#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aou n ILE 2 N 0.00 0.00 -0.31 2.46 -5.35 -1.26 -4.70 119.36 110.20 1aou n ILE 2 Ca 0.00 0.00 0.09 0.00 -0.27 0.00 0.00 62.75 62.57 1aou n ILE 2 Cb 0.00 0.00 0.20 0.00 -1.74 0.00 0.00 39.64 38.10 1aou n ILE 2 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 1aou h GLN 3 N 0.00 0.04 -1.34 6.28 1.08 -1.99 -3.43 115.11 115.75 1aou h GLN 3 Ca 0.00 -0.00 -0.24 0.00 -1.45 0.00 0.00 58.65 56.96 1aou h GLN 3 Cb 0.00 -0.01 -0.10 0.00 -0.05 0.00 0.00 27.48 27.33 1aou h GLN 3 CO 0.00 0.02 -0.22 0.00 -0.95 0.00 0.00 178.83 177.68 1aou n ALA 4 N -3.18 -0.18 -1.95 3.87 0.00 -1.22 -4.56 120.51 113.28 1aou n ALA 4 Ca 0.18 0.19 -0.05 0.00 0.00 0.00 0.00 53.44 53.75 1aou n ALA 4 Cb 0.58 -1.31 -0.05 0.00 0.00 0.00 0.00 19.45 18.67 1aou n ALA 4 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1aou n GLU 5 N -1.70 0.00 0.16 0.00 1.02 -1.23 -4.80 120.64 114.09 1aou n GLU 5 Ca -0.12 -0.77 0.00 0.00 -0.02 0.00 0.00 57.16 56.25 1aou n GLU 5 Cb 0.40 0.42 0.00 0.00 -0.02 0.00 0.00 31.44 32.24 1aou n GLU 5 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1aou n GLU 6 N 0.00 0.00 0.00 3.49 -0.58 -1.26 -4.96 120.64 117.33 1aou n GLU 6 Ca -0.22 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.52 1aou n GLU 6 Cb 0.63 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.50 1aou n GLU 6 CO 0.00 0.00 0.00 -2.67 -0.48 0.00 0.00 177.13 173.98 1aou n TRP 7 N -3.19 0.00 -3.43 -0.32 4.27 -1.26 -4.68 117.44 108.83 1aou n TRP 7 Ca 0.00 -0.20 -0.18 0.00 -3.89 0.00 0.00 57.50 53.22 1aou n TRP 7 Cb 0.00 -0.02 -0.11 0.00 -1.36 0.00 0.00 31.31 29.82 1aou n TRP 7 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 1aou s TYR 8 N -0.41 -0.36 0.14 -2.67 5.04 -1.26 0.28 117.35 118.10 1aou s TYR 8 Ca 0.00 -0.15 -0.12 0.00 -2.44 0.00 0.00 57.07 54.36 1aou s TYR 8 Cb 0.00 -0.48 -0.04 0.00 0.35 0.00 0.00 41.96 41.79 1aou s TYR 8 CO 0.00 -0.85 1.48 0.74 -1.34 0.00 0.00 175.55 175.58 1aou h PHE 9 N 8.28 1.07 0.00 4.97 -1.00 -1.08 -3.22 116.94 125.96 1aou h PHE 9 Ca -0.15 -0.30 0.00 0.00 2.81 0.00 0.00 57.97 60.33 1aou h PHE 9 Cb 1.08 -0.23 0.00 0.00 3.61 0.00 0.00 35.95 40.41 1aou h PHE 9 CO 0.25 1.11 0.00 0.41 -1.61 0.00 0.00 178.31 178.47 1aou n GLY 10 N 0.07 0.14 2.55 -1.45 0.00 -1.22 -4.88 105.19 100.41 1aou n GLY 10 Ca -0.02 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 1aou n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aou n LYS 11 N 0.00 2.73 -2.60 1.61 5.02 -1.26 -1.39 118.16 122.27 1aou n LYS 11 Ca 0.00 -4.65 -0.12 0.00 -2.02 0.00 0.00 58.31 51.53 1aou n LYS 11 Cb 0.00 -2.30 -0.00 0.00 -0.02 0.00 0.00 35.03 32.71 1aou n LYS 11 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 1aou n LEU 12 N 1.03 0.00 -4.93 -0.35 -0.00 -1.26 -4.78 117.00 106.70 1aou n LEU 12 Ca 0.28 -1.26 -0.27 0.00 -0.00 0.00 0.00 56.01 54.76 1aou n LEU 12 Cb 0.39 0.01 -0.03 0.00 -0.00 0.00 0.00 43.42 43.79 1aou n LEU 12 CO 0.44 -0.37 -0.11 -0.83 -0.00 0.00 0.00 177.39 176.51 1aou s GLY 13 N -2.62 1.82 0.63 1.47 0.00 -1.26 -4.28 107.32 103.08 1aou s GLY 13 Ca 0.11 -0.99 0.36 0.00 0.00 0.00 0.00 44.72 44.21 1aou s GLY 13 CO 0.07 -0.99 2.28 0.07 0.00 0.00 0.00 173.10 174.54 1aou h ARG 14 N 2.38 0.00 -0.01 2.90 -0.00 -1.94 0.17 114.38 117.88 1aou h ARG 14 Ca -0.48 0.00 -0.17 0.00 -0.00 0.00 0.00 59.98 59.34 1aou h ARG 14 Cb 1.19 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 31.14 1aou h ARG 14 CO 0.70 0.00 -0.77 -0.22 -0.00 0.00 0.00 179.97 179.68 1aou h LYS 15 N 0.00 0.08 0.00 0.08 3.64 -2.00 -2.55 116.57 