#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ury s LEU 19 N 0.00 4.17 0.00 4.31 1.43 -1.26 -5.05 118.68 122.28 1ury s LEU 19 Ca 0.00 1.38 0.00 0.00 -1.03 0.00 0.00 54.13 54.48 1ury s LEU 19 Cb 0.00 -3.48 0.00 0.00 0.03 0.00 0.00 46.19 42.74 1ury s LEU 19 CO 0.00 -0.53 0.00 -1.54 0.23 0.00 0.00 176.35 174.51 1ury n SER 20 N 5.64 -0.73 0.05 2.29 3.41 -1.26 -4.77 113.62 118.24 1ury n SER 20 Ca 0.09 -0.55 -0.09 0.00 -0.26 0.00 0.00 58.87 58.07 1ury n SER 20 Cb 0.48 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.36 1ury n SER 20 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1ury h GLU 21 N 0.00 -0.22 -0.71 4.33 4.57 -1.99 -2.67 114.58 117.90 1ury h GLU 21 Ca 0.00 0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.15 1ury h GLU 21 Cb 0.00 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1ury h GLU 21 CO 0.00 0.15 0.26 0.00 -1.18 0.00 0.00 179.01 178.23 1ury h ALA 22 N -0.54 0.92 -0.49 2.92 0.00 -1.98 -1.63 119.26 118.45 1ury h ALA 22 Ca -0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1ury h ALA 22 Cb 0.47 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1ury h ALA 22 CO 0.04 0.57 0.17 0.93 0.00 0.00 0.00 179.25 180.96 1ury h GLU 23 N 1.02 0.75 -0.90 0.00 5.08 -1.93 0.91 114.58 119.51 1ury h GLU 23 Ca 0.23 -0.15 0.15 0.00 -1.00 0.00 0.00 59.36 58.59 1ury h GLU 23 Cb 0.25 -0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.29 1ury h GLU 23 CO -0.01 0.69 0.50 -0.09 -1.00 0.00 0.00 179.01 179.10 1ury h ARG 24 N 0.66 0.70 0.01 2.33 2.43 -1.19 -2.41 114.38 116.89 1ury h ARG 24 Ca 0.16 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 59.09 1ury h ARG 24 Cb 0.24 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1ury h ARG 24 CO -0.01 0.46 -0.90 -0.22 -1.51 0.00 0.00 179.97 177.79 1ury h LYS 25 N 0.72 0.17 -0.25 0.20 3.64 -0.41 -1.84 116.57 118.80 1ury h LYS 25 Ca 0.49 -0.19 -0.16 0.00 -1.27 0.00 0.00 60.65 59.51 1ury h LYS 25 Cb 0.66 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1ury h LYS 25 CO -0.35 0.95 -0.48 0.00 -2.27 0.00 0.00 179.45 177.31 1ury h ALA 26 N 0.97 0.40 -0.18 5.00 0.00 -0.62 -1.17 119.26 123.65 1ury h ALA 26 Ca -0.04 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 1ury h ALA 26 Cb 1.54 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 1ury h ALA 26 CO 0.13 0.56 0.09 0.28 0.00 0.00 0.00 179.25 180.31 1ury h VAL 27 N 0.51 1.13 -0.60 0.00 2.07 -1.41 -2.47 116.25 115.47 1ury h VAL 27 Ca 0.01 -0.36 -0.10 0.00 0.82 0.00 0.00 66.70 67.07 1ury h VAL 27 Cb 1.09 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1ury h VAL 27 CO 0.11 0.12 -0.03 1.56 0.02 0.00 0.00 177.57 179.35 1ury h GLN 28 N 0.17 1.07 -0.35 1.57 4.20 -1.28 0.17 115.11 120.66 1ury h GLN 28 Ca 0.06 -0.36 -0.03 0.00 0.06 0.00 0.00 58.65 58.39 1ury h GLN 28 Cb 0.11 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1ury h GLN 28 CO -0.01 1.06 0.12 0.00 -0.67 0.00 0.00 178.83 179.33 1ury h ALA 29 N 0.98 0.46 -0.49 3.87 0.00 -1.20 -1.98 119.26 120.89 1ury h ALA 29 Ca 0.17 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1ury h ALA 29 Cb 0.60 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1ury h ALA 29 CO 0.04 0.09 -0.19 1.98 0.00 0.00 0.00 179.25 181.16 1ury h MET 30 N 0.41 0.99 -0.90 0.00 1.85 -1.30 -2.93 114.93 113.05 1ury h MET 30 Ca 0.11 -0.41 -0.01 0.00 -0.61 0.00 0.00 59.70 58.78 1ury h MET 30 Cb 0.24 -0.04 -0.04 0.00 0.43 0.00 0.00 31.60 32.18 1ury h MET 30 CO -0.01 1.09 0.52 2.35 -0.40 0.00 0.00 176.91 180.46 1ury h TRP 31 N 0.86 1.21 -0.78 1.39 2.91 -0.54 -0.82 115.95 120.18 1ury h TRP 31 Ca 0.12 -0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.10 1ury h TRP 31 Cb 0.77 -0.39 -0.04 0.00 -0.51 0.00 0.00 29.16 28.99 1ury h TRP 31 CO 0.05 0.82 0.42 0.00 -1.03 0.00 0.00 178.44 178.70 1ury h ALA 32 N 1.31 1.27 -0.52 2.65 0.00 -1.26 0.13 119.26 122.85 1ury h ALA 32 Ca 0.32 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 1ury h ALA 32 Cb -0.01 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1ury h ALA 32 CO -0.06 0.59 -0.03 0.00 0.00 0.00 0.00 179.25 179.76 1ury h ARG 33 N 1.09 0.93 0.28 0.00 3.08 -1.20 -2.93 114.38 115.63 1ury h ARG 33 Ca 0.27 -0.31 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1ury h ARG 33 Cb 0.04 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 1ury h ARG 33 CO -0.04 0.96 -0.16 -0.07 -1.07 0.00 0.00 179.97 179.59 1ury h LEU 34 N 0.80 -0.38 -1.82 3.04 3.38 -0.54 -3.24 115.31 116.54 1ury h LEU 34 Ca 0.14 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1ury h LEU 34 Cb 0.56 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1ury h LEU 34 CO 0.03 -0.26 0.00 0.22 0.09 0.00 0.00 178.44 178.53 1ury h TYR 35 N -0.41 0.00 0.00 1.13 3.20 -0.73 -1.64 116.97 118.52 1ury h TYR 35 Ca -0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.84 1ury h TYR 35 Cb 0.33 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1ury h TYR 35 CO -0.08 0.00 0.00 0.00 -1.64 0.00 0.00 178.16 176.44 1ury h ALA 36 N 2.02 1.00 -1.74 1.82 0.00 -1.54 -1.21 119.26 119.61 1ury h ALA 36 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 1ury h ALA 36 Cb 0.34 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 17.73 1ury h ALA 36 CO 0.00 -0.00 -1.19 0.27 0.00 0.00 0.00 179.25 178.33 1ury n ASN 37 N -2.70 1.05 -0.18 0.00 6.94 -0.63 -4.96 115.26 114.77 1ury n ASN 37 Ca -0.02 -2.94 0.13 0.00 -0.02 0.00 0.00 54.58 51.72 1ury n ASN 37 Cb 0.05 -0.60 