#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2epa s SER 2 N 0.00 -0.33 0.30 1.61 0.01 -1.26 -5.19 113.70 108.84 2epa s SER 2 Ca 0.00 -0.44 0.04 0.00 1.31 0.00 0.00 55.95 56.86 2epa s SER 2 Cb 0.00 0.68 -0.03 0.00 0.21 0.00 0.00 66.02 66.87 2epa s SER 2 CO 0.00 -1.22 0.21 -0.44 0.41 0.00 0.00 173.24 172.20 2epa s SER 3 N -2.87 1.41 -0.42 2.44 0.01 -1.26 -5.13 113.70 107.88 2epa s SER 3 Ca 0.09 -1.63 -0.03 0.00 1.31 0.00 0.00 55.95 55.69 2epa s SER 3 Cb -0.04 0.48 0.11 0.00 0.21 0.00 0.00 66.02 66.78 2epa s SER 3 CO 0.02 -0.96 0.22 -0.83 0.41 0.00 0.00 173.24 172.10 2epa s GLY 4 N -3.35 2.02 -0.07 3.44 0.00 -1.26 -4.89 107.32 103.23 2epa s GLY 4 Ca 0.38 -2.58 0.12 0.00 0.00 0.00 0.00 44.72 42.64 2epa s GLY 4 CO 0.21 1.04 1.30 -1.14 0.00 0.00 0.00 173.10 174.51 2epa n SER 5 N 4.54 3.22 -0.35 1.64 3.41 -1.26 -4.76 113.62 120.06 2epa n SER 5 Ca -0.02 -2.38 -0.11 0.00 -0.26 0.00 0.00 58.87 56.10 2epa n SER 5 Cb 0.41 -0.34 -0.10 0.00 -0.26 0.00 0.00 64.21 63.93 2epa n SER 5 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2epa h SER 6 N 1.83 -2.02 -2.10 4.04 0.87 -2.06 -3.47 113.55 110.65 2epa h SER 6 Ca 0.00 0.30 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 2epa h SER 6 Cb 0.98 0.88 0.00 0.00 -0.44 0.00 0.00 62.40 63.82 2epa h SER 6 CO 0.08 -0.25 0.00 0.61 -0.53 0.00 0.00 176.83 176.74 2epa n GLY 7 N -1.26 -1.80 3.77 5.77 0.00 -1.26 -4.92 105.19 105.49 2epa n GLY 7 Ca 0.01 -1.48 -0.35 0.00 0.00 0.00 0.00 46.02 44.20 2epa n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2epa s PRO 8 N 0.00 3.35 -0.15 1.61 0.04 -1.26 -4.96 135.00 133.64 2epa s PRO 8 Ca 0.00 1.61 0.16 0.00 0.04 0.00 0.00 61.00 62.81 2epa s PRO 8 Cb 0.00 -2.01 0.68 0.00 0.04 0.00 0.00 34.50 33.22 2epa s PRO 8 CO 0.00 -0.85 1.60 0.00 0.04 0.00 0.00 177.00 177.79 2epa n GLN 9 N -1.32 3.85 -2.38 4.56 -0.00 -1.26 -4.95 117.38 115.88 2epa n GLN 9 Ca 0.12 -2.89 -0.43 0.00 -0.00 0.00 0.00 57.00 53.79 2epa n GLN 9 Cb 0.51 -1.94 -0.02 0.00 -0.00 0.00 0.00 30.24 28.79 2epa n GLN 9 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2epa s ILE 10 N -2.19 4.14 0.09 -0.39 -1.09 -1.26 -4.99 121.20 115.51 2epa s ILE 10 Ca 0.48 1.34 -0.18 0.00 -2.23 0.00 0.00 60.65 60.06 2epa s ILE 10 Cb 0.34 -4.02 0.04 0.00 -1.58 0.00 0.00 42.46 37.24 2epa s ILE 10 CO 0.19 -0.29 0.44 -0.62 -1.23 0.00 0.00 174.94 173.43 2epa s ASP 11 N 2.57 -0.31 -0.09 3.58 -1.08 -1.26 -5.16 116.67 114.92 2epa s ASP 11 Ca 0.58 -0.11 0.01 0.00 -0.52 0.00 0.00 52.55 52.50 2epa s ASP 11 Cb -0.20 0.47 0.02 0.00 -1.46 0.00 0.00 42.92 