#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 1.00 -0.07 4.25 1.01 -1.26 -1.79 121.20 124.34 4otc s ILE 2 Ca 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 60.65 60.26 4otc s ILE 2 Cb 0.00 -1.11 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 4otc s ILE 2 CO 0.00 0.24 -0.13 0.00 0.00 0.00 0.00 174.94 175.06 4otc s ALA 3 N 1.70 2.71 -0.18 9.38 0.00 -0.27 -5.01 121.76 130.09 4otc s ALA 3 Ca 0.03 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 51.06 4otc s ALA 3 Cb -0.14 -1.08 0.02 0.00 0.00 0.00 0.00 23.12 21.92 4otc s ALA 3 CO -0.08 0.47 -0.19 -1.14 0.00 0.00 0.00 175.76 174.83 4otc s GLN 4 N -0.45 2.83 -0.19 0.00 0.74 -1.26 -0.30 119.66 121.03 4otc s GLN 4 Ca 0.06 -0.78 -0.04 0.00 0.05 0.00 0.00 55.36 54.64 4otc s GLN 4 Cb -0.12 -2.48 -0.02 0.00 1.10 0.00 0.00 33.01 31.49 4otc s GLN 4 CO 0.02 -0.22 -0.03 0.42 -0.55 0.00 0.00 175.29 174.92 4otc s ILE 5 N 1.33 3.65 -0.31 -2.34 1.01 0.14 -4.97 121.20 119.70 4otc s ILE 5 Ca 0.05 -0.42 -0.12 0.00 0.00 0.00 0.00 60.65 60.16 4otc s ILE 5 Cb -0.13 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.67 4otc s ILE 5 CO -0.12 0.44 0.21 -1.00 0.00 0.00 0.00 174.94 174.47 4otc s HIS 6 N 1.01 3.22 0.06 3.97 3.76 -1.26 -0.23 115.29 125.83 4otc s HIS 6 Ca 0.01 -0.10 0.04 0.00 -0.15 0.00 0.00 55.06 54.86 4otc s HIS 6 Cb -0.15 -2.42 -0.03 0.00 1.11 0.00 0.00 32.58 31.09 4otc s HIS 6 CO 0.01 -0.28 -0.12 0.96 -0.85 0.00 0.00 174.74 174.45 4otc s ILE 7 N 1.73 0.93 0.45 0.60 -4.36 -0.65 -4.99 121.20 114.91 4otc s ILE 7 Ca 0.06 -1.26 -0.24 0.00 -0.26 0.00 0.00 60.65 58.95 4otc s ILE 7 Cb -0.17 -0.95 -0.07 0.00 1.25 0.00 0.00 42.46 42.52 4otc s ILE 7 CO 0.10 -0.30 1.25 -0.76 0.24 0.00 0.00 174.94 175.48 4otc s LEU 8 N -1.74 4.07 0.79 0.37 1.43 -1.26 -0.12 118.68 122.22 4otc s LEU 8 Ca -0.04 2.53 -0.13 0.00 -1.03 0.00 0.00 54.13 55.46 4otc s LEU 8 Cb -0.10 -4.11 0.07 0.00 0.03 0.00 0.00 46.19 42.09 4otc s LEU 8 CO 0.02 -1.01 1.16 -1.83 0.23 0.00 0.00 176.35 174.92 4otc s GLU 9 N -2.54 1.85 0.00 1.70 -1.05 -0.24 -4.44 118.70 113.98 4otc s GLU 9 Ca 0.62 1.56 0.00 0.00 -0.15 0.00 0.00 54.97 57.00 4otc s GLU 9 Cb -0.35 -1.82 0.00 0.00 -0.44 0.00 0.00 34.13 31.52 4otc s GLU 9 CO 0.43 -2.01 0.00 0.41 0.95 0.00 0.00 175.26 175.03 4otc n GLY 10 N -0.01 1.62 3.83 -3.83 0.00 -1.26 -4.94 105.19 100.60 4otc n GLY 10 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 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 4.11 0.77 1.61 3.00 -1.26 -5.06 118.95 122.12 4otc s ARG 11 Ca 0.00 0.98 -0.11 0.00 0.00 0.00 0.00 55.73 56.60 4otc s ARG 11 Cb 0.00 -2.22 0.05 0.00 