0.45 0.00 -2.36 0.00 0.00 39.78 37.33 1ury n ASN 37 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1ury h SER 38 N 3.00 0.49 -0.08 0.53 4.64 -1.05 -1.59 113.55 119.49 1ury h SER 38 Ca 0.05 0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.31 1ury h SER 38 Cb 1.02 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1ury h SER 38 CO 0.51 0.27 -0.27 1.05 -0.87 0.00 0.00 176.83 177.52 1ury h GLU 39 N 0.53 0.33 -0.03 4.77 9.09 -1.89 -1.17 114.58 126.21 1ury h GLU 39 Ca 0.36 -0.25 -0.01 0.00 0.05 0.00 0.00 59.36 59.52 1ury h GLU 39 Cb 0.67 0.04 -0.00 0.00 -1.65 0.00 0.00 28.75 27.81 1ury h GLU 39 CO -0.13 0.87 0.00 -0.44 0.05 0.00 0.00 179.01 179.36 1ury h ASP 40 N -0.14 0.06 -0.17 3.06 3.32 -1.93 -2.95 116.42 117.67 1ury h ASP 40 Ca -0.01 -0.31 0.05 0.00 0.02 0.00 0.00 57.03 56.78 1ury h ASP 40 Cb 0.90 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 40.37 1ury h ASP 40 CO 0.06 0.35 -0.21 0.58 -1.72 0.00 0.00 179.24 178.30 1ury h VAL 41 N -0.24 0.47 -0.67 -1.35 2.07 -1.36 -1.79 116.25 113.38 1ury h VAL 41 Ca 0.01 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 1ury h VAL 41 Cb 0.32 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 1ury h VAL 41 CO 0.00 0.00 0.26 1.23 0.02 0.00 0.00 177.57 179.08 1ury h GLY 42 N -0.24 1.08 1.76 2.17 0.00 -1.29 -0.84 103.07 105.71 1ury h GLY 42 Ca 0.11 -0.59 -0.16 0.00 0.00 0.00 0.00 47.33 46.69 1ury h GLY 42 CO -0.31 0.56 -0.68 -0.39 0.00 0.00 0.00 176.54 175.72 1ury h VAL 43 N 0.95 1.41 -0.36 4.60 -1.51 -1.50 -2.60 116.25 117.25 1ury h VAL 43 Ca 0.22 -2.15 -0.01 0.00 -1.23 0.00 0.00 66.70 63.53 1ury h VAL 43 Cb 0.22 2.12 -0.02 0.00 -2.13 0.00 0.00 31.29 31.48 1ury h VAL 43 CO -0.02 0.63 0.18 0.00 -1.23 0.00 0.00 177.57 177.13 1ury h ALA 44 N 1.13 0.46 -0.41 5.19 0.00 -0.81 0.19 119.26 125.02 1ury h ALA 44 Ca -0.02 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.87 1ury h ALA 44 Cb 1.22 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 1ury h ALA 44 CO 0.10 0.02 0.00 0.82 0.00 0.00 0.00 179.25 180.19 1ury h ILE 45 N 0.44 0.69 -0.07 0.00 2.04 -1.19 -0.61 117.51 118.82 1ury h ILE 45 Ca 0.12 -0.04 -0.23 0.00 1.00 0.00 0.00 64.86 65.72 1ury h ILE 45 Cb 0.11 0.58 0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1ury h ILE 45 CO -0.02 0.02 -0.87 -0.07 0.00 0.00 0.00 178.15 177.22 1ury h LEU 46 N 0.11 0.74 -0.10 1.44 3.38 -1.02 -0.94 115.31 118.92 1ury h LEU 46 Ca 0.20 -0.53 0.02 0.00 0.09 0.00 0.00 57.88 57.66 1ury h LEU 46 Cb 0.28 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1ury h LEU 46 CO -0.33 1.32 -0.03 0.58 0.09 0.00 0.00 178.44 180.07 1ury h VAL 47 N 0.38 0.89 -0.73 1.22 2.07 -0.57 0.16 116.25 119.65 1ury h VAL 47 Ca -0.07 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 1ury h VAL 47 Cb 1.49 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 32.10 1ury h VAL 47 CO 0.16 0.00 0.45 -0.09 0.02 0.00 0.00 177.57 178.12 1ury h ARG 48 N -0.01 0.84 -0.08 1.57 2.43 -1.01 0.32 114.38 118.44 1ury h ARG 48 Ca 0.05 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1ury h ARG 48 Cb 0.09 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 1ury h ARG 48 CO -0.11 0.56 -0.02 0.35 -1.51 0.00 0.00 179.97 179.24 1ury h PHE 49 N 0.87 -0.04 0.00 2.20 3.57 -0.83 -1.70 116.94 121.01 1ury h PHE 49 Ca 0.30 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.71 1ury h PHE 49 Cb 0.07 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 1ury h PHE 49 CO -0.04 -0.03 -0.49 0.74 -2.23 0.00 0.00 178.31 176.26 1ury h PHE 50 N 0.00 0.00 -0.23 0.41 0.04 -0.28 -0.27 116.94 116.61 1ury h PHE 50 Ca 0.04 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.69 1ury h PHE 50 Cb 0.06 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1ury h PHE 50 CO -0.13 0.49 -0.31 0.28 -0.60 0.00 0.00 178.31 178.04 1ury h VAL 51 N 0.00 1.32 0.00 -0.55 2.07 -0.19 -3.02 116.25 115.88 1ury h VAL 51 Ca -0.00 -1.50 0.00 0.00 0.82 0.00 0.00 66.70 66.02 1ury h VAL 51 Cb 1.15 1.73 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 1ury h VAL 51 CO 0.06 0.47 -0.65 0.59 0.02 0.00 0.00 177.57 178.06 1ury n ASN 52 N -4.30 0.61 -3.30 0.57 3.02 -0.66 -4.21 115.26 106.99 1ury n ASN 52 Ca -0.05 -0.08 -0.25 0.00 -0.03 0.00 0.00 54.58 54.16 1ury n ASN 52 Cb 0.48 0.32 -0.08 0.00 -0.61 0.00 0.00 39.78 39.88 1ury n ASN 52 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1ury n PHE 53 N -1.85 -0.06 0.25 3.10 3.72 -0.12 -4.98 117.46 117.52 1ury n PHE 53 Ca 0.04 -3.56 0.12 0.00 -0.05 0.00 0.00 57.45 54.00 1ury n PHE 53 Cb 0.40 -0.19 0.75 0.00 -0.94 0.00 0.00 39.48 39.50 1ury n PHE 53 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1ury h PRO 54 N 4.57 0.00 -0.97 -1.08 0.13 -1.70 -1.62 132.00 131.33 1ury h PRO 54 Ca 0.14 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 65.50 1ury h PRO 54 Cb 0.87 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.91 1ury h PRO 54 CO 0.47 0.00 0.63 0.66 -0.23 0.00 0.00 178.00 179.53 1ury h SER 55 N 0.00 0.51 0.36 1.44 4.64 -1.94 -2.22 113.55 116.34 1ury h SER 55 Ca 0.03 0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 1ury h SER 55 Cb 0.12 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1ury h SER 55 CO -0.00 0.17 -0.04 0.00 -0.87 0.00 0.00 176.83 176.09 1ury h ALA 56 N 1.62 1.14 0.00 5.18 0.00 -1.65 -2.18 119.26 123.37 1ury h ALA 56 Ca 0.53 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1ury h ALA 56 