#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a24 s THR 7 N 0.00 0.08 -0.17 -0.18 -4.23 -1.26 -1.23 115.64 108.65 2a24 s THR 7 Ca 0.00 -0.64 -0.12 0.00 -1.18 0.00 0.00 61.69 59.75 2a24 s THR 7 Cb 0.00 -0.56 0.05 0.00 1.34 0.00 0.00 72.50 73.33 2a24 s THR 7 CO 0.00 -0.35 0.42 0.72 -0.54 0.00 0.00 174.62 174.86 2a24 s PHE 8 N -1.53 -0.54 0.08 3.99 -0.71 -0.97 -4.74 117.98 113.56 2a24 s PHE 8 Ca -0.13 1.22 -0.29 0.00 -1.04 0.00 0.00 56.93 56.69 2a24 s PHE 8 Cb -0.06 0.22 -0.05 0.00 -1.21 0.00 0.00 43.02 41.92 2a24 s PHE 8 CO 0.02 -0.29 0.94 -1.17 -1.34 0.00 0.00 175.22 173.38 2a24 s LEU 9 N 0.87 4.46 -0.27 -1.99 1.98 -1.26 -1.31 118.68 121.16 2a24 s LEU 9 Ca -0.05 1.72 -0.02 0.00 -2.89 0.00 0.00 54.13 52.89 2a24 s LEU 9 Cb -0.06 -3.54 0.09 0.00 0.66 0.00 0.00 46.19 43.33 2a24 s LEU 9 CO -0.07 -0.10 0.08 -0.94 -1.89 0.00 0.00 176.35 173.43 2a24 s SER 10 N 0.22 3.60 0.07 3.68 1.04 0.68 -0.25 113.70 122.74 2a24 s SER 10 Ca 0.47 -1.32 -0.30 0.00 0.48 0.00 0.00 55.95 55.28 2a24 s SER 10 Cb -0.22 -0.71 -0.05 0.00 0.10 0.00 0.00 66.02 65.13 2a24 s SER 10 CO 0.29 -0.38 1.13 -0.13 0.98 0.00 0.00 173.24 175.13 2a24 s ARG 11 N 1.76 4.49 0.07 4.02 1.81 0.14 -2.02 118.95 129.22 2a24 s ARG 11 Ca 0.06 1.68 0.09 0.00 -1.72 0.00 0.00 55.73 55.85 2a24 s ARG 11 Cb -0.17 -3.36 -0.03 0.00 -0.45 0.00 0.00 34.95 30.94 2a24 s ARG 11 CO -0.21 -0.16 -0.25 -1.01 -0.68 0.00 0.00 175.30 172.99 2a24 s HIS 12 N 0.83 2.21 0.33 -0.53 3.76 0.87 -0.07 115.29 122.69 2a24 s HIS 12 Ca 0.56 -0.40 -0.01 0.00 -0.15 0.00 0.00 55.06 55.06 2a24 s HIS 12 Cb -0.28 -1.27 0.07 0.00 1.11 0.00 0.00 32.58 32.21 2a24 s HIS 12 CO 0.30 0.19 0.45 0.43 -0.85 0.00 0.00 174.74 175.26 2a24 n SER 13 N 1.47 0.52 -0.36 1.40 7.64 -0.52 0.64 113.62 124.42 2a24 n SER 13 Ca -0.17 -1.46 0.04 0.00 1.01 0.00 0.00 58.87 58.29 2a24 n SER 13 Cb 0.53 -0.30 0.20 0.00 -1.01 0.00 0.00 64.21 63.63 2a24 n SER 13 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2a24 h MET 14 N 0.00 1.08 -0.21 1.43 2.86 -1.92 0.13 114.93 118.30 2a24 h MET 14 Ca -0.15 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 2a24 h MET 14 Cb 0.53 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.94 2a24 h MET 14 CO 0.15 0.71 0.00 -0.40 1.06 0.00 0.00 176.91 178.43 2a24 n ASP 15 N -4.53 0.94 -1.25 1.22 5.75 -1.26 -4.86 116.55 112.56 2a24 n ASP 15 Ca 0.16 -2.01 -0.14 0.00 -0.01 0.00 0.00 54.79 52.79 2a24 n ASP 15 Cb 0.23 -0.14 -0.04 0.00 -1.03 0.00 0.00 41.12 40.15 2a24 n ASP 15 CO 0.00 0.00 0.00 0.80 -0.11 0.00 0.00 177.20 177.89 2a24 n MET 16 N -0.01 -1.02 -1.94 0.11 1.56 0.45 -4.91 117.12 111.36 2a24 n MET 16 Ca 0.05 0.87 -0.29 0.00 -0.27 0.00 0.00 57.70 58.07 2a24 n MET 16 Cb 0.16 -5.03 0.07 0.00 2.15 0.00 0.00 33.22 30.56 2a24 n MET 16 CO 0.00 0.00 0.00 -1.59 -0.73 0.00 0.00 175.97 173.65 2a24 s LYS 17 N -3.72 2.44 -0.35 2.12 -2.85 -1.26 -4.54 119.74 111.57 2a24 s LYS 17 Ca 0.00 0.24 -0.24 0.00 -1.00 0.00 0.00 55.97 54.97 2a24 s LYS 17 Cb 0.00 -2.01 0.01 0.00 -2.06 0.00 0.00 37.83 33.77 2a24 s LYS 17 CO 0.00 -1.27 0.84 -0.06 0.10 0.00 0.00 175.35 174.96 2a24 s PHE 18 N -3.43 3.12 -0.13 1.78 0.08 -1.25 -1.43 117.98 116.71 2a24 s PHE 18 Ca 0.60 0.68 -0.08 0.00 0.12 0.00 0.00 56.93 58.25 2a24 s PHE 18 Cb -0.11 -3.46 -0.25 0.00 -0.57 0.00 0.00 43.02 38.63 2a24 s PHE 18 CO 0.50 -0.74 0.33 2.41 -0.10 0.00 0.00 175.22 177.62 2a24 n THR 19 N 5.81 1.75 -3.62 0.64 -1.04 0.90 -1.53 114.28 117.20 2a24 n THR 19 Ca 0.05 -0.58 -0.03 