0.00 0.00 0.00 34.95 32.79 4otc s ARG 11 CO 0.00 -0.06 1.08 -1.54 0.00 0.00 0.00 175.30 174.79 4otc s SER 12 N -2.45 4.68 0.38 0.23 1.04 -1.26 -4.89 113.70 111.43 4otc s SER 12 Ca 0.60 1.46 0.05 0.00 0.48 0.00 0.00 55.95 58.54 4otc s SER 12 Cb -0.09 -2.23 0.75 0.00 0.10 0.00 0.00 66.02 64.54 4otc s SER 12 CO 0.19 -1.87 2.01 0.44 0.98 0.00 0.00 173.24 174.99 4otc h ASP 13 N -1.02 0.55 -0.44 7.02 5.19 -1.99 -2.08 116.42 123.66 4otc h ASP 13 Ca -0.46 -0.03 -0.08 0.00 -0.62 0.00 0.00 57.03 55.84 4otc h ASP 13 Cb 1.25 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 40.61 4otc h ASP 13 CO 0.57 0.44 -0.04 -0.08 -3.12 0.00 0.00 179.24 177.01 4otc h GLU 14 N 0.63 0.80 -0.50 3.56 4.81 -1.99 -0.71 114.58 121.18 4otc h GLU 14 Ca 0.16 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 4otc h GLU 14 Cb 0.01 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 4otc h GLU 14 CO -0.03 0.89 0.31 1.96 -0.73 0.00 0.00 179.01 181.41 4otc h GLN 15 N 0.63 0.67 -0.04 1.92 4.20 -1.82 -0.27 115.11 120.40 4otc h GLN 15 Ca 0.12 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 4otc h GLN 15 Cb 0.55 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 4otc h GLN 15 CO 0.03 0.48 -0.44 0.87 -0.67 0.00 0.00 178.83 179.10 4otc h LYS 16 N 0.67 0.08 -0.38 1.46 1.57 -1.23 -0.67 116.57 118.07 4otc h LYS 16 Ca 0.18 -0.04 -0.14 0.00 -1.87 0.00 0.00 60.65 58.78 4otc h LYS 16 Cb -0.03 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 4otc h LYS 16 CO -0.04 0.51 -0.33 0.93 -0.57 0.00 0.00 179.45 179.95 4otc h GLU 17 N 0.07 0.85 -0.26 3.15 5.08 -0.40 -1.80 114.58 121.27 4otc h GLU 17 Ca 0.00 -0.41 -0.07 0.00 -1.00 0.00 0.00 59.36 57.88 4otc h GLU 17 Cb 0.80 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 4otc h GLU 17 CO 0.06 1.05 -0.12 1.15 -1.00 0.00 0.00 179.01 180.15 4otc h THR 18 N 0.71 1.30 -0.41 1.13 2.02 -0.73 -2.35 112.91 114.57 4otc h THR 18 Ca 0.07 -1.20 0.06 0.00 0.77 0.00 0.00 66.41 66.12 4otc h THR 18 Cb 0.89 1.53 -0.06 0.00 -1.74 0.00 0.00 68.15 68.77 4otc h THR 18 CO 0.08 0.37 0.08 0.25 0.37 0.00 0.00 175.52 176.68 4otc h LEU 19 N 0.27 0.01 -1.04 2.58 5.85 -1.03 0.28 115.31 122.22 4otc h LEU 19 Ca 0.06 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.86 4otc h LEU 19 Cb 0.62 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 4otc h LEU 19 CO 0.04 0.04 0.65 0.40 -0.34 0.00 0.00 178.44 179.22 4otc h ILE 20 N 0.21 1.24 -0.02 4.05 2.04 -1.24 -1.09 117.51 122.71 4otc h ILE 20 Ca 0.20 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 4otc h ILE 20 Cb 0.24 -0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.14 