#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2otf h LEU 2 N 0.00 0.18 -0.13 1.04 4.07 -1.61 -1.14 115.31 117.73 2otf h LEU 2 Ca 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 2otf h LEU 2 Cb 0.00 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 41.71 2otf h LEU 2 CO 0.00 0.08 0.06 -0.07 -1.08 0.00 0.00 178.44 177.43 2otf h LEU 3 N 0.19 0.17 -0.33 1.67 -0.00 -1.95 0.34 115.31 115.40 2otf h LEU 3 Ca 0.37 -0.13 -0.10 0.00 -0.00 0.00 0.00 57.88 58.02 2otf h LEU 3 Cb 1.19 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 41.79 2otf h LEU 3 CO -0.07 0.26 -0.18 -0.33 -0.00 0.00 0.00 178.44 178.12 2otf h GLU 4 N 0.08 0.70 -0.74 1.13 3.07 -1.64 -2.63 114.58 114.55 2otf h GLU 4 Ca 0.04 -0.32 0.01 0.00 -0.50 0.00 0.00 59.36 58.59 2otf h GLU 4 Cb 0.13 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 27.99 2otf h GLU 4 CO -0.01 0.92 0.49 0.35 -1.40 0.00 0.00 179.01 179.36 2otf h PHE 5 N 0.47 0.94 -0.68 4.33 3.57 -1.17 -0.71 116.94 123.69 2otf h PHE 5 Ca 0.07 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.52 2otf h PHE 5 Cb 0.72 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 2otf h PHE 5 CO 0.06 0.60 0.17 0.78 -2.23 0.00 0.00 178.31 177.69 2otf h GLY 6 N 1.01 1.16 1.30 2.40 0.00 -0.89 -1.29 103.07 106.75 2otf h GLY 6 Ca 0.27 -0.72 -0.12 0.00 0.00 0.00 0.00 47.33 46.77 2otf h GLY 6 CO -0.06 0.67 -0.24 1.70 0.00 0.00 0.00 176.54 178.61 2otf h LYS 7 N 1.03 0.80 -0.12 4.80 3.64 -1.07 -2.03 116.57 123.62 2otf h LYS 7 Ca 0.22 -0.34 -0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2otf h LYS 7 Cb 0.36 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 2otf h LYS 7 CO 0.00 0.96 0.06 1.98 -2.27 0.00 0.00 179.45 180.18 2otf h MET 8 N 0.70 0.17 -0.08 1.90 4.05 -0.85 -1.34 114.93 119.48 2otf h MET 8 Ca 0.09 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 2otf h MET 8 Cb 0.76 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.53 2otf h MET 8 CO 0.06 0.23 0.04 0.82 0.23 0.00 0.00 176.91 178.29 2otf h ILE 9 N 0.07 1.00 -0.32 1.77 2.04 -1.13 -0.70 117.51 120.23 2otf h ILE 9 Ca 0.04 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.90 2otf h ILE 9 Cb 0.12 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 2otf h ILE 9 CO -0.01 0.02 0.15 0.25 0.00 0.00 0.00 178.15 178.56 2otf h LEU 10 N 0.08 0.21 -0.80 1.44 5.85 -1.30 0.20 115.31 120.99 2otf h LEU 10 Ca 0.03 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2otf h LEU 10 Cb 0.01 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 2otf h LEU 10 CO -0.03 0.16 0.51 -0.33 -0.34 0.00 0.00 178.44 178.42 2otf h GLU 11 N 0.31 1.06 -0.00 1.25 5.08 -1.02 0.19 114.58 121.45 2otf h GLU 11 Ca 0.14 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2otf h GLU 11 Cb 0.06 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.08 2otf h GLU 11 CO -0.10 0.72 -0.00 0.93 -1.00 0.00 0.00 179.01 179.56 2otf h GLU 12 N 1.09 0.00 0.00 2.33 4.39 -0.73 -3.39 114.58 118.26 2otf h GLU 12 Ca 0.29 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.99 2otf h GLU 12 Cb -0.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 2otf h GLU 12 CO -0.06 0.53 -1.49 0.25 -1.16 0.00 0.00 179.01 177.08 2otf n THR 13 N -4.83 0.00 -0.57 1.13 -2.24 0.02 -4.87 114.28 102.92 2otf n THR 13 Ca -0.09 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 2otf n THR 13 Cb 0.27 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 2otf n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2otf n GLY 14 N 1.50 1.51 3.87 3.38 0.00 0.67 -5.01 105.19 111.10 2otf n GLY 14 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2otf n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2otf