#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tcf h GLN 3 N 0.00 0.35 -0.13 -1.24 4.20 -2.01 -2.20 115.11 114.08 1tcf h GLN 3 Ca 0.00 -0.19 -0.21 0.00 0.06 0.00 0.00 58.65 58.31 1tcf h GLN 3 Cb 0.00 0.01 0.01 0.00 0.30 0.00 0.00 27.48 27.79 1tcf h GLN 3 CO 0.00 0.74 -0.77 1.96 -0.67 0.00 0.00 178.83 180.09 1tcf h GLN 4 N 0.29 0.70 -0.92 1.46 4.20 -1.99 -2.36 115.11 116.48 1tcf h GLN 4 Ca 0.02 -0.57 -0.01 0.00 0.06 0.00 0.00 58.65 58.15 1tcf h GLN 4 Cb 0.92 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.78 1tcf h GLN 4 CO 0.08 1.19 0.55 0.00 -0.67 0.00 0.00 178.83 179.97 1tcf h ALA 5 N 0.65 1.17 -0.48 3.87 0.00 -1.92 -0.14 119.26 122.41 1tcf h ALA 5 Ca -0.05 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 1tcf h ALA 5 Cb 1.39 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1tcf h ALA 5 CO 0.15 0.64 -0.01 0.93 0.00 0.00 0.00 179.25 180.97 1tcf h GLU 6 N 1.27 0.86 -0.42 0.00 5.08 -1.44 -1.79 114.58 118.14 1tcf h GLU 6 Ca 0.33 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1tcf h GLU 6 Cb -0.04 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1tcf h GLU 6 CO -0.06 0.90 0.20 0.00 -1.00 0.00 0.00 179.01 179.06 1tcf h ALA 7 N 0.92 0.54 -0.12 3.43 0.00 -0.82 -2.38 119.26 120.83 1tcf h ALA 7 Ca 0.14 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1tcf h ALA 7 Cb 0.52 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1tcf h ALA 7 CO 0.03 0.10 0.01 -0.09 0.00 0.00 0.00 179.25 179.29 1tcf h ARG 8 N 0.53 0.05 0.00 0.00 2.43 -0.95 -2.36 114.38 114.08 1tcf h ARG 8 Ca 0.14 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 1tcf h ARG 8 Cb 0.11 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1tcf h ARG 8 CO -0.02 0.03 -0.09 0.66 -1.51 0.00 0.00 179.97 179.04 1tcf h SER 9 N 0.05 0.00 0.84 -3.80 4.64 -1.06 -1.94 113.55 112.28 1tcf h SER 9 Ca 0.05 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.25 1tcf h SER 9 Cb 0.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 1tcf h SER 9 CO -0.09 0.09 -0.60 0.22 -0.87 0.00 0.00 176.83 175.58 1tcf h TYR 10 N 0.00 0.00 -2.71 4.77 3.20 -0.92 -3.45 116.97 117.85 1tcf h TYR 10 Ca -0.00 0.00 -0.57 0.00 3.14 0.00 0.00 58.73 61.29 1tcf h TYR 10 Cb 0.19 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.43 1tcf h TYR 10 CO 0.00 0.60 -0.49 -0.51 -1.64 0.00 0.00 178.16 176.12 1tcf s LEU 11 N -7.18 4.31 0.40 2.82 1.43 -0.73 -5.10 118.68 114.62 1tcf s LEU 11 Ca 0.00 0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.27 1tcf s LEU 11 Cb 0.11 -2.89 -0.03 0.00 0.03 0.00 0.00 46.19 43.41 1tcf s LEU 11 CO 0.75 0.10 0.64 -0.94 0.23 0.00 0.00 176.35 177.13 1tcf s SER 12 N -2.93 6.26 0.28 2.29 1.04 -1.26 -4.88 113.70 114.49 1tcf s SER 12 Ca 0.34 0.61 -0.01 0.00 0.48 0.00 0.00 55.95 57.38 1tcf s SER 12 Cb -0.12 -2.09 0.63 0.00 0.10 0.00 0.00 66.02 64.54 1tcf s SER 12 CO 0.28 -0.42 1.65 -0.33 0.98 0.00 0.00 173.24 175.40 1tcf h GLU 13 N 0.54 0.19 -0.58 4.02 5.08 -1.99 0.19 114.58 122.03 1tcf h GLU 13 Ca -0.49 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 57.80 1tcf h GLU 13 Cb 1.22 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 1tcf h GLU 13 CO 0.61 0.12 0.10 0.93 -1.00 0.00 0.00 179.01 179.77 1tcf h GLU 14 N 0.19 0.93 -0.02 2.33 3.07 -1.99 -1.59 114.58 117.50 1tcf h GLU 14 Ca 0.51 -0.23 -0.22 0.00 -0.50 0.00 0.00 59.36 58.93 1tcf h GLU 14 Cb 0.99 -0.12 0.02 0.00 -0.84 0.00 0.00 28.75 28.79 1tcf h GLU 14 CO -0.65 0.86 -0.83 0.52 -1.40 0.00 0.00 179.01 177.51 1tcf h MET 15 N 0.88 0.60 -0.10 2.33 2.86 -1.31 -3.05 114.93 117.14 1tcf h MET 15 Ca 0.18 -0.62 0.02 0.00 -2.06 0.00 0.00 59.70 57.22 1tcf h MET 15 Cb 0.38 0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 1tcf h MET 15 CO 0.01 1.23 -0.03 0.82 1.06 0.00 0.00 176.91 179.99 1tcf h ILE 16 N 0.22 0.88 -0.08 -1.22 2.04 -0.52 -0.83 117.51 118.00 1tcf h ILE 16 Ca -0.10 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.79 1tcf h ILE 16 Cb 1.51 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.46 1tcf h ILE 16 CO 0.17 0.00 0.07 0.00 0.00 0.00 0.00 178.15 178.39 1tcf h ALA 17 N 1.09 1.83 -0.18 1.87 0.00 -1.35 0.45 119.26 122.97 1tcf h ALA 17 Ca 0.05 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 1tcf h ALA 17 Cb 0.09 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1tcf h ALA 17 CO -0.11 -0.12 -0.65 0.93 0.00 0.00 0.00 179.25 179.30 1tcf h GLU 18 N 0.00 0.76 -0.13 0.00 5.08 -1.23 -2.86 114.58 116.19 1tcf h GLU 18 Ca 0.04 -0.57 -0.17 0.00 -1.00 0.00 0.00 59.36 57.65 1tcf h GLU 18 Cb 0.19 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1tcf h GLU 18 CO -0.00 1.19 -0.64 0.74 -1.00 0.00 0.00 179.01 179.30 1tcf h PHE 19 N 0.48 0.63 -0.75 4.33 0.04 0.82 -2.51 116.94 119.99 1tcf h PHE 19 Ca -0.03 -0.25 0.04 0.00 2.80 0.00 0.00 57.97 60.53 1tcf h PHE 19 Cb 1.28 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 39.28 1tcf h PHE 19 CO 0.09 0.99 0.49 0.87 -0.60 0.00 0.00 178.31 180.15 1tcf h LYS 20 N 0.36 0.86 -0.34 1.51 1.57 -0.29 0.20 116.57 120.44 1tcf h LYS 20 Ca -0.01 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.64 1tcf h LYS 20 Cb 1.20 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1tcf h LYS 20 CO 0.12 0.57 -0.08 0.00 -0.57 0.00 0.00 179.45 179.49 1tcf h ALA 21 N 1.57 0.47 0.18 3.86 0.00 -1.33 0.21 119.26 124.22 1tcf h ALA 21 Ca 0.30 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1tcf h ALA 21 Cb 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1tcf h