 4otc s ARG 39 Cb -0.16 -2.22 -0.01 0.00 0.52 0.00 0.00 34.95 33.09 4otc s ARG 39 CO 0.11 0.16 -0.22 0.08 0.02 0.00 0.00 175.30 175.45 4otc s VAL 40 N 0.39 1.79 -0.13 3.52 1.01 -1.26 -0.97 120.40 124.76 4otc s VAL 40 Ca -0.18 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 60.90 4otc s VAL 40 Cb -0.18 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.70 4otc s VAL 40 CO 0.08 0.50 -0.19 -0.63 0.00 0.00 0.00 175.10 174.86 4otc s ILE 41 N -0.13 1.85 -0.18 2.22 1.01 0.62 -4.98 121.20 121.61 4otc s ILE 41 Ca -0.02 -0.86 -0.07 0.00 0.00 0.00 0.00 60.65 59.70 4otc s ILE 41 Cb -0.12 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 4otc s ILE 41 CO 0.03 0.51 0.06 -0.63 0.00 0.00 0.00 174.94 174.90 4otc s ILE 42 N 0.88 4.75 -0.19 2.92 1.01 -1.26 -0.01 121.20 129.31 4otc s ILE 42 Ca -0.07 -0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.54 4otc s ILE 42 Cb -0.15 -3.14 0.03 0.00 0.01 0.00 0.00 42.46 39.21 4otc s ILE 42 CO -0.02 0.46 -0.13 -0.89 0.00 0.00 0.00 174.94 174.37 4otc s THR 43 N 0.36 1.71 0.20 2.92 2.01 0.12 -4.93 115.64 118.04 4otc s THR 43 Ca 0.03 -0.93 -0.17 0.00 0.31 0.00 0.00 61.69 60.93 4otc s THR 43 Cb -0.12 -1.70 -0.08 0.00 0.01 0.00 0.00 72.50 70.61 4otc s THR 43 CO 0.00 0.29 0.65 -1.61 -0.69 0.00 0.00 174.62 173.27 4otc s GLU 44 N 1.39 4.12 -0.08 4.92 2.02 -1.26 -1.35 118.70 128.45 4otc s GLU 44 Ca 0.01 0.69 0.03 0.00 0.02 0.00 0.00 54.97 55.72 4otc s GLU 44 Cb -0.15 -2.86 -0.02 0.00 0.10 0.00 0.00 34.13 31.20 4otc s GLU 44 CO -0.09 0.41 -0.16 -1.64 0.02 0.00 0.00 175.26 173.79 4otc s MET 45 N -2.06 2.85 0.52 1.61 -1.94 0.61 -4.88 119.30 116.01 4otc s MET 45 Ca 0.42 -0.73 -0.21 0.00 -1.71 0.00 0.00 55.69 53.46 4otc s MET 45 Cb -0.15 -2.43 -0.06 0.00 2.01 0.00 0.00 34.83 34.20 4otc s MET 45 CO 0.20 0.42 1.17 0.00 -0.01 0.00 0.00 175.02 176.80 4otc s ALA 46 N -0.21 2.78 0.62 3.03 0.00 -1.26 -1.05 121.76 125.67 4otc s ALA 46 Ca -0.00 0.92 0.31 0.00 0.00 0.00 0.00 51.96 53.19 4otc s ALA 46 Cb -0.13 -3.39 1.71 0.00 0.00 0.00 0.00 23.12 21.31 4otc s ALA 46 CO 0.03 -0.82 2.05 0.87 0.00 0.00 0.00 175.76 177.89 4otc h LYS 47 N 1.48 0.00 -0.54 0.00 1.57 -1.96 0.86 116.57 117.98 4otc h LYS 47 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 4otc h LYS 47 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 4otc h LYS 47 CO 0.58 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.87 4otc n GLY 48 N -1.34 1.51 0.23 3.86 0.00 -1.26 -4.04 105.19 104.16 4otc n GLY 48 Ca 0.01 -0.58 0.02 0.00 0.00 0.00 0.00 46.02 45.48 4otc n GLY 48 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 4otc n HIS 49 N 1.03 0.12 -4.01 1.61 8.25 0.29 -4.96 115.22 117.56 4otc n HIS 49 Ca 0.18 -0.31 -0.29 0.00 -0.26 0.00 0.00 57.72 