s LYS 16 N -0.13 3.33 -0.01 1.61 1.02 -1.26 -5.00 119.74 119.31 2otf s LYS 16 Ca 0.00 -0.37 -0.27 0.00 0.02 0.00 0.00 55.97 55.35 2otf s LYS 16 Cb 0.00 -3.03 -0.04 0.00 -0.52 0.00 0.00 37.83 34.24 2otf s LYS 16 CO 0.00 0.67 0.83 -0.51 -0.92 0.00 0.00 175.35 175.42 2otf s LEU 17 N -1.91 4.38 0.24 3.17 1.43 -1.26 -3.41 118.68 121.31 2otf s LEU 17 Ca 0.26 1.45 -0.11 0.00 -1.03 0.00 0.00 54.13 54.71 2otf s LEU 17 Cb -0.12 -3.32 0.34 0.00 0.03 0.00 0.00 46.19 43.11 2otf s LEU 17 CO 0.18 -0.14 1.61 0.00 0.23 0.00 0.00 176.35 178.23 2otf h ALA 18 N 6.47 0.56 -3.13 4.21 0.00 -1.94 -2.75 119.26 122.69 2otf h ALA 18 Ca -0.42 0.29 -0.64 0.00 0.00 0.00 0.00 54.91 54.15 2otf h ALA 18 Cb 1.21 0.55 -0.20 0.00 0.00 0.00 0.00 17.79 19.35 2otf h ALA 18 CO 0.74 -0.42 -0.62 0.42 0.00 0.00 0.00 179.25 179.38 2otf s ILE 19 N -6.22 4.33 -2.06 0.00 1.01 -1.26 0.30 121.20 117.29 2otf s ILE 19 Ca -0.14 -0.18 0.21 0.00 0.00 0.00 0.00 60.65 60.53 2otf s ILE 19 Cb 0.22 -2.97 0.57 0.00 0.01 0.00 0.00 42.46 40.29 2otf s ILE 19 CO 0.75 0.41 1.49 -0.81 0.00 0.00 0.00 174.94 176.78 2otf n PRO 20 N 4.17 2.54 -0.09 2.79 -0.04 -1.25 -4.96 135.00 138.16 2otf n PRO 20 Ca -0.17 -2.39 -0.09 0.00 -0.04 0.00 0.00 63.50 60.82 2otf n PRO 20 Cb 0.52 -1.52 0.06 0.00 -0.04 0.00 0.00 33.50 32.52 2otf n PRO 20 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2otf h SER 21 N 3.98 0.83 0.00 3.54 0.02 -1.22 -3.35 113.55 117.35 2otf h SER 21 Ca 0.00 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 2otf h SER 21 Cb 0.91 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2otf h SER 21 CO 0.00 1.06 -0.06 -1.22 -1.14 0.00 0.00 176.83 175.47 2otf n TYR 22 N -4.09 0.00 0.53 3.45 4.01 0.15 -4.60 117.16 116.61 2otf n TYR 22 Ca -0.00 -0.80 0.08 0.00 -0.16 0.00 0.00 57.90 57.02 2otf n TYR 22 Cb 0.47 -0.12 -0.11 0.00 -0.31 0.00 0.00 39.34 39.26 2otf n TYR 22 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2otf n SER 23 N -1.12 0.86 -2.44 7.72 3.41 -0.99 -3.90 113.62 117.16 2otf n SER 23 Ca 0.12 -0.60 0.00 0.00 -0.26 0.00 0.00 58.87 58.13 2otf n SER 23 Cb 0.59 1.27 0.05 0.00 -0.26 0.00 0.00 64.21 65.86 2otf n SER 23 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2otf n SER 24 N -1.64 0.86 -4.75 4.04 3.41 -1.02 -3.86 113.62 110.66 2otf n SER 24 Ca 0.01 -2.04 -0.36 0.00 -0.26 0.00 0.00 58.87 56.22 2otf n SER 24 Cb 0.33 -0.23 -0.08 0.00 -0.26 0.00 0.00 64.21 63.98 2otf n SER 24 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2otf s TYR 25 N -2.23 3.45 0.00 7.33 6.14 -0.82 0.17 117.35 131.38 2otf s TYR 25 Ca 0.24 0.42 0.00 0.00 0.64 0.00 0.00 57.07 58.37 2otf s TYR 25 Cb 0.34 -2.17 0.00 0.00 0.42 0.00 0.00 41.96 40.55 2otf s TYR 25 CO -0.08 0.34 0.00 0.41 0.64 0.00 0.00 175.55 176.86 2otf n GLY 26 N 3.27 1.74 0.03 8.97 0.00 -0.24 -1.91 105.19 117.06 2otf n GLY 26 Ca -0.16 -0.49 0.11 0.00 0.00 0.00 0.00 46.02 45.48 2otf n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2otf n TYR 28 N -2.28 0.00 -2.66 0.00 4.02 -1.25 -3.89 117.16 111.09 2otf n TYR 28 Ca -0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.45 2otf n TYR 28 Cb 0.54 -0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.83 2otf n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2otf n GLY 30 N 5.54 2.47 0.13 0.00 0.00 -1.25 -1.95 105.19 110.13 2otf n GLY 30 Ca 0.05 -0.80 -0.20 0.00 0.00 0.00 0.00 46.02 45.08 2otf n GLY 30 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2otf h TRP 31 N 0.00 0.45 0.00 1.61 7.01 -1.76 -3.49 115.95 119.76 2otf h TRP 31 Ca 0.00 -0.33 0.00 0.00 2.11 0.00 0.00 58.89 60.67 2otf h TRP 31 Cb 0.00 -0.02 0.00 0.00 -2.10 0.00 0.00 29.16 27.04 2otf h TRP 31 CO 0.00 1.64 