0.00 -2.04 0.00 0.00 64.05 61.44 2a24 n THR 19 Cb 0.48 -1.77 -0.05 0.00 -1.82 0.00 0.00 70.33 67.17 2a24 n THR 19 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2a24 s TYR 20 N -2.54 -1.10 0.18 -1.42 5.04 -1.20 -4.79 117.35 111.54 2a24 s TYR 20 Ca -0.23 2.02 0.10 0.00 -2.44 0.00 0.00 57.07 56.52 2a24 s TYR 20 Cb 0.07 0.66 -0.04 0.00 0.35 0.00 0.00 41.96 42.99 2a24 s TYR 20 CO 0.74 -0.54 -0.18 0.00 -1.34 0.00 0.00 175.55 174.23 2a24 s ASP 22 N -2.70 4.92 0.00 0.00 -1.08 0.66 -4.74 116.67 113.73 2a24 s ASP 22 Ca 0.22 1.50 0.18 0.00 -0.52 0.00 0.00 52.55 53.93 2a24 s ASP 22 Cb -0.08 -2.31 1.08 0.00 -1.46 0.00 0.00 42.92 40.15 2a24 s ASP 22 CO 0.12 -1.72 1.60 0.47 0.52 0.00 0.00 175.17 176.16 2a24 n ASP 23 N -3.29 0.00 0.10 -0.34 9.92 -1.26 -2.83 116.55 118.84 2a24 n ASP 23 Ca 0.07 -1.14 0.13 0.00 -0.53 0.00 0.00 54.79 53.32 2a24 n ASP 23 Cb 0.55 0.00 0.31 0.00 -0.64 0.00 0.00 41.12 41.34 2a24 n ASP 23 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2a24 h ARG 24 N 0.00 0.00 0.00 -1.24 2.47 -1.92 -3.30 114.38 110.39 2a24 h ARG 24 Ca 0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 2a24 h ARG 24 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 2a24 h ARG 24 CO 0.00 0.00 -0.04 0.97 0.56 0.00 0.00 179.97 181.46 2a24 h ILE 25 N 0.00 0.48 0.00 2.04 2.10 -1.80 -1.91 117.51 118.43 2a24 h ILE 25 Ca 0.00 -0.19 -0.04 0.00 1.08 0.00 0.00 64.86 65.71 2a24 h ILE 25 Cb 0.76 1.12 -0.01 0.00 -1.09 0.00 0.00 36.82 37.61 2a24 h ILE 25 CO 0.00 0.04 -0.19 0.71 -1.08 0.00 0.00 178.15 177.63 2a24 h THR 26 N 0.00 0.67 0.00 2.19 1.35 -1.60 0.93 112.91 116.46 2a24 h THR 26 Ca -0.00 -0.82 -0.16 0.00 -0.55 0.00 0.00 66.41 64.88 2a24 h THR 26 Cb 0.12 1.52 -0.03 0.00 -1.73 0.00 0.00 68.15 68.03 2a24 h THR 26 CO 0.01 0.19 -1.68 -0.62 -0.25 0.00 0.00 175.52 173.17 2a24 n GLU 27 N -3.64 0.64 -0.01 4.72 -0.58 -0.73 -3.32 120.64 117.72 2a24 n GLU 27 Ca -0.01 0.09 -0.01 0.00 -0.42 0.00 0.00 57.16 56.81 2a24 n GLU 27 Cb 0.32 -1.70 -0.00 0.00 -0.57 0.00 0.00 31.44 29.48 2a24 n GLU 27 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2a24 n LEU 28 N -2.72 0.25 0.09 -4.62 4.77 -1.05 -4.66 117.00 109.06 2a24 n LEU 28 Ca -0.12 0.26 -0.14 0.00 -0.03 0.00 0.00 56.01 55.98 2a24 n LEU 28 Cb 0.82 -0.55 -0.14 0.00 -2.33 0.00 0.00 43.42 41.23 2a24 n LEU 28 CO 0.43 -0.49 -0.04 0.40 -1.33 0.00 0.00 177.39 176.36 2a24 h ILE 29 N -0.14 1.51 0.00 -0.08 1.08 -1.19 -3.47 117.51 115.22 2a24 h ILE 29 Ca 0.00 -3.11 0.00 0.00 -0.39 0.00 0.00 64.86 61.36 2a24 h ILE 29 Cb 0.08 2.92 0.00 0.00 -3.07 0.00 0.00 36.82 36.74 2a24 h ILE 29 CO 0.00 0.90 0.00 0.61 -0.69 0.00 0.00 178.15 178.97 2a24 n GLY 30 N 1.51 0.09 3.91 5.37 0.00 0.06 -0.58 105.19 115.54 2a24 n GLY 30 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 2a24 n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2a24 s TYR 31 N -2.00 3.48 0.36 1.61 2.02 -1.24 -4.80 117.35 116.77 2a24 s TYR 31 Ca 0.00 0.64 -0.25 0.00 -0.37 0.00 0.00 57.07 57.09 2a24 s TYR 31 Cb 0.00 -2.11 -0.10 0.00 -0.40 0.00 0.00 41.96 39.36 2a24 s TYR 31 CO 0.00 0.16 0.99 -1.01 -1.57 0.00 0.00 175.55 174.12 2a24 s HIS 32 N -2.11 3.50 0.18 2.71 3.76 -1.26 -2.77 115.29 119.29 2a24 s HIS 32 Ca 0.44 1.71 -0.17 0.00 -0.15 0.00 0.00 55.06 56.90 2a24 s HIS 32 Cb -0.11 -3.02 0.13 0.00 1.11 0.00 0.00 32.58 30.69 2a24 s HIS 32 CO 0.30 -0.18 1.65 -1.35 -0.85 0.00 0.00 174.74 174.31 2a24 h PRO 33 N 2.88 -0.04 -0.04 8.40 0.11 -1.86 -0.23 132.00 141.21 