ALA 21 CO -0.09 0.32 -0.09 0.00 0.00 0.00 0.00 179.25 179.39 1tcf h ALA 22 N 0.81 -0.24 -0.58 0.00 0.00 -1.00 -1.56 119.26 116.69 1tcf h ALA 22 Ca 0.09 -0.13 0.11 0.00 0.00 0.00 0.00 54.91 54.98 1tcf h ALA 22 Cb 0.58 0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.35 1tcf h ALA 22 CO 0.03 -0.54 -0.24 0.35 0.00 0.00 0.00 179.25 178.86 1tcf h PHE 23 N -0.44 -0.60 -0.82 0.00 3.57 -0.47 0.24 116.94 118.43 1tcf h PHE 23 Ca -0.02 0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.57 1tcf h PHE 23 Cb 0.34 0.35 -0.05 0.00 2.79 0.00 0.00 35.95 39.38 1tcf h PHE 23 CO -0.01 -0.32 0.53 -0.44 -2.23 0.00 0.00 178.31 175.84 1tcf h ASP 24 N -0.09 0.87 -0.25 0.41 5.19 -0.49 0.28 116.42 122.35 1tcf h ASP 24 Ca 0.26 -0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.65 1tcf h ASP 24 Cb 0.50 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 1tcf h ASP 24 CO -0.64 0.60 0.11 0.24 -3.12 0.00 0.00 179.24 176.42 1tcf h MET 25 N 1.03 0.37 -0.60 3.56 2.86 0.45 -2.60 114.93 119.99 1tcf h MET 25 Ca 0.33 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.89 1tcf h MET 25 Cb 0.01 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 1tcf h MET 25 CO -0.12 0.40 0.30 0.74 1.06 0.00 0.00 176.91 179.29 1tcf h PHE 26 N 0.26 0.83 -0.03 -0.22 0.04 -0.32 -3.30 116.94 114.20 1tcf h PHE 26 Ca 0.08 -0.02 -0.63 0.00 2.80 0.00 0.00 57.97 60.20 1tcf h PHE 26 Cb 0.16 -0.26 0.05 0.00 2.20 0.00 0.00 35.95 38.10 1tcf h PHE 26 CO -0.01 0.60 2.17 -3.47 -0.60 0.00 0.00 178.31 177.00 1tcf n ASP 27 N -4.36 2.45 -0.35 2.17 2.03 0.93 -4.78 116.55 114.63 1tcf n ASP 27 Ca 0.05 -2.67 0.30 0.00 0.52 0.00 0.00 54.79 53.00 1tcf n ASP 27 Cb 0.12 -1.11 0.56 0.00 -0.72 0.00 0.00 41.12 39.98 1tcf n ASP 27 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1tcf h ALA 28 N 8.13 2.22 -0.26 -1.67 0.00 -1.78 0.39 119.26 126.29 1tcf h ALA 28 Ca 0.40 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1tcf h ALA 28 Cb 0.69 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1tcf h ALA 28 CO 1.93 -0.91 0.00 -0.40 0.00 0.00 0.00 179.25 179.87 1tcf n ASP 29 N -5.05 2.61 -0.33 0.00 5.75 -1.26 -4.93 116.55 113.33 1tcf n ASP 29 Ca 0.36 -1.87 -0.04 0.00 -0.01 0.00 0.00 54.79 53.23 1tcf n ASP 29 Cb 1.21 -0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 41.11 1tcf n ASP 29 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tcf n GLY 30 N 1.33 0.52 0.03 6.12 0.00 0.14 -4.89 105.19 108.43 1tcf n GLY 30 Ca 0.18 -0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.21 1tcf n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tcf n GLY 31 N -0.16 -1.06 0.00 -0.02 0.00 -1.26 -4.90 105.19 97.79 1tcf n GLY 31 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1tcf n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tcf n GLY 32 N 0.00 0.28 3.25 -0.02 0.00 -1.26 -5.07 105.19 102.38 1tcf n GLY 32 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1tcf n GLY 32 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1tcf s ASP 33 N -2.19 -0.20 -0.21 1.61 -4.77 -1.26 -4.13 116.67 105.52 1tcf s ASP 33 Ca 0.00 0.06 -0.18 0.00 -3.30 0.00 0.00 52.55 49.13 1tcf s ASP 33 Cb 0.00 0.33 -0.03 0.00 -1.09 0.00 0.00 42.92 42.13 1tcf s ASP 33 CO 0.00 -0.48 0.52 -0.63 0.70 0.00 0.00 175.17 175.27 1tcf s ILE 34 N -1.54 5.10 0.58 2.11 1.01 0.16 -4.87 121.20 123.74 1tcf s ILE 34 Ca -0.12 0.94 0.03 0.00 0.00 0.00 0.00 60.65 61.50 1tcf s ILE 34 Cb -0.04 -3.84 0.06 0.00 0.01 0.00 0.00 42.46 38.65 1tcf s ILE 34 CO 0.03 0.17 0.80 -0.94 0.00 0.00 0.00 174.94 175.00 1tcf s SER 35 N 1.19 5.08 0.38 3.58 1.04 -1.26 -1.16 113.70 122.56 1tcf s SER 35 Ca 0.24 -0.29 0.05 0.00 0.48 0.00 0.00 55.95 56.43 1tcf s SER 35 Cb -0.15 -0.46 0.76 0.00 0.10 0.00 0.00 66.02 66.27 1tcf s SER 35 CO 0.09 -1.29 2.03 0.58 0.98 0.00 0.00 173.24 175.64 1tcf h VAL 36 N 0.03 1.12 -0.07 5.02 2.07 -1.94 0.04 116.25 122.52 1tcf h VAL 36 Ca -0.39 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 1tcf h VAL 36 Cb 1.29 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1tcf h VAL 36 CO 0.46 0.13 -0.09 0.07 0.02 0.00 0.00 177.57 178.16 1tcf h LYS 37 N 0.70 0.19 -0.76 1.57 2.10 -1.98 -1.82 116.57 116.56 1tcf h LYS 37 Ca 0.20 -0.11 -0.06 0.00 -2.00 0.00 0.00 60.65 58.68 1tcf h LYS 37 Cb -0.05 0.01 -0.03 0.00 -0.90 0.00 0.00 32.23 31.25 1tcf h LYS 37 CO -0.04 0.64 0.25 0.93 -2.00 0.00 0.00 179.45 179.23 1tcf h GLU 38 N -0.25 1.16 -0.18 0.07 5.08 -1.82 -2.02 114.58 116.62 1tcf h GLU 38 Ca 0.01 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.02 1tcf h GLU 38 Cb 0.62 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1tcf h GLU 38 CO 0.02 0.98 -0.35 1.25 -1.00 0.00 0.00 179.01 179.91 1tcf h LEU 39 N 1.12 0.40 -0.65 1.33 5.85 -1.01 -3.00 115.31 119.34 1tcf h LEU 39 Ca 0.25 -0.15 -0.11 0.00 0.84 0.00 0.00 57.88 58.70 1tcf h LEU 39 Cb 0.29 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1tcf h LEU 39 CO -0.01 0.72 -0.19 1.23 -0.34 0.00 0.00 178.44 179.85 1tcf h GLY 40 N 1.10 0.93 1.10 3.75 0.00 -0.81 -1.50 103.07 107.64 1tcf h GLY 40 Ca 0.04 -0.78 0.00 0.00 0.00 0.00 0.00 47.33 46.59 1tcf h GLY 40 CO 0.06 0.71 0.57 -0.84 0.00 0.00 0.00 176.54 177.04 1tcf h THR 41 N 0.75 1.24 -0.15 4.70 2.02 -1.25 0.12 112.91 120.34 1tcf h THR 41 Ca 0.11 -0.49 -0.17 0.00 0.77 0.00 0.00 66.41 66.63 1tcf h THR 41 Cb 0.71 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1tcf h THR 41 CO 0.05 0.24 -0.60 0.58 0.37 0.00 0.00 175.52 176.17 1tcf h VAL 