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1ury h ALA 56 CO -0.26 0.05 0.00 0.36 0.00 0.00 0.00 179.25 179.40 1ury n LYS 57 N -3.33 0.55 0.30 0.00 2.85 -0.83 -3.63 118.16 114.07 1ury n LYS 57 Ca -0.02 0.02 0.16 0.00 -1.05 0.00 0.00 58.31 57.42 1ury n LYS 57 Cb 0.18 -1.50 0.92 0.00 -0.65 0.00 0.00 35.03 33.98 1ury n LYS 57 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 177.40 176.79 1ury h GLN 58 N 0.00 0.00 -0.00 -1.58 3.07 -1.56 -2.51 115.11 112.52 1ury h GLN 58 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1ury h GLN 58 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.73 1ury h GLN 58 CO 0.00 0.03 -0.15 0.66 0.09 0.00 0.00 178.83 179.46 1ury n TYR 59 N -3.61 0.00 -3.94 0.06 4.02 -1.24 -4.75 117.16 107.71 1ury n TYR 59 Ca -0.03 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.53 1ury n TYR 59 Cb 0.13 -0.18 -0.14 0.00 -0.02 0.00 0.00 39.34 39.13 1ury n TYR 59 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1ury s PHE 60 N -2.50 3.51 0.31 -0.72 0.08 -0.95 -5.00 117.98 112.72 1ury s PHE 60 Ca 0.27 -2.46 0.07 0.00 0.12 0.00 0.00 56.93 54.94 1ury s PHE 60 Cb 0.20 -2.64 0.80 0.00 -0.57 0.00 0.00 43.02 40.81 1ury s PHE 60 CO 0.49 -0.91 1.76 0.66 -0.10 0.00 0.00 175.22 177.12 1ury h SER 61 N 7.85 0.75 1.90 1.36 4.64 -1.85 -0.69 113.55 127.50 1ury h SER 61 Ca -0.13 0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1ury h SER 61 Cb 1.04 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1ury h SER 61 CO 0.56 0.22 -0.10 1.56 -0.87 0.00 0.00 176.83 178.19 1ury h GLN 62 N 0.70 0.00 0.00 4.77 1.08 -1.95 -3.36 115.11 116.35 1ury h GLN 62 Ca 0.60 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.80 1ury h GLN 62 Cb 1.02 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.44 1ury h GLN 62 CO -0.41 0.07 -0.44 1.97 -0.95 0.00 0.00 178.83 179.06 1ury n PHE 63 N -3.10 0.00 0.19 2.96 -1.74 -1.04 -4.86 117.46 109.88 1ury n PHE 63 Ca 0.04 -0.17 0.17 0.00 -0.56 0.00 0.00 57.45 56.92 1ury n PHE 63 Cb 0.56 -0.07 0.80 0.00 1.52 0.00 0.00 39.48 42.29 1ury n PHE 63 CO 0.00 0.00 0.00 1.57 -0.56 0.00 0.00 176.76 177.77 1ury h LYS 64 N 0.04 0.00 -0.37 3.97 2.10 -1.26 -1.59 116.57 119.46 1ury h LYS 64 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1ury h LYS 64 Cb 1.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 1ury h LYS 64 CO 0.00 0.00 0.00 0.72 -2.00 0.00 0.00 179.45 178.17 1ury n HIS 65 N -3.93 0.49 -2.57 0.07 8.25 -1.26 -4.75 115.22 111.53 1ury n HIS 65 Ca 0.02 -0.50 -0.41 0.00 -0.26 0.00 0.00 57.72 56.57 1ury n HIS 65 Cb 0.33 -0.03 -0.04 0.00 1.12 0.00 0.00 29.99 31.37 1ury n HIS 65 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 1ury s MET 66 N -1.00 4.64 -0.02 -0.41 1.75 -0.60 -4.93 119.30 118.72 1ury s MET 66 Ca 0.25 1.66 0.00 0.00 -1.25 0.00 0.00 55.69 56.35 1ury s MET 66 Cb 0.13 -3.29 -0.02 0.00 2.84 0.00 0.00 34.83 34.50 1ury s MET 66 CO 0.17 0.15 -0.02 0.39 -0.65 0.00 0.00 175.02 175.06 1ury n GLU 67 N 2.26 0.06 -1.64 4.11 1.02 -1.26 -5.01 120.64 120.18 1ury n GLU 67 Ca 0.02 0.01 -0.42 0.00 -0.02 0.00 0.00 57.16 56.75 1ury n GLU 67 Cb 0.47 -1.04 -0.03 0.00 -0.02 0.00 0.00 31.44 30.82 1ury n GLU 67 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1ury s ASP 68 N -4.26 5.95 0.51 1.62 2.15 -1.26 -4.89 116.67 116.48 1ury s ASP 68 Ca -0.03 2.29 0.20 0.00 0.43 0.00 0.00 52.55 55.44 1ury s ASP 68 Cb 0.01 -2.52 1.29 0.00 -0.30 0.00 0.00 42.92 41.40 1ury s ASP 68 CO 0.06 -1.51 2.04 1.55 -0.17 0.00 0.00 175.17 177.13 1ury h PRO 69 N 12.84 0.08 -0.05 4.34 0.13 -1.97 -1.88 132.00 145.50 1ury h PRO 69 Ca -0.45 -0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.53 1ury h PRO 69 Cb 1.24 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1ury h PRO 69 CO 0.95 0.05 -0.60 -0.07 -0.23 0.00 0.00 178.00 178.10 1ury h LEU 70 N 0.08 0.20 0.08 1.56 3.38 -2.00 -2.06 115.31 116.55 1ury h LEU 70 Ca 0.19 -0.11 -0.29 0.00 0.09 0.00 0.00 57.88 57.75 1ury h LEU 70 Cb 0.64 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 41.35 1ury h LEU 70 CO -0.02 0.75 -1.21 -0.08 0.09 0.00 0.00 178.44 177.98 1ury h GLU 71 N 0.13 0.56 -0.85 1.13 4.57 -1.90 -3.28 114.58 114.94 1ury h GLU 71 Ca -0.01 -0.75 0.02 0.00 -1.18 0.00 0.00 59.36 57.45 1ury h GLU 71 Cb 1.10 0.25 -0.05 0.00 -0.16 0.00 0.00 28.75 29.88 1ury h GLU 71 CO 0.09 1.33 0.55 0.52 -1.18 0.00 0.00 179.01 180.32 1ury h MET 72 N 0.25 1.06 0.00 1.92 2.86 -1.18 -2.10 114.93 117.73 1ury h MET 72 Ca -0.17 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.37 1ury h MET 72 Cb 1.88 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 33.30 1ury h MET 72 CO 0.23 0.70 -0.18 1.49 1.06 0.00 0.00 176.91 180.20 1ury h GLU 73 N 1.09 0.00 -0.02 1.72 4.81 -1.48 -2.55 114.58 118.15 1ury h GLU 73 Ca 0.33 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 1ury h GLU 73 Cb -0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1ury h GLU 73 CO -0.10 0.18 -0.10 0.54 -0.73 0.00 0.00 179.01 178.80 1ury n ARG 74 N -3.89 1.55 -2.68 1.92 1.74 -0.83 -4.90 116.66 109.57 1ury n ARG 74 Ca -0.02 -1.03 -0.43 0.00 -0.77 0.00 0.00 57.85 55.61 1ury n ARG 74 Cb 0.27 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.21 1ury n ARG 74 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ury s SER 75 N -2.16 7.17 0.24 0.55 0.15 -0.96 -4.96 113.70 113.74 1ury s SER 75 Ca 0.31 1.45 -0.05 0.00 0.70 0.00 0.00 55.95 58.36 1ury s SER 75 Cb 0.20 -2.54 0.37 0.00 -1.71 0.00 0.00 66.02 62.33 