2a24 h PRO 33 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2a24 h PRO 33 Cb 1.20 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2a24 h PRO 33 CO 0.64 -0.03 0.00 0.39 -0.21 0.00 0.00 178.00 178.79 2a24 n GLU 34 N -5.36 1.36 0.03 1.05 1.02 -1.26 -3.29 120.64 114.19 2a24 n GLU 34 Ca 0.03 -0.53 0.13 0.00 -0.02 0.00 0.00 57.16 56.78 2a24 n GLU 34 Cb 0.27 -1.43 0.38 0.00 -0.02 0.00 0.00 31.44 30.64 2a24 n GLU 34 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2a24 n GLU 35 N -0.32 0.12 0.00 3.49 -0.58 -0.10 -3.40 120.64 119.85 2a24 n GLU 35 Ca 0.19 0.06 0.07 0.00 -0.42 0.00 0.00 57.16 57.06 2a24 n GLU 35 Cb 0.22 -1.60 -0.01 0.00 -0.57 0.00 0.00 31.44 29.48 2a24 n GLU 35 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2a24 n LEU 36 N -1.79 1.43 -4.65 -4.62 4.32 -1.21 -4.85 117.00 105.63 2a24 n LEU 36 Ca 0.05 -0.74 -0.43 0.00 -0.02 0.00 0.00 56.01 54.87 2a24 n LEU 36 Cb 0.38 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.16 2a24 n LEU 36 CO 0.32 0.28 1.24 -0.76 -1.22 0.00 0.00 177.39 177.25 2a24 s LEU 37 N -1.96 4.08 0.00 2.23 1.43 -1.22 -2.84 118.68 120.40 2a24 s LEU 37 Ca 0.11 1.72 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 2a24 s LEU 37 Cb 0.11 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.80 2a24 s LEU 37 CO 0.37 -1.00 0.00 0.61 0.23 0.00 0.00 176.35 176.56 2a24 n GLY 38 N 4.16 3.19 3.84 -3.19 0.00 -0.58 -5.03 105.19 107.57 2a24 n GLY 38 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2a24 n GLY 38 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2a24 s ARG 39 N -0.46 2.81 -0.23 1.61 1.70 -1.13 -4.94 118.95 118.31 2a24 s ARG 39 Ca 0.00 0.69 -0.29 0.00 -0.47 0.00 0.00 55.73 55.66 2a24 s ARG 39 Cb 0.00 -2.00 0.00 0.00 -0.57 0.00 0.00 34.95 32.39 2a24 s ARG 39 CO 0.00 -1.12 1.14 -1.12 -1.08 0.00 0.00 175.30 173.12 2a24 s SER 40 N -4.05 6.98 0.39 -2.89 0.01 -1.26 -3.93 113.70 108.94 2a24 s SER 40 Ca 0.58 1.41 0.15 0.00 1.31 0.00 0.00 55.95 59.40 2a24 s SER 40 Cb -0.13 -2.54 0.81 0.00 0.21 0.00 0.00 66.02 64.37 2a24 s SER 40 CO 0.54 -0.77 1.85 0.00 0.41 0.00 0.00 173.24 175.26 2a24 h ALA 41 N 7.98 1.36 0.00 1.44 0.00 -1.91 -2.41 119.26 125.71 2a24 h ALA 41 Ca -0.22 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2a24 h ALA 41 Cb 1.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2a24 h ALA 41 CO 0.99 0.42 0.00 0.66 0.00 0.00 0.00 179.25 181.32 2a24 n TYR 42 N -4.01 0.00 0.51 0.00 4.02 -1.26 -1.88 117.16 114.54 2a24 n TYR 42 Ca -0.02 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.00 2a24 n TYR 42 Cb 0.39 -0.21 0.42 0.00 -0.02 0.00 0.00 39.34 39.92 2a24 n TYR 42 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 176.86 176.90 2a24 h GLU 43 N 0.00 0.00 0.00 -0.72 4.11 -1.84 -3.27 114.58 112.86 2a24 h GLU 43 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 2a24 h GLU 43 Cb 0.12 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2a24 h GLU 43 CO 0.00 0.00 -0.42 1.97 0.07 0.00 0.00 179.01 180.63 2a24 n PHE 44 N -2.36 0.00 -1.18 2.06 -1.74 -1.03 -4.96 117.46 108.25 2a24 n PHE 44 Ca 0.04 -0.04 -0.31 0.00 -0.56 0.00 0.00 57.45 56.58 2a24 n PHE 44 Cb 0.38 0.02 -0.06 0.00 1.52 0.00 0.00 39.48 41.34 2a24 n PHE 44 CO 0.00 0.00 0.00 0.66 -0.56 0.00 0.00 176.76 176.86 2a24 n TYR 45 N 0.03 1.78 -1.51 2.97 4.01 -0.79 -4.24 117.16 119.41 2a24 n TYR 45 Ca -0.00 -2.63 0.00 0.00 -0.16 0.00 0.00 57.90 55.11 2a24 n TYR 45 Cb 0.68 -2.21 0.00 0.00 -0.31 0.00 0.00 39.34 37.50 2a24 