#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aou s ILE 2 N 0.00 2.20 0.15 2.46 -4.36 -1.26 -4.98 121.20 115.42 1aou s ILE 2 Ca 0.00 -0.28 -0.17 0.00 -0.26 0.00 0.00 60.65 59.94 1aou s ILE 2 Cb 0.00 -2.93 0.00 0.00 1.25 0.00 0.00 42.46 40.79 1aou s ILE 2 CO 0.00 0.00 1.79 1.56 0.24 0.00 0.00 174.94 178.53 1aou h GLN 3 N -0.77 0.42 -2.17 0.37 4.20 -1.96 -3.44 115.11 111.75 1aou h GLN 3 Ca -0.43 -0.03 -0.18 0.00 0.06 0.00 0.00 58.65 58.07 1aou h GLN 3 Cb 1.29 -0.10 -0.06 0.00 0.30 0.00 0.00 27.48 28.92 1aou h GLN 3 CO 0.53 0.28 -0.18 0.00 -0.67 0.00 0.00 178.83 178.79 1aou n ALA 4 N -2.22 -0.30 -1.40 3.87 0.00 -1.26 -4.56 120.51 114.63 1aou n ALA 4 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1aou n ALA 4 Cb 0.05 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 -1.86 0.00 -0.26 0.00 1.02 -1.25 -4.63 120.64 113.66 1aou n GLU 5 Ca -0.09 -0.44 0.00 0.00 -0.02 0.00 0.00 57.16 56.61 1aou n GLU 5 Cb 0.36 -0.37 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 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 1.02 -1.26 -4.93 120.64 118.96 1aou n GLU 6 Ca 0.00 -0.45 0.00 0.00 -0.02 0.00 0.00 57.16 56.69 1aou n GLU 6 Cb 0.53 -0.30 0.00 0.00 -0.02 0.00 0.00 31.44 31.65 1aou n GLU 6 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 1aou n TRP 7 N 0.00 0.00 -3.67 -0.32 4.27 -1.26 -3.14 117.44 113.32 1aou n TRP 7 Ca 0.00 0.00 -0.11 0.00 -3.89 0.00 0.00 57.50 53.50 1aou n TRP 7 Cb 0.56 0.00 -0.09 0.00 -1.36 0.00 0.00 31.31 30.42 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 0.00 -0.76 -0.22 -2.67 6.14 -1.26 0.10 117.35 118.67 1aou s TYR 8 Ca 0.00 1.64 0.06 0.00 0.64 0.00 0.00 57.07 59.42 1aou s TYR 8 Cb 0.00 0.36 -0.18 0.00 0.42 0.00 0.00 41.96 42.57 1aou s TYR 8 CO 0.00 -0.39 -0.13 1.19 0.64 0.00 0.00 175.55 176.86 1aou n PHE 9 N 3.71 0.00 0.00 4.97 3.01 -0.81 -3.85 117.46 124.49 1aou n PHE 9 Ca -0.19 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.27 1aou n PHE 9 Cb 0.57 -0.92 0.00 0.00 -0.01 0.00 0.00 39.48 39.12 1aou n PHE 9 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1aou n GLY 10 N 2.21 0.29 2.86 1.37 0.00 -1.26 -4.92 105.19 105.74 1aou n GLY 10 Ca -0.39 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 44.63 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 4.00 -3.39 1.61 5.02 -1.26 -2.12 118.16 122.02 1aou n LYS 11 Ca 0.00 -4.59 -0.19 0.00 -2.02 0.00 0.00 58.31 51.51 1aou n LYS 11 Cb 0.00 -2.45 -0.01 0.00 -0.02 0.00 0.00 35.03 32.55 1aou n LYS 11 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1aou s LEU 12 N -2.72 3.68 0.11 -0.35 2.96 -1.26 -4.73 118.68 116.37 1aou s LEU 12 Ca 0.33 -0.44 0.08 0.00 -0.22 0.00 0.00 54.13 53.89 1aou s LEU 12 Cb 0.07 -2.48 -0.04 0.00 0.50 0.00 0.00 46.19 44.24 1aou s LEU 12 CO 0.08 -0.58 -0.16 -0.83 -1.32 0.00 0.00 176.35 173.54 1aou s GLY 13 N -4.19 1.71 0.65 7.98 0.00 -1.26 -3.43 107.32 108.78 1aou s GLY 13 Ca 0.48 -1.32 0.18 0.00 0.00 0.00 0.00 44.72 44.06 1aou s GLY 13 CO 0.30 -1.30 1.52 -0.09 0.00 0.00 0.00 173.10 173.54 1aou h ARG 14 N 3.74 0.00 -0.02 2.90 1.12 -1.95 0.20 114.38 120.38 1aou h ARG 14 Ca -0.50 0.00 -0.21 0.00 -1.11 0.00 0.00 59.98 58.17 1aou h ARG 14 Cb 1.17 0.00 0.02 0.00 -0.01 0.00 0.00 29.97 31.14 1aou h ARG 14 CO 0.47 0.00 -0.81 0.87 -3.11 0.00 0.00 179.97 177.40 1aou h LYS 15 N 0.00 0.57 -0.01 0.20 1.57 -2.00 -2.82 116.57 114.09 1aou h LYS 15 Ca 0.05 -0.60 -0.19 0.00 -1.87 0.00 0.00 60.65 58.04 1aou h LYS 15 Cb 1.38 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.84 