4otc h ILE 20 CO -0.26 0.24 -0.10 -0.09 0.00 0.00 0.00 178.15 177.94 4otc h ARG 21 N 1.31 0.10 -0.72 2.37 2.43 -0.68 -2.33 114.38 116.87 4otc h ARG 21 Ca 0.36 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.43 4otc h ARG 21 Cb -0.14 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 4otc h ARG 21 CO -0.08 0.76 0.37 0.93 -1.51 0.00 0.00 179.97 180.43 4otc h GLU 22 N -0.53 1.02 -0.62 0.20 4.39 -0.42 -1.71 114.58 116.91 4otc h GLU 22 Ca -0.01 -0.13 -0.09 0.00 0.34 0.00 0.00 59.36 59.47 4otc h GLU 22 Cb 0.78 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.21 4otc h GLU 22 CO 0.02 0.78 0.04 0.28 -1.16 0.00 0.00 179.01 178.97 4otc h VAL 23 N 1.00 1.26 -0.64 3.13 2.07 -1.29 -0.14 116.25 121.64 4otc h VAL 23 Ca 0.25 -1.10 -0.05 0.00 0.82 0.00 0.00 66.70 66.62 4otc h VAL 23 Cb 0.08 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 4otc h VAL 23 CO -0.04 0.40 0.22 0.28 0.02 0.00 0.00 177.57 178.46 4otc h SER 24 N 0.98 0.92 -0.43 0.57 0.02 -1.13 -1.16 113.55 113.32 4otc h SER 24 Ca 0.18 -0.19 -0.09 0.00 -0.84 0.00 0.00 61.79 60.84 4otc h SER 24 Cb 0.51 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 4otc h SER 24 CO 0.02 0.86 -0.10 -0.33 -1.14 0.00 0.00 176.83 176.15 4otc h GLU 25 N 0.92 0.82 -0.73 3.45 5.08 -1.07 -1.10 114.58 121.94 4otc h GLU 25 Ca 0.21 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 4otc h GLU 25 Cb 0.26 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 4otc h GLU 25 CO -0.01 0.94 0.40 0.00 -1.00 0.00 0.00 179.01 179.34 4otc h ALA 26 N 0.86 1.34 -0.09 3.43 0.00 -0.77 0.19 119.26 124.22 4otc h ALA 26 Ca 0.11 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 4otc h ALA 26 Cb 0.64 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.13 4otc h ALA 26 CO 0.04 0.54 -0.33 0.82 0.00 0.00 0.00 179.25 180.32 4otc h ILE 27 N 1.01 1.41 -0.37 0.00 2.04 -1.06 -1.06 117.51 119.48 4otc h ILE 27 Ca 0.26 -1.70 -0.00 0.00 1.00 0.00 0.00 64.86 64.41 4otc h ILE 27 Cb 0.02 2.25 -0.02 0.00 -0.74 0.00 0.00 36.82 38.33 4otc h ILE 27 CO -0.04 0.49 0.22 -1.28 0.00 0.00 0.00 178.15 177.54 4otc h SER 28 N -0.09 0.45 -0.38 1.72 0.87 -1.03 -2.39 113.55 112.72 4otc h SER 28 Ca -0.02 -0.06 -0.13 0.00 -1.23 0.00 0.00 61.79 60.35 4otc h SER 28 Cb 0.97 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.80 4otc h SER 28 CO 0.07 0.38 -0.24 -0.09 -0.53 0.00 0.00 176.83 176.43 4otc h ARG 29 N 0.49 0.88 -0.49 2.24 2.43 -1.01 -0.82 114.38 118.09 4otc h ARG 29 Ca 0.13 -0.38 -0.06 0.00 -0.81 0.00 0.00 59.98 58.87 4otc h ARG 29 Cb 0.02 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 4otc h ARG 