n TYR 45 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2a24 n HIS 46 N 3.39 -3.38 0.10 -0.72 8.25 -1.26 -4.00 115.22 117.60 2a24 n HIS 46 Ca 0.67 1.99 -0.02 0.00 -0.26 0.00 0.00 57.72 60.10 2a24 n HIS 46 Cb 0.37 -3.13 0.22 0.00 1.12 0.00 0.00 29.99 28.57 2a24 n HIS 46 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2a24 h ALA 47 N 2.78 1.09 0.01 -1.41 0.00 -1.91 -3.15 119.26 116.67 2a24 h ALA 47 Ca 0.00 -0.43 -0.40 0.00 0.00 0.00 0.00 54.91 54.08 2a24 h ALA 47 Cb 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 2a24 h ALA 47 CO 0.00 0.61 -2.31 1.47 0.00 0.00 0.00 179.25 179.01 2a24 n LEU 48 N -4.00 2.41 -2.29 0.00 -0.00 -1.26 -4.48 117.00 107.37 2a24 n LEU 48 Ca -0.02 0.16 -0.21 0.00 -0.00 0.00 0.00 56.01 55.93 2a24 n LEU 48 Cb 0.50 -0.91 -0.08 0.00 -0.00 0.00 0.00 43.42 42.93 2a24 n LEU 48 CO 0.42 0.71 1.55 0.47 -0.00 0.00 0.00 177.39 180.54 2a24 n ASP 49 N -3.81 6.10 -0.07 1.45 8.00 -1.25 -4.40 116.55 122.56 2a24 n ASP 49 Ca -0.46 -2.98 -0.13 0.00 0.71 0.00 0.00 54.79 51.93 2a24 n ASP 49 Cb 0.92 -1.27 -0.11 0.00 -0.02 0.00 0.00 41.12 40.64 2a24 n ASP 49 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2a24 h SER 50 N 2.85 0.00 -0.85 -2.24 0.02 -1.68 -3.30 113.55 108.35 2a24 h SER 50 Ca 0.32 -0.82 0.11 0.00 -0.84 0.00 0.00 61.79 60.56 2a24 h SER 50 Cb 0.96 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.44 2a24 h SER 50 CO 0.67 1.00 0.55 -0.33 -1.14 0.00 0.00 176.83 177.58 2a24 h GLU 51 N -1.00 0.74 -0.79 3.45 4.39 -1.91 -0.06 114.58 119.40 2a24 h GLU 51 Ca -0.04 -0.04 0.05 0.00 0.34 0.00 0.00 59.36 59.66 2a24 h GLU 51 Cb 0.92 -0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 29.36 2a24 h GLU 51 CO -0.02 0.49 0.52 -0.91 -1.16 0.00 0.00 179.01 177.92 2a24 h ASN 52 N 0.76 0.80 -0.07 1.42 4.21 -1.89 0.20 115.58 121.02 2a24 h ASN 52 Ca 0.41 -0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.79 2a24 h ASN 52 Cb 0.52 -0.18 0.01 0.00 -1.12 0.00 0.00 38.32 37.55 2a24 h ASN 52 CO -0.17 0.54 -0.41 0.24 -1.29 0.00 0.00 177.43 176.33 2a24 h MET 53 N 0.92 0.41 -0.69 0.81 2.86 -1.11 -1.55 114.93 116.59 2a24 h MET 53 Ca 0.33 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2a24 h MET 53 Cb 0.13 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 2a24 h MET 53 CO -0.10 0.98 0.43 1.15 1.06 0.00 0.00 176.91 180.43 2a24 h THR 54 N -0.05 1.19 -0.21 2.22 2.02 -0.89 0.21 112.91 117.40 2a24 h THR 54 Ca -0.03 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 2a24 h THR 54 Cb 1.07 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 2a24 h THR 54 CO 0.09 0.19 0.05 0.11 0.37 0.00 0.00 175.52 176.32 2a24 h LYS 55 N 0.93 0.34 -0.49 6.66 6.56 -0.63 -1.15 116.57 128.79 2a24 h LYS 55 Ca 0.25 -0.09 -0.03 0.00 -1.06 0.00 0.00 60.65 59.72 2a24 h LYS 55 Cb -0.06 -0.04 -0.02 0.00 -0.57 0.00 0.00 32.23 31.53 2a24 h LYS 55 CO -0.05 0.47 0.18 0.77 -2.06 0.00 0.00 179.45 178.76 2a24 h SER 56 N 0.16 0.65 0.41 0.86 0.02 -0.99 -0.38 113.55 114.29 2a24 h SER 56 Ca 0.07 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 2a24 h SER 56 Cb 0.29 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2a24 h SER 56 CO 0.00 0.61 -0.20 -0.74 -1.14 0.00 0.00 176.83 175.36 2a24 h HIS 57 N 0.71 -0.51 -0.25 3.45 6.17 -0.25 0.44 115.15 124.91 2a24 h HIS 57 Ca 0.17 -0.01 -0.03 0.00 0.71 0.00 0.00 60.37 61.20 2a24 h HIS 57 Cb 0.17 0.17 -0.01 0.00 2.52 0.00 0.00 27.41 30.26 2a24 h HIS 57 CO 0.01 -0.24 0.01 1.96 0.71 0.00 0.00 177.93 180.38 