41.74 2epa s ASP 11 CO 0.20 -0.78 -0.10 -0.44 0.52 0.00 0.00 175.17 174.57 2epa s SER 12 N -2.41 1.97 -0.24 -0.34 0.01 -1.26 -5.09 113.70 106.35 2epa s SER 12 Ca -0.01 -0.31 -0.28 0.00 1.31 0.00 0.00 55.95 56.66 2epa s SER 12 Cb 0.00 -0.85 -0.04 0.00 0.21 0.00 0.00 66.02 65.35 2epa s SER 12 CO -0.07 -0.03 2.06 -0.55 0.41 0.00 0.00 173.24 175.06 2epa s SER 13 N 1.12 5.66 0.12 2.44 0.15 -1.26 -4.91 113.70 117.02 2epa s SER 13 Ca -0.06 1.75 -0.25 0.00 0.70 0.00 0.00 55.95 58.09 2epa s SER 13 Cb -0.14 -2.52 0.07 0.00 -1.71 0.00 0.00 66.02 61.73 2epa s SER 13 CO -0.02 -1.82 0.71 0.00 1.20 0.00 0.00 173.24 173.31 2epa s ARG 14 N 6.00 1.18 0.16 5.44 1.04 -1.26 -5.15 118.95 126.37 2epa s ARG 14 Ca 0.93 -0.47 -0.30 0.00 -1.04 0.00 0.00 55.73 54.84 2epa s ARG 14 Cb -0.30 0.52 -0.07 0.00 -2.04 0.00 0.00 34.95 33.05 2epa s ARG 14 CO 0.35 -0.52 1.20 0.42 -0.04 0.00 0.00 175.30 176.71 2epa s ILE 15 N -3.55 3.68 -0.24 4.99 -1.09 -1.26 -5.02 121.20 118.70 2epa s ILE 15 Ca 0.04 1.35 -0.03 0.00 -2.23 0.00 0.00 60.65 59.78 2epa s ILE 15 Cb -0.01 -3.87 0.13 0.00 -1.58 0.00 0.00 42.46 37.13 2epa s ILE 15 CO -0.09 0.19 0.39 0.00 -1.23 0.00 0.00 174.94 174.19 2epa s ARG 16 N 0.09 0.35 -0.05 2.79 1.70 -1.26 -2.80 118.95 119.77 2epa s ARG 16 Ca 0.54 0.58 -0.04 0.00 -0.47 0.00 0.00 55.73 56.34 2epa s ARG 16 Cb -0.32 -0.40 -0.01 0.00 -0.57 0.00 0.00 34.95 33.64 2epa s ARG 16 CO 0.35 -0.62 -0.08 0.43 -1.08 0.00 0.00 175.30 174.29 2epa n SER 17 N 5.37 0.51 -4.47 -2.89 7.64 0.92 -4.61 113.62 116.08 2epa n SER 17 Ca -0.04 0.15 -0.48 0.00 1.01 0.00 0.00 58.87 59.51 2epa n SER 17 Cb 0.50 -0.57 -0.07 0.00 -1.01 0.00 0.00 64.21 63.06 2epa n SER 17 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2epa n HIS 18 N -2.99 1.55 -3.40 1.43 8.25 -0.04 -4.69 115.22 115.32 2epa n HIS 18 Ca -0.03 0.23 -0.36 0.00 -0.26 0.00 0.00 57.72 57.30 2epa n HIS 18 Cb 0.12 -2.55 -0.06 0.00 1.12 0.00 0.00 29.99 28.63 2epa n HIS 18 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2epa s ILE 19 N 8.00 4.90 -0.04 1.59 1.09 -1.26 -1.06 121.20 134.43 2epa s ILE 19 Ca 1.09 0.81 -0.30 0.00 -1.10 0.00 0.00 60.65 61.16 2epa s ILE 19 Cb -0.77 -3.74 -0.05 0.00 -1.06 0.00 0.00 42.46 36.85 2epa s ILE 19 CO 0.45 0.33 1.49 0.00 -0.10 0.00 0.00 174.94 177.12 2epa h SER 21 N 8.53 0.68 -2.09 0.00 0.02 -1.96 -3.43 113.55 115.31 2epa h SER 21 Ca -0.37 -0.05 -0.61 0.00 -0.84 0.00 0.00 61.79 59.92 2epa h SER 21 Cb 1.17 -0.17 0.06 0.00 0.14 0.00 0.00 62.40 63.59 2epa h SER 21 CO 0.93 0.53 0.70 1.57 -1.14 0.00 0.00 176.83 179.43 2epa n HIS 