0.00 0.41 -2.79 0.00 0.00 178.44 177.70 2otf n GLY 32 N 1.90 1.70 7.00 2.65 0.00 -1.23 -5.00 105.19 112.22 2otf n GLY 32 Ca -0.28 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2otf n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2otf n GLY 33 N 0.00 2.55 2.99 -0.02 0.00 -1.26 -4.10 105.19 105.34 2otf n GLY 33 Ca 0.00 0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 2otf n GLY 33 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2otf n LYS 34 N 14.00 0.66 0.00 1.61 -0.00 -1.26 -5.03 118.16 128.13 2otf n LYS 34 Ca 0.00 -2.37 0.00 0.00 -0.00 0.00 0.00 58.31 55.94 2otf n LYS 34 Cb 0.00 -0.21 0.00 0.00 -0.00 0.00 0.00 35.03 34.82 2otf n LYS 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2otf n GLY 35 N -0.44 -1.53 3.78 2.58 0.00 -1.25 -4.75 105.19 103.58 2otf n GLY 35 Ca 0.13 -1.23 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 2otf n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2otf s THR 36 N 0.00 5.29 0.26 2.61 2.01 -0.95 -4.55 115.64 120.32 2otf s THR 36 Ca 0.00 0.52 -0.31 0.00 0.31 0.00 0.00 61.69 62.21 2otf s THR 36 Cb 0.00 -3.60 -0.12 0.00 0.01 0.00 0.00 72.50 68.79 2otf s THR 36 CO 0.00 0.47 1.58 -2.65 -0.69 0.00 0.00 174.62 173.34 2otf n PRO 37 N 2.93 2.55 -0.18 4.92 -0.02 -1.26 -4.82 135.00 139.12 2otf n PRO 37 Ca -0.14 0.91 -0.10 0.00 -2.02 0.00 0.00 63.50 62.15 2otf n PRO 37 Cb 0.53 -2.68 0.02 0.00 -0.02 0.00 0.00 33.50 31.35 2otf n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2otf h LYS 38 N 5.14 1.01 0.00 -0.52 1.79 -1.97 -3.47 116.57 118.56 2otf h LYS 38 Ca -0.46 -0.38 0.00 0.00 -2.18 0.00 0.00 60.65 57.64 2otf h LYS 38 Cb 1.23 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.82 2otf h LYS 38 CO 0.82 1.06 0.00 -0.40 -1.08 0.00 0.00 179.45 179.86 2otf n ASP 39 N -4.14 0.00 -0.17 0.86 5.75 -1.26 -5.02 116.55 112.58 2otf n ASP 39 Ca 0.01 -0.79 -0.07 0.00 -0.01 0.00 0.00 54.79 53.93 2otf n ASP 39 Cb 0.41 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.51 2otf n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2otf h ALA 40 N 1.72 0.62 -0.78 2.12 0.00 -1.93 -0.87 119.26 120.15 2otf h ALA 40 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2otf h ALA 40 Cb 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2otf h ALA 40 CO 0.00 0.09 0.45 1.15 0.00 0.00 0.00 179.25 180.94 2otf h THR 41 N 0.66 1.23 -0.16 0.00 2.02 -1.92 -1.14 112.91 113.60 2otf h THR 41 Ca 0.18 -0.53 -0.07 0.00 0.77 0.00 0.00 66.41 66.76 2otf h THR 41 Cb -0.04 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.53 2otf h THR 41 CO -0.04 0.24 -0.20 -0.78 0.37 0.00 0.00 175.52 175.12 2otf h ASP 42 N 1.07 0.26 0.15 4.18 3.58 -1.85 -1.91 116.42 121.90 2otf h ASP 42 Ca 0.28 -0.07 -0.11 0.00 0.42 0.00 0.00 57.03 57.55 2otf h ASP 42 Cb -0.00 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 2otf h ASP 42 CO -0.05 0.48 -0.40 0.03 -2.88 0.00 0.00 179.24 176.42 2otf h ARG 43 N 0.25 0.33 -0.91 0.28 3.08 -0.29 -1.13 114.38 115.99 2otf h ARG 43 Ca 0.05 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.94 2otf h ARG 43 Cb 0.50 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.50 2otf h ARG 43 CO 0.03 0.68 0.57 0.00 -1.07 0.00 0.00 179.97 180.18 2otf h PHE 46 N 0.55 -0.18 -0.86 0.00 3.57 -0.71 0.19 116.94 119.50 2otf h PHE 46 Ca 0.01 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 2otf h PHE 46 Cb 1.11 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.89 2otf h PHE 46 CO 0.06 -0.11 0.45 0.28 -2.23 0.00 0.00 178.31 176.76 2otf h VAL 47 N -0.12 1.26 -0.66 1.41 2.07 -1.08 -1.09 116.25 118.03 2otf h VAL 47 Ca 0.03 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2otf h VAL 47 Cb 