115.82 1aou h LYS 15 Ca 0.01 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 1aou h LYS 15 Cb 0.08 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1aou h LYS 15 CO -0.00 0.81 -0.19 0.22 -2.27 0.00 0.00 179.45 178.02 1aou h ASP 16 N 0.05 0.00 0.23 4.20 3.58 -1.06 -2.58 116.42 120.84 1aou h ASP 16 Ca -0.02 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.18 1aou h ASP 16 Cb 1.35 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.42 1aou h ASP 16 CO 0.11 0.19 -1.04 0.00 -2.88 0.00 0.00 179.24 175.62 1aou h ALA 17 N 1.81 0.22 0.00 -0.78 0.00 -1.04 0.67 119.26 120.14 1aou h ALA 17 Ca -0.00 -0.73 -0.10 0.00 0.00 0.00 0.00 54.91 54.08 1aou h ALA 17 Cb 0.85 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1aou h ALA 17 CO 0.02 0.77 -0.47 1.05 0.00 0.00 0.00 179.25 180.62 1aou h GLU 18 N 0.27 0.00 0.00 0.00 4.11 -1.31 0.01 114.58 117.66 1aou h GLU 18 Ca -0.11 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.10 1aou h GLU 18 Cb 1.69 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.91 1aou h GLU 18 CO 0.19 0.47 -1.26 0.00 0.07 0.00 0.00 179.01 178.48 1aou h ARG 19 N 0.00 0.00 0.00 1.06 2.47 -1.39 -2.77 114.38 113.75 1aou h ARG 19 Ca -0.00 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.69 1aou h ARG 19 Cb 0.90 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.21 1aou h ARG 19 CO 0.06 0.59 -0.65 1.96 0.56 0.00 0.00 179.97 182.48 1aou h GLN 20 N 0.00 0.00 0.01 0.04 1.08 -0.69 -2.04 115.11 113.51 1aou h GLN 20 Ca -0.14 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 56.90 1aou h GLN 20 Cb 1.75 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 29.16 1aou h GLN 20 CO 0.08 0.06 -0.91 -0.07 -0.95 0.00 0.00 178.83 177.04 1aou h LEU 21 N 0.00 0.02 -0.66 1.46 4.07 -1.08 -3.37 115.31 115.74 1aou h LEU 21 Ca -0.01 -0.67 -0.14 0.00 0.08 0.00 0.00 57.88 57.14 1aou h LEU 21 Cb 1.07 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.79 1aou h LEU 21 CO 0.01 1.36 -0.67 -0.07 -1.08 0.00 0.00 178.44 177.99 1aou h LEU 22 N -0.96 0.02 -7.46 1.67 3.38 -1.64 -3.33 115.31 106.99 1aou h LEU 22 Ca -0.25 -0.01 -0.79 0.00 0.09 0.00 0.00 57.88 56.92 1aou h LEU 22 Cb 1.24 -0.01 -0.29 0.00 0.09 0.00 0.00 40.66 41.70 1aou h LEU 22 CO -0.14 0.68 0.46 -0.24 0.09 0.00 0.00 178.44 179.29 1aou n SER 23 N -3.75 5.55 0.00 -0.43 2.88 -0.77 -4.33 113.62 112.77 1aou n SER 23 Ca -0.01 -3.09 0.00 0.00 -1.33 0.00 0.00 58.87 54.43 1aou n SER 23 Cb 0.66 -1.34 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 1aou n SER 23 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1aou n PHE 24 N 2.47 0.00 0.00 0.66 -0.00 -1.26 -4.65 117.46 114.68 1aou n PHE 24 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.69 1aou n PHE 24 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.86 1aou n PHE 24 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1aou n GLY 25 N 0.00 0.94 3.46 7.13 0.00 -1.25 -5.05 105.19 110.40 1aou n GLY 25 Ca 0.00 -0.02 -0.45 0.00 0.00 0.00 0.00 46.02 45.55 1aou n GLY 25 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1aou n ASN 26 N 0.00 0.65 -4.85 1.61 4.13 -1.25 -4.87 115.26 110.68 1aou n ASN 26 Ca 0.00 0.22 -0.29 0.00 1.68 0.00 0.00 54.58 56.19 1aou n ASN 26 Cb 0.00 -0.99 0.09 0.00 -1.54 0.00 0.00 39.78 37.34 1aou n ASN 26 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1aou s PRO 27 N 8.24 1.91 0.76 3.52 0.04 -1.26 -4.70 135.00 143.51 1aou s PRO 27 Ca 1.28 0.30 -0.17 0.00 0.04 0.00 0.00 61.00 62.46 1aou s PRO 27 Cb -1.19 -1.93 -0.11 0.00 0.04 0.00 0.00 34.50 31.32 1aou s PRO 27 CO 0.50 -1.67 -0.13 -2.13 0.04 0.00 0.00 177.00 173.62 1aou n ARG 28 N -3.40 0.07 -0.02 4.56 0.63 -1.26 -3.07 116.66 114.16 1aou n ARG 28 Ca 0.07 0.04 0.00 0.00 -0.92 0.00 0.00 57.85 57.04 1aou n ARG 28 Cb 0.59 -1.29 0.00 0.00 0.45 0.00 0.00 32.46 32.21 1aou n ARG 28 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1aou n GLY 29 N 2.52 0.31 3.89 5.14 0.00 -0.94 -4.93 105.19 111.18 1aou n GLY 29 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1aou n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aou s THR 30 N -2.06 4.90 -0.30 2.61 2.01 -1.17 -3.46 115.64 118.16 1aou s THR 30 Ca 0.00 0.36 -0.02 0.00 0.31 0.00 0.00 61.69 62.34 1aou s THR 30 Cb 0.00 -3.73 0.12 0.00 0.01 0.00 0.00 72.50 68.90 1aou s THR 30 CO 0.00 -0.42 0.22 -0.36 -0.69 0.00 0.00 174.62 173.37 1aou s PHE 31 N -2.22 -0.02 0.46 4.92 0.40 -1.26 -1.42 117.98 118.84 1aou s PHE 31 Ca 0.48 -0.63 -0.04 0.00 -0.60 0.00 0.00 56.93 56.14 1aou s PHE 31 Cb -0.10 -0.69 -0.03 0.00 0.51 0.00 0.00 43.02 42.71 1aou s PHE 31 CO 0.30 -0.88 0.73 -1.17 0.70 0.00 0.00 175.22 174.91 1aou s LEU 32 N 2.09 3.68 0.10 -0.37 0.20 0.24 -3.04 118.68 121.59 1aou s LEU 32 Ca 0.10 0.76 0.04 0.00 0.69 0.00 0.00 54.13 55.72 1aou s LEU 32 Cb -0.16 -3.68 -0.04 0.00 -0.43 0.00 0.00 46.19 41.89 1aou s LEU 32 CO -0.30 -0.56 -0.10 -0.63 -0.29 0.00 0.00 176.35 174.46 1aou s ILE 33 N -2.65 0.96 0.00 6.68 1.01 0.78 0.26 121.20 128.24 1aou s ILE 33 Ca 0.46 -1.67 0.00 0.00 0.00 0.00 0.00 60.65 59.45 1aou s ILE 33 Cb -0.10 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 40.98 1aou s ILE 33 CO 0.42 -0.57 0.00 -2.11 0.00 0.00 0.00 174.94 172.69 1aou n ARG 34 N 0.51 0.00 -1.75 2.79 -4.01 -0.46 -0.46 116.66 113.28 1aou n ARG 34 Ca -0.16 0.00 -0.42 0.00 -1.04 0.00 0.00 57.85 56.24 1aou n ARG 34 Cb 0.58 0.00 -0.01 0.00 -3.04 0.00 0.00 32.46 29.98 1aou n ARG 34 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 1aou n GLU 35 N -0.03 2.71 -0.62 2.89 1.02 -0.49 0.53 120.64 126.65 1aou n GLU 35 Ca 0.00 0.96 -0.17 0.00 -0.02 0.00 0.00 57.16 57.93 1aou n GLU 35 Cb 0.00 -2.75 0.15 0.00 -0.02 0.00 0.00 31.44 28.82 1aou n GLU 35 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1aou n SER 36 N 2.13 -1.61 -0.23 1.62 7.64 -0.38 -4.32 113.62 118.47 1aou n SER 36 Ca 0.08 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 59.07 1aou n SER 36 Cb 0.37 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 1aou n SER 36 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1aou n GLU 37 N -3.43 0.00 -0.03 1.43 1.02 -1.26 -4.52 120.64 113.84 1aou n GLU 37 Ca 0.09 -0.70 -0.19 0.00 -0.02 0.00 0.00 57.16 56.34 1aou n GLU 37 Cb 0.34 -0.48 -0.14 0.00 -0.02 0.00 0.00 31.44 31.15 1aou n GLU 37 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1aou n THR 38 N 0.00 1.69 -3.83 2.62 5.66 -1.26 -4.98 114.28 114.17 1aou n THR 38 Ca 0.00 -0.66 -0.09 0.00 -3.05 0.00 0.00 64.05 60.25 1aou n THR 38 Cb 0.59 -1.54 -0.01 0.00 -1.55 0.00 0.00 70.33 67.82 1aou n THR 38 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1aou n THR 39 N -3.36 0.00 -0.40 1.09 5.66 -1.26 -4.96 114.28 111.05 1aou n THR 39 Ca -0.33 -0.72 0.33 0.00 -3.05 0.00 0.00 64.05 60.28 1aou n THR 39 Cb 1.04 -0.18 0.60 0.00 -1.55 0.00 0.00 70.33 70.24 1aou n THR 39 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 1aou h LYS 40 N 0.00 0.14 0.00 1.09 1.57 -1.96 -3.39 116.57 114.02 1aou h LYS 40 Ca -0.12 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1aou h LYS 40 Cb 0.41 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1aou h LYS 40 CO 0.19 0.09 0.00 0.41 -0.57 0.00 0.00 179.45 179.57 1aou n GLY 41 N -1.46 -1.74 0.00 3.86 0.00 -1.26 -5.03 105.19 99.55 1aou n GLY 41 Ca 0.35 0.70 0.00 0.00 0.00 0.00 0.00 46.02 47.07 1aou n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aou n ALA 42 N 0.00 0.00 -4.43 4.61 0.00 -1.26 -4.74 120.51 114.69 1aou n ALA 42 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1aou n ALA 42 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1aou n ALA 42 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1aou n TYR 43 N -0.00 0.65 -3.65 0.00 4.19 -0.59 -1.25 117.16 116.51 1aou n TYR 43 Ca 0.00 -1.61 -0.08 0.00 3.31 0.00 0.00 57.90 59.52 1aou n TYR 43 Cb 0.00 -0.18 -0.02 0.00 0.49 0.00 0.00 39.34 39.63 1aou n TYR 43 CO 0.00 0.00 0.00 -1.12 0.91 0.00 0.00 176.86 176.65 1aou s SER 44 N -2.76 -0.36 -0.38 2.98 0.01 0.19 -0.48 113.70 112.90 1aou s SER 44 Ca 0.02 -0.30 0.02 0.00 1.31 0.00 0.00 55.95 57.01 1aou s SER 44 Cb 0.00 0.60 0.15 0.00 0.21 0.00 0.00 66.02 66.98 1aou s SER 44 CO 0.01 -1.05 0.31 -0.22 0.41 0.00 0.00 173.24 172.70 1aou s LEU 45 N -2.81 0.79 0.98 2.44 0.20 -0.35 -1.36 118.68 118.57 1aou s LEU 45 Ca 0.07 -2.33 -0.12 0.00 0.69 0.00 0.00 54.13 52.45 1aou s LEU 45 Cb -0.03 -0.12 0.18 0.00 -0.43 0.00 0.00 46.19 45.79 1aou s LEU 45 CO -0.02 -0.24 1.08 -0.55 -0.29 0.00 0.00 176.35 176.33 1aou s SER 46 N 0.81 2.70 -0.24 3.68 0.15 0.74 -1.04 113.70 120.50 1aou s SER 46 Ca 0.23 1.54 -0.10 0.00 0.70 0.00 0.00 55.95 58.32 1aou s SER 46 Cb -0.12 -2.20 0.10 0.00 -1.71 0.00 0.00 66.02 62.08 1aou s SER 46 CO -0.06 -3.13 0.54 0.27 1.20 0.00 0.00 173.24 172.05 1aou s ILE 47 N -2.79 -0.56 0.36 6.45 -4.36 -0.36 0.82 121.20 120.76 1aou s ILE 47 Ca 0.65 0.07 -0.27 0.00 -0.26 0.00 0.00 60.65 60.84 1aou s ILE 47 Cb -0.20 -0.82 -0.09 0.00 1.25 0.00 0.00 42.46 42.59 1aou s ILE 47 CO 0.59 0.03 1.21 -0.60 0.24 0.00 0.00 174.94 176.41 1aou s ARG 48 N 2.35 4.25 -0.36 0.37 3.00 -0.50 -1.47 118.95 126.59 1aou s ARG 48 Ca -0.06 1.98 0.14 0.00 -1.00 0.00 0.00 55.73 56.79 1aou s ARG 48 Cb -0.10 -2.90 0.41 0.00 0.00 0.00 0.00 34.95 32.36 1aou s ARG 48 CO -0.16 -0.20 0.99 -3.47 0.00 0.00 0.00 175.30 172.46 1aou n ASP 49 N 0.51 0.34 -4.50 -2.12 2.03 -0.75 -2.21 116.55 109.86 1aou n ASP 49 Ca 0.02 -2.82 -0.28 0.00 0.52 0.00 0.00 54.79 52.23 1aou n ASP 49 Cb 0.44 -0.05 0.25 0.00 -0.72 0.00 0.00 41.12 41.05 1aou n ASP 49 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 1aou s TRP 50 N -2.05 1.34 0.05 -0.67 -0.00 -1.26 -4.24 118.94 112.12 1aou s TRP 50 Ca 0.29 1.23 -0.14 0.00 -0.00 0.00 0.00 56.10 57.48 1aou s TRP 50 Cb 0.41 -3.11 0.02 0.00 -0.00 0.00 0.00 33.47 30.79 1aou s TRP 50 CO -0.02 -3.86 0.31 0.34 -0.00 0.00 0.00 176.95 173.72 1aou s ASP 51 N -2.50 -0.12 -0.10 5.86 2.15 -0.47 -4.68 116.67 116.81 1aou s ASP 51 Ca 0.68 -0.23 0.01 0.00 0.43 0.00 0.00 52.55 53.44 1aou s ASP 51 Cb -0.25 0.37 0.13 0.00 -0.30 0.00 0.00 42.92 42.87 1aou s ASP 51 CO 0.64 -0.65 1.35 -0.90 -0.17 0.00 0.00 175.17 175.45 1aou n ASP 52 N 0.45 3.70 -2.57 -0.34 5.75 -1.26 -3.28 116.55 118.99 1aou n ASP 52 Ca -0.18 -2.40 -0.02 0.00 -0.01 0.00 0.00 54.79 52.18 1aou n ASP 52 Cb 0.60 -0.68 0.12 0.00 -1.03 0.00 0.00 41.12 40.13 1aou n ASP 52 CO 0.00 0.00 0.00 1.15 -0.11 0.00 0.00 177.20 178.24 1aou n MET 53 N 0.33 1.24 0.00 0.11 0.00 -1.26 -4.96 117.12 112.58 1aou n MET 53 Ca 0.12 -1.13 0.00 0.00 0.00 0.00 0.00 57.70 56.69 1aou n MET 53 Cb 0.70 0.37 0.00 0.00 0.00 0.00 0.00 33.22 34.29 1aou n MET 53 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 1aou n LYS 54 N -1.39 0.00 0.00 3.17 2.85 -1.25 -5.15 118.16 116.39 1aou n LYS 54 Ca -0.16 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.10 1aou n LYS 54 Cb 0.85 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.23 1aou n LYS 54 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1aou n GLY 55 N 0.00 -0.01 3.92 2.58 0.00 -1.21 -4.99 105.19 105.48 1aou n GLY 55 Ca 0.00 -2.27 -0.26 0.00 0.00 0.00 0.00 46.02 43.49 1aou n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aou s ASP 56 N -4.00 5.01 0.12 1.61 1.01 -1.26 -1.36 116.67 117.79 1aou s ASP 56 Ca 0.00 0.55 -0.15 0.00 0.71 0.00 0.00 52.55 53.65 1aou s ASP 56 Cb 0.00 -1.27 0.05 0.00 1.01 0.00 0.00 42.92 42.71 1aou s ASP 56 CO 0.00 -1.48 0.73 1.41 0.21 0.00 0.00 175.17 176.04 1aou n HIS 57 N -2.86 -1.09 -3.53 4.23 8.25 -1.26 -4.82 115.22 114.14 1aou n HIS 57 Ca 0.07 -0.88 -0.17 0.00 -0.26 0.00 0.00 57.72 56.49 1aou n HIS 57 Cb 0.60 0.43 -0.06 0.00 1.12 0.00 0.00 29.99 32.08 1aou n HIS 57 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1aou s VAL 58 N -2.21 0.00 0.17 1.59 0.11 -1.26 -1.81 120.40 117.00 1aou s VAL 58 Ca 0.16 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.23 1aou s VAL 58 Cb -0.02 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.82 1aou s VAL 58 CO 0.04 0.00 0.06 0.29 -3.33 0.00 0.00 175.10 172.16 1aou n LYS 59 N 0.85 0.83 -3.65 1.54 5.02 -0.54 -4.92 118.16 117.28 1aou n LYS 59 Ca -0.18 -1.45 -0.15 0.00 -2.02 0.00 0.00 58.31 54.51 1aou n LYS 59 Cb 0.57 0.77 -0.08 0.00 -0.02 0.00 0.00 35.03 36.27 1aou n LYS 59 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1aou s HIS 60 N -2.16 -0.52 -0.53 2.13 3.76 -1.26 -1.22 115.29 115.48 1aou s HIS 60 Ca 0.08 1.07 -0.06 0.00 -0.15 0.00 0.00 55.06 56.01 1aou s HIS 60 Cb 0.00 0.25 0.14 0.00 1.11 0.00 0.00 32.58 34.08 1aou s HIS 60 CO 0.06 -0.42 0.37 0.71 -0.85 0.00 0.00 174.74 174.61 1aou s TYR 61 N -0.60 3.50 -0.28 1.40 2.02 -0.21 -4.88 117.35 118.29 1aou s TYR 61 Ca -0.07 -2.32 -0.34 0.00 -0.37 0.00 0.00 57.07 53.97 1aou s TYR 61 Cb -0.03 -3.35 -0.11 0.00 -0.40 0.00 0.00 41.96 38.08 1aou s TYR 61 CO 0.05 -0.94 2.13 1.17 -1.57 0.00 0.00 175.55 176.39 1aou n LYS 62 N 4.27 1.39 -2.86 -0.62 3.00 -1.26 -1.22 118.16 120.86 1aou n LYS 62 Ca 0.01 0.41 -0.41 0.00 -0.00 0.00 0.00 58.31 58.32 1aou n LYS 62 Cb 0.40 -2.61 -0.04 0.00 0.00 0.00 0.00 35.03 32.79 1aou n LYS 62 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1aou s ILE 63 N 6.83 4.81 -0.16 3.15 1.09 0.37 -4.75 121.20 132.54 1aou s ILE 63 Ca 1.05 1.80 0.02 0.00 -1.10 0.00 0.00 60.65 62.42 1aou s ILE 63 Cb -0.75 -4.20 0.01 0.00 -1.06 0.00 0.00 42.46 36.46 1aou s ILE 63 CO 0.48 0.26 -0.21 -0.13 -0.10 0.00 0.00 174.94 175.24 1aou s ARG 64 N 0.50 3.02 -0.05 2.79 1.81 -1.05 -1.54 118.95 124.43 1aou s ARG 64 Ca 0.44 -0.84 0.00 0.00 -1.72 0.00 0.00 55.73 53.61 1aou s ARG 64 Cb -0.20 -2.49 -0.03 0.00 -0.45 0.00 0.00 34.95 31.77 1aou s ARG 64 CO 0.25 -0.08 -0.02 0.21 -0.68 0.00 0.00 175.30 174.97 1aou s LYS 65 N 0.99 2.82 0.52 3.54 2.20 -1.26 -2.20 119.74 126.35 1aou s LYS 65 Ca -0.03 -0.53 -0.20 0.00 -0.36 0.00 0.00 55.97 54.85 1aou s LYS 65 Cb -0.15 -2.68 -0.07 0.00 -1.51 0.00 0.00 37.83 33.43 1aou s LYS 65 CO -0.06 0.66 1.13 -0.51 -0.36 0.00 0.00 175.35 176.21 1aou s LEU 66 N -1.12 3.82 0.44 5.43 1.02 -0.11 -4.76 118.68 123.41 1aou s LEU 66 Ca 0.15 2.17 0.29 0.00 0.02 0.00 0.00 54.13 56.77 1aou s LEU 66 Cb -0.11 -4.50 1.14 0.00 0.02 0.00 0.00 46.19 42.73 1aou s LEU 66 CO 0.05 -1.10 1.86 0.44 0.02 0.00 0.00 176.35 177.62 1aou h ASP 67 N 1.44 0.00 0.21 2.29 5.19 -1.98 -0.85 116.42 122.71 1aou h ASP 67 Ca -0.50 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.91 1aou h ASP 67 Cb 1.