42 N 1.23 1.33 -0.10 3.16 2.07 -1.35 -2.51 116.25 120.08 1tcf h VAL 42 Ca 0.33 -1.88 -0.22 0.00 0.82 0.00 0.00 66.70 65.75 1tcf h VAL 42 Cb -0.09 1.86 0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1tcf h VAL 42 CO -0.07 0.58 -0.79 0.24 0.02 0.00 0.00 177.57 177.55 1tcf h MET 43 N 0.38 0.71 -0.67 1.57 2.86 -0.74 -2.33 114.93 116.71 1tcf h MET 43 Ca -0.00 -0.63 0.04 0.00 -2.06 0.00 0.00 59.70 57.05 1tcf h MET 43 Cb 1.15 0.15 -0.05 0.00 0.06 0.00 0.00 31.60 32.91 1tcf h MET 43 CO 0.11 1.24 0.40 0.00 1.06 0.00 0.00 176.91 179.71 1tcf h ARG 44 N 0.40 0.73 -0.70 1.72 3.08 -0.81 -0.90 114.38 117.90 1tcf h ARG 44 Ca -0.07 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.00 1tcf h ARG 44 Cb 1.44 -0.17 -0.06 0.00 0.08 0.00 0.00 29.97 31.26 1tcf h ARG 44 CO 0.16 0.48 0.39 0.52 -1.07 0.00 0.00 179.97 180.45 1tcf h MET 45 N 0.75 0.68 0.00 0.04 2.86 -1.28 0.48 114.93 118.46 1tcf h MET 45 Ca 0.29 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 1tcf h MET 45 Cb 0.11 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1tcf h MET 45 CO -0.14 0.45 0.00 1.28 1.06 0.00 0.00 176.91 179.55 1tcf n LEU 46 N -4.78 0.00 0.00 1.22 4.77 -0.45 -4.82 117.00 112.94 1tcf n LEU 46 Ca 0.10 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 1tcf n LEU 46 Cb 0.20 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1tcf n LEU 46 CO 0.28 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 1tcf n GLY 47 N -0.35 0.92 3.98 -0.72 0.00 0.17 -5.09 105.19 104.10 1tcf n GLY 47 Ca 0.07 -0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1tcf n GLY 47 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tcf s GLN 48 N -0.74 3.25 -0.63 1.61 -0.21 -0.59 -4.98 119.66 117.37 1tcf s GLN 48 Ca 0.00 -0.87 0.06 0.00 0.02 0.00 0.00 55.36 54.57 1tcf s GLN 48 Cb 0.00 -2.83 0.26 0.00 1.00 0.00 0.00 33.01 31.44 1tcf s GLN 48 CO 0.00 0.19 0.77 0.25 -2.12 0.00 0.00 175.29 174.38 1tcf n THR 49 N -1.57 2.41 -2.84 -0.19 -2.24 -1.26 -3.75 114.28 104.83 1tcf n THR 49 Ca -0.04 -5.25 -0.33 0.00 -2.27 0.00 0.00 64.05 56.17 1tcf n THR 49 Cb 0.58 -2.03 -0.07 0.00 -2.10 0.00 0.00 70.33 66.71 1tcf n THR 49 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1tcf s PRO 50 N -2.57 4.18 0.66 -0.78 0.04 -1.26 -5.07 135.00 130.20 1tcf s PRO 50 Ca 0.41 1.05 -0.03 0.00 0.04 0.00 0.00 61.00 62.47 1tcf s PRO 50 Cb 0.16 -2.21 0.06 0.00 0.04 0.00 0.00 34.50 32.56 1tcf s PRO 50 CO -0.02 -0.02 0.93 0.95 0.04 0.00 0.00 177.00 178.88 1tcf s THR 51 N -2.18 2.39 0.37 1.26 -4.23 -1.26 -4.94 115.64 107.06 1tcf s THR 51 Ca 0.61 -0.46 0.10 0.00 -1.18 0.00 0.00 61.69 60.77 1tcf s THR 51 Cb -0.09 -2.94 0.12 0.00 1.34 0.00 0.00 72.50 70.93 1tcf s THR 51 CO 0.15 0.00 1.87 0.11 -0.54 0.00 0.00 174.62 176.20 1tcf h LYS 52 N -0.37 0.15 -0.33 3.99 1.57 -1.98 -2.48 116.57 117.12 1tcf h LYS 52 Ca -0.42 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.17 1tcf h LYS 52 Cb 1.30 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.59 1tcf h LYS 52 CO 0.54 0.39 -0.34 1.49 -0.57 0.00 0.00 179.45 180.96 1tcf h GLU 53 N 0.14 0.82 -0.41 3.15 4.81 -1.98 -0.65 114.58 120.46 1tcf h GLU 53 Ca 0.02 -0.44 -0.03 0.00 -0.13 0.00 0.00 59.36 58.79 1tcf h GLU 53 Cb 0.51 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1tcf h GLU 53 CO 0.04 1.07 0.14 0.93 -0.73 0.00 0.00 179.01 180.46 1tcf h GLU 54 N 0.60 0.59 -0.22 1.92 5.08 -1.84 -0.25 114.58 120.47 1tcf h GLU 54 Ca 0.05 -0.08 -0.18 0.00 -1.00 0.00 0.00 59.36 58.15 1tcf h GLU 54 Cb 0.93 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.07 1tcf h GLU 54 CO 0.08 0.51 -0.59 -0.07 -1.00 0.00 0.00 179.01 177.94 1tcf h LEU 55 N 0.58 0.79 -0.96 1.33 3.38 -1.14 -2.50 115.31 116.79 1tcf h LEU 55 Ca 0.14 -0.44 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 1tcf h LEU 55 Cb 0.15 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 1tcf h LEU 55 CO -0.01 1.20 0.27 -0.78 0.09 0.00 0.00 178.44 179.20 1tcf h ASP 56 N 0.53 0.94 0.01 -0.43 1.82 -0.59 -2.31 116.42 116.38 1tcf h ASP 56 Ca 0.00 -0.14 -0.00 0.00 -0.39 0.00 0.00 57.03 56.50 1tcf h ASP 56 Cb 1.17 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 40.93 1tcf h ASP 56 CO 0.12 0.84 -0.00 0.00 -1.61 0.00 0.00 179.24 178.59 1tcf h ALA 57 N 1.29 -0.01 -0.67 -0.78 0.00 -0.81 -2.24 119.26 116.04 1tcf h ALA 57 Ca 0.23 -0.13 0.11 0.00 0.00 0.00 0.00 54.91 55.12 1tcf h ALA 57 Cb 0.20 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1tcf h ALA 57 CO -0.02 -0.38 0.27 0.82 0.00 0.00 0.00 179.25 179.94 1tcf h ILE 58 N -0.26 0.74 -0.50 0.00 2.04 -1.30 -0.65 117.51 117.58 1tcf h ILE 58 Ca -0.00 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.73 1tcf h ILE 58 Cb 0.26 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 1tcf h ILE 58 CO 0.00 0.08 0.33 0.40 0.00 0.00 0.00 178.15 178.97 1tcf h ILE 59 N 0.45 1.06 0.00 -0.67 2.04 -1.24 -0.81 117.51 118.34 1tcf h ILE 59 Ca 0.35 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.94 1tcf h ILE 59 Cb 0.46 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1tcf h ILE 59 CO -0.33 0.10 -0.34 -0.33 0.00 0.00 0.00 178.15 177.25 1tcf h GLU 60 N 0.57 0.00 -0.16 2.37 5.08 -0.52 0.49 114.58 122.41 1tcf h GLU 60 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1tcf h GLU 60 Cb 0.