0.16 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 2otf h VAL 47 CO -0.08 0.30 0.43 -0.74 0.02 0.00 0.00 177.57 177.49 2otf h HIS 48 N 1.21 0.84 -0.75 1.57 -0.00 -0.62 0.29 115.15 117.70 2otf h HIS 48 Ca 0.30 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.67 2otf h HIS 48 Cb 0.06 -0.28 -0.04 0.00 -0.00 0.00 0.00 27.41 27.15 2otf h HIS 48 CO 0.01 0.54 0.42 -0.44 -0.00 0.00 0.00 177.93 178.45 2otf h ASP 49 N 0.90 0.92 -0.57 3.26 3.32 -0.06 -1.46 116.42 122.73 2otf h ASP 49 Ca 0.24 -0.09 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 2otf h ASP 49 Cb -0.09 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.20 2otf h ASP 49 CO -0.05 0.75 0.05 0.00 -1.72 0.00 0.00 179.24 178.26 2otf h TYR 52 N 0.80 0.92 -0.03 0.00 -1.99 -1.01 -2.45 116.97 113.21 2otf h TYR 52 Ca 0.21 -0.14 0.01 0.00 2.00 0.00 0.00 58.73 60.81 2otf h TYR 52 Cb 0.01 -0.25 -0.00 0.00 2.00 0.00 0.00 36.73 38.49 2otf h TYR 52 CO -0.02 0.84 0.08 0.78 -0.00 0.00 0.00 178.16 179.85 2otf h GLY 53 N 0.98 0.00 1.77 3.88 0.00 0.28 0.44 103.07 110.42 2otf h GLY 53 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2otf h GLY 53 CO 0.02 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.26 2otf n ASN 54 N -3.36 0.00 -3.15 0.19 3.02 -0.84 -4.19 115.26 106.93 2otf n ASN 54 Ca -0.02 0.16 -0.28 0.00 -0.03 0.00 0.00 54.58 54.42 2otf n ASN 54 Cb 0.16 -0.39 -0.05 0.00 -0.61 0.00 0.00 39.78 38.89 2otf n ASN 54 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2otf n LEU 55 N -1.39 4.40 0.04 3.41 4.77 0.14 -4.93 117.00 123.45 2otf n LEU 55 Ca 0.11 -5.59 0.18 0.00 -0.03 0.00 0.00 56.01 50.68 2otf n LEU 55 Cb 0.28 -0.63 0.68 0.00 -2.33 0.00 0.00 43.42 41.42 2otf n LEU 55 CO 0.24 2.23 1.16 1.55 -1.33 0.00 0.00 177.39 181.25 2otf h PRO 56 N 3.48 0.00 -0.49 3.23 0.13 -1.75 -2.28 132.00 134.32 2otf h PRO 56 Ca 0.17 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2otf h PRO 56 Cb 0.55 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 2otf h PRO 56 CO 0.85 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.37 2otf n ASP 59 N -4.41 5.22 -4.71 1.44 10.43 -1.26 -4.94 116.55 118.33 2otf n ASP 59 Ca 0.08 -2.95 -0.24 0.00 2.57 0.00 0.00 54.79 54.25 2otf n ASP 59 Cb 0.52 -0.65 -0.07 0.00 1.84 0.00 0.00 41.12 42.76 2otf n ASP 59 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2otf n ASN 67 N -1.10 1.98 -0.27 0.00 3.02 -1.26 -4.99 115.26 112.63 2otf n ASN 67 Ca -0.03 -3.01 0.22 0.00 -0.03 0.00 0.00 54.58 51.73 2otf n ASN 67 Cb 0.62 -0.67 0.53 0.00 -0.61 0.00 0.00 39.78 39.66 2otf n ASN 67 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2otf h PRO 68 N 4.83 0.35 0.00 3.52 0.13 -1.92 0.53 132.00 139.44 2otf h PRO 68 Ca 0.17 -0.02 -0.10 0.00 -0.87 0.00 0.00 66.00 65.18 2otf h PRO 68 Cb 0.78 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 2otf h PRO 68 CO 0.63 0.23 -0.47 0.87 -0.23 0.00 0.00 178.00 179.03 2otf h LYS 69 N 0.36 0.00 0.00 0.86 1.57 -1.94 -3.21 116.57 114.21 2otf h LYS 69 Ca 0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.30 2otf h LYS 69 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.69 2otf h LYS 69 CO -0.20 0.47 -0.96 -1.13 -0.57 0.00 0.00 179.45 177.06 2otf n SER 70 N -3.62 3.99 -4.64 0.86 3.41 -0.91 -2.26 113.62 110.45 2otf n SER 70 Ca -0.01 -0.07 -0.43 0.00 -0.26 0.00 0.00 58.87 58.11 2otf n SER 70 Cb 0.56 1.08 -0.02 0.00 -0.26 0.00 0.00 64.21 65.56 2otf n SER 70 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2otf s ASP 71 N -2.09 6.90 0.18 4.04 -1.08 0.13 -4.75 116.67 119.99 2otf s ASP 71 Ca -0.01 1.21 -0.26 0.00 -0.52 0.00 0.00 52.55 52.98 2otf s ASP 71 Cb 0.01 -2.54 -0.08 0.00 -1.46 0.00 0.00 42.92 38.85 