1ury s SER 75 CO 0.39 -0.54 1.83 -0.65 1.20 0.00 0.00 173.24 175.47 1ury h PRO 76 N 7.27 0.87 -0.50 5.44 0.11 -1.91 -1.22 132.00 142.06 1ury h PRO 76 Ca -0.26 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.75 1ury h PRO 76 Cb 1.11 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 1ury h PRO 76 CO 0.91 0.58 0.10 0.37 -0.21 0.00 0.00 178.00 179.74 1ury h GLN 77 N 0.90 0.77 0.02 1.05 4.15 -1.96 0.27 115.11 120.31 1ury h GLN 77 Ca 0.39 -0.16 -0.00 0.00 0.77 0.00 0.00 58.65 59.65 1ury h GLN 77 Cb 0.26 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.84 1ury h GLN 77 CO -0.21 0.71 -0.01 1.25 -1.93 0.00 0.00 178.83 178.65 1ury h LEU 78 N 0.74 -0.03 -1.47 -2.39 7.12 -1.83 -1.62 115.31 115.84 1ury h LEU 78 Ca 0.16 -0.21 -0.05 0.00 0.13 0.00 0.00 57.88 57.91 1ury h LEU 78 Cb 0.31 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.43 1ury h LEU 78 CO 0.00 0.20 -0.14 0.03 -0.13 0.00 0.00 178.44 178.40 1ury h ARG 79 N -0.25 0.17 -0.20 1.25 3.08 -0.80 -0.64 114.38 116.99 1ury h ARG 79 Ca -0.00 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 1ury h ARG 79 Cb 0.24 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 1ury h ARG 79 CO 0.01 0.32 -0.28 -0.22 -1.07 0.00 0.00 179.97 178.73 1ury h LYS 80 N 0.17 0.54 -0.58 0.04 3.64 -0.33 -1.90 116.57 118.15 1ury h LYS 80 Ca 0.03 -0.32 -0.04 0.00 -1.27 0.00 0.00 60.65 59.05 1ury h LYS 80 Cb 0.36 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 1ury h LYS 80 CO 0.02 0.91 0.18 1.25 -2.27 0.00 0.00 179.45 179.55 1ury h HIS 81 N 0.21 0.88 -0.46 1.91 2.76 -0.28 -0.79 115.15 119.38 1ury h HIS 81 Ca 0.02 -0.07 -0.04 0.00 -2.20 0.00 0.00 60.37 58.08 1ury h HIS 81 Cb 0.85 -0.26 -0.02 0.00 1.55 0.00 0.00 27.41 29.53 1ury h HIS 81 CO 0.09 0.71 0.12 0.00 -1.30 0.00 0.00 177.93 177.55 1ury h ALA 82 N 1.36 0.61 -0.73 5.26 0.00 -0.94 0.08 119.26 124.90 1ury h ALA 82 Ca 0.19 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1ury h ALA 82 Cb 0.24 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1ury h ALA 82 CO -0.01 0.29 0.21 1.03 0.00 0.00 0.00 179.25 180.77 1ury h SER 83 N 0.62 1.09 -0.22 0.00 0.87 -1.01 -1.30 113.55 113.59 1ury h SER 83 Ca 0.15 -0.22 -0.14 0.00 -1.23 0.00 0.00 61.79 60.35 1ury h SER 83 Cb 0.31 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1ury h SER 83 CO -0.00 1.02 -0.38 0.03 -0.53 0.00 0.00 176.83 176.97 1ury h ARG 84 N 1.10 0.76 -0.19 2.24 -0.00 -0.84 -0.52 114.38 116.94 1ury h ARG 84 Ca 0.23 -0.38 -0.06 0.00 -0.50 0.00 0.00 59.98 59.27 1ury h ARG 84 Cb 0.33 0.01 -0.00 0.00 0.00 0.00 0.00 29.97 30.31 1ury h ARG 84 CO -0.00 1.01 -0.10 0.28 0.00 0.00 0.00 179.97 181.15 1ury h VAL 85 N 0.62 1.31 -0.71 2.04 2.07 -0.85 -2.02 116.25 118.72 1ury h VAL 85 Ca 0.05 -1.17 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1ury h VAL 85 Cb 0.93 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 32.34 1ury h VAL 85 CO 0.08 0.35 0.45 0.24 0.02 0.00 0.00 177.57 178.72 1ury h MET 86 N 0.09 0.94 -0.31 1.57 2.86 -1.21 -1.92 114.93 116.94 1ury h MET 86 Ca 0.04 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1ury h MET 86 Cb 0.59 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1ury h MET 86 CO 0.03 0.63 0.06 0.78 1.06 0.00 0.00 176.91 179.48 1ury h GLY 87 N 0.97 0.55 0.88 8.32 0.00 -0.99 -0.49 103.07 112.32 1ury h GLY 87 Ca 0.26 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 1ury h GLY 87 CO -0.05 0.33 -0.06 0.00 0.00 0.00 0.00 176.54 176.75 1ury h ALA 88 N 0.90 -0.18 -0.02 3.60 0.00 -1.07 -1.86 119.26 120.62 1ury h ALA 88 Ca 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ury h ALA 88 Cb 0.32 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ury h ALA 88 CO 0.00 -0.54 -0.14 -0.07 0.00 0.00 0.00 179.25 178.50 1ury h LEU 89 N -0.30 0.03 -0.27 0.00 3.38 -1.43 -1.09 115.31 115.64 1ury h LEU 89 Ca -0.02 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1ury h LEU 89 Cb 0.24 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1ury h LEU 89 CO 0.03 0.18 0.15 -1.13 0.09 0.00 0.00 178.44 177.76 1ury h ASN 90 N 0.04 0.33 -0.51 -0.43 -1.24 -0.70 0.12 115.58 113.18 1ury h ASN 90 Ca 0.01 -0.07 0.08 0.00 0.71 0.00 0.00 56.30 57.03 1ury h ASN 90 Cb 0.27 -0.08 -0.06 0.00 0.73 0.00 0.00 38.32 39.17 1ury h ASN 90 CO 0.02 0.30 0.15 0.74 -1.29 0.00 0.00 177.43 177.35 1ury h THR 91 N 0.33 0.77 -0.05 -3.57 2.02 -0.64 -0.94 112.91 110.82 1ury h THR 91 Ca 0.09 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1ury h THR 91 Cb 0.04 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1ury h THR 91 CO -0.02 0.06 0.01 0.58 0.37 0.00 0.00 175.52 176.52 1ury h VAL 92 N 0.30 1.20 -0.25 3.16 2.07 -0.83 -2.64 116.25 119.26 1ury h VAL 92 Ca 0.25 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 1ury h VAL 92 Cb 0.31 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1ury h VAL 92 CO -0.29 0.17 0.06 0.58 0.02 0.00 0.00 177.57 178.10 1ury h VAL 93 N -0.14 1.21 0.00 2.57 2.07 -0.57 -2.49 116.25 118.90 1ury h VAL 93 Ca 0.02 -0.70 -0.05 0.00 0.82 0.00 0.00 66.70 66.78 1ury h VAL 93 Cb 0.25 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1ury h VAL 93 CO 0.00 0.23 -0.25 -0.33 0.02 0.00 0.00 177.57 177.23 1ury h GLU 94 N 0.23 0.00 -0.65 1.57 4.39 -1.24 -3.05 114.58 115.84 1ury h GLU 94 Ca 0.08 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.40 1ury h GLU 94 Cb 0.29 0.00 -0.22 0.00 -0.10 0.00 0.00 28.75 28.71 1ury h GLU 94 CO 0.00 0.25 