29 CO -0.02 1.02 0.07 0.77 -1.51 0.00 0.00 179.97 180.30 4otc h SER 30 N 0.76 0.73 -0.17 -3.80 0.02 -1.02 -3.24 113.55 106.83 4otc h SER 30 Ca 0.10 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 4otc h SER 30 Cb 0.78 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.13 4otc h SER 30 CO 0.07 0.76 0.00 0.18 -1.14 0.00 0.00 176.83 176.69 4otc n LEU 31 N -4.25 2.36 -3.78 5.07 4.77 -0.91 -4.98 117.00 115.28 4otc n LEU 31 Ca 0.03 -1.52 -0.26 0.00 -0.03 0.00 0.00 56.01 54.23 4otc n LEU 31 Cb 0.25 -0.11 0.04 0.00 -2.33 0.00 0.00 43.42 41.27 4otc n LEU 31 CO 0.40 0.54 0.08 0.47 -1.33 0.00 0.00 177.39 177.56 4otc n ASP 32 N 0.49 -3.91 -4.72 -1.43 8.00 -0.40 -4.99 116.55 109.60 4otc n ASP 32 Ca 0.08 -0.74 -0.31 0.00 0.71 0.00 0.00 54.79 54.53 4otc n ASP 32 Cb 0.33 -4.19 -0.08 0.00 -0.02 0.00 0.00 41.12 37.17 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 -3.41 3.38 0.23 2.24 0.00 -0.70 -5.05 121.76 118.46 4otc s ALA 33 Ca 0.43 -1.01 -0.32 0.00 0.00 0.00 0.00 51.96 51.07 4otc s ALA 33 Cb -0.21 -1.34 -0.12 0.00 0.00 0.00 0.00 23.12 21.45 4otc s ALA 33 CO 0.80 0.69 1.68 -2.30 0.00 0.00 0.00 175.76 176.64 4otc n PRO 34 N 0.88 2.74 -0.31 0.00 -0.02 -1.26 -4.59 135.00 132.44 4otc n PRO 34 Ca -0.12 0.98 0.15 0.00 -2.02 0.00 0.00 63.50 62.50 4otc n PRO 34 Cb 0.52 -2.81 0.39 0.00 -0.02 0.00 0.00 33.50 31.58 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 6.16 0.66 -0.62 2.45 5.85 -1.92 0.87 115.31 128.75 4otc h LEU 35 Ca -0.44 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.35 4otc h LEU 35 Cb 1.21 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.19 4otc h LEU 35 CO 0.91 0.26 0.00 0.35 -0.34 0.00 0.00 178.44 179.61 4otc n THR 36 N -4.65 1.10 1.19 1.05 -2.24 -1.26 -1.61 114.28 107.86 4otc n THR 36 Ca 0.21 0.40 0.13 0.00 -2.27 0.00 0.00 64.05 62.52 4otc n THR 36 Cb 0.60 -1.32 0.39 0.00 -2.10 0.00 0.00 70.33 67.91 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 -1.97 0.74 -4.67 3.42 3.41 0.30 -4.84 113.62 110.02 4otc n SER 37 Ca 0.01 -0.60 -0.39 0.00 -0.26 0.00 0.00 58.87 57.63 4otc n SER 37 Cb 0.13 0.10 -0.06 0.00 -0.26 0.00 0.00 64.21 64.12 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 -2.65 5.08 -0.10 -3.33 1.01 -0.63 -2.09 120.40 117.68 4otc s VAL 38 Ca 0.21 1.04 0.04 0.00 0.00 0.00 0.00 61.98 63.27 4otc s VAL 38 Cb 0.19 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.69 4otc s VAL 38 CO 0.56 0.17 -0.22 -0.13 0.00 0.00 0.00 175.10 175.47 4otc s ARG 39 N 1.65 2.87 -0.05 2.72 0.52 -0.74 -4.99 118.95 120.94 4otc s ARG 39 Ca 0.26 -0.82 0.06 0.00 -0.52 0.00 0.00 55.73 54.71 4otc