2otf s ASP 71 CO 0.08 -0.88 0.80 -0.13 0.52 0.00 0.00 175.17 175.55 2otf s ARG 72 N 3.69 4.59 0.34 4.34 0.52 -1.26 -0.62 118.95 130.55 2otf s ARG 72 Ca 0.49 1.18 0.04 0.00 -0.52 0.00 0.00 55.73 56.92 2otf s ARG 72 Cb -0.15 -3.23 -0.06 0.00 0.52 0.00 0.00 34.95 32.03 2otf s ARG 72 CO 0.16 0.55 0.05 1.52 0.02 0.00 0.00 175.30 177.60 2otf s TYR 73 N -1.18 2.04 -0.01 -0.53 -0.85 -1.26 -4.85 117.35 110.70 2otf s TYR 73 Ca 0.37 -0.93 0.06 0.00 -0.52 0.00 0.00 57.07 56.05 2otf s TYR 73 Cb -0.23 -1.36 -0.03 0.00 0.38 0.00 0.00 41.96 40.73 2otf s TYR 73 CO 0.27 0.06 -0.18 0.15 -1.52 0.00 0.00 175.55 174.33 2otf s LYS 74 N -3.86 2.28 0.03 -3.49 -0.14 -1.26 -4.90 119.74 108.40 2otf s LYS 74 Ca 0.35 -0.84 -0.08 0.00 -1.36 0.00 0.00 55.97 54.04 2otf s LYS 74 Cb 0.09 -2.24 0.00 0.00 -1.68 0.00 0.00 37.83 33.99 2otf s LYS 74 CO 0.16 0.58 0.17 1.52 -0.76 0.00 0.00 175.35 177.02 2otf s TYR 75 N -0.77 0.07 0.31 3.18 -0.85 -1.26 -1.08 117.35 116.96 2otf s TYR 75 Ca 0.12 -0.27 0.03 0.00 -0.52 0.00 0.00 57.07 56.43 2otf s TYR 75 Cb -0.10 -0.05 -0.04 0.00 0.38 0.00 0.00 41.96 42.14 2otf s TYR 75 CO 0.02 -0.39 0.12 -1.59 -1.52 0.00 0.00 175.55 172.19 2otf s LYS 76 N -2.31 1.61 -0.19 -3.49 -2.85 -0.32 -4.93 119.74 107.25 2otf s LYS 76 Ca -0.07 -1.91 -0.01 0.00 -1.00 0.00 0.00 55.97 52.97 2otf s LYS 76 Cb -0.02 -0.35 -0.00 0.00 -2.06 0.00 0.00 37.83 35.40 2otf s LYS 76 CO -0.03 -0.37 -0.11 1.03 0.10 0.00 0.00 175.35 175.97 2otf s ARG 77 N -3.87 3.25 -0.86 1.78 1.81 -1.26 -0.30 118.95 119.50 2otf s ARG 77 Ca 0.34 -0.71 -0.03 0.00 -1.72 0.00 0.00 55.73 53.61 2otf s ARG 77 Cb 0.06 -2.78 0.21 0.00 -0.45 0.00 0.00 34.95 31.99 2otf s ARG 77 CO 0.16 -0.11 0.74 0.08 -0.68 0.00 0.00 175.30 175.49 2otf s VAL 78 N 1.17 4.43 -0.82 3.52 1.01 -0.50 -4.76 120.40 124.45 2otf s VAL 78 Ca 0.02 -3.59 -0.02 0.00 0.00 0.00 0.00 61.98 58.38 2otf s VAL 78 Cb -0.14 -3.76 -0.00 0.00 0.00 0.00 0.00 36.38 32.47 2otf s VAL 78 CO -0.04 -1.05 0.68 0.59 0.00 0.00 0.00 175.10 175.28 2otf n ASN 79 N 2.66 -6.53 0.00 3.32 4.13 -1.26 -3.19 115.26 114.39 2otf n ASN 79 Ca 0.19 -0.49 0.00 0.00 1.68 0.00 0.00 54.58 55.96 2otf n ASN 79 Cb 0.38 -3.89 0.00 0.00 -1.54 0.00 0.00 39.78 34.73 2otf n ASN 79 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2otf n GLY 80 N -1.70 2.15 3.77 7.41 0.00 -1.26 -5.01 105.19 110.54 2otf n GLY 80 Ca -0.12 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 2otf n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2otf s ALA 81 N 0.00 3.62 -0.05 4.61 0.00 -1.19 -4.96 121.76 123.79 2otf s ALA 81 Ca 0.00 1.54 -0.26 0.00 0.00 0.00 0.00 51.96 53.24 2otf s ALA 81 Cb 0.00 -3.61 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 2otf s ALA 81 CO 0.00 -0.99 0.84 0.42 0.00 0.00 0.00 175.76 176.03 2otf s ILE 82 N -0.72 4.95 -0.21 0.00 1.01 -1.26 -1.42 121.20 123.55 2otf s ILE 82 Ca 0.56 1.73 0.00 0.00 0.00 0.00 0.00 60.65 62.95 2otf s ILE 82 Cb -0.46 -4.17 0.05 0.00 0.01 0.00 0.00 42.46 37.89 2otf s ILE 82 CO 0.57 0.19 -0.06 -0.69 0.00 0.00 0.00 174.94 174.95 2otf s VAL 83 N 1.02 1.40 0.06 2.92 1.01 0.59 -4.96 120.40 122.45 2otf s VAL 83 Ca 0.44 -0.99 -0.31 0.00 0.00 0.00 0.00 61.98 61.12 2otf s VAL 83 Cb -0.19 -1.61 -0.06 0.00 0.00 0.00 0.00 36.38 34.51 2otf s VAL 83 CO 0.22 0.01 1.35 0.00 0.00 0.00 0.00 175.10 176.68 2otf s GLU 85 N 1.55 3.65 0.15 0.00 2.02 -0.24 -4.96 118.70 120.87 2otf s GLU 85 Ca 0.63 0.23 -0.31 0.00 0.02 0.00 0.00 54.97 55.53 2otf s GLU 85 Cb -0.33 -2.46 -0.10 0.00 0.10 0.00 0.00 34.13 31.33 2otf s GLU 85 CO 0.29 -0.01 1.65 0.21 0.02 0.00 0.00 175.26 177.41 2otf s LYS 86 N -4.07 4.18 0.00 1.61 2.20 -1.26 -4.68 119.74 117.72 2otf s LYS 