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.76 1aou h ASP 67 CO 0.58 0.00 -0.27 0.59 -3.12 0.00 0.00 179.24 177.02 1aou n ASN 68 N -2.80 1.13 0.00 6.45 3.02 -1.26 -4.94 115.26 116.86 1aou n ASN 68 Ca 0.02 -0.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.60 1aou n ASN 68 Cb 0.31 0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1aou n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1aou n GLY 69 N 1.34 0.76 2.48 7.41 0.00 -0.33 -5.08 105.19 111.78 1aou n GLY 69 Ca 0.12 -0.65 -0.19 0.00 0.00 0.00 0.00 46.02 45.30 1aou n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aou n GLY 70 N 0.00 1.37 3.67 -0.02 0.00 -0.98 -4.28 105.19 104.95 1aou n GLY 70 Ca 0.00 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 1aou n GLY 70 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1aou s TYR 71 N 0.12 2.81 -0.18 1.61 2.02 0.11 -0.93 117.35 122.90 1aou s TYR 71 Ca 0.32 0.93 -0.10 0.00 -0.37 0.00 0.00 57.07 57.86 1aou s TYR 71 Cb 0.07 -3.55 0.06 0.00 -0.40 0.00 0.00 41.96 38.14 1aou s TYR 71 CO -0.15 -1.95 0.43 1.52 -1.57 0.00 0.00 175.55 173.84 1aou s TYR 72 N 3.22 -0.64 0.15 2.71 -0.85 -0.93 0.17 117.35 121.17 1aou s TYR 72 Ca 0.58 1.36 0.08 0.00 -0.52 0.00 0.00 57.07 58.57 1aou s TYR 72 Cb -0.24 0.30 -0.07 0.00 0.38 0.00 0.00 41.96 42.32 1aou s TYR 72 CO 0.19 -0.36 1.36 0.82 -1.52 0.00 0.00 175.55 176.04 1aou h ILE 73 N 5.51 1.64 -4.20 -3.49 2.04 -1.85 -2.77 117.51 114.40 1aou h ILE 73 Ca -0.36 -3.10 -0.50 0.00 1.00 0.00 0.00 64.86 61.90 1aou h ILE 73 Cb 1.19 2.67 -0.28 0.00 -0.74 0.00 0.00 36.82 39.66 1aou h ILE 73 CO 0.28 0.88 -0.82 0.28 0.00 0.00 0.00 178.15 178.78 1aou s THR 74 N -2.93 1.25 -1.54 -0.27 -1.32 -1.26 -4.78 115.64 104.79 1aou s THR 74 Ca 0.00 -0.79 0.08 0.00 -1.21 0.00 0.00 61.69 59.77 1aou s THR 74 Cb 0.11 -1.06 0.15 0.00 -1.51 0.00 0.00 72.50 70.19 1aou s THR 74 CO 0.81 0.26 1.08 0.35 -2.21 0.00 0.00 174.62 174.90 1aou n THR 75 N 2.44 0.69 0.46 5.08 -2.24 -1.26 -1.78 114.28 117.67 1aou n THR 75 Ca -0.15 0.17 0.13 0.00 -2.27 0.00 0.00 64.05 61.93 1aou n THR 75 Cb 0.55 -1.04 0.45 0.00 -2.10 0.00 0.00 70.33 68.18 1aou n THR 75 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1aou h ARG 76 N 0.00 0.00 -2.28 -0.78 9.65 -1.96 -3.43 114.38 115.58 1aou h ARG 76 Ca 0.00 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 1aou h ARG 76 Cb 0.06 0.00 -0.24 0.00 -1.39 0.00 0.00 29.97 28.40 1aou h ARG 76 CO 0.00 0.00 -0.25 0.00 2.80 0.00 0.00 179.97 182.52 1aou s ALA 77 N -3.26 -1.55 0.37 2.80 0.00 -0.73 -5.16 121.76 114.22 1aou s ALA 77 Ca 0.07 1.89 0.05 0.00 0.00 0.00 0.00 51.96 53.97 1aou s ALA 77 Cb 0.10 -1.51 -0.07 0.00 0.00 0.00 0.00 23.12 21.64 1aou s ALA 77 CO 0.52 -0.80 0.03 1.14 0.00 0.00 0.00 175.76 176.65 1aou s GLN 78 N 2.66 1.81 0.00 0.00 0.00 -1.26 -4.24 119.66 118.64 1aou s GLN 78 Ca -0.04 -2.02 0.00 0.00 -0.00 0.00 0.00 55.36 53.30 1aou s GLN 78 Cb -0.12 -1.27 0.00 0.00 0.00 0.00 0.00 33.01 31.62 1aou s GLN 78 CO -0.16 -0.11 0.00 1.19 0.00 0.00 0.00 175.29 176.21 1aou n PHE 79 N -0.83 -0.08 -0.06 9.60 3.01 0.13 -4.75 117.46 124.46 1aou n PHE 79 Ca -0.04 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.41 1aou n PHE 79 Cb 0.67 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.99 1aou n PHE 79 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1aou n GLU 80 N 0.00 0.83 -4.21 -1.08 0.28 -1.26 -0.72 120.64 114.49 1aou n GLU 80 Ca 0.00 -0.08 -0.16 0.00 -0.16 0.00 0.00 57.16 