22 N -4.65 2.05 -1.36 3.45 -0.00 -1.26 -4.94 115.22 108.51 2epa n HIS 22 Ca 0.04 0.37 -0.31 0.00 -0.00 0.00 0.00 57.72 57.82 2epa n HIS 22 Cb 0.05 -2.48 0.08 0.00 -0.00 0.00 0.00 29.99 27.64 2epa n HIS 22 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 2epa s PRO 23 N 0.89 2.36 0.00 1.57 0.04 -1.26 -3.76 135.00 134.83 2epa s PRO 23 Ca 0.81 1.22 0.00 0.00 0.04 0.00 0.00 61.00 63.07 2epa s PRO 23 Cb -0.76 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 31.87 2epa s PRO 23 CO 0.41 -1.57 0.00 0.41 0.04 0.00 0.00 177.00 176.29 2epa n GLY 24 N -1.05 1.22 0.37 0.56 0.00 -1.26 -4.69 105.19 100.33 2epa n GLY 24 Ca 0.09 -0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2epa n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2epa n GLY 26 N -1.22 -0.40 2.98 0.00 0.00 -1.26 -5.01 105.19 100.27 2epa n GLY 26 Ca 0.02 0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 2epa n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2epa s LYS 27 N -5.25 1.89 0.19 1.61 1.02 -1.26 -5.03 119.74 112.91 2epa s LYS 27 Ca 0.03 -0.41 0.11 0.00 0.02 0.00 0.00 55.97 55.72 2epa s LYS 27 Cb -0.00 -1.78 -0.04 0.00 -0.52 0.00 0.00 37.83 35.49 2epa s LYS 27 CO 0.71 -0.20 -0.21 0.99 -0.92 0.00 0.00 175.35 175.73 2epa s THR 28 N 1.42 2.55 0.05 2.17 2.01 -1.26 -1.51 115.64 121.07 2epa s THR 28 Ca 0.01 -1.94 0.02 0.00 0.31 0.00 0.00 61.69 60.08 2epa s THR 28 Cb -0.13 -2.23 -0.03 0.00 0.01 0.00 0.00 72.50 70.11 2epa s THR 28 CO -0.07 -0.11 -0.06 -0.31 -0.69 0.00 0.00 174.62 173.37 2epa s TYR 29 N -1.68 0.66 -0.11 4.92 2.02 -0.22 -4.80 117.35 118.14 2epa s TYR 29 Ca 0.22 -0.65 -0.19 0.00 -0.37 0.00 0.00 57.07 56.08 2epa s TYR 29 Cb -0.08 -0.40 -0.17 0.00 -0.40 0.00 0.00 41.96 40.91 2epa s TYR 29 CO 0.11 -0.14 0.57 0.35 -1.57 0.00 0.00 175.55 174.87 2epa h PHE 30 N 4.04 -0.03 -1.73 2.71 3.57 -1.82 0.32 116.94 124.01 2epa h PHE 30 Ca -0.35 -0.00 -0.49 0.00 3.53 0.00 0.00 57.97 60.66 2epa h PHE 30 Cb 1.19 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.94 2epa h PHE 30 CO 0.63 0.59 1.59 0.15 -2.23 0.00 0.00 178.31 179.03 2epa s LYS 31 N -2.23 2.33 0.59 1.11 -0.14 -1.26 -4.47 119.74 115.66 2epa s LYS 31 Ca -0.12 1.47 0.37 0.00 -1.36 0.00 0.00 55.97 56.33 2epa s LYS 31 Cb -0.02 -4.53 1.31 0.00 -1.68 0.00 0.00 37.83 32.91 2epa s LYS 31 CO 0.46 -3.02 1.44 0.66 -0.76 0.00 0.00 175.35 174.13 2epa h SER 32 N 18.39 0.00 0.02 2.83 4.64 -1.98 0.88 113.55 138.33 2epa h SER 32 Ca -0.27 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.00 2epa h SER 32 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2epa