86 Ca 0.48 2.43 0.00 0.00 -0.36 0.00 0.00 55.97 58.52 2otf s LYS 86 Cb -0.10 -3.30 0.00 0.00 -1.51 0.00 0.00 37.83 32.92 2otf s LYS 86 CO 0.35 -0.69 0.00 0.41 -0.36 0.00 0.00 175.35 175.06 2otf n GLY 88 N 3.91 4.77 3.73 5.54 0.00 -1.26 -4.96 105.19 116.92 2otf n GLY 88 Ca 0.15 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 2otf n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2otf s THR 89 N 0.36 2.20 0.25 2.61 -4.23 -1.26 -4.77 115.64 110.80 2otf s THR 89 Ca 0.00 0.07 -0.05 0.00 -1.18 0.00 0.00 61.69 60.53 2otf s THR 89 Cb 0.00 -2.67 0.18 0.00 1.34 0.00 0.00 72.50 71.35 2otf s THR 89 CO 0.00 -0.09 1.83 0.77 -0.54 0.00 0.00 174.62 176.60 2otf h SER 90 N -1.65 0.98 -0.15 3.99 4.64 -2.01 -1.13 113.55 118.23 2otf h SER 90 Ca -0.52 -0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 60.66 2otf h SER 90 Cb 1.32 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 63.15 2otf h SER 90 CO 0.59 0.86 0.07 0.00 -0.87 0.00 0.00 176.83 177.48 2otf h GLU 92 N 0.12 0.93 -0.48 0.00 5.08 -1.84 0.14 114.58 118.54 2otf h GLU 92 Ca 0.05 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2otf h GLU 92 Cb 0.12 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 2otf h GLU 92 CO -0.01 0.62 0.22 -0.91 -1.00 0.00 0.00 179.01 177.93 2otf h ASN 93 N 0.96 0.64 -0.00 1.42 2.35 -0.99 -1.59 115.58 118.37 2otf h ASN 93 Ca 0.34 -0.14 -0.16 0.00 -0.55 0.00 0.00 56.30 55.79 2otf h ASN 93 Cb 0.09 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 2otf h ASN 93 CO -0.14 0.61 -0.53 0.03 -1.65 0.00 0.00 177.43 175.74 2otf h ARG 94 N 0.64 0.58 -0.29 0.81 3.08 -0.77 -2.38 114.38 116.04 2otf h ARG 94 Ca 0.16 -0.36 -0.03 0.00 0.07 0.00 0.00 59.98 59.83 2otf h ARG 94 Cb 0.14 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2otf h ARG 94 CO -0.02 0.97 0.07 0.82 -1.07 0.00 0.00 179.97 180.73 2otf h ILE 95 N 0.45 1.22 -0.70 2.04 2.04 -0.62 -2.33 117.51 119.60 2otf h ILE 95 Ca 0.01 -0.73 0.04 0.00 1.00 0.00 0.00 64.86 65.18 2otf h ILE 95 Cb 1.08 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 38.25 2otf h ILE 95 CO 0.10 0.24 0.43 0.00 0.00 0.00 0.00 178.15 178.92 2otf h GLU 97 N 0.83 1.10 -0.30 0.00 4.39 -1.24 0.14 114.58 119.49 2otf h GLU 97 Ca 0.29 -0.11 -0.02 0.00 0.34 0.00 0.00 59.36 59.86 2otf h GLU 97 Cb 0.06 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.47 2otf h GLU 97 CO -0.13 0.79 0.10 0.00 -1.16 0.00 0.00 179.01 178.62 2otf h ASP 99 N 0.33 0.65 -0.42 0.00 5.19 -0.88 -2.31 116.42 118.98 2otf h ASP 99 Ca 0.10 -0.29 0.06 0.00 -0.62 0.00 0.00 57.03 56.28 2otf h ASP 99 Cb 0.22 -0.17 -0.05 0.00 0.18 0.00 0.00 39.33 39.51 2otf h ASP 99 CO -0.01 0.78 0.14 0.50 -3.12 0.00 0.00 179.24 177.53 2otf h LYS 100 N 0.50 0.29 -0.68 3.56 3.64 -0.69 -0.13 116.57 123.06 2otf h LYS 100 Ca 0.11 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2otf h LYS 100 Cb 0.42 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.15 2otf h LYS 100 CO 0.01 0.19 0.42 0.00 -2.27 0.00 0.00 179.45 177.81 2otf h ALA 101 N 1.28 0.86 -0.40 5.00 0.00 -1.29 -1.93 119.26 122.79 2otf h ALA 101 Ca 0.20 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2otf h ALA 101 Cb 0.20 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2otf h ALA 101 CO -0.21 0.32 0.13 0.00 0.00 0.00 0.00 179.25 179.48 2otf h ALA 102 N 1.22 0.52 -0.63 0.00 0.00 -0.82 -0.53 119.26 119.02 2otf h ALA 102 Ca 0.24 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2otf h ALA 102 Cb -0.05 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 2otf h ALA 102 CO -0.05 0.17 0.38 0.00 0.00 0.00 0.00 179.25 179.75 2otf h ALA 103 N 0.97 0.82 -0.51 0.00 0.00 -0.80 0.99 119.26 120.73 2otf h ALA 103 