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1tcf h GLU 60 CO -0.05 0.34 0.11 0.93 -1.00 0.00 0.00 179.01 179.33 1tcf h GLU 61 N 0.00 0.21 0.00 2.33 5.08 -0.46 -3.31 114.58 118.43 1tcf h GLU 61 Ca -0.00 -0.01 -0.26 0.00 -1.00 0.00 0.00 59.36 58.09 1tcf h GLU 61 Cb 0.79 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.95 1tcf h GLU 61 CO 0.04 0.14 -1.98 0.28 -1.00 0.00 0.00 179.01 176.50 1tcf n VAL 62 N -4.51 0.98 -1.14 3.13 0.31 -0.80 -4.96 118.33 111.33 1tcf n VAL 62 Ca -0.01 -0.42 -0.10 0.00 -0.01 0.00 0.00 64.34 63.81 1tcf n VAL 62 Cb 0.08 -1.02 -0.05 0.00 -0.91 0.00 0.00 33.84 31.94 1tcf n VAL 62 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1tcf n ASP 63 N -2.90 -0.42 0.08 4.52 2.03 0.17 -4.81 116.55 115.21 1tcf n ASP 63 Ca -0.29 -1.77 0.13 0.00 0.52 0.00 0.00 54.79 53.38 1tcf n ASP 63 Cb 0.85 -0.89 0.46 0.00 -0.72 0.00 0.00 41.12 40.82 1tcf n ASP 63 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1tcf n GLU 64 N 5.97 0.19 -0.09 -0.67 1.02 -1.26 -3.41 120.64 122.38 1tcf n GLU 64 Ca 0.19 0.19 0.06 0.00 -0.02 0.00 0.00 57.16 57.58 1tcf n GLU 64 Cb 0.45 -1.73 0.11 0.00 -0.02 0.00 0.00 31.44 30.24 1tcf n GLU 64 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1tcf n ASP 65 N -2.06 2.51 -0.32 1.62 5.75 -1.26 -5.01 116.55 117.78 1tcf n ASP 65 Ca 0.05 -1.75 -0.04 0.00 -0.01 0.00 0.00 54.79 53.05 1tcf n ASP 65 Cb 0.38 -0.12 -0.02 0.00 -1.03 0.00 0.00 41.12 40.33 1tcf n ASP 65 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tcf n GLY 66 N 0.67 0.62 0.21 6.12 0.00 -1.22 -4.92 105.19 106.67 1tcf n GLY 66 Ca 0.10 -0.22 0.15 0.00 0.00 0.00 0.00 46.02 46.05 1tcf n GLY 66 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1tcf h SER 67 N 0.00 0.00 0.00 1.61 4.64 -1.95 -3.45 113.55 114.40 1tcf h SER 67 Ca -0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1tcf h SER 67 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1tcf h SER 67 CO 0.12 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.69 1tcf n GLY 68 N 0.04 0.83 3.30 -0.77 0.00 -1.26 -5.00 105.19 102.32 1tcf n GLY 68 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 1tcf n GLY 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tcf s THR 69 N -3.25 0.74 -0.27 2.61 -4.23 -1.26 -4.58 115.64 105.38 1tcf s THR 69 Ca 0.00 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.46 1tcf s THR 69 Cb 0.00 -2.40 0.02 0.00 1.34 0.00 0.00 72.50 71.45 1tcf s THR 69 CO 0.00 -0.24 0.02 -0.63 -0.54 0.00 0.00 174.62 173.24 1tcf s ILE 70 N -3.62 3.52 0.63 2.99 1.01 -0.31 -4.81 121.20 120.62 1tcf s ILE 70 Ca 0.31 -0.82 0.07 0.00 0.00 0.00 0.00 60.65 60.21 1tcf s ILE 70 Cb 0.07 -2.80 0.11 0.00 0.01 0.00 0.00 42.46 39.84 1tcf s ILE 70 CO 0.09 0.13 0.87 1.51 0.00 0.00 0.00 174.94 177.55 1tcf s ASP 71 N 1.43 4.81 0.16 3.58 1.47 -1.26 0.36 116.67 127.22 1tcf s ASP 71 Ca 0.02 -0.74 -0.18 0.00 1.18 0.00 0.00 52.55 52.83 1tcf s ASP 71 Cb -0.17 0.29 0.07 0.00 -0.34 0.00 0.00 42.92 42.77 1tcf s ASP 71 CO -0.00 -1.55 1.67 0.15 0.68 0.00 0.00 175.17 176.11 1tcf h PHE 72 N -0.08 -0.24 -0.95 2.11 3.57 -2.00 0.13 116.94 119.48 1tcf h PHE 72 Ca -0.31 0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.35 1tcf h PHE 72 Cb 1.28 0.16 -0.08 0.00 2.79 0.00 0.00 35.95 40.11 1tcf h PHE 72 CO 0.22 -0.18 0.60 0.93 -2.23 0.00 0.00 178.31 177.65 1tcf h GLU 73 N -0.03 0.83 0.00 1.11 5.08 -1.96 -0.09 114.58 119.53 1tcf h GLU 73 Ca 0.17 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.36 1tcf h GLU 73 Cb 0.29 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1tcf h GLU 73 CO -0.38 0.55 -0.59 0.93 -1.00 0.00 0.00 179.01 178.52 1tcf h GLU 74 N 0.86 0.00 -0.30 2.33 5.08 -1.59 -3.18 114.58 117.78 1tcf h GLU 74 Ca 0.47 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.79 1tcf h GLU 74 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1tcf h GLU 74 CO -0.24 0.59 0.02 0.35 -1.00 0.00 0.00 179.01 178.73 1tcf h PHE 75 N 0.00 0.56 -0.33 4.33 3.57 0.86 -1.82 116.94 124.11 1tcf h PHE 75 Ca -0.01 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.36 1tcf h PHE 75 Cb 1.24 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.81 1tcf h PHE 75 CO 0.00 0.64 0.01 -0.07 -2.23 0.00 0.00 178.31 176.66 1tcf h LEU 76 N 0.32 0.47 -0.13 0.59 3.38 -1.37 0.20 115.31 118.76 1tcf h LEU 76 Ca 0.09 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tcf h LEU 76 Cb 0.41 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1tcf h LEU 76 CO 0.01 0.53 0.06 0.58 0.09 0.00 0.00 178.44 179.72 1tcf h VAL 77 N 0.48 1.11 -0.83 1.22 2.07 -1.56 0.37 116.25 119.11 1tcf h VAL 77 Ca 0.11 -0.32 0.06 0.00 0.82 0.00 0.00 66.70 67.37 1tcf h VAL 77 Cb 0.30 1.10 -0.06 0.00 -1.52 0.00 0.00 31.29 31.11 1tcf h VAL 77 CO 0.01 0.10 0.51 -0.03 0.02 0.00 0.00 177.57 178.18 1tcf h MET 78 N 0.09 0.91 -0.28 1.57 1.85 -0.32 -1.24 114.93 117.51 1tcf h MET 78 Ca 0.04 -0.05 -0.12 0.00 -0.61 0.00 0.00 59.70 58.96 1tcf h MET 78 Cb 0.11 -0.21 -0.00 0.00 0.43 0.00 0.00 31.60 31.93 1tcf h MET 78 CO -0.01 0.60 -0.30 0.52 -0.40 0.00 0.00 176.91 177.32 1tcf h MET 79 N 0.94 0.70 -0.18 0.39 2.07 0.18 -2.49 114.93 116.55 1tcf h MET 79 Ca 0.36 -0.38 -0.05 0.00 -2.07 0.00 0.00 59.70 57.57 1tcf h MET 79 Cb 0.17 0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 29.90 1tcf h MET 79 CO -0.17 0.99 -0.10 0.28 1.07 0.00 0.00 176.91 178.99 1tcf h VAL 80 N 0.44 1.17 -0.27 -2.22 2.07 0.05 0.15 116.25 117.65 1tcf h VAL 80 Ca 0.04 -0.73 -0.09 0.00 0.82 0.00 0.00 66.70 66.74 1tcf h VAL 80 Cb 0.88 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1tcf h VAL 80 CO 0.07 0.23 -0.20 0.03 0.02 0.00 0.00 177.57 177.73 1tcf h ARG 81 N 0.26 0.61 -0.50 1.57 3.08 -1.11 -0.51 114.38 117.77 1tcf h ARG 81 Ca 0.06 -0.30 -0.08 0.00 0.07 0.00 0.00 59.98 59.73 1tcf h ARG 81 Cb 0.34 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 1tcf h ARG 81 CO 0.02 0.89 -0.00 1.96 -1.07 0.00 0.00 179.97 181.76 1tcf h GLN 82 N 0.33 0.84 -0.34 0.04 4.20 -0.89 -1.70 115.11 117.59 1tcf h GLN 82 Ca 0.05 -0.23 -0.02 0.00 0.06 0.00 0.00 58.65 58.51 1tcf h GLN 82 Cb 0.74 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 1tcf h GLN 82 CO 0.05 0.84 0.13 0.52 -0.67 0.00 0.00 178.83 179.70 1tcf h MET 83 N 0.78 0.52 -0.07 1.46 2.86 -0.51 -1.85 114.93 118.12 1tcf h MET 83 Ca 0.15 -0.10 -0.12 0.00 -2.06 0.00 0.00 59.70 57.57 1tcf h MET 83 Cb 0.47 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 1tcf h MET 83 CO 0.02 0.52 -0.50 0.87 1.06 0.00 0.00 176.91 178.89 1tcf h LYS 84 N 0.41 0.18 -0.35 1.72 1.57 -0.97 -2.17 116.57 116.95 1tcf h LYS 84 Ca 0.11 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 1tcf h LYS 84 Cb 0.21 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1tcf h LYS 84 CO -0.01 0.64 -0.16 1.49 -0.57 0.00 0.00 179.45 180.84 1tcf h GLU 85 N 0.14 0.73 -0.33 3.15 4.81 -1.15 -2.23 114.58 119.70 1tcf h GLU 85 Ca 0.00 -0.32 -0.02 0.00 -0.13 0.00 0.00 59.36 58.90 1tcf h GLU 85 Cb 0.93 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 1tcf h GLU 85 CO 0.07 0.92 0.12 0.22 -0.73 0.00 0.00 179.01 179.62 1tcf h ASP 86 N 0.51 0.47 -0.74 1.04 3.58 -1.26 0.14 116.42 120.17 1tcf h ASP 86 Ca 0.08 -0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.35 1tcf h ASP 86 Cb 0.70 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 41.59 1tcf h ASP 86 CO 0.05 0.53 0.47 0.00 -2.88 0.00 0.00 179.24 177.41 1tcf h ALA 87 N 0.96 0.94 -0.43 -0.78 0.00 -1.39 0.29 119.26 118.84 1tcf h ALA 87 Ca 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1tcf h ALA 87 Cb 0.21 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1tcf h ALA 87 CO -0.01 0.37 0.20 0.87 0.00 0.00 0.00 179.25 180.69 1tcf h LYS 88 N 1.00 0.63 -0.13 0.00 1.57 -1.23 -1.16 116.57 117.26 1tcf h LYS 88 Ca 0.27 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.85 1tcf h LYS 88 Cb -0.09 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1tcf h LYS 88 CO -0.06 0.55 -0.38 0.78 -0.57 0.00 0.00 179.45 179.78 1tcf h GLY 89 N 0.56 0.30 1.71 3.86 0.00 0.02 -2.32 103.07 107.20 1tcf h GLY 89 Ca 0.15 -0.27 -0.19 0.00 0.00 0.00 0.00 47.33 47.01 1tcf h GLY 89 CO -0.02 0.25 -0.84 0.50 0.00 0.00 0.00 176.54 176.43 1tcf h LYS 90 N 0.23 0.27 -0.54 4.80 1.57 -0.35 -2.67 116.57 119.88 1tcf h LYS 90 Ca 0.02 -0.27 -0.07 0.00 -1.87 0.00 0.00 60.65 58.47 1tcf h LYS 90 Cb 0.78 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.13 1tcf h LYS 90 CO 0.06 0.96 0.08 1.03 -0.57 0.00 0.00 179.45 181.01 1tcf h SER 91 N 0.16 0.86 -0.31 0.86 0.87 -1.09 -2.50 113.55 112.41 1tcf h SER 91 Ca -0.04 -0.26 -0.12 0.00 -1.23 0.00 0.00 61.79 60.13 1tcf h SER 91 Cb 1.44 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 63.16 1tcf h SER 91 CO 0.13 0.91 -0.25 -0.33 -0.53 0.00 0.00 176.83 176.76 1tcf h GLU 92 N 0.79 0.81 -0.38 2.24 5.08 -1.46 -2.87 114.58 118.79 1tcf h GLU 92 Ca 0.16 -0.34 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 1tcf h GLU 92 Cb 0.42 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 1tcf h GLU 92 CO 0.01 0.97 0.07 0.93 -1.00 0.00 0.00 179.01 179.99 1tcf h GLU 93 N 0.70 0.57 -0.31 2.33 5.08 -1.32 -0.48 114.58 121.14 1tcf h GLU 93 Ca 0.09 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1tcf h GLU 93 Cb 0.78 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1tcf h GLU 93 CO 0.06 0.54 -0.05 0.93 -1.00 0.00 0.00 179.01 179.49 1tcf h GLU 94 N 0.56 0.59 -0.49 2.33 5.08 -1.32 -2.37 114.58 118.96 1tcf h GLU 94 Ca 0.13 -0.22 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 1tcf h GLU 94 Cb 0.25 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1tcf h GLU 94 CO 0.00 0.76 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.67 1tcf h LEU 95 N 0.37 0.87 -0.11 1.33 3.38 -1.26 0.15 115.31 120.04 1tcf h LEU 95 Ca 0.08 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1tcf h LEU 95 Cb 0.53 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1tcf h LEU 95 CO 0.03 0.98 0.03 0.00 0.09 0.00 0.00 178.44 179.57 1tcf h ALA 96 N 0.92 0.15 0.00 1.53 0.00 -1.09 -2.55 119.26 118.21 1tcf h ALA 96 Ca 0.13 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1tcf h ALA 96 Cb 0.56 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1tcf h ALA 96 CO 0.03 -0.21 -0.26 1.49 0.00 0.00 0.00 179.25 180.30 1tcf h GLU 97 N -0.03 0.00 0.15 0.00 4.57 -1.38 -1.01 114.58 116.88 1tcf h GLU 97 Ca 0.04 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1tcf h GLU 97 Cb 0.