h SER 32 CO 1.13 0.00 -0.17 -1.28 -0.87 0.00 0.00 176.83 175.63 2epa h SER 33 N 0.00 0.12 -0.66 4.97 0.87 -1.96 -3.35 113.55 113.54 2epa h SER 33 Ca 0.69 -0.87 0.08 0.00 -1.23 0.00 0.00 61.79 60.45 2epa h SER 33 Cb 3.27 -0.04 -0.09 0.00 -0.44 0.00 0.00 62.40 65.10 2epa h SER 33 CO -0.01 0.98 -0.34 1.41 -0.53 0.00 0.00 176.83 178.35 2epa n HIS 34 N -4.55 -0.17 -0.38 2.24 8.25 0.31 0.33 115.22 121.25 2epa n HIS 34 Ca -0.10 0.82 -0.08 0.00 -0.26 0.00 0.00 57.72 58.10 2epa n HIS 34 Cb 0.50 -0.63 -0.06 0.00 1.12 0.00 0.00 29.99 30.93 2epa n HIS 34 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2epa n LEU 35 N -4.88 -0.88 -0.29 2.41 7.94 -1.23 0.97 117.00 121.04 2epa n LEU 35 Ca 0.04 1.64 0.11 0.00 -1.11 0.00 0.00 56.01 56.68 2epa n LEU 35 Cb 0.21 -0.26 0.27 0.00 0.53 0.00 0.00 43.42 44.17 2epa n LEU 35 CO -0.10 -1.37 1.01 0.50 -1.11 0.00 0.00 177.39 176.32 2epa h LYS 36 N 0.00 0.35 -0.09 1.96 3.64 -0.32 0.43 116.57 122.55 2epa h LYS 36 Ca 0.20 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.45 2epa h LYS 36 Cb 0.43 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2epa h LYS 36 CO -0.88 0.23 -0.41 0.00 -2.27 0.00 0.00 179.45 176.11 2epa h ALA 37 N 1.68 1.14 0.50 5.00 0.00 0.83 -3.26 119.26 125.16 2epa h ALA 37 Ca 0.51 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2epa h ALA 37 Cb 0.95 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2epa h ALA 37 CO -0.53 0.58 -0.24 1.25 0.00 0.00 0.00 179.25 180.31 2epa h HIS 38 N 0.16 -0.63 -1.87 0.00 -0.00 0.29 -3.02 115.15 110.09 2epa h HIS 38 Ca 0.01 -0.01 0.54 0.00 -0.00 0.00 0.00 60.37 60.91 2epa h HIS 38 Cb 0.81 0.21 -0.07 0.00 -0.00 0.00 0.00 27.41 28.35 2epa h HIS 38 CO 0.01 -0.31 1.36 2.41 -0.00 0.00 0.00 177.93 181.40 2epa n THR 39 N -5.26 0.00 -0.21 6.26 -1.04 -0.23 0.64 114.28 114.44 2epa n THR 39 Ca -0.10 1.42 0.02 0.00 -2.04 0.00 0.00 64.05 63.34 2epa n THR 39 Cb 0.31 -2.37 0.12 0.00 -1.82 0.00 0.00 70.33 66.58 2epa n THR 39 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 2epa h ARG 40 N 0.00 0.25 -0.09 -2.82 3.08 -1.60 0.25 114.38 113.44 2epa h ARG 40 Ca 0.89 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.95 2epa h ARG 40 Cb 3.60 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 33.59 2epa h ARG 40 CO -0.01 0.17 0.07 0.00 -1.07 0.00 0.00 179.97 179.13 2epa h THR 41 N 0.26 0.90 -0.01 2.04 1.03 0.03 -2.52 112.91 114.64 2epa h THR 41 Ca 0.34 0.00 -0.04 0.00 -0.01 0.00 0.00 66.41 66.70 2epa h THR 41 Cb 0.52 0.95 0.00 0.00 -1.07 0.00 0.00 68.15 68.55 2epa h THR 41 