2a24 h GLN 58 N -0.72 0.36 0.02 5.26 4.20 -1.05 -2.58 115.11 120.60 2a24 h GLN 58 Ca -0.06 -0.06 -0.18 0.00 0.06 0.00 0.00 58.65 58.41 2a24 h GLN 58 Cb 0.51 -0.06 0.02 0.00 0.30 0.00 0.00 27.48 28.24 2a24 h GLN 58 CO 0.09 0.39 -0.72 -0.97 -0.67 0.00 0.00 178.83 176.95 2a24 h ASN 59 N 0.36 0.61 -0.91 1.46 -1.24 -0.92 -3.31 115.58 111.62 2a24 h ASN 59 Ca 0.08 -0.77 0.08 0.00 0.71 0.00 0.00 56.30 56.40 2a24 h ASN 59 Cb 0.23 -0.19 -0.06 0.00 0.73 0.00 0.00 38.32 39.03 2a24 h ASN 59 CO 0.00 1.31 0.59 0.25 -1.29 0.00 0.00 177.43 178.29 2a24 h LEU 60 N -0.02 0.88 -2.22 0.34 5.85 0.16 -1.24 115.31 119.05 2a24 h LEU 60 Ca -0.09 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.68 2a24 h LEU 60 Cb 1.43 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.29 2a24 h LEU 60 CO 0.14 0.54 0.14 0.00 -0.34 0.00 0.00 178.44 178.92 2a24 n THR 62 N -4.01 1.59 0.00 0.00 -1.04 -0.52 -4.56 114.28 105.75 2a24 n THR 62 Ca 0.01 -1.44 0.00 0.00 -2.04 0.00 0.00 64.05 60.57 2a24 n THR 62 Cb 0.26 0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.91 2a24 n THR 62 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2a24 n LYS 63 N -0.10 2.98 0.00 -2.82 4.76 -0.13 -5.04 118.16 117.81 2a24 n LYS 63 Ca 0.15 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 2a24 n LYS 63 Cb 0.62 -0.96 0.00 0.00 -1.84 0.00 0.00 35.03 32.85 2a24 n LYS 63 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2a24 n GLY 64 N 2.92 2.05 2.85 0.72 0.00 0.21 -4.85 105.19 109.10 2a24 n GLY 64 Ca 0.00 -0.30 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 2a24 n GLY 64 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a24 s GLN 65 N 0.00 1.12 -0.08 1.61 0.74 -1.26 0.21 119.66 122.00 2a24 s GLN 65 Ca 0.00 -0.10 0.00 0.00 0.05 0.00 0.00 55.36 55.31 2a24 s GLN 65 Cb 0.00 -1.34 0.02 0.00 1.10 0.00 0.00 33.01 32.80 2a24 s GLN 65 CO 0.00 -0.29 -0.06 0.08 -0.55 0.00 0.00 175.29 174.47 2a24 s VAL 66 N 1.82 0.77 -0.65 1.34 1.01 -0.13 -4.98 120.40 119.58 2a24 s VAL 66 Ca 0.05 -0.18 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 2a24 s VAL 66 Cb -0.13 -0.81 0.16 0.00 0.00 0.00 0.00 36.38 35.60 2a24 s VAL 66 CO -0.07 0.31 0.62 -0.69 0.00 0.00 0.00 175.10 175.27 2a24 s VAL 67 N 1.45 5.31 -0.06 2.92 1.01 -1.26 -0.18 120.40 129.58 2a24 s VAL 67 Ca -0.01 -1.79 -0.30 0.00 0.00 0.00 0.00 61.98 59.88 2a24 s VAL 67 Cb -0.13 -4.40 -0.03 0.00 0.00 0.00 0.00 36.38 31.81 2a24 s VAL 67 CO -0.04 -0.96 1.21 -0.44 0.00 0.00 0.00 175.10 174.88 2a24 s SER 68 N 3.12 7.03 1.10 3.32 0.01 -0.05 -4.93 113.70 123.31 2a24 s SER 68 Ca 0.09 1.81 -0.12 0.00 1.31 0.00 0.00 55.95 59.05 2a24 s SER 68 Cb -0.22 -2.56 0.25 0.00 0.21 0.00 0.00 66.02 63.70 2a24 s SER 68 CO -0.01 -0.60 1.06 -0.83 0.41 0.00 0.00 173.24 173.26 2a24 s GLY 69 N 1.54 1.58 -0.08 3.44 0.00 -1.26 -1.69 107.32 110.84 2a24 s GLY 69 Ca 0.56 0.05 -0.35 0.00 0.00 0.00 0.00 44.72 44.98 2a24 s GLY 69 CO 0.21 0.70 1.79 0.61 0.00 0.00 0.00 173.10 176.42 2a24 n GLN 70 N -4.76 1.95 -4.56 2.90 10.64 -1.26 -4.49 117.38 117.80 2a24 n GLN 70 Ca 0.05 0.71 -0.26 0.00 -1.83 0.00 0.00 57.00 55.67 2a24 n GLN 70 Cb 0.54 -2.51 -0.11 0.00 -0.86 0.00 0.00 30.24 27.30 2a24 n GLN 70 CO 0.00 0.00 0.00 1.52 -1.83 0.00 0.00 177.06 176.75 2a24 s TYR 71 N 3.40 2.27 -0.83 2.61 -0.85 0.46 -4.78 117.35 119.63 2a24 s TYR 71 Ca 0.92 -0.80 -0.25 0.00 -0.52 0.00 0.00 57.07 56.41 2a24 s TYR 71 Cb -0.77 -1.58 0.04 0.00 0.38 0.00 0.00 41.96 40.03 2a24 s TYR 71 CO 0.52 0.26 1.31 