Ca 0.13 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2otf h ALA 103 Cb 0.26 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2otf h ALA 103 CO -0.00 0.12 -0.13 0.82 0.00 0.00 0.00 179.25 180.05 2otf h ILE 104 N 0.74 1.27 -0.77 0.00 2.04 -1.25 -2.21 117.51 117.33 2otf h ILE 104 Ca 0.26 -1.29 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 2otf h ILE 104 Cb 0.04 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 2otf h ILE 104 CO -0.11 0.45 0.43 0.00 0.00 0.00 0.00 178.15 178.91 2otf h PHE 106 N 1.06 1.00 -0.48 0.00 0.04 -0.65 -2.14 116.94 115.77 2otf h PHE 106 Ca 0.27 -0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.94 2otf h PHE 106 Cb 0.03 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 37.84 2otf h PHE 106 CO -0.00 0.71 -0.01 -0.09 -0.60 0.00 0.00 178.31 178.32 2otf h ARG 107 N 0.99 0.80 0.00 1.51 9.65 -0.81 -1.97 114.38 124.55 2otf h ARG 107 Ca 0.25 -0.22 -0.05 0.00 -1.10 0.00 0.00 59.98 58.86 2otf h ARG 107 Cb 0.06 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 2otf h ARG 107 CO -0.04 0.81 -0.22 0.37 2.80 0.00 0.00 179.97 183.69 2otf h GLN 108 N 0.74 0.00 -0.18 0.20 4.15 -0.47 -3.18 115.11 116.38 2otf h GLN 108 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.56 2otf h GLN 108 Cb 0.47 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.16 2otf h GLN 108 CO 0.02 0.22 0.00 0.09 -1.93 0.00 0.00 178.83 177.24 2otf n ASN 109 N -3.50 3.20 -0.31 -0.69 3.02 -0.85 -4.68 115.26 111.44 2otf n ASN 109 Ca -0.01 -2.85 0.07 0.00 -0.03 0.00 0.00 54.58 51.77 2otf n ASN 109 Cb 0.39 -0.44 0.28 0.00 -0.61 0.00 0.00 39.78 39.39 2otf n ASN 109 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2otf h LEU 110 N 1.19 0.85 -1.92 3.41 3.38 -1.34 -2.23 115.31 118.64 2otf h LEU 110 Ca 0.00 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.10 2otf h LEU 110 Cb 1.17 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 2otf h LEU 110 CO 0.12 0.49 0.28 0.78 0.09 0.00 0.00 178.44 180.19 2otf h ASN 111 N 0.93 0.08 -0.32 -0.43 2.35 -1.85 -1.51 115.58 114.83 2otf h ASN 111 Ca 0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.19 2otf h ASN 111 Cb 0.43 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.78 2otf h ASN 111 CO -0.20 0.05 0.00 0.35 -1.65 0.00 0.00 177.43 175.98 2otf n THR 112 N -4.44 0.45 -1.68 2.81 -2.24 -0.85 -4.96 114.28 103.36 2otf n THR 112 Ca 0.06 -0.72 -0.45 0.00 -2.27 0.00 0.00 64.05 60.66 2otf n THR 112 Cb 0.41 1.03 -0.04 0.00 -2.10 0.00 0.00 70.33 69.63 2otf n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2otf n TYR 113 N 1.33 2.42 -4.66 4.78 4.19 -0.57 -4.95 117.16 119.70 2otf n TYR 113 Ca 0.17 -0.00 -0.32 0.00 3.31 0.00 0.00 57.90 61.05 2otf n TYR 113 Cb 0.56 -2.66 -0.17 0.00 0.49 0.00 0.00 39.34 37.57 2otf n TYR 113 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 2otf s SER 114 N 2.81 3.08 0.56 2.98 0.15 -1.26 -5.00 113.70 117.02 2otf s SER 114 Ca 0.85 -0.60 0.37 0.00 0.70 0.00 0.00 55.95 57.28 2otf s SER 114 Cb -0.60 -1.43 1.97 0.00 -1.71 0.00 0.00 66.02 64.25 2otf s SER 114 CO 0.43 0.08 2.14 0.11 1.20 0.00 0.00 173.24 177.19 2otf h LYS 115 N 7.33 0.00 0.00 5.44 1.57 -1.99 -1.99 116.57 126.93 2otf h LYS 115 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 2otf h LYS 115 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2otf h LYS 115 CO 0.55 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 179.79 2otf n LYS 116 N -2.84 0.10 0.00 3.15 2.85 -1.26 -2.28 118.16 117.87 2otf n LYS 116 Ca -0.02 0.16 0.12 0.00 -1.05 0.00 0.00 58.31 57.52 2otf n LYS 116 Cb 0.09 -1.50 0.07 0.00 -0.65 0.00 0.00 35.03 33.04 2otf n LYS 116 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2otf