CO -0.43 0.00 -0.14 0.45 -0.01 0.00 0.00 175.52 175.39 2epa h HIS 42 N 0.00 0.15 -3.35 0.00 3.86 -0.66 -3.44 115.15 111.71 2epa h HIS 42 Ca 0.04 -0.08 -0.59 0.00 -1.16 0.00 0.00 60.37 58.59 2epa h HIS 42 Cb 0.18 -0.02 -0.08 0.00 1.06 0.00 0.00 27.41 28.55 2epa h HIS 42 CO 0.00 0.85 0.27 0.95 0.86 0.00 0.00 177.93 180.86 2epa s THR 43 N -3.22 4.94 0.00 2.45 -4.23 -0.50 -4.90 115.64 110.18 2epa s THR 43 Ca -0.16 1.43 0.00 0.00 -1.18 0.00 0.00 61.69 61.77 2epa s THR 43 Cb 0.00 -4.05 0.00 0.00 1.34 0.00 0.00 72.50 69.79 2epa s THR 43 CO 0.72 0.06 0.00 0.61 -0.54 0.00 0.00 174.62 175.47 2epa n GLY 44 N 3.61 0.96 0.07 3.99 0.00 -1.26 -4.79 105.19 107.78 2epa n GLY 44 Ca 0.02 -2.11 -0.09 0.00 0.00 0.00 0.00 46.02 43.84 2epa n GLY 44 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2epa h GLU 45 N 0.00 0.00 -3.88 1.61 4.57 -1.91 -3.47 114.58 111.50 2epa h GLU 45 Ca 0.00 0.00 -0.47 0.00 -1.18 0.00 0.00 59.36 57.71 2epa h GLU 45 Cb 0.00 0.00 -0.38 0.00 -0.16 0.00 0.00 28.75 28.21 2epa h GLU 45 CO 0.00 0.46 -0.78 0.15 -1.18 0.00 0.00 179.01 177.66 2epa s LYS 46 N -2.04 0.91 0.18 1.92 1.02 -1.26 -4.88 119.74 115.59 2epa s LYS 46 Ca -0.14 -0.01 -0.06 0.00 0.02 0.00 0.00 55.97 55.77 2epa s LYS 46 Cb 0.01 -1.17 0.08 0.00 -0.52 0.00 0.00 37.83 36.23 2epa s LYS 46 CO 0.35 -0.29 1.53 -1.00 -0.92 0.00 0.00 175.35 175.02 2epa h PRO 47 N 8.25 0.76 -6.23 -1.68 0.13 -1.84 -3.44 132.00 127.95 2epa h PRO 47 Ca -0.23 -0.40 -0.57 0.00 -0.87 0.00 0.00 66.00 63.92 2epa h PRO 47 Cb 1.13 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.23 2epa h PRO 47 CO 0.31 1.02 -0.16 -0.06 -0.23 0.00 0.00 178.00 178.89 2epa s PHE 48 N -4.31 3.59 -0.19 1.56 0.08 -1.22 -5.02 117.98 112.46 2epa s PHE 48 Ca -0.09 0.93 -0.08 0.00 0.12 0.00 0.00 56.93 57.80 2epa s PHE 48 Cb 0.12 -2.27 0.08 0.00 -0.57 0.00 0.00 43.02 40.38 2epa s PHE 48 CO 0.86 0.46 0.44 -1.54 -0.10 0.00 0.00 175.22 175.34 2epa s SER 49 N -1.76 -0.42 0.08 1.36 1.04 -1.26 -2.46 113.70 110.27 2epa s SER 49 Ca 0.36 1.00 -0.24 0.00 0.48 0.00 0.00 55.95 57.55 2epa s SER 49 Cb -0.14 1.15 -0.09 0.00 0.10 0.00 0.00 66.02 67.03 2epa s SER 49 CO 0.19 -0.22 1.38 0.00 0.98 0.00 0.00 173.24 175.57 2epa n SER 51 N -4.53 -2.97 -4.79 0.00 2.88 -1.26 -5.00 113.62 97.95 2epa n SER 51 Ca -0.05 -0.62 -0.24 0.00 -1.33 0.00 0.00 58.87 56.63 2epa n SER 51 Cb 0.27 -5.00 0.08 0.00 -0.75 0.00 0.00 64.21 58.82 2epa n SER 51 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 2epa s TRP 52 N -3.37 2.28 0.01 0.66 -0.00 -1.26 -4.96 118.94 112.30 2epa s TRP 52 Ca 0.14 