1.03 -1.52 0.00 0.00 175.55 177.15 2a24 s ARG 72 N -3.78 3.32 0.05 -3.49 0.52 -1.26 -0.63 118.95 113.68 2a24 s ARG 72 Ca 0.34 -0.59 -0.22 0.00 -0.52 0.00 0.00 55.73 54.74 2a24 s ARG 72 Cb 0.09 -4.57 -0.06 0.00 0.52 0.00 0.00 34.95 30.93 2a24 s ARG 72 CO 0.16 -2.14 0.65 1.41 0.02 0.00 0.00 175.30 175.40 2a24 s MET 73 N 5.33 4.36 -0.25 3.54 1.75 0.13 -4.67 119.30 129.48 2a24 s MET 73 Ca 0.38 0.86 -0.29 0.00 -1.25 0.00 0.00 55.69 55.39 2a24 s MET 73 Cb -0.06 -3.31 0.01 0.00 2.84 0.00 0.00 34.83 34.31 2a24 s MET 73 CO 0.06 0.45 1.04 -1.17 -0.65 0.00 0.00 175.02 174.76 2a24 s LEU 74 N -0.55 4.06 0.75 4.11 2.96 -1.26 -0.53 118.68 128.22 2a24 s LEU 74 Ca 0.33 1.28 -0.04 0.00 -0.22 0.00 0.00 54.13 55.48 2a24 s LEU 74 Cb -0.20 -3.52 0.13 0.00 0.50 0.00 0.00 46.19 43.10 2a24 s LEU 74 CO 0.20 -0.72 1.03 0.00 -1.32 0.00 0.00 176.35 175.55 2a24 s ALA 75 N 3.30 3.43 0.25 5.97 0.00 0.11 -4.94 121.76 129.87 2a24 s ALA 75 Ca 0.44 -1.54 -0.06 0.00 0.00 0.00 0.00 51.96 50.81 2a24 s ALA 75 Cb -0.14 -2.19 0.28 0.00 0.00 0.00 0.00 23.12 21.06 2a24 s ALA 75 CO 0.08 -1.55 1.93 -0.22 0.00 0.00 0.00 175.76 176.00 2a24 h LYS 76 N -0.67 1.31 -0.44 0.00 3.64 -1.15 -0.87 116.57 118.39 2a24 h LYS 76 Ca -0.39 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2a24 h LYS 76 Cb 1.27 -0.30 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 2a24 h LYS 76 CO 0.43 0.87 0.00 -2.39 -2.27 0.00 0.00 179.45 176.08 2a24 n HIS 77 N -4.39 0.23 -0.98 1.91 1.44 -1.26 -4.83 115.22 107.33 2a24 n HIS 77 Ca 0.12 -0.09 0.00 0.00 -2.01 0.00 0.00 57.72 55.74 2a24 n HIS 77 Cb 0.03 -0.07 0.00 0.00 0.12 0.00 0.00 29.99 30.07 2a24 n HIS 77 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2a24 n GLY 78 N 0.45 0.51 3.80 -1.39 0.00 -0.33 -5.01 105.19 103.23 2a24 n GLY 78 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2a24 n GLY 78 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a24 s GLY 79 N -2.00 2.64 -0.43 -0.02 0.00 -1.26 -4.70 107.32 101.55 2a24 s GLY 79 Ca 0.00 0.32 -0.16 0.00 0.00 0.00 0.00 44.72 44.88 2a24 s GLY 79 CO 0.00 0.69 0.37 -0.19 0.00 0.00 0.00 173.10 173.97 2a24 s TYR 80 N -1.66 3.21 -0.13 1.90 2.02 -1.26 0.08 117.35 121.52 2a24 s TYR 80 Ca 0.49 -0.58 -0.11 0.00 -0.37 0.00 0.00 57.07 56.49 2a24 s TYR 80 Cb -0.16 -2.82 -0.05 0.00 -0.40 0.00 0.00 41.96 38.53 2a24 s TYR 80 CO 0.21 -0.68 0.23 0.08 -1.57 0.00 0.00 175.55 173.82 2a24 s VAL 81 N 1.85 5.34 -1.01 0.71 1.01 0.31 -0.32 120.40 128.30 2a24 s VAL 81 Ca 0.07 0.42 -0.23 0.00 0.00 0.00 0.00 61.98 62.24 2a24 s VAL 81 Cb -0.19 -3.54 0.04 0.00 0.00 0.00 0.00 36.38 32.68 2a24 s VAL 81 CO 0.11 0.49 1.50 0.26 0.00 0.00 0.00 175.10 177.46 2a24 s TRP 82 N -0.20 2.46 -0.08 5.22 0.52 -1.09 0.18 118.94 125.94 2a24 s TRP 82 Ca 0.15 -0.69 0.02 0.00 0.02 0.00 0.00 56.10 55.60 2a24 s TRP 82 Cb -0.13 -4.63 -0.02 0.00 -1.15 0.00 0.00 33.47 27.53 2a24 s TRP 82 CO 0.04 -1.92 -0.11 -0.51 0.02 0.00 0.00 176.95 174.46 2a24 s LEU 83 N 5.49 2.87 0.20 2.99 1.02 0.20 -2.47 118.68 128.98 2a24 s LEU 83 Ca 0.48 -0.18 -0.01 0.00 0.02 0.00 0.00 54.13 54.44 2a24 s LEU 83 Cb -0.01 -1.62 -0.04 0.00 0.02 0.00 0.00 46.19 44.54 2a24 s LEU 83 CO -0.09 0.30 0.39 -0.70 0.02 0.00 0.00 176.35 176.27 2a24 s GLU 84 N -0.42 3.53 -0.19 1.70 2.12 0.12 -0.40 118.70 125.16 2a24 s GLU 84 Ca 0.05 -0.31 -0.08 0.00 0.36 0.00 0.00 54.97 54.99 2a24 s GLU 84 Cb -0.12 -2.84 0.08 0.00 0.26 0.00 0.00 34.13 31.51 2a24 s GLU 84 CO 0.02 0.41 0.42 0.99 -0.54 0.00 0.00 