n TYR 117 N -1.42 0.00 -2.38 5.58 4.01 -0.75 -4.84 117.16 117.36 2otf n TYR 117 Ca 0.06 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.39 2otf n TYR 117 Cb 0.19 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.18 2otf n TYR 117 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 2otf s MET 118 N -2.14 4.55 -1.48 -0.72 -1.94 -0.97 -1.08 119.30 115.53 2otf s MET 118 Ca 0.25 1.90 -0.06 0.00 -1.71 0.00 0.00 55.69 56.07 2otf s MET 118 Cb 0.19 -3.18 0.03 0.00 2.01 0.00 0.00 34.83 33.88 2otf s MET 118 CO 0.38 0.07 0.60 1.28 -0.01 0.00 0.00 175.02 177.35 2otf n LEU 119 N 1.39 -2.39 -4.72 -0.03 4.77 0.13 -4.89 117.00 111.25 2otf n LEU 119 Ca 0.00 -0.33 -0.42 0.00 -0.03 0.00 0.00 56.01 55.23 2otf n LEU 119 Cb 0.44 -2.74 -0.02 0.00 -2.33 0.00 0.00 43.42 38.77 2otf n LEU 119 CO 0.55 0.23 1.30 0.00 -1.33 0.00 0.00 177.39 178.14 2otf n TYR 120 N -4.38 2.74 -2.13 -1.77 9.36 -1.14 -4.93 117.16 114.90 2otf n TYR 120 Ca -0.08 0.16 -0.39 0.00 3.32 0.00 0.00 57.90 60.90 2otf n TYR 120 Cb 0.59 -2.63 -0.01 0.00 -0.63 0.00 0.00 39.34 36.67 2otf n TYR 120 CO 0.00 0.00 0.00 -2.14 0.22 0.00 0.00 176.86 174.94 2otf s PRO 121 N 0.42 4.09 0.21 2.98 0.02 -1.26 -4.91 135.00 136.55 2otf s PRO 121 Ca 0.71 2.09 -0.10 0.00 0.02 0.00 0.00 61.00 63.72 2otf s PRO 121 Cb -0.52 -2.82 0.16 0.00 0.02 0.00 0.00 34.50 31.34 2otf s PRO 121 CO 0.40 -0.36 1.87 0.22 -0.33 0.00 0.00 177.00 178.79 2otf h ASP 122 N 2.86 0.90 0.15 2.53 1.82 -1.95 -2.86 116.42 119.87 2otf h ASP 122 Ca -0.49 -0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.11 2otf h ASP 122 Cb 1.24 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 41.02 2otf h ASP 122 CO 0.63 0.68 0.00 2.19 -1.61 0.00 0.00 179.24 181.13 2otf h PHE 124 N 1.05 0.00 -0.01 0.28 -0.00 -2.04 -0.63 116.94 115.59 2otf h PHE 124 Ca 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.25 2otf h PHE 124 Cb -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 35.87 2otf h PHE 124 CO -0.01 0.00 -0.14 1.28 -0.00 0.00 0.00 178.31 179.43 2otf n LEU 125 N -2.66 0.84 -4.40 2.10 4.77 -1.08 -4.58 117.00 111.98 2otf n LEU 125 Ca -0.02 -0.18 -0.45 0.00 -0.03 0.00 0.00 56.01 55.33 2otf n LEU 125 Cb 0.09 -0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2otf n LEU 125 CO 0.16 0.15 0.75 0.00 -1.33 0.00 0.00 177.39 177.12 2otf s LYS 127 N 1.77 1.19 0.00 0.00 -2.85 -1.26 -3.75 119.74 114.83 2otf s LYS 127 Ca 0.26 -1.34 0.00 0.00 -1.00 0.00 0.00 55.97 53.89 2otf s LYS 127 Cb -0.08 -1.19 0.00 0.00 -2.06 0.00 0.00 37.83 34.50 2otf s LYS 127 CO -0.08 0.24 0.00 0.41 0.10 0.00 0.00 175.35 176.01 2otf n GLY 128 N 0.40 1.80 3.11 0.59 0.00 -1.26 -2.23 105.19 107.59 2otf n GLY 128 Ca -0.14 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.64 2otf n GLY 128 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2otf s GLU 129 N -1.39 2.19 -0.30 1.61 -6.30 -1.26 -3.92 118.70 109.32 2otf s GLU 129 Ca 0.00 -0.60 0.02 0.00 -2.50 0.00 0.00 54.97 51.89 2otf s GLU 129 Cb 0.00 -1.74 0.19 0.00 0.00 0.00 0.00 34.13 32.59 2otf s GLU 129 CO 0.00 0.11 0.60 -1.17 0.02 0.00 0.00 175.26 174.82 2otf s LEU 130 N 0.47 -1.50 0.28 2.70 0.20 -1.26 -4.85 118.68 114.72 2otf s LEU 130 Ca -0.15 0.54 -0.08 0.00 0.69 0.00 0.00 54.13 55.13 2otf s LEU 130 Cb -0.16 2.09 -0.06 0.00 -0.43 0.00 0.00 46.19 47.63 2otf s LEU 130 CO 0.05 -0.28 0.58 -0.75 -0.29 0.00 0.00 176.35 175.67 2otf s LYS 131 N 2.85 3.74 0.00 1.98 2.20 -1.26 -5.04 119.74 124.21 2otf s LYS 131 Ca 0.16 0.21 0.17 0.00 -0.36 0.00 0.00 55.97 56.15 2otf s LYS 131 Cb -0.12 -2.61 0.99 0.00 -1.51 0.00 0.00 37.83 34.58 2otf s LYS 131 CO -0.23 0.23 1.40 0.00 -0.36 0.00 0.00 175.35 176.38