57.04 4otc n HIS 49 Cb 0.46 -0.02 -0.17 0.00 1.12 0.00 0.00 29.99 31.38 4otc n HIS 49 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 4otc s PHE 50 N -0.76 2.02 0.07 4.41 5.36 -1.24 -4.90 117.98 122.94 4otc s PHE 50 Ca 0.08 -1.12 0.08 0.00 -0.96 0.00 0.00 56.93 55.01 4otc s PHE 50 Cb 0.05 -1.52 -0.03 0.00 -0.34 0.00 0.00 43.02 41.17 4otc s PHE 50 CO 0.06 -0.63 -0.18 0.20 -1.46 0.00 0.00 175.22 173.21 4otc s GLY 51 N 1.52 1.62 -0.13 13.12 0.00 -1.26 -0.23 107.32 121.96 4otc s GLY 51 Ca 0.05 -1.24 -0.02 0.00 0.00 0.00 0.00 44.72 43.51 4otc s GLY 51 CO -0.10 -1.16 -0.00 -0.42 0.00 0.00 0.00 173.10 171.42 4otc s ILE 52 N -1.00 0.57 -1.36 0.90 1.01 0.87 -4.78 121.20 117.41 4otc s ILE 52 Ca 0.16 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.58 4otc s ILE 52 Cb -0.11 -0.83 0.00 0.00 0.01 0.00 0.00 42.46 41.53 4otc s ILE 52 CO 0.07 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.72 4otc n GLY 53 N 5.07 0.46 2.28 6.18 0.00 -1.26 -2.08 105.19 115.85 4otc n GLY 53 Ca -0.09 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.63 4otc n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4otc n GLY 54 N -1.09 0.94 3.57 -0.02 0.00 -1.26 -5.03 105.19 102.29 4otc n GLY 54 Ca -0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 4otc n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4otc s GLU 55 N -0.24 2.21 0.25 1.61 0.41 -0.88 -5.07 118.70 116.99 4otc s GLU 55 Ca 0.00 -0.95 -0.31 0.00 -0.41 0.00 0.00 54.97 53.30 4otc s GLU 55 Cb 0.00 -2.33 -0.11 0.00 -1.78 0.00 0.00 34.13 29.90 4otc s GLU 55 CO 0.00 0.53 1.62 -0.51 -0.49 0.00 0.00 175.26 176.41 4otc s LEU 56 N -1.95 4.36 0.29 1.80 1.43 -1.26 -0.09 118.68 123.26 4otc s LEU 56 Ca 0.20 2.86 0.02 0.00 -1.03 0.00 0.00 54.13 56.18 4otc s LEU 56 Cb -0.11 -3.62 0.58 0.00 0.03 0.00 0.00 46.19 43.08 4otc s LEU 56 CO 0.11 -0.90 1.85 0.00 0.23 0.00 0.00 176.35 177.64 4otc h ALA 57 N 5.71 1.56 -1.03 4.21 0.00 -0.82 -0.79 119.26 128.10 4otc h ALA 57 Ca -0.45 0.02 0.27 0.00 0.00 0.00 0.00 54.91 54.74 4otc h ALA 57 Cb 1.21 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 4otc h ALA 57 CO 0.86 0.20 0.68 0.66 0.00 0.00 0.00 179.25 181.65 4otc h SER 58 N 0.96 0.34 -0.57 0.00 4.64 -1.79 -2.14 113.55 114.99 4otc h SER 58 Ca 0.48 0.06 -0.37 0.00 -0.47 0.00 0.00 61.79 61.49 4otc h SER 58 Cb 0.49 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.34 4otc h SER 58 CO -0.24 0.08 -0.18 2.29 -0.87 0.00 0.00 176.83 177.90 4otc n LYS 59 N -4.51 2.52 0.00 4.77 2.85 -0.31 -5.19 118.16 118.29 4otc n LYS 59 Ca 0.24 -3.53 0.00 0.00 -1.05 0.00 0.00 58.31 53.97 4otc n LYS 59 Cb 0.91 -2.03 0.00 0.00 -0.65 0.00 0.00 35.03 33.25 4otc n LYS 59 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63