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1tcf h GLU 97 CO 0.00 0.26 -0.07 1.25 -1.18 0.00 0.00 179.01 179.26 1tcf h LEU 98 N 0.00 -0.17 -1.47 1.64 6.46 -0.82 -1.62 115.31 119.33 1tcf h LEU 98 Ca -0.00 -0.16 -0.00 0.00 -0.12 0.00 0.00 57.88 57.59 1tcf h LEU 98 Cb 0.58 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.53 1tcf h LEU 98 CO 0.03 0.06 0.29 0.15 -0.62 0.00 0.00 178.44 178.35 1tcf h PHE 99 N -0.41 0.62 -0.44 1.25 3.04 -1.18 -2.46 116.94 117.37 1tcf h PHE 99 Ca -0.02 0.00 -0.10 0.00 3.98 0.00 0.00 57.97 61.83 1tcf h PHE 99 Cb 0.32 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 38.61 1tcf h PHE 99 CO -0.01 0.42 -0.15 -0.09 -2.02 0.00 0.00 178.31 176.47 1tcf h ARG 100 N 0.66 0.82 -0.41 1.11 2.43 -0.90 -2.53 114.38 115.56 1tcf h ARG 100 Ca 0.17 -0.30 -0.04 0.00 -0.81 0.00 0.00 59.98 59.00 1tcf h ARG 100 Cb -0.02 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1tcf h ARG 100 CO -0.03 0.92 0.09 0.82 -1.51 0.00 0.00 179.97 180.26 1tcf h ILE 101 N 0.74 1.23 -0.70 1.20 2.04 -0.83 -3.22 117.51 117.97 1tcf h ILE 101 Ca 0.12 -0.82 -0.06 0.00 1.00 0.00 0.00 64.86 65.10 1tcf h ILE 101 Cb 0.65 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 1tcf h ILE 101 CO 0.05 0.28 0.21 -0.26 0.00 0.00 0.00 178.15 178.43 1tcf h PHE 102 N 0.53 1.13 -0.52 1.37 -1.00 -1.53 -3.33 116.94 113.60 1tcf h PHE 102 Ca 0.13 -0.12 -0.71 0.00 2.81 0.00 0.00 57.97 60.08 1tcf h PHE 102 Cb 0.33 -0.33 -0.05 0.00 3.61 0.00 0.00 35.95 39.52 1tcf h PHE 102 CO 0.02 0.91 3.10 -3.47 -1.61 0.00 0.00 178.31 177.26 1tcf n ASP 103 N -4.29 7.43 -0.11 2.17 2.03 -0.95 -4.69 116.55 118.12 1tcf n ASP 103 Ca 0.05 -2.85 0.17 0.00 0.52 0.00 0.00 54.79 52.68 1tcf n ASP 103 Cb 0.23 -1.50 0.56 0.00 -0.72 0.00 0.00 41.12 39.68 1tcf n ASP 103 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1tcf h ARG 104 N 5.10 0.29 -0.32 -0.67 0.11 -1.77 0.41 114.38 117.54 1tcf h ARG 104 Ca 0.72 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.79 1tcf h ARG 104 Cb 0.38 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.39 1tcf h ARG 104 CO 1.69 0.19 0.00 0.27 0.10 0.00 0.00 179.97 182.22 1tcf n ASN 105 N -4.45 2.44 -3.36 0.08 0.23 -1.26 -4.97 115.26 103.97 1tcf n ASN 105 Ca 0.13 -1.87 -0.12 0.00 -0.53 0.00 0.00 54.58 52.19 1tcf n ASN 105 Cb 0.55 -0.21 0.00 0.00 -2.08 0.00 0.00 39.78 38.04 1tcf n ASN 105 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1tcf n ALA 106 N 0.83 -1.56 -0.03 -2.53 0.00 0.14 -4.80 120.51 112.57 1tcf n ALA 106 Ca 0.17 -0.14 0.09 0.00 0.00 0.00 0.00 53.44 53.56 1tcf n ALA 106 Cb 0.43 -0.50 0.21 0.00 0.00 0.00 0.00 19.45 19.59 1tcf n ALA 106 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1tcf n ASP 107 N -0.30 3.32 0.00 0.00 5.75 -1.26 -4.93 116.55 119.13 1tcf n ASP 107 Ca -0.07 -1.95 0.00 0.00 -0.01 0.00 0.00 54.79 52.76 1tcf n ASP 107 Cb 0.20 -0.29 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1tcf n ASP 107 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tcf n GLY 108 N 1.18 0.64 3.06 6.12 0.00 -1.26 -5.05 105.19 109.88 1tcf n GLY 108 Ca 0.17 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1tcf n GLY 108 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tcf s TYR 109 N -2.00 -0.03 -0.26 1.61 1.51 -1.26 -4.42 117.35 112.50 1tcf s TYR 109 Ca 0.00 0.06 -0.08 0.00 -1.01 0.00 0.00 57.07 56.03 1tcf s TYR 109 Cb 0.00 -0.02 -0.03 0.00 -0.11 0.00 0.00 41.96 41.80 1tcf s TYR 109 CO 0.00 -0.19 0.11 0.42 -1.11 0.00 0.00 175.55 174.78 1tcf s ILE 110 N -0.78 4.62 0.39 2.71 1.01 0.59 -4.81 121.20 124.92 1tcf s ILE 110 Ca -0.09 -0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.56 1tcf s ILE 110 Cb -0.05 -3.18 -0.00 0.00 0.01 0.00 0.00 42.46 39.24 1tcf s ILE 110 CO 0.01 0.30 0.50 1.51 0.00 0.00 0.00 174.94 177.26 1tcf s ASP 111 N 1.66 5.65 0.45 3.58 1.47 -1.26 -0.58 116.67 127.63 1tcf s ASP 111 Ca 0.06 -0.40 0.22 0.00 1.18 0.00 0.00 52.55 53.61 1tcf s ASP 111 Cb -0.15 -0.83 1.20 0.00 -0.34 0.00 0.00 42.92 42.80 1tcf s ASP 111 CO 0.06 -0.63 1.86 0.00 0.68 0.00 0.00 175.17 177.14 1tcf h ALA 112 N 0.80 2.39 -0.04 2.11 0.00 -1.98 0.17 119.26 122.71 1tcf h ALA 112 Ca -0.42 0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.25 1tcf h ALA 112 Cb 1.27 0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.08 1tcf h ALA 112 CO 0.49 -0.67 -0.96 0.93 0.00 0.00 0.00 179.25 179.04 1tcf h GLU 113 N 0.29 0.69 -0.39 0.00 5.08 -1.99 -1.32 114.58 116.94 1tcf h GLU 113 Ca 0.47 -0.69 -0.14 0.00 -1.00 0.00 0.00 59.36 58.00 1tcf h GLU 113 Cb 1.35 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.77 1tcf h GLU 113 CO -0.14 1.28 -0.31 0.93 -1.00 0.00 0.00 179.01 179.76 1tcf h GLU 114 N 0.41 0.85 -0.01 2.33 5.08 -1.69 -0.90 114.58 120.66 1tcf h GLU 114 Ca -0.10 -0.40 -0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1tcf h GLU 114 Cb 1.61 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.85 1tcf h GLU 114 CO 0.19 1.04 0.01 1.25 -1.00 0.00 0.00 179.01 180.50 1tcf h LEU 115 N 0.72 0.02 -0.30 1.33 5.85 -0.64 -2.53 115.31 119.76 1tcf h LEU 115 Ca 0.08 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.72 1tcf h LEU 115 Cb 0.87 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 1tcf h LEU 115 CO 0.08 0.12 0.12 0.00 -0.34 0.00 0.00 178.44 178.41 1tcf h ALA 116 N 0.90 0.35 -0.72 1.25 0.00 -1.00 -2.92 119.26 117.11 1tcf h ALA 116 Ca 0.00 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.01 1tcf h ALA 116 Cb 0.10 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 1tcf h ALA 116 CO -0.00 -0.28 0.47 1.49 0.00 0.00 0.00 179.25 180.94 1tcf h GLU 117 N 0.26 0.71 -0.04 0.00 4.57 -1.00 0.20 114.58 119.28 1tcf h GLU 117 Ca 0.13 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 1tcf h GLU 117 Cb 0.08 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 28.51 1tcf h GLU 117 CO -0.12 0.47 -0.01 0.82 -1.18 0.00 0.00 179.01 178.99 1tcf h ILE 118 N 0.73 1.29 -0.61 2.32 1.08 -1.27 0.60 117.51 121.64 1tcf h ILE 118 Ca 0.31 -0.89 -0.05 0.00 -0.39 0.00 0.00 64.86 63.84 1tcf h ILE 118 Cb 0.29 1.82 -0.03 0.00 -3.07 0.00 0.00 36.82 35.84 1tcf h ILE 118 CO -0.11 0.24 0.17 -0.26 -0.69 0.00 0.00 178.15 177.51 1tcf h PHE 119 