0.14 0.09 -1.16 0.00 0.00 179.01 178.33 1ury n ASN 95 N -3.90 3.83 0.13 1.42 4.13 -0.99 -4.66 115.26 115.21 1ury n ASN 95 Ca -0.02 -3.75 0.11 0.00 1.68 0.00 0.00 54.58 52.60 1ury n ASN 95 Cb 0.33 -0.70 0.50 0.00 -1.54 0.00 0.00 39.78 38.37 1ury n ASN 95 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1ury n LEU 96 N -1.05 0.58 0.10 3.41 4.77 -0.96 -2.10 117.00 121.74 1ury n LEU 96 Ca 0.45 0.68 0.13 0.00 -0.03 0.00 0.00 56.01 57.24 1ury n LEU 96 Cb 1.12 -0.65 0.30 0.00 -2.33 0.00 0.00 43.42 41.86 1ury n LEU 96 CO 0.40 -0.67 0.67 1.12 -1.33 0.00 0.00 177.39 177.59 1ury h HIS 97 N 0.00 0.00 -3.40 -1.77 2.07 -1.88 -3.40 115.15 106.77 1ury h HIS 97 Ca 0.00 0.00 -0.66 0.00 -2.85 0.00 0.00 60.37 56.86 1ury h HIS 97 Cb 0.23 0.00 -0.38 0.00 2.57 0.00 0.00 27.41 29.83 1ury h HIS 97 CO 0.00 0.00 -0.47 0.34 -3.07 0.00 0.00 177.93 174.73 1ury s ASP 98 N -4.53 4.87 0.59 3.10 2.15 -0.89 -4.99 116.67 116.97 1ury s ASP 98 Ca 0.09 -3.14 0.29 0.00 0.43 0.00 0.00 52.55 50.22 1ury s ASP 98 Cb 0.12 -1.74 1.57 0.00 -0.30 0.00 0.00 42.92 42.57 1ury s ASP 98 CO 0.65 -0.26 2.00 -0.65 -0.17 0.00 0.00 175.17 176.74 1ury h PRO 99 N 6.50 0.00 0.00 4.34 0.11 -1.78 -2.41 132.00 138.75 1ury h PRO 99 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ury h PRO 99 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1ury h PRO 99 CO 0.72 0.00 -0.78 -0.44 -0.21 0.00 0.00 178.00 177.29 1ury h ASP 100 N 0.00 0.00 0.47 -2.05 3.32 -1.94 -2.15 116.42 114.07 1ury h ASP 100 Ca 0.14 -0.02 -0.18 0.00 0.02 0.00 0.00 57.03 56.99 1ury h ASP 100 Cb 0.82 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 1ury h ASP 100 CO -0.00 0.01 -0.78 0.50 -1.72 0.00 0.00 179.24 177.25 1ury h LYS 101 N 0.00 0.24 -0.39 3.56 1.63 -1.76 -2.64 116.57 117.22 1ury h LYS 101 Ca 0.00 -0.22 -0.14 0.00 -0.85 0.00 0.00 60.65 59.44 1ury h LYS 101 Cb 0.98 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.65 1ury h LYS 101 CO 0.00 0.90 -0.31 -0.39 -3.45 0.00 0.00 179.45 176.20 1ury h VAL 102 N 0.15 1.28 -0.64 2.00 -1.51 -1.45 -2.37 116.25 113.71 1ury h VAL 102 Ca -0.03 -1.48 -0.00 0.00 -1.23 0.00 0.00 66.70 63.96 1ury h VAL 102 Cb 1.36 1.36 -0.03 0.00 -2.13 0.00 0.00 31.29 31.85 1ury h VAL 102 CO 0.12 0.49 0.39 0.28 -1.23 0.00 0.00 177.57 177.62 1ury h SER 103 N 0.71 0.77 -0.21 4.19 0.02 -1.40 -1.29 113.55 116.33 1ury h SER 103 Ca 0.07 -0.06 -0.19 0.00 -0.84 0.00 0.00 61.79 60.77 1ury h SER 103 Cb 0.90 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1ury h SER 103 CO 0.08 0.60 -0.61 0.77 -1.14 0.00 0.00 176.83 176.53 1ury h SER 104 N 0.87 0.93 -0.60 3.07 4.64 -1.47 -1.23 113.55 119.76 1ury h SER 104 Ca 0.23 -0.53 -0.04 0.00 -0.47 0.00 0.00 61.79 60.99 1ury h SER 104 Cb -0.03 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 61.77 1ury h SER 104 CO -0.04 1.32 0.22 0.58 -0.87 0.00 0.00 176.83 178.04 1ury h VAL 105 N 0.61 1.23 0.00 0.95 2.07 -1.21 -1.90 116.25 118.01 1ury h VAL 105 Ca -0.00 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1ury h VAL 105 Cb 1.22 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1ury h VAL 105 CO 0.13 0.29 0.00 -0.07 0.02 0.00 0.00 177.57 177.94 1ury h LEU 106 N 0.83 0.00 0.18 2.57 3.38 -1.16 -2.54 115.31 118.57 1ury h LEU 106 Ca 0.20 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.82 1ury h LEU 106 Cb 0.23 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.99 1ury h LEU 106 CO -0.01 0.00 -1.71 0.00 0.09 0.00 0.00 178.44 176.80 1ury h ALA 107 N 2.00 0.15 -0.95 1.53 0.00 -1.00 -1.63 119.26 119.36 1ury h ALA 107 Ca 0.00 -1.12 0.04 0.00 0.00 0.00 0.00 54.91 53.83 1ury h ALA 107 Cb 0.80 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 1ury h ALA 107 CO 0.00 1.02 0.62 -0.07 0.00 0.00 0.00 179.25 180.82 1ury h LEU 108 N 0.11 1.01 0.18 0.00 4.07 -1.31 -0.75 115.31 118.61 1ury h LEU 108 Ca -0.33 -0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.62 1ury h LEU 108 Cb 2.10 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 43.62 1ury h LEU 108 CO 0.18 0.68 -0.08 0.58 -1.08 0.00 0.00 178.44 178.72 1ury h VAL 109 N 1.17 0.86 -0.03 1.22 2.07 -1.49 -1.80 116.25 118.25 1ury h VAL 109 Ca 0.39 -1.05 0.03 0.00 0.82 0.00 0.00 66.70 66.89 1ury h VAL 109 Cb 0.05 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.17 1ury h VAL 109 CO -0.14 0.21 -0.46 1.23 0.02 0.00 0.00 177.57 178.43 1ury h GLY 110 N -0.82 -0.87 0.65 2.17 0.00 -1.28 -0.84 103.07 102.08 1ury h GLY 110 Ca -0.02 0.56 0.06 0.00 0.00 0.00 0.00 47.33 47.92 1ury h GLY 110 CO 0.04 -0.24 0.28 0.50 0.00 0.00 0.00 176.54 177.12 1ury h LYS 111 N -0.59 0.51 -0.66 4.80 1.57 -1.21 0.62 116.57 121.60 1ury h LYS 111 Ca 0.04 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1ury h LYS 111 Cb 0.67 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.83 1ury h LYS 111 CO -0.35 0.34 0.41 0.00 -0.57 0.00 0.00 179.45 179.28 1ury h ALA 112 N 1.32 0.86 -0.21 3.86 0.00 -0.96 -0.29 119.26 123.84 1ury h ALA 112 Ca 0.26 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 1ury h ALA 112 Cb 0.20 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ury h ALA 112 CO -0.19 0.19 -0.46 0.45 0.00 0.00 0.00 179.25 179.23 1ury h HIS 113 N 0.82 0.64 0.04 0.00 3.86 -0.17 0.13 115.15 120.48 1ury h HIS 113 Ca 0.26 -0.20 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1ury h HIS 113 Cb -0.00 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.34 1ury h HIS 113 CO -0.04 0.89 -0.02 0.00 0.86 