175.26 176.56 2a24 s THR 85 N -1.85 -0.47 -0.25 -1.70 2.01 -0.68 0.40 115.64 113.10 2a24 s THR 85 Ca 0.39 0.15 -0.09 0.00 0.31 0.00 0.00 61.69 62.44 2a24 s THR 85 Cb -0.11 -0.65 -0.04 0.00 0.01 0.00 0.00 72.50 71.70 2a24 s THR 85 CO 0.29 0.06 0.13 0.00 -0.69 0.00 0.00 174.62 174.41 2a24 s GLN 86 N 2.27 3.90 -0.30 4.92 -2.07 -0.71 -0.87 119.66 126.80 2a24 s GLN 86 Ca -0.04 -0.36 -0.10 0.00 -1.82 0.00 0.00 55.36 53.04 2a24 s GLN 86 Cb -0.11 -3.47 -0.02 0.00 -1.09 0.00 0.00 33.01 28.33 2a24 s GLN 86 CO -0.13 -0.06 0.16 0.20 -1.32 0.00 0.00 175.29 174.14 2a24 s GLY 87 N 1.35 1.88 -0.34 2.60 0.00 0.75 -1.39 107.32 112.15 2a24 s GLY 87 Ca 0.06 -1.31 -0.03 0.00 0.00 0.00 0.00 44.72 43.44 2a24 s GLY 87 CO 0.06 0.68 0.09 -1.59 0.00 0.00 0.00 173.10 172.33 2a24 s THR 88 N 1.65 3.19 0.01 0.90 2.01 0.29 -0.96 115.64 122.73 2a24 s THR 88 Ca 0.05 -1.60 -0.30 0.00 0.31 0.00 0.00 61.69 60.15 2a24 s THR 88 Cb -0.17 -2.97 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 2a24 s THR 88 CO 0.07 -0.33 1.12 -0.69 -0.69 0.00 0.00 174.62 174.10 2a24 s VAL 89 N 1.23 4.39 -0.11 3.82 1.01 0.13 0.22 120.40 131.10 2a24 s VAL 89 Ca 0.00 1.71 -0.08 0.00 0.00 0.00 0.00 61.98 63.62 2a24 s VAL 89 Cb -0.21 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 2a24 s VAL 89 CO -0.02 0.10 0.17 -0.51 0.00 0.00 0.00 175.10 174.84 2a24 s ILE 90 N 1.35 5.45 0.17 2.22 2.07 0.56 -4.87 121.20 128.16 2a24 s ILE 90 Ca 0.55 0.28 0.04 0.00 -1.41 0.00 0.00 60.65 60.12 2a24 s ILE 90 Cb -0.25 -3.44 -0.04 0.00 0.13 0.00 0.00 42.46 38.87 2a24 s ILE 90 CO 0.26 0.61 0.20 -0.31 -1.91 0.00 0.00 174.94 173.80 2a24 s TYR 91 N -0.98 3.27 0.11 3.50 1.51 -1.26 -0.13 117.35 123.36 2a24 s TYR 91 Ca 0.16 0.01 -0.30 0.00 -1.01 0.00 0.00 57.07 55.93 2a24 s TYR 91 Cb -0.12 -1.55 -0.06 0.00 -0.11 0.00 0.00 41.96 40.12 2a24 s TYR 91 CO 0.05 0.51 1.07 1.21 -1.11 0.00 0.00 175.55 177.28 2a24 s ASN 92 N -3.29 7.30 0.24 2.29 3.84 0.10 -4.81 114.94 120.62 2a24 s ASN 92 Ca 0.32 1.93 0.20 0.00 0.21 0.00 0.00 52.86 55.53 2a24 s ASN 92 Cb -0.10 -2.59 0.95 0.00 -0.55 0.00 0.00 41.25 38.96 2a24 s ASN 92 CO 0.25 -0.24 1.61 -0.81 -2.79 0.00 0.00 177.10 175.13 2a24 n PRO 93 N 3.03 0.14 -0.06 0.43 -0.04 -1.26 -0.62 135.00 136.61 2a24 n PRO 93 Ca 0.04 0.51 -0.14 0.00 -0.04 0.00 0.00 63.50 63.87 2a24 n PRO 93 Cb 0.48 -1.85 -0.05 0.00 -0.04 0.00 0.00 33.50 32.04 2a24 n PRO 93 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2a24 n ARG 94 N -2.13 0.30 0.25 0.54 1.74 -1.26 -4.64 116.66 111.45 2a24 n ARG 94 Ca 0.01 0.13 0.14 0.00 -0.77 0.00 0.00 57.85 57.35 2a24 n ARG 94 Cb 0.12 -1.00 0.49 0.00 -1.02 0.00 0.00 32.46 31.05 2a24 n ARG 94 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2a24 h ASN 95 N -0.51 0.00 -5.12 0.55 4.21 -1.98 -3.46 115.58 109.27 2a24 h ASN 95 Ca -0.32 0.00 -0.41 0.00 1.21 0.00 0.00 56.30 56.79 2a24 h ASN 95 Cb 1.21 0.00 0.05 0.00 -1.12 0.00 0.00 38.32 38.46 2a24 h ASN 95 CO -0.19 0.06 -0.63 0.18 -1.29 0.00 0.00 177.43 175.56 2a24 n LEU 96 N -3.16 -2.67 -4.18 1.61 7.99 0.20 -4.96 117.00 111.85 2a24 n LEU 96 Ca 0.01 -0.41 -0.13 0.00 -0.01 0.00 0.00 56.01 55.48 2a24 n LEU 96 Cb 0.40 -2.83 -0.10 0.00 -0.11 0.00 0.00 43.42 40.78 2a24 n LEU 96 CO 0.31 0.34 -0.40 0.00 -1.51 0.00 0.00 177.39 176.12 2a24 s GLN 97 N -5.98 0.85 0.26 3.23 -2.07 -1.25 -4.86 119.66 109.84 2a24 s GLN 97 Ca 0.42 -1.24 -0.31 0.00 -1.82 0.00 0.00 55.36 52.41 2a24 s GLN 97 Cb -0.19 -0.41 -0.13 0.00 -1.09 0.00 0.00 33.01 