s ARG 39 Cb -0.16 -2.19 -0.01 0.00 0.52 0.00 0.00 34.95 33.11 4otc s ARG 39 CO 0.10 0.15 -0.24 0.08 0.02 0.00 0.00 175.30 175.41 4otc s VAL 40 N 0.41 1.94 -0.14 3.52 1.01 -1.26 -1.12 120.40 124.76 4otc s VAL 40 Ca -0.18 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 60.81 4otc s VAL 40 Cb -0.18 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.58 4otc s VAL 40 CO 0.08 0.54 -0.19 -0.63 0.00 0.00 0.00 175.10 174.90 4otc s ILE 41 N -0.19 1.88 -0.19 2.22 1.01 0.59 -4.98 121.20 121.54 4otc s ILE 41 Ca -0.02 -0.86 -0.09 0.00 0.00 0.00 0.00 60.65 59.68 4otc s ILE 41 Cb -0.13 -1.68 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 4otc s ILE 41 CO 0.03 0.51 0.10 -0.63 0.00 0.00 0.00 174.94 174.95 4otc s ILE 42 N 0.97 5.12 -0.18 2.92 1.01 -1.26 0.24 121.20 130.02 4otc s ILE 42 Ca -0.04 0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.70 4otc s ILE 42 Cb -0.15 -3.33 0.04 0.00 0.01 0.00 0.00 42.46 39.03 4otc s ILE 42 CO -0.04 0.44 -0.09 -0.89 0.00 0.00 0.00 174.94 174.36 4otc s THR 43 N 0.42 1.48 0.20 2.92 2.01 0.69 -4.93 115.64 118.43 4otc s THR 43 Ca 0.06 -0.86 -0.19 0.00 0.31 0.00 0.00 61.69 61.01 4otc s THR 43 Cb -0.12 -1.57 -0.08 0.00 0.01 0.00 0.00 72.50 70.75 4otc s THR 43 CO -0.01 0.19 0.70 -1.61 -0.69 0.00 0.00 174.62 173.20 4otc s GLU 44 N 1.47 4.23 -0.08 4.92 2.02 -1.26 -1.63 118.70 128.37 4otc s GLU 44 Ca -0.00 0.83 0.02 0.00 0.02 0.00 0.00 54.97 55.84 4otc s GLU 44 Cb -0.16 -2.92 -0.02 0.00 0.10 0.00 0.00 34.13 31.14 4otc s GLU 44 CO -0.08 0.42 -0.13 -1.64 0.02 0.00 0.00 175.26 173.85 4otc s MET 45 N -1.90 2.87 0.54 1.61 -1.94 0.84 -4.87 119.30 116.44 4otc s MET 45 Ca 0.41 -0.68 -0.20 0.00 -1.71 0.00 0.00 55.69 53.52 4otc s MET 45 Cb -0.17 -2.50 -0.06 0.00 2.01 0.00 0.00 34.83 34.12 4otc s MET 45 CO 0.21 0.47 1.15 0.00 -0.01 0.00 0.00 175.02 176.84 4otc s ALA 46 N -0.32 2.72 0.60 3.03 0.00 -1.26 -1.08 121.76 125.45 4otc s ALA 46 Ca 0.03 0.88 0.30 0.00 0.00 0.00 0.00 51.96 53.17 4otc s ALA 46 Cb -0.13 -3.38 1.67 0.00 0.00 0.00 0.00 23.12 21.28 4otc s ALA 46 CO 0.03 -0.83 2.07 0.87 0.00 0.00 0.00 175.76 177.90 4otc h LYS 47 N 1.29 0.00 -0.42 0.00 1.57 -1.96 0.10 116.57 117.16 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 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 4otc h LYS 47 CO 0.57 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.86 4otc n GLY 48 N -1.38 1.05 0.33 3.86 0.00 -1.26 -4.01 105.19 103.78 4otc n GLY 48 Ca 0.02 -0.49 0.03 0.00 0.00 0.00 0.00 46.02 45.58 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 0.80 0.13 -4.22 1.61 8.25 0.36 -4.96 115.22 117.20 