0.01 -0.02 0.00 -0.00 0.00 0.00 56.10 56.23 2epa s TRP 52 Cb -0.06 -3.04 -0.00 0.00 -0.00 0.00 0.00 33.47 30.36 2epa s TRP 52 CO 0.74 -1.45 0.74 1.17 -0.00 0.00 0.00 176.95 178.15 2epa n LYS 53 N -2.77 -0.03 -2.60 5.86 4.81 -1.26 -3.26 118.16 118.92 2epa n LYS 53 Ca 0.11 0.74 -0.12 0.00 -0.87 0.00 0.00 58.31 58.17 2epa n LYS 53 Cb 0.60 -1.10 0.03 0.00 0.02 0.00 0.00 35.03 34.58 2epa n LYS 53 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2epa n GLY 54 N -1.02 3.02 0.04 3.14 0.00 -1.26 -4.90 105.19 104.22 2epa n GLY 54 Ca 0.00 -1.67 -0.04 0.00 0.00 0.00 0.00 46.02 44.31 2epa n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2epa n GLU 56 N -3.50 -6.73 -4.05 0.00 4.07 -1.26 -4.98 120.64 104.18 2epa n GLU 56 Ca -0.06 0.71 -0.33 0.00 -0.06 0.00 0.00 57.16 57.41 2epa n GLU 56 Cb 0.24 -5.39 -0.15 0.00 -0.06 0.00 0.00 31.44 26.08 2epa n GLU 56 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 2epa s ARG 57 N -6.04 2.75 0.47 5.31 1.81 -1.26 -4.98 118.95 117.02 2epa s ARG 57 Ca 0.46 -1.01 0.09 0.00 -1.72 0.00 0.00 55.73 53.55 2epa s ARG 57 Cb -0.20 -2.79 0.04 0.00 -0.45 0.00 0.00 34.95 31.54 2epa s ARG 57 CO 0.62 -0.36 0.63 1.03 -0.68 0.00 0.00 175.30 176.54 2epa s ARG 58 N 1.25 2.63 0.06 3.54 0.52 -1.26 -1.80 118.95 123.89 2epa s ARG 58 Ca -0.00 -1.41 -0.17 0.00 -0.52 0.00 0.00 55.73 53.63 2epa s ARG 58 Cb -0.16 -2.69 0.03 0.00 0.52 0.00 0.00 34.95 32.65 2epa s ARG 58 CO -0.08 -0.47 0.40 -0.06 0.02 0.00 0.00 175.30 175.11 2epa s PHE 59 N -2.47 -0.24 -0.16 -0.53 0.40 -1.03 -4.90 117.98 109.05 2epa s PHE 59 Ca 0.57 0.14 -0.08 0.00 -0.60 0.00 0.00 56.93 56.95 2epa s PHE 59 Cb -0.08 0.21 -0.23 0.00 0.51 0.00 0.00 43.02 43.43 2epa s PHE 59 CO 0.35 -0.59 0.23 0.00 0.70 0.00 0.00 175.22 175.90 2epa n ALA 60 N 0.37 0.95 -2.45 5.36 0.00 -1.26 -3.45 120.51 120.03 2epa n ALA 60 Ca -0.18 -0.66 -0.33 0.00 0.00 0.00 0.00 53.44 52.26 2epa n ALA 60 Cb 0.61 -0.55 -0.05 0.00 0.00 0.00 0.00 19.45 19.45 2epa n ALA 60 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2epa s ARG 61 N -2.52 3.84 0.01 0.00 1.81 -1.26 -4.73 118.95 116.09 2epa s ARG 61 Ca -0.26 0.30 -0.14 0.00 -1.72 0.00 0.00 55.73 53.91 2epa s ARG 61 Cb 0.07 -2.82 -0.08 0.00 -0.45 0.00 0.00 34.95 31.68 2epa s ARG 61 CO 0.70 0.42 0.92 0.77 -0.68 0.00 0.00 175.30 177.44 2epa h SER 62 N 3.10 -0.42 -0.97 0.23 0.02 -2.01 -3.16 113.55 110.34 2epa h SER 62 Ca -0.48 0.01 0.33 0.00 -0.84 0.00 0.00 61.79 60.82 2epa h SER 62 Cb 1.18 0.11 -0.18 0.00 0.14 0.00 0.00 62.40 63.65 2epa h SER 62 CO 0.68 -0.23 0.26 0.47 -1.14 0.00 0.00 