31.19 2a24 s GLN 97 CO 0.52 0.04 1.51 -0.35 -1.32 0.00 0.00 175.29 175.69 2a24 n PRO 98 N 0.28 2.34 -0.01 9.60 -0.04 -1.26 0.03 135.00 145.94 2a24 n PRO 98 Ca -0.14 0.83 -0.04 0.00 -0.04 0.00 0.00 63.50 64.11 2a24 n PRO 98 Cb 0.59 -2.56 -0.01 0.00 -0.04 0.00 0.00 33.50 31.48 2a24 n PRO 98 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2a24 n GLN 99 N 2.24 0.21 -4.17 0.54 7.27 0.81 -4.79 117.38 119.49 2a24 n GLN 99 Ca 0.11 0.08 -0.11 0.00 0.07 0.00 0.00 57.00 57.16 2a24 n GLN 99 Cb 0.34 -0.86 -0.10 0.00 2.41 0.00 0.00 30.24 32.02 2a24 n GLN 99 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2a24 s ILE 101 N -3.95 2.83 -0.60 0.00 1.01 0.21 -0.32 121.20 120.38 2a24 s ILE 101 Ca 0.24 -0.69 -0.20 0.00 0.00 0.00 0.00 60.65 59.99 2a24 s ILE 101 Cb 0.07 -2.23 0.08 0.00 0.01 0.00 0.00 42.46 40.39 2a24 s ILE 101 CO 0.02 0.49 0.78 -0.04 0.00 0.00 0.00 174.94 176.19 2a24 s MET 102 N 1.15 3.09 -0.24 2.79 -1.94 0.13 -0.09 119.30 124.19 2a24 s MET 102 Ca 0.01 -1.06 -0.07 0.00 -1.71 0.00 0.00 55.69 52.86 2a24 s MET 102 Cb -0.14 -4.22 -0.03 0.00 2.01 0.00 0.00 34.83 32.44 2a24 s MET 102 CO -0.04 -1.58 0.07 0.00 -0.01 0.00 0.00 175.02 173.46 2a24 s VAL 104 N 1.43 5.01 -0.09 0.00 1.01 -0.49 -0.23 120.40 127.04 2a24 s VAL 104 Ca 0.05 0.07 -0.17 0.00 0.00 0.00 0.00 61.98 61.93 2a24 s VAL 104 Cb -0.15 -3.37 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 2a24 s VAL 104 CO 0.04 0.29 0.45 0.21 0.00 0.00 0.00 175.10 176.08 2a24 s ASN 105 N 1.62 6.70 -0.23 3.32 3.84 -0.43 -1.73 114.94 128.04 2a24 s ASN 105 Ca 0.07 0.84 0.02 0.00 0.21 0.00 0.00 52.86 53.99 2a24 s ASN 105 Cb -0.15 -2.27 0.04 0.00 -0.55 0.00 0.00 41.25 38.31 2a24 s ASN 105 CO 0.08 0.09 -0.13 -0.31 -2.79 0.00 0.00 177.10 174.04 2a24 s TYR 106 N 0.17 3.06 -0.21 0.43 2.02 0.16 -2.28 117.35 120.70 2a24 s TYR 106 Ca 0.25 -1.96 -0.24 0.00 -0.37 0.00 0.00 57.07 54.74 2a24 s TYR 106 Cb -0.15 -1.95 -0.01 0.00 -0.40 0.00 0.00 41.96 39.45 2a24 s TYR 106 CO 0.11 -0.83 0.81 0.08 -1.57 0.00 0.00 175.55 174.14 2a24 s VAL 107 N 1.20 4.87 -0.02 0.71 1.01 -0.36 0.16 120.40 127.98 2a24 s VAL 107 Ca -0.02 1.56 0.02 0.00 0.00 0.00 0.00 61.98 63.53 2a24 s VAL 107 Cb -0.17 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 32.08 2a24 s VAL 107 CO -0.08 -0.01 0.01 0.18 0.00 0.00 0.00 175.10 175.20 2a24 n LEU 108 N 5.57 0.00 -4.06 3.92 4.77 -1.17 -4.72 117.00 121.31 2a24 n LEU 108 Ca 0.04 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.89 2a24 n LEU 108 Cb 0.48 0.05 -0.11 0.00 -2.33 0.00 0.00 43.42 41.51 2a24 n LEU 108 CO 0.47 0.05 -0.40 -0.44 -1.33 0.00 0.00 177.39 175.74 2a24 s SER 109 N -3.22 0.86 1.00 -1.43 0.01 -1.03 -5.07 113.70 104.82 2a24 s SER 109 Ca -0.01 -0.55 -0.01 0.00 1.31 0.00 0.00 55.95 56.69 2a24 s SER 109 Cb 0.01 0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.28 2a24 s SER 109 CO 0.08 -0.20 0.04 -0.62 0.41 0.00 0.00 173.24 172.95 2a24 n GLU 110 N 1.46 -0.33 -2.02 12.44 -0.58 -1.26 -2.68 120.64 127.67 2a24 n GLU 110 Ca -0.23 -0.07 -0.41 0.00 -0.42 0.00 0.00 57.16 56.04 2a24 n GLU 110 Cb 0.55 -0.05 -0.02 0.00 -0.57 0.00 0.00 31.44 31.35 2a24 n GLU 110 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 2a24 s ILE 111 N -1.09 2.52 -2.27 -3.67 -4.36 -1.26 -3.18 121.20 107.89 2a24 s ILE 111 Ca 0.02 0.52 0.30 0.00 -0.26 0.00 0.00 60.65 61.23 2a24 s ILE 111 Cb -0.00 -3.33 0.71 0.00 1.25 0.00 0.00 42.46 41.09 2a24 s ILE 111 CO 0.02 0.12 1.96 1.21 0.24 0.00 0.00 174.94 178.49