4otc n HIS 49 Ca 0.15 -0.23 -0.31 0.00 -0.26 0.00 0.00 57.72 57.08 4otc n HIS 49 Cb 0.39 -0.02 -0.16 0.00 1.12 0.00 0.00 29.99 31.32 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 -0.77 2.30 0.05 4.41 5.36 -1.24 -4.90 117.98 123.19 4otc s PHE 50 Ca 0.11 -1.25 0.08 0.00 -0.96 0.00 0.00 56.93 54.91 4otc s PHE 50 Cb 0.06 -1.64 -0.03 0.00 -0.34 0.00 0.00 43.02 41.07 4otc s PHE 50 CO 0.09 -0.64 -0.21 0.20 -1.46 0.00 0.00 175.22 173.20 4otc s GLY 51 N 1.26 1.54 -0.12 13.12 0.00 -1.26 -0.28 107.32 121.57 4otc s GLY 51 Ca 0.01 -1.23 -0.02 0.00 0.00 0.00 0.00 44.72 43.48 4otc s GLY 51 CO -0.08 -1.13 0.00 -0.42 0.00 0.00 0.00 173.10 171.48 4otc s ILE 52 N -0.91 0.51 -1.31 0.90 1.01 0.13 -4.76 121.20 116.78 4otc s ILE 52 Ca 0.14 -0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.61 4otc s ILE 52 Cb -0.10 -0.78 0.00 0.00 0.01 0.00 0.00 42.46 41.59 4otc s ILE 52 CO 0.05 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.70 4otc n GLY 53 N 5.09 0.63 2.11 6.18 0.00 -1.26 -1.97 105.19 115.96 4otc n GLY 53 Ca -0.08 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.16 0.83 3.51 -0.02 0.00 -1.26 -5.04 105.19 102.05 4otc n GLY 54 Ca -0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.25 1.98 0.20 1.61 0.41 -0.83 -5.07 118.70 116.74 4otc s GLU 55 Ca 0.00 -1.07 -0.32 0.00 -0.41 0.00 0.00 54.97 53.17 4otc s GLU 55 Cb 0.00 -2.20 -0.12 0.00 -1.78 0.00 0.00 34.13 30.04 4otc s GLU 55 CO 0.00 0.51 1.73 -0.51 -0.49 0.00 0.00 175.26 176.50 4otc s LEU 56 N -1.94 4.37 0.33 1.80 1.43 -1.26 0.21 118.68 123.62 4otc s LEU 56 Ca 0.18 2.84 0.07 0.00 -1.03 0.00 0.00 54.13 56.19 4otc s LEU 56 Cb -0.11 -3.60 0.75 0.00 0.03 0.00 0.00 46.19 43.27 4otc s LEU 56 CO 0.10 -0.97 1.84 0.00 0.23 0.00 0.00 176.35 177.55 4otc h ALA 57 N 7.01 1.74 -1.01 4.21 0.00 -0.87 -0.69 119.26 129.65 4otc h ALA 57 Ca -0.43 0.03 0.25 0.00 0.00 0.00 0.00 54.91 54.76 4otc h ALA 57 Cb 1.20 -0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.77 4otc h ALA 57 CO 0.95 -0.02 0.65 0.66 0.00 0.00 0.00 179.25 181.50 4otc h SER 58 N 0.77 0.45 -0.73 0.00 4.64 -1.80 -2.30 113.55 114.58 4otc h SER 58 Ca 0.49 0.07 -0.50 0.00 -0.47 0.00 0.00 61.79 61.38 4otc h SER 58 Cb 0.73 -0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.50 4otc h SER 58 CO -0.26 0.11 -0.15 2.29 -0.87 0.00 0.00 176.83 177.96 4otc n LYS 59 N -4.60 2.93 0.00 4.77 2.85 -0.27 -5.20 118.16 118.65 4otc n LYS 59 Ca 0.24 -3.68 0.00 0.00 -1.05 0.00 0.00 58.31 53.81 4otc n LYS 59 Cb 0.83 -2.18 0.00 0.00 -0.65 0.00 0.00 35.03 33.03 4otc n LYS 59 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63