176.83 176.87 2epa n ASP 63 N -3.75 0.10 -0.19 3.07 9.92 -1.26 0.10 116.55 124.55 2epa n ASP 63 Ca -0.06 1.63 -0.00 0.00 -0.53 0.00 0.00 54.79 55.82 2epa n ASP 63 Cb 0.20 -0.69 0.10 0.00 -0.64 0.00 0.00 41.12 40.09 2epa n ASP 63 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2epa h GLU 64 N 0.00 0.25 0.92 -1.24 4.39 -1.97 0.14 114.58 117.07 2epa h GLU 64 Ca 0.70 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 60.34 2epa h GLU 64 Cb 1.67 -0.06 0.01 0.00 -0.10 0.00 0.00 28.75 30.28 2epa h GLU 64 CO -0.83 0.17 -0.44 1.25 -1.16 0.00 0.00 179.01 177.99 2epa h LEU 65 N 0.26 -1.05 -0.83 1.33 5.85 0.74 -0.90 115.31 120.71 2epa h LEU 65 Ca 0.30 0.04 0.18 0.00 0.84 0.00 0.00 57.88 59.24 2epa h LEU 65 Cb 0.43 0.27 -0.11 0.00 0.37 0.00 0.00 40.66 41.63 2epa h LEU 65 CO -0.38 -0.72 0.34 -1.28 -0.34 0.00 0.00 178.44 176.05 2epa h SER 66 N -1.30 0.29 0.54 1.25 0.87 -1.19 0.78 113.55 114.78 2epa h SER 66 Ca -0.13 0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.54 2epa h SER 66 Cb 0.95 0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 63.02 2epa h SER 66 CO 0.21 0.05 -0.14 -0.09 -0.53 0.00 0.00 176.83 176.32 2epa h ARG 67 N 0.42 0.00 0.00 2.24 2.43 -0.61 -2.61 114.38 116.26 2epa h ARG 67 Ca 0.48 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.40 2epa h ARG 67 Cb 0.83 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.33 2epa h ARG 67 CO -0.47 0.14 -1.59 1.25 -1.51 0.00 0.00 179.97 177.79 2epa h HIS 68 N 0.00 0.00 -0.14 2.20 2.76 0.17 -3.32 115.15 116.82 2epa h HIS 68 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2epa h HIS 68 Cb 0.45 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.41 2epa h HIS 68 CO 0.00 0.90 0.00 -2.13 -1.30 0.00 0.00 177.93 175.40 2epa n ARG 69 N -3.03 1.55 -0.03 5.26 3.00 0.19 -3.61 116.66 120.00 2epa n ARG 69 Ca -0.14 -0.59 -0.19 0.00 -0.00 0.00 0.00 57.85 56.93 2epa n ARG 69 Cb 0.99 -1.36 -0.14 0.00 0.00 0.00 0.00 32.46 31.95 2epa n ARG 69 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2epa n ARG 70 N 0.03 0.72 0.13 -0.14 1.85 -1.14 -4.23 116.66 113.88 2epa n ARG 70 Ca 0.05 0.23 -0.00 0.00 -1.00 0.00 0.00 57.85 57.13 2epa n ARG 70 Cb 0.27 -1.67 0.14 0.00 -1.05 0.00 0.00 32.46 30.16 2epa n ARG 70 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2epa h THR 71 N 0.05 1.31 0.00 8.89 1.03 -1.79 -3.53 112.91 118.87 2epa h THR 71 Ca -0.45 -2.23 0.00 0.00 -0.01 0.00 0.00 66.41 63.72 2epa h THR 71 Cb 2.01 2.25 0.00 0.00 -1.07 0.00 0.00 68.15 71.34 2epa h THR 71 CO 0.05 0.61 0.00 1.41 -0.01 0.00 0.00 175.52 177.58