0.00 0.00 177.93 179.62 1ury h ALA 114 N 1.07 -0.06 0.00 2.45 0.00 -0.48 0.19 119.26 122.42 1ury h ALA 114 Ca 0.03 -0.21 -0.26 0.00 0.00 0.00 0.00 54.91 54.47 1ury h ALA 114 Cb 0.97 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 1ury h ALA 114 CO 0.09 -0.33 -1.56 1.28 0.00 0.00 0.00 179.25 178.73 1ury n LEU 115 N -4.92 1.89 -0.09 0.00 4.77 -0.16 -2.34 117.00 116.15 1ury n LEU 115 Ca -0.08 0.42 -0.11 0.00 -0.03 0.00 0.00 56.01 56.20 1ury n LEU 115 Cb 0.22 -0.88 -0.04 0.00 -2.33 0.00 0.00 43.42 40.39 1ury n LEU 115 CO 0.33 0.22 0.75 0.11 -1.33 0.00 0.00 177.39 177.47 1ury h LYS 116 N -1.00 0.48 0.00 3.23 1.57 -0.92 -3.38 116.57 116.56 1ury h LYS 116 Ca -0.39 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 1ury h LYS 116 Cb 1.27 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1ury h LYS 116 CO -0.23 0.66 -1.21 0.72 -0.57 0.00 0.00 179.45 178.82 1ury n HIS 117 N -4.59 0.00 -3.75 -1.35 8.25 -0.92 -5.02 115.22 107.84 1ury n HIS 117 Ca -0.03 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.20 1ury n HIS 117 Cb 0.26 -0.18 0.03 0.00 1.12 0.00 0.00 29.99 31.22 1ury n HIS 117 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1ury n LYS 118 N -1.70 -4.93 -3.47 -0.41 5.02 0.54 -4.95 118.16 108.26 1ury n LYS 118 Ca -0.01 0.61 -0.37 0.00 -2.02 0.00 0.00 58.31 56.52 1ury n LYS 118 Cb 0.28 -5.19 -0.07 0.00 -0.02 0.00 0.00 35.03 30.04 1ury n LYS 118 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ury s VAL 119 N -3.63 5.25 0.26 -0.18 1.01 -0.54 -5.01 120.40 117.57 1ury s VAL 119 Ca 0.10 0.69 -0.30 0.00 0.00 0.00 0.00 61.98 62.47 1ury s VAL 119 Cb -0.05 -3.69 -0.10 0.00 0.00 0.00 0.00 36.38 32.53 1ury s VAL 119 CO 0.82 0.38 1.49 -1.61 0.00 0.00 0.00 175.10 176.19 1ury s GLU 120 N 0.40 4.22 0.55 2.72 2.02 -1.26 -4.67 118.70 122.68 1ury s GLU 120 Ca 0.20 2.40 0.22 0.00 0.02 0.00 0.00 54.97 57.80 1ury s GLU 120 Cb -0.14 -3.08 1.50 0.00 0.10 0.00 0.00 34.13 32.51 1ury s GLU 120 CO 0.06 -0.50 2.19 -1.00 0.02 0.00 0.00 175.26 176.04 1ury h PRO 121 N 5.01 0.00 -0.02 0.39 0.13 -1.98 -2.53 132.00 133.00 1ury h PRO 121 Ca -0.46 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 1ury h PRO 121 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1ury h PRO 121 CO 0.79 0.00 -0.25 -0.24 -0.23 0.00 0.00 178.00 178.07 1ury h VAL 122 N 0.00 1.19 -0.08 1.56 3.04 -2.01 -1.14 116.25 118.81 1ury h VAL 122 Ca 0.01 -0.90 0.02 0.00 -1.01 0.00 0.00 66.70 64.82 1ury h VAL 122 Cb 0.03 1.45 -0.00 0.00 -2.01 0.00 0.00 31.29 30.76 1ury h VAL 122 CO -0.00 0.26 0.09 1.88 -1.01 0.00 0.00 177.57 178.80 1ury h TYR 123 N 0.04 0.00 -0.18 3.17 0.05 -1.83 -0.61 116.97 117.61 1ury h TYR 123 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 1ury h TYR 123 Cb 0.46 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.19 1ury h TYR 123 CO 0.00 0.00 0.09 0.74 -1.05 0.00 0.00 178.16 177.94 1ury h PHE 124 N 0.00 0.25 -0.49 4.88 0.04 -1.39 0.60 116.94 120.82 1ury h PHE 124 Ca 0.04 -0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.89 1ury h PHE 124 Cb 0.23 -0.08 -0.08 0.00 2.20 0.00 0.00 35.95 38.22 1ury h PHE 124 CO 0.00 0.27 0.05 -0.22 -0.60 0.00 0.00 178.31 177.81 1ury h LYS 125 N 0.16 0.17 -0.37 1.51 3.64 -1.22 -1.04 116.57 119.42 1ury h LYS 125 Ca 0.06 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.30 1ury h LYS 125 Cb 0.11 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1ury h LYS 125 CO -0.01 0.11 -0.27 0.82 -2.27 0.00 0.00 179.45 177.83 1ury h ILE 126 N 0.17 1.28 -0.41 2.00 2.04 -1.19 -1.90 117.51 119.51 1ury h ILE 126 Ca 0.25 -1.43 -0.05 0.00 1.00 0.00 0.00 64.86 64.63 1ury h ILE 126 Cb 0.36 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1ury h ILE 126 CO -0.37 0.48 0.06 0.25 0.00 0.00 0.00 178.15 178.57 1ury h LEU 127 N 0.65 0.65 -0.95 1.44 5.85 -0.71 -2.26 115.31 119.98 1ury h LEU 127 Ca 0.07 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.57 1ury h LEU 127 Cb 0.85 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.65 1ury h LEU 127 CO 0.07 0.75 0.62 0.28 -0.34 0.00 0.00 178.44 179.82 1ury h SER 128 N 0.52 1.01 -0.83 1.25 0.02 -1.04 -0.15 113.55 114.33 1ury h SER 128 Ca 0.12 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1ury h SER 128 Cb 0.38 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.66 1ury h SER 128 CO 0.01 0.68 0.39 1.23 -1.14 0.00 0.00 176.83 177.99 1ury h GLY 129 N 1.17 1.29 0.95 -3.77 0.00 -0.93 -1.03 103.07 100.75 1ury h GLY 129 Ca 0.39 -0.65 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 1ury h GLY 129 CO -0.14 0.62 0.15 -2.08 0.00 0.00 0.00 176.54 175.09 1ury h VAL 130 N 1.19 1.22 -0.26 4.60 2.07 -0.82 -2.15 116.25 122.11 1ury h VAL 130 Ca 0.28 -0.72 0.04 0.00 0.82 0.00 0.00 66.70 67.13 1ury h VAL 130 Cb 0.14 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 1ury h VAL 130 CO -0.03 0.26 -0.01 0.40 0.02 0.00 0.00 177.57 178.21 1ury h ILE 131 N 0.58 0.81 -0.48 4.57 2.04 -0.68 -1.21 117.51 123.14 1ury h ILE 131 Ca 0.15 -0.02 -0.04 0.00 1.00 0.00 0.00 64.86 65.94 1ury h ILE 131 Cb 0.25 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1ury h ILE 131 CO -0.01 0.01 0.13 0.25 0.00 0.00 0.00 178.15 178.53 1ury h LEU 132 N 0.07 0.66 -0.53 1.44 7.12 -1.09 -0.22 115.31 122.76 1ury h LEU 132 Ca 0.12 -0.10 -0.14 0.00 0.13 0.00 0.00 57.88 57.89 1ury h LEU 132 Cb 0.16 -0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.11 1ury h LEU 132 CO -0.21 0.64 -0.32 -0.08 -0.13 0.00 0.00 178.44 178.34 1ury h GLU 133 N 0.69 0.84 -0.25 1.25 4.57 -0.84 -1.25 114.58 119.59 1ury h GLU 133 Ca 0.16 -0.40 -0.16 0.00 -1.18 0.00 0.00 59.36 57.77 1ury h GLU 133 Cb 0.24 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1ury h GLU 133 CO -0.00 1.04 -0.48 0.28 -1.18 0.00 0.00 179.01 178.66 1ury h VAL 134 N 0.71 1.29 -0.64 0.32 2.07 -0.69 -1.23 116.25 118.09 1ury h VAL 134 Ca 0.07 -1.68 -0.04 0.00 0.82 0.00 0.00 66.70 65.88 1ury h VAL 134 Cb 0.88 1.72 -0.03 0.00 -1.52 0.00 0.00 31.29 32.34 1ury h VAL 134 CO 0.08 0.54 0.25 0.58 0.02 0.00 0.00 177.57 179.04 1ury h VAL 135 N 0.52 1.22 -0.60 2.57 2.07 -1.06 -0.73 116.25 120.24 1ury h VAL 135 Ca 0.01 -0.70 -0.07 0.00 0.82 0.00 0.00 66.70 66.76 1ury h VAL 135 Cb 1.09 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1ury h VAL 135 CO 0.11 0.28 0.11 0.00 0.02 0.00 0.00 177.57 178.09 1ury h ALA 136 N 1.36 0.79 -0.14 1.67 0.00 -1.07 -0.93 119.26 120.94 1ury h ALA 136 Ca 0.22 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ury h ALA 136 Cb 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1ury h ALA 136 CO -0.02 0.53 0.06 0.93 0.00 0.00 0.00 179.25 180.75 1ury h GLU 137 N 0.88 0.21 -0.29 0.00 5.08 -0.96 -1.51 114.58 117.99 1ury h GLU 137 Ca 0.18 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.41 1ury h GLU 137 Cb 0.40 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1ury h GLU 137 CO 0.01 0.30 -0.22 0.93 -1.00 0.00 0.00 179.01 179.03 1ury h GLU 138 N 0.07 0.54 -0.66 2.33 4.39 -1.02 -3.13 114.58 117.09 1ury h GLU 138 Ca 0.05 -0.19 -0.47 0.00 0.34 0.00 0.00 59.36 59.09 1ury h GLU 138 Cb 0.17 -0.04 -0.32 0.00 -0.10 0.00 0.00 28.75 28.45 1ury h GLU 138 CO -0.00 0.72 -0.43 1.19 -1.16 0.00 0.00 179.01 179.33 1ury n PHE 139 N -4.14 2.34 0.01 4.33 3.72 -0.37 -4.81 117.46 118.54 1ury n PHE 139 Ca -0.00 -2.20 0.21 0.00 -0.05 0.00 0.00 57.45 55.41 1ury n PHE 139 Cb 0.39 -0.53 0.71 0.00 -0.94 0.00 0.00 39.48 39.11 1ury n PHE 139 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ury h ALA 140 N 1.88 2.46 -0.50 4.37 0.00 -1.21 0.46 119.26 126.71 1ury h ALA 140 Ca 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1ury h ALA 140 Cb 1.39 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1ury h ALA 140 CO 0.77 -0.67 0.00 0.43 0.00 0.00 0.00 179.25 179.77 1ury n SER 141 N -4.27 2.99 -2.75 0.00 7.64 -1.26 -4.06 113.62 111.91 1ury n SER 141 Ca 0.10 -2.09 -0.02 0.00 1.01 0.00 0.00 58.87 57.86 1ury n SER 141 Cb 0.62 -0.39 0.09 0.00 -1.01 0.00 0.00 64.21 63.52 1ury n SER 141 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1ury n ASP 142 N 0.93 0.09 -2.73 6.43 -0.08 0.13 -5.00 116.55 116.32 1ury n ASP 142 Ca 0.18 -2.20 -0.25 0.00 -1.51 0.00 0.00 54.79 51.00 1ury n ASP 142 Cb 0.50 0.10 -0.02 0.00 2.34 0.00 0.00 41.12 44.04 1ury n ASP 142 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1ury n PHE 143 N -0.92 3.37 -1.12 -0.67 -0.00 -1.06 -4.99 117.46 112.07 1ury n PHE 143 Ca -0.03 -3.51 -0.30 0.00 -0.00 0.00 0.00 57.45 53.60 1ury n PHE 143 Cb 0.84 -0.29 0.13 0.00 -0.00 0.00 0.00 39.48 40.16 1ury n PHE 143 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 1ury s PRO 144 N -3.43 1.40 0.27 -7.13 0.04 -1.26 -4.54 135.00 120.35 1ury s PRO 144 Ca 0.47 1.01 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 1ury s PRO 144 Cb 0.35 -1.81 0.57 0.00 0.04 0.00 0.00 34.50 33.65 1ury s PRO 144 CO -0.15 -2.20 1.62 -1.35 0.04 0.00 0.00 177.00 174.97 1ury h PRO 145 N -1.53 0.10 -0.88 0.56 0.11 -1.99 0.47 132.00 128.85 1ury h PRO 145 Ca -0.48 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.72 1ury h PRO 145 Cb 1.27 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.28 1ury h PRO 145 CO 0.52 0.07 0.52 1.49 -0.21 0.00 0.00 178.00 180.39 1ury h GLU 146 N 0.11 0.85 -0.24 1.05 4.81 -2.00 0.17 114.58 119.34 1ury h GLU 146 Ca 0.49 -0.05 -0.19 0.00 -0.13 0.00 0.00 59.36 59.48 1ury h GLU 146 Cb 0.92 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.12 1ury h GLU 146 CO -0.73 0.56 -0.58 1.15 -0.73 0.00 0.00 179.01 178.69 1ury h THR 147 N 0.88 1.29 -0.88 0.32 2.02 -1.26 -2.04 112.91 113.23 1ury h THR 147 Ca 0.42 -1.77 0.13 0.00 0.77 0.00 0.00 66.41 65.96 1ury h THR 147 Cb 0.37 1.77 -0.09 0.00 -1.74 0.00 0.00 68.15 68.46 1ury h THR 147 CO -0.24 0.57 0.50 1.56 0.37 0.00 0.00 175.52 178.28 1ury h GLN 148 N 0.56 0.72 -0.29 6.66 4.20 -0.70 -2.45 115.11 123.81 1ury h GLN 148 Ca -0.01 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 1ury h GLN 148 Cb 1.19 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.80 1ury h GLN 148 CO 0.13 0.48 -0.05 0.00 -0.67 0.00 0.00 178.83 178.72 1ury h ARG 149 N 0.75 0.54 -0.30 1.46 3.08 -0.66 -1.18 114.38 118.06 1ury h ARG 149 Ca 0.46 -0.20 0.06 0.00 0.07 0.00 0.00 59.98 60.37 1ury h ARG 149 Cb 0.57 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.53 1ury h ARG 149 CO -0.32 0.73 -0.04 0.00 -1.07 0.00 0.00 179.97 179.27 1ury h ALA 150 N 0.80 0.23 -0.67 0.04 0.00 -1.20 -0.65 119.26 117.80 1ury h ALA 150 Ca 0.08 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1ury h ALA 150 Cb 0.51 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1ury h ALA 150 CO 0.02 -0.44 0.11 -1.49 0.00 0.00 0.00 179.25 177.45 1ury h TRP 151 N 0.04 1.17 -0.69 0.00 4.06 -1.42 -1.71 115.95 117.40 1ury h TRP 151 Ca 0.14 -0.16 -0.02 0.00 2.06 0.00 0.00 58.89 60.91 1ury h TRP 151 Cb 0.21 -0.32 -0.03 0.00 -1.00 0.00 0.00 29.16 28.01 1ury