N -0.28 0.97 0.27 1.37 -1.00 -1.30 0.69 116.94 117.66 1tcf h PHE 119 Ca 0.01 -0.09 0.01 0.00 2.81 0.00 0.00 57.97 60.71 1tcf h PHE 119 Cb 0.39 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.64 1tcf h PHE 119 CO 0.05 0.79 -0.37 -0.09 -1.61 0.00 0.00 178.31 177.08 1tcf h ARG 120 N 0.91 -0.67 -0.38 1.51 2.43 -0.41 -2.06 114.38 115.71 1tcf h ARG 120 Ca 0.20 0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.47 1tcf h ARG 120 Cb 0.29 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 1tcf h ARG 120 CO -0.00 -0.45 0.25 0.00 -1.51 0.00 0.00 179.97 178.26 1tcf h ALA 121 N -0.22 1.98 0.00 2.80 0.00 0.82 -1.12 119.26 123.52 1tcf h ALA 121 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1tcf h ALA 121 Cb 0.66 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1tcf h ALA 121 CO -0.12 -0.04 -0.02 0.66 0.00 0.00 0.00 179.25 179.72 1tcf h SER 122 N 0.30 0.00 0.00 0.00 4.64 -0.18 -3.46 113.55 114.84 1tcf h SER 122 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1tcf h SER 122 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1tcf h SER 122 CO -0.03 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.56 1tcf n GLY 123 N -0.28 0.95 3.37 -0.77 0.00 -0.42 -5.09 105.19 102.95 1tcf n GLY 123 Ca -0.00 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 1tcf n GLY 123 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1tcf s GLU 124 N -0.22 2.17 0.00 1.61 2.56 -0.99 -5.06 118.70 118.76 1tcf s GLU 124 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.97 54.07 1tcf s GLU 124 Cb 0.00 -2.13 0.00 0.00 2.00 0.00 0.00 34.13 34.00 1tcf s GLU 124 CO 0.00 0.57 0.35 -2.39 -0.56 0.00 0.00 175.26 173.23 1tcf n HIS 125 N 2.25 0.00 -2.17 5.30 1.44 -1.26 -4.21 115.22 116.58 1tcf n HIS 125 Ca -0.16 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.55 1tcf n HIS 125 Cb 0.51 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.62 1tcf n HIS 125 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 1tcf n VAL 126 N -0.69-10.05 -3.01 0.61 0.31 -1.26 -4.86 118.33 99.39 1tcf n VAL 126 Ca 0.00 2.44 -0.30 0.00 -0.01 0.00 0.00 64.34 66.46 1tcf n VAL 126 Cb 0.00 -4.69 -0.04 0.00 -0.91 0.00 0.00 33.84 28.20 1tcf n VAL 126 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1tcf s THR 127 N -0.43 4.83 0.44 2.52 -4.23 -1.26 -4.93 115.64 112.58 1tcf s THR 127 Ca 0.00 0.54 0.19 0.00 -1.18 0.00 0.00 61.69 61.24 1tcf s THR 127 Cb 0.00 -3.71 0.39 0.00 1.34 0.00 0.00 72.50 70.52 1tcf s THR 127 CO 0.00 -0.42 1.87 0.44 -0.54 0.00 0.00 174.62 175.97 1tcf h ASP 128 N 1.51 0.35 0.06 3.99 3.32 -2.00 0.26 116.42 123.91 1tcf h ASP 128 Ca -0.47 0.03 -0.12 0.00 0.02 0.00 0.00 57.03 56.49 1tcf h ASP 128 Cb 1.19 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 1tcf h ASP 128 CO 0.65 0.14 -0.39 -0.33 -1.72 0.00 0.00 179.24 177.59 1tcf h GLU 129 N 0.35 0.43 -0.30 3.56 3.07 -1.99 -2.21 114.58 117.49 1tcf h GLU 129 Ca 0.45 -0.21 -0.07 0.00 -0.50 0.00 0.00 59.36 59.03 1tcf h GLU 129 Cb 1.19 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.09 1tcf h GLU 129 CO -0.15 0.75 -0.09 0.93 -1.40 0.00 0.00 179.01 179.06 1tcf h GLU 130 N 0.36 0.59 -0.82 2.33 5.08 -0.89 -1.32 114.58 119.91 1tcf h GLU 130 Ca 0.03 -0.23 0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1tcf h GLU 130 Cb 0.85 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.02 1tcf h GLU 130 CO 0.07 0.79 0.54 0.82 -1.00 0.00 0.00 179.01 180.23 1tcf h ILE 131 N 0.36 1.20 -0.16 3.13 1.08 -1.27 -0.92 117.51 120.92 1tcf h ILE 131 Ca 0.08 -0.38 0.02 0.00 -0.39 0.00 0.00 64.86 64.18 1tcf h ILE 131 Cb 0.58 -0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.31 1tcf h ILE 131 CO 0.03 0.20 0.05 -0.08 -0.69 0.00 0.00 178.15 177.67 1tcf h GLU 132 N 1.10 0.13 -0.82 2.37 4.81 -1.26 0.38 114.58 121.28 1tcf h GLU 132 Ca 0.31 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1tcf h GLU 132 Cb -0.11 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 1tcf h GLU 132 CO -0.07 0.08 0.51 1.03 -0.73 0.00 0.00 179.01 179.83 1tcf h SER 133 N 0.13 0.97 -0.04 1.04 0.87 -0.69 -0.45 113.55 115.37 1tcf h SER 133 Ca 0.07 -0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1tcf h SER 133 Cb 0.04 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.76 1tcf h SER 133 CO -0.07 0.73 -0.01 0.25 -0.53 0.00 0.00 176.83 177.20 1tcf h LEU 134 N 1.12 0.07 -1.01 2.23 5.85 -0.29 -1.62 115.31 121.67 1tcf h LEU 134 Ca 0.30 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 1tcf h LEU 134 Cb -0.08 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1tcf h LEU 134 CO -0.06 0.40 0.32 0.24 -0.34 0.00 0.00 178.44 179.00 1tcf h MET 135 N -0.26 1.03 0.00 1.25 2.86 0.01 -2.55 114.93 117.27 1tcf h MET 135 Ca 0.01 -0.15 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 1tcf h MET 135 Cb 0.37 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 1tcf h MET 135 CO 0.00 0.81 -0.53 0.87 1.06 0.00 0.00 176.91 179.12 1tcf h LYS 136 N 1.02 0.00 0.00 1.72 6.56 -0.97 -1.18 116.57 123.72 1tcf h LYS 136 Ca 0.25 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.69 1tcf h LYS 136 Cb 0.14 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.78 1tcf h LYS 136 CO -0.03 0.53 -0.71 -0.44 -2.06 0.00 0.00 179.45 176.75 1tcf h ASP 137 N 0.00 0.00 1.19 0.86 5.19 -1.12 -3.31 116.42 119.23 1tcf h ASP 137 Ca -0.01 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.31 1tcf h ASP 137 Cb 1.18 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.68 