56.77 1aou n GLU 80 Cb 0.00 -1.47 -0.08 0.00 1.43 0.00 0.00 31.44 31.32 1aou n GLU 80 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 177.13 176.89 1aou s THR 81 N -2.81 0.00 0.03 3.84 -1.32 -1.26 -4.68 115.64 109.45 1aou s THR 81 Ca -0.08 -1.90 -0.10 0.00 -1.21 0.00 0.00 61.69 58.39 1aou s THR 81 Cb 0.08 -2.51 -0.32 0.00 -1.51 0.00 0.00 72.50 68.25 1aou s THR 81 CO 0.79 0.00 0.99 -0.07 -2.21 0.00 0.00 174.62 174.11 1aou h LEU 82 N 2.28 0.63 -2.18 9.08 3.38 -1.95 -2.74 115.31 123.80 1aou h LEU 82 Ca -0.29 -0.72 -0.01 0.00 0.09 0.00 0.00 57.88 56.95 1aou h LEU 82 Cb 1.24 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1aou h LEU 82 CO 0.42 1.57 -0.04 -0.61 0.09 0.00 0.00 178.44 179.86 1aou h GLN 83 N 0.11 0.00 0.18 1.13 4.15 -1.98 -1.01 115.11 117.69 1aou h GLN 83 Ca -0.23 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 58.87 1aou h GLN 83 Cb 2.08 0.00 0.01 0.00 0.21 0.00 0.00 27.48 29.78 1aou h GLN 83 CO 0.23 0.04 -1.53 1.96 -1.93 0.00 0.00 178.83 177.60 1aou h GLN 84 N 0.00 0.38 0.00 1.69 7.50 -1.94 -1.44 115.11 121.29 1aou h GLN 84 Ca -0.00 -0.65 -0.09 0.00 0.50 0.00 0.00 58.65 58.41 1aou h GLN 84 Cb 0.25 0.24 -0.01 0.00 0.05 0.00 0.00 27.48 28.01 1aou h GLN 84 CO 0.01 1.28 -0.44 1.37 -1.50 0.00 0.00 178.83 179.55 1aou h LEU 85 N 0.10 0.00 0.00 1.46 8.10 -1.11 -1.30 115.31 122.56 1aou h LEU 85 Ca -0.26 0.00 -0.15 0.00 0.11 0.00 0.00 57.88 57.58 1aou h LEU 85 Cb 2.08 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 42.28 1aou h LEU 85 CO 0.21 0.44 -0.77 -0.37 -4.11 0.00 0.00 178.44 173.84 1aou h VAL 86 N 0.00 1.17 -0.35 0.15 -1.51 -1.26 0.18 116.25 114.63 1aou h VAL 86 Ca -0.00 -2.68 -0.06 0.00 -1.23 0.00 0.00 66.70 62.72 1aou h VAL 86 Cb 1.00 2.56 -0.01 0.00 -2.13 0.00 0.00 31.29 32.71 1aou h VAL 86 CO 0.06 0.67 -0.03 -0.61 -1.23 0.00 0.00 177.57 176.42 1aou h GLN 87 N 0.00 0.64 0.12 5.19 4.15 -0.59 0.51 115.11 125.13 1aou h GLN 87 Ca -0.02 -0.22 -0.29 0.00 0.77 0.00 0.00 58.65 58.88 1aou h GLN 87 Cb 1.56 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 29.19 1aou h GLN 87 CO 0.09 0.78 -1.41 1.25 -1.93 0.00 0.00 178.83 177.60 1aou h HIS 88 N 0.45 0.45 0.00 3.99 2.76 -1.26 -3.24 115.15 118.29 1aou h HIS 88 Ca 0.10 -0.33 0.00 0.00 -2.20 0.00 0.00 60.37 57.94 1aou h HIS 88 Cb 0.51 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.45 1aou h HIS 88 CO 0.04 1.32 0.00 0.66 -1.30 0.00 0.00 177.93 178.66 1aou n TYR 89 N -3.47 0.73 0.09 5.26 4.02 0.64 -1.94 117.16 122.50 1aou n TYR 89 Ca -0.13 0.23 -0.06 0.00 -0.01 0.00 0.00 57.90 57.93 1aou n TYR 89 Cb 1.03 -0.88 0.06 0.00 -0.02 0.00 0.00 39.34 39.54 1aou n TYR 89 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 1aou h SER 90 N 0.00 0.18 0.63 7.72 0.02 0.02 -3.05 113.55 119.06 1aou h SER 90 Ca 0.00 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1aou h SER 90 Cb 0.60 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1aou h SER 90 CO 0.00 0.86 -1.27 -0.62 -1.14 0.00 0.00 176.83 174.66 1aou n GLU 91 N -3.73 0.56 -3.94 3.45 1.02 -1.14 -4.85 120.64 112.01 1aou n GLU 91 Ca -0.02 0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.03 1aou n GLU 91 Cb 0.72 -1.70 -0.12 0.00 -0.02 0.00 0.00 31.44 30.32 1aou n GLU 91 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1aou s ARG 92 N -3.37 0.26 0.56 3.49 0.52 -0.82 -5.01 118.95 114.58 1aou s ARG 92 Ca -0.02 -0.45 0.25 0.00 -0.52 0.00 0.00 55.73 55.00 1aou s ARG 92 Cb 0.12 0.10 1.58 0.00 0.52 0.00 0.00 34.95 37.27 1aou s ARG 92 CO 0.82 -0.05 2.17 0.00 0.02 0.00 0.00 175.30 178.26 1aou h ALA 93 N 4.95 