h TRP 151 CO -0.26 0.98 0.35 0.00 -3.56 0.00 0.00 178.44 175.95 1ury h ALA 152 N 1.08 0.88 -0.32 1.49 0.00 -0.50 -0.69 119.26 121.21 1ury h ALA 152 Ca 0.20 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1ury h ALA 152 Cb 0.44 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ury h ALA 152 CO 0.01 0.43 -0.23 0.87 0.00 0.00 0.00 179.25 180.33 1ury h LYS 153 N 0.95 0.62 -0.18 0.00 1.57 -1.05 -0.52 116.57 117.96 1ury h LYS 153 Ca 0.24 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1ury h LYS 153 Cb 0.09 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1ury h LYS 153 CO -0.03 0.80 0.05 1.25 -0.57 0.00 0.00 179.45 180.95 1ury h LEU 154 N 0.54 0.27 -0.43 2.94 5.85 -0.88 -0.76 115.31 122.83 1ury h LEU 154 Ca 0.08 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.63 1ury h LEU 154 Cb 0.69 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.61 1ury h LEU 154 CO 0.05 0.41 0.21 -0.09 -0.34 0.00 0.00 178.44 178.68 1ury h ARG 155 N 0.12 0.40 -0.51 1.25 1.12 -0.95 -1.21 114.38 114.60 1ury h ARG 155 Ca 0.06 -0.02 -0.07 0.00 -1.11 0.00 0.00 59.98 58.83 1ury h ARG 155 Cb 0.24 -0.09 -0.02 0.00 -0.01 0.00 0.00 29.97 30.09 1ury h ARG 155 CO -0.00 0.27 0.03 0.78 -3.11 0.00 0.00 179.97 177.93 1ury h GLY 156 N 0.41 0.89 1.00 2.80 0.00 -0.95 -2.47 103.07 104.77 1ury h GLY 156 Ca 0.19 -0.59 -0.09 0.00 0.00 0.00 0.00 47.33 46.84 1ury h GLY 156 CO -0.14 0.54 -0.07 -2.00 0.00 0.00 0.00 176.54 174.87 1ury h LEU 157 N 0.78 0.83 -0.59 3.11 6.46 -0.88 -1.91 115.31 123.12 1ury h LEU 157 Ca 0.15 -0.35 0.07 0.00 -0.12 0.00 0.00 57.88 57.64 1ury h LEU 157 Cb 0.43 -0.23 -0.06 0.00 -0.73 0.00 0.00 40.66 40.08 1ury h LEU 157 CO 0.02 0.99 0.28 0.40 -0.62 0.00 0.00 178.44 179.50 1ury h ILE 158 N 0.67 0.89 -0.26 4.05 2.04 -1.07 -2.52 117.51 121.31 1ury h ILE 158 Ca 0.12 -0.17 -0.17 0.00 1.00 0.00 0.00 64.86 65.63 1ury h ILE 158 Cb 0.60 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1ury h ILE 158 CO 0.04 0.09 -0.52 0.22 0.00 0.00 0.00 178.15 177.98 1ury h TYR 159 N 0.51 0.92 0.44 1.37 3.20 -1.28 -2.01 116.97 120.13 1ury h TYR 159 Ca 0.28 -0.32 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 1ury h TYR 159 Cb 0.25 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 1ury h TYR 159 CO -0.12 1.10 -0.36 0.77 -1.64 0.00 0.00 178.16 177.91 1ury h SER 160 N 0.58 -0.94 -0.28 -2.11 0.02 -1.19 0.40 113.55 110.02 1ury h SER 160 Ca 0.02 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 61.00 1ury h SER 160 Cb 1.09 0.30 -0.02 0.00 0.14 0.00 0.00 62.40 63.91 1ury h SER 160 CO 0.11 -0.52 0.04 0.45 -1.14 0.00 0.00 176.83 175.77 1ury h HIS 161 N -0.80 0.59 -0.07 3.45 3.86 -1.44 0.51 115.15 121.24 1ury h HIS 161 Ca -0.04 -0.05 -0.24 0.00 -1.16 0.00 0.00 60.37 58.88 1ury h HIS 161 Cb 0.69 -0.17 0.01 0.00 1.06 0.00 0.00 27.41 29.00 1ury h HIS 161 CO -0.16 0.54 -0.90 0.28 0.86 0.00 0.00 177.93 178.55 1ury h VAL 162 N 0.55 1.30 -0.10 2.45 2.07 -1.33 -1.92 116.25 119.27 1ury h VAL 162 Ca 0.12 -2.16 -0.00 0.00 0.82 0.00 0.00 66.70 65.49 1ury h VAL 162 Cb 0.29 2.20 -0.00 0.00 -1.52 0.00 0.00 31.29 32.26 1ury h VAL 162 CO 0.00 0.67 0.05 0.74 0.02 0.00 0.00 177.57 179.06 1ury h THR 163 N 0.42 1.08 -0.98 2.57 2.02 -0.46 -2.22 112.91 115.34 1ury h THR 163 Ca -0.09 -0.23 0.07 0.00 0.77 0.00 0.00 66.41 66.93 1ury h THR 163 Cb 1.54 1.06 -0.07 0.00 -1.74 0.00 0.00 68.15 68.94 1ury h THR 163 CO 0.18 0.07 0.63 0.00 0.37 0.00 0.00 175.52 176.77 1ury h ALA 164 N 0.96 1.45 -0.59 6.16 0.00 0.09 -1.27 119.26 126.06 1ury h ALA 164 Ca 0.03 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1ury h ALA 164 Cb 0.07 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ury h ALA 164 CO -0.01 0.40 0.02 0.00 0.00 0.00 0.00 179.25 179.66 1ury h ALA 165 N 1.48 0.91 -0.61 0.00 0.00 -1.26 -1.07 119.26 118.71 1ury h ALA 165 Ca 0.42 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ury h ALA 165 Cb 0.20 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1ury h ALA 165 CO -0.17 0.65 0.40 1.88 0.00 0.00 0.00 179.25 182.01 1ury h TYR 166 N 0.94 0.77 -0.20 0.00 0.05 -0.62 -2.86 116.97 115.05 1ury h TYR 166 Ca 0.17 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.96 1ury h TYR 166 Cb 0.52 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.99 1ury h TYR 166 CO 0.03 0.49 0.09 0.87 -1.05 0.00 0.00 178.16 178.60 1ury h LYS 167 N 0.83 0.29 -0.10 4.88 1.57 -1.09 -1.61 116.57 121.33 1ury h LYS 167 Ca 0.22 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.99 1ury h LYS 167 Cb -0.09 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 1ury h LYS 167 CO -0.05 0.32 0.20 1.49 -0.57 0.00 0.00 179.45 180.85 1ury h GLU 168 N 0.19 0.00 -0.00 3.15 4.81 -1.12 -2.18 114.58 119.43 1ury h GLU 168 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1ury h GLU 168 Cb 0.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1ury h GLU 168 CO -0.01 0.00 -0.74 1.55 -0.73 0.00 0.00 179.01 179.08 1ury n VAL 169 N -3.39 0.00 0.00 0.32 3.14 -1.09 -5.00 118.33 112.31 1ury n VAL 169 Ca -0.00 -0.13 0.00 0.00 -2.96 0.00 0.00 64.34 61.25 1ury n VAL 169 Cb 0.30 1.04 0.00 0.00 -1.06 0.00 0.00 33.84 34.11 1ury n VAL 169 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ury n GLY 170 N 1.38 1.17 0.00 7.55 0.00 -0.82 -5.09 105.19 109.39 1ury n GLY 170 Ca 0.04 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.15 1ury n GLY 170 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19