1tcf h ASP 137 CO 0.07 0.71 -0.85 1.23 -3.12 0.00 0.00 179.24 177.28 1tcf h GLY 138 N 3.10 0.00 -7.57 2.75 0.00 -1.39 -3.42 103.07 96.54 1tcf h GLY 138 Ca -0.01 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.66 1tcf h GLY 138 CO 0.09 0.00 1.75 -0.35 0.00 0.00 0.00 176.54 178.04 1tcf s ASP 139 N -5.97 6.75 0.41 0.19 -1.08 -0.45 -4.74 116.67 111.78 1tcf s ASP 139 Ca 0.01 -2.17 0.23 0.00 -0.52 0.00 0.00 52.55 50.09 1tcf s ASP 139 Cb 0.08 -2.54 0.64 0.00 -1.46 0.00 0.00 42.92 39.64 1tcf s ASP 139 CO 0.77 -1.21 1.70 0.11 0.52 0.00 0.00 175.17 177.06 1tcf h LYS 140 N 8.32 0.00 -0.43 4.34 1.57 -1.86 -3.10 116.57 125.41 1tcf h LYS 140 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1tcf h LYS 140 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1tcf h LYS 140 CO 1.39 0.22 0.00 0.27 -0.57 0.00 0.00 179.45 180.76 1tcf n ASN 141 N -3.25 3.16 -4.00 0.86 6.94 -1.26 -5.00 115.26 112.71 1tcf n ASN 141 Ca 0.01 -1.97 -0.31 0.00 -0.02 0.00 0.00 54.58 52.30 1tcf n ASN 141 Cb 0.51 -0.28 0.01 0.00 -2.36 0.00 0.00 39.78 37.66 1tcf n ASN 141 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1tcf n ASN 142 N 0.86 -3.89 -1.23 0.53 3.02 -1.17 -4.87 115.26 108.50 1tcf n ASN 142 Ca 0.15 -0.86 0.12 0.00 -0.03 0.00 0.00 54.58 53.96 1tcf n ASN 142 Cb 0.48 -3.52 0.25 0.00 -0.61 0.00 0.00 39.78 36.38 1tcf n ASN 142 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1tcf n ASP 143 N -2.80 3.65 0.00 6.41 5.75 -1.26 -4.95 116.55 123.34 1tcf n ASP 143 Ca 0.01 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.79 1tcf n ASP 143 Cb 0.53 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 1tcf n ASP 143 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tcf n GLY 144 N 1.57 3.10 3.87 6.12 0.00 -1.26 -5.01 105.19 113.58 1tcf n GLY 144 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 1tcf n GLY 144 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1tcf s ARG 145 N -0.26 2.38 -0.14 1.61 1.70 -1.26 -4.58 118.95 118.39 1tcf s ARG 145 Ca 0.00 -1.75 0.01 0.00 -0.47 0.00 0.00 55.73 53.52 1tcf s ARG 145 Cb 0.00 -2.24 0.02 0.00 -0.57 0.00 0.00 34.95 32.16 1tcf s ARG 145 CO 0.00 -0.36 -0.18 0.42 -1.08 0.00 0.00 175.30 174.10 1tcf s ILE 146 N -2.60 1.79 0.54 4.99 1.01 0.25 -4.70 121.20 122.48 1tcf s ILE 146 Ca 0.43 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 60.31 1tcf s ILE 146 Cb -0.02 -1.62 0.04 0.00 0.01 0.00 0.00 42.46 40.86 1tcf s ILE 146 CO 0.25 0.50 0.76 1.51 0.00 0.00 0.00 174.94 177.96 1tcf s ASP 147 N 1.15 5.26 0.38 3.58 1.47 -1.26 -0.30 116.67 126.95 1tcf s ASP 147 Ca -0.01 -0.13 0.10 0.00 1.18 0.00 0.00 52.55 53.69 1tcf s ASP 147 Cb -0.14 -0.74 0.87 0.00 -0.34 0.00 0.00 42.92 42.58 1tcf s ASP 147 CO -0.07 -1.14 1.92 0.15 0.68 0.00 0.00 175.17 176.71 1tcf h PHE 148 N 0.12 0.68 0.03 2.11 3.57 -2.00 0.06 116.94 121.52 1tcf h PHE 148 Ca -0.41 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.11 1tcf h PHE 148 Cb 1.29 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.81 1tcf h PHE 148 CO 0.34 0.29 -0.01 0.22 -2.23 0.00 0.00 178.31 176.92 1tcf h ASP 149 N 0.61 -0.03 -0.61 0.41 3.58 -1.98 -2.05 116.42 116.35 1tcf h ASP 149 Ca 0.38 -0.09 -0.08 0.00 0.42 0.00 0.00 57.03 57.66 1tcf h ASP 149 Cb 0.61 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.64 1tcf h ASP 149 CO -0.14 0.07 0.07 -0.33 -2.88 0.00 0.00 179.24 176.02 1tcf h GLU 150 N -0.13 1.05 -0.02 0.28 5.08 -1.77 -2.69 114.58 116.37 1tcf h GLU 150 Ca -0.00 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1tcf h GLU 150 Cb 0.12 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1tcf h GLU 150 CO 0.01 0.98 0.01 0.35 -1.00 0.00 0.00 179.01 179.36 1tcf h PHE 151 N 0.97 0.02 -0.49 4.33 3.57 -0.83 -2.16 116.94 122.35 1tcf h PHE 151 Ca 0.19 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.76 1tcf h PHE 151 Cb 0.47 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.14 1tcf h PHE 151 CO 0.03 0.03 0.17 1.25 -2.23 0.00 0.00 178.31 177.56 1tcf h LEU 152 N 0.01 0.16 -1.21 0.59 5.85 -1.32 0.17 115.31 119.56 1tcf h LEU 152 Ca 0.01 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1tcf h LEU 152 Cb 0.01 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 1tcf h LEU 152 CO -0.00 0.12 0.54 0.11 -0.34 0.00 0.00 178.44 178.86 1tcf h LYS 153 N 0.34 1.04 -0.32 1.25 1.57 -1.29 0.21 116.57 119.37 1tcf h LYS 153 Ca 0.24 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.81 1tcf h LYS 153 Cb 0.25 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1tcf h LYS 153 CO -0.25 0.69 -0.37 1.98 -0.57 0.00 0.00 179.45 180.93 1tcf h MET 154 N 1.07 0.73 0.16 3.15 4.05 -0.59 0.82 114.93 124.32 1tcf h MET 154 Ca 0.30 -0.37 -0.01 0.00 -0.28 0.00 0.00 59.70 59.35 1tcf h MET 154 Cb -0.08 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.72 1tcf h MET 154 CO -0.07 0.98 -0.08 0.52 0.23 0.00 0.00 176.91 178.49 1tcf h MET 155 N 0.61 -0.21 0.00 0.39 2.86 0.07 -3.31 114.93 115.34 1tcf h MET 155 Ca 0.06 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1tcf h MET 155 Cb 0.91 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.62 1tcf h MET 155 CO 0.08 -0.09 0.00 0.93 1.06 0.00 0.00 176.91 178.89 1tcf h GLU 156 N -1.05 0.00 0.00 1.72 5.08 -1.12 -3.51 114.58 115.71 1tcf h GLU 156 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1tcf h GLU 156 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1tcf h GLU 156 CO 0.04 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.46