1.82 0.00 2.13 0.00 -1.83 -3.35 119.26 122.98 1aou h ALA 93 Ca -0.30 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1aou h ALA 93 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1aou h ALA 93 CO 0.43 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.55 1aou n ALA 94 N -2.42 0.00 0.00 0.00 0.00 -1.26 -3.27 120.51 113.57 1aou n ALA 94 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1aou n ALA 94 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 1aou n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aou n GLY 95 N -2.00 1.38 0.00 0.00 0.00 -1.26 -4.91 105.19 98.40 1aou n GLY 95 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1aou n GLY 95 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1aou n LEU 96 N 0.00 0.00 0.14 0.99 -0.00 -1.20 -4.88 117.00 112.05 1aou n LEU 96 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 56.01 56.20 1aou n LEU 96 Cb 0.00 0.00 0.77 0.00 -0.00 0.00 0.00 43.42 44.19 1aou n LEU 96 CO 0.00 -0.06 1.17 0.28 -0.00 0.00 0.00 177.39 178.77 1aou h SER 97 N 0.00 0.00 0.00 1.45 0.02 -1.99 -3.46 113.55 109.57 1aou h SER 97 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1aou h SER 97 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1aou h SER 97 CO 0.00 0.00 0.00 -1.20 -1.14 0.00 0.00 176.83 174.49 1aou n SER 98 N -3.64 0.00 -3.00 3.07 7.64 -1.26 -5.05 113.62 111.37 1aou n SER 98 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.93 1aou n SER 98 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 1aou n SER 98 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1aou n ARG 99 N -0.42 -0.77 0.00 1.43 1.74 -1.26 -4.66 116.66 112.72 1aou n ARG 99 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1aou n ARG 99 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1aou n ARG 99 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1aou n LEU 100 N 0.00 0.00 -4.75 0.55 7.99 -1.23 -4.89 117.00 114.68 1aou n LEU 100 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 56.01 55.61 1aou n LEU 100 Cb 0.00 0.00 0.03 0.00 -0.11 0.00 0.00 43.42 43.34 1aou n LEU 100 CO 0.00 -0.09 1.00 0.55 -1.51 0.00 0.00 177.39 177.35 1aou n VAL 101 N -0.17 3.46 -1.70 4.08 3.14 -1.17 -4.36 118.33 121.60 1aou n VAL 101 Ca 0.00 -0.50 -0.41 0.00 -2.96 0.00 0.00 64.34 60.47 1aou n VAL 101 Cb 0.00 -1.71 0.01 0.00 -1.06 0.00 0.00 33.84 31.08 1aou n VAL 101 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 1aou n VAL 102 N -0.75 2.56 0.05 1.55 3.14 -1.22 -4.82 118.33 118.84 1aou n VAL 102 Ca 0.09 -0.50 -0.20 0.00 -2.96 0.00 0.00 64.34 60.76 1aou n VAL 102 Cb 0.43 -1.57 -0.12 0.00 -1.06 0.00 0.00 33.84 31.53 1aou n VAL 102 CO 0.00 0.00 0.00 1.55 -6.46 0.00 0.00 176.83 171.92 1aou h PRO 103 N 2.09 0.58 -1.88 1.45 0.13 -1.94 -3.32 132.00 129.11 1aou h PRO 103 Ca -0.48 -0.69 -0.71 0.00 -0.87 0.00 0.00 66.00 63.24 1aou h PRO 103 Cb 1.29 0.21 -0.32 0.00 0.13 0.00 0.00 31.00 32.32 1aou h PRO 103 CO 0.60 1.29 0.48 0.45 -0.23 0.00 0.00 178.00 180.59 1aou n SER 104 N -3.94 6.60 -0.43 1.44 2.88 -1.26 -4.78 113.62 114.13 1aou n SER 104 Ca -0.12 -3.79 0.35 0.00 -1.33 0.00 0.00 58.87 53.98 1aou n SER 104 Cb 0.86 -0.88 0.66 0.00 -0.75 0.00 0.00 64.21 64.10 1aou n SER 104 CO 0.00 0.00 0.00 1.12 -1.23 0.00 0.00 175.04 174.93 1aou h HIS 105 N 2.95 0.39 0.00 0.66 2.07 -1.96 -3.54 115.15 115.72 1aou h HIS 105 Ca 0.47 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 58.01 1aou h HIS 105 Cb 0.32 -0.10 0.00 0.00 2.57 0.00 0.00 27.41 30.20 1aou h HIS 105 CO 1.07 -0.08 0.00 1.17 -3.07 0.00 0.00 177.93 177.02