1aou h LYS 15 CO -0.00 1.21 -0.85 0.22 -0.57 0.00 0.00 179.45 179.46 1aou h ASP 16 N 0.17 0.28 0.36 0.86 1.82 -1.04 -2.85 116.42 116.02 1aou h ASP 16 Ca -0.10 -0.22 -0.02 0.00 -0.39 0.00 0.00 57.03 56.31 1aou h ASP 16 Cb 1.48 -0.08 -0.00 0.00 0.68 0.00 0.00 39.33 41.41 1aou h ASP 16 CO 0.16 1.00 -0.19 0.00 -1.61 0.00 0.00 179.24 178.60 1aou h ALA 17 N 0.98 -0.51 -0.31 -0.78 0.00 -1.32 1.21 119.26 118.53 1aou h ALA 17 Ca -0.04 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.78 1aou h ALA 17 Cb 1.47 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1aou h ALA 17 CO 0.13 -0.79 0.18 1.05 0.00 0.00 0.00 179.25 179.82 1aou h GLU 18 N -0.51 0.35 0.00 0.00 -0.00 -1.56 0.43 114.58 113.30 1aou h GLU 18 Ca -0.04 -0.02 0.00 0.00 -0.00 0.00 0.00 59.36 59.29 1aou h GLU 18 Cb 0.41 -0.08 0.00 0.00 -0.00 0.00 0.00 28.75 29.08 1aou h GLU 18 CO 0.06 0.23 0.00 -2.13 -0.00 0.00 0.00 179.01 177.18 1aou n ARG 19 N -4.92 0.01 0.00 1.06 0.00 -1.06 -2.30 116.66 109.45 1aou n ARG 19 Ca -0.01 0.18 0.00 0.00 -0.00 0.00 0.00 57.85 58.02 1aou n ARG 19 Cb 0.05 -1.51 0.00 0.00 0.00 0.00 0.00 32.46 31.00 1aou n ARG 19 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1aou n GLN 20 N -1.52 0.00 -0.28 -0.14 1.13 0.42 -1.88 117.38 115.11 1aou n GLN 20 Ca 0.05 0.20 0.09 0.00 -1.94 0.00 0.00 57.00 55.39 1aou n GLN 20 Cb 0.22 -0.65 0.22 0.00 0.11 0.00 0.00 30.24 30.14 1aou n GLN 20 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1aou h LEU 21 N 0.00 -0.18 -0.08 1.08 4.07 -1.16 1.73 115.31 120.77 1aou h LEU 21 Ca 0.00 0.20 -0.03 0.00 0.08 0.00 0.00 57.88 58.13 1aou h LEU 21 Cb 0.00 0.31 -0.00 0.00 1.08 0.00 0.00 40.66 42.05 1aou h LEU 21 CO 0.00 -0.16 -0.05 -0.07 -1.08 0.00 0.00 178.44 177.08 1aou h LEU 22 N 0.16 0.19 -4.37 1.67 3.38 -1.65 -3.20 115.31 111.49 1aou h LEU 22 Ca 0.48 -0.44 -0.70 0.00 0.09 0.00 0.00 57.88 57.31 1aou h LEU 22 Cb 0.90 -0.05 -0.30 0.00 0.09 0.00 0.00 40.66 41.30 1aou h LEU 22 CO -0.66 0.58 0.78 -1.20 0.09 0.00 0.00 178.44 178.03 1aou n SER 23 N -4.74 7.37 -0.06 -0.43 7.64 0.11 -4.39 113.62 119.12 1aou n SER 23 Ca -0.07 -3.80 -0.07 0.00 1.01 0.00 0.00 58.87 55.94 1aou n SER 23 Cb 0.28 -0.95 -0.07 0.00 -1.01 0.00 0.00 64.21 62.45 1aou n SER 23 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1aou n PHE 24 N -0.75 0.00 0.00 1.43 7.35 0.57 -4.74 117.46 121.32 1aou n PHE 24 Ca 0.58 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.27 1aou n PHE 24 Cb 0.52 -0.50 0.00 0.00 0.35 0.00 0.00 39.48 39.85 1aou n PHE 24 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1aou n GLY 25 N 2.62 1.37 3.47 7.13 0.00 -1.26 -5.06 105.19 113.45 1aou n GLY 25 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 1aou n GLY 25 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1aou s ASN 26 N -1.78 3.84 1.02 1.61 3.84 -1.26 -5.13 114.94 117.08 1aou s ASN 26 Ca 0.00 -0.50 -0.17 0.00 0.21 0.00 0.00 52.86 52.40 1aou s ASN 26 Cb 0.00 -0.57 0.23 0.00 -0.55 0.00 0.00 41.25 40.35 1aou s ASN 26 CO 0.00 0.22 1.29 -2.16 -2.79 0.00 0.00 177.10 173.66 1aou s PRO 27 N -1.79 0.17 1.03 0.43 0.04 -1.26 -4.83 135.00 128.79 1aou s PRO 27 Ca 0.16 -0.40 -0.22 0.00 0.04 0.00 0.00 61.00 60.59 1aou s PRO 27 Cb -0.11 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 1aou s PRO 27 CO 0.08 -2.73 -0.68 2.89 0.04 0.00 0.00 177.00 176.59 1aou n ARG 28 N -4.00 -0.89 -0.59 4.56 1.85 -1.26 -3.74 116.66 112.60 1aou n ARG 28 Ca 0.16 -0.25 0.00 0.00 -1.00 0.00 0.00 57.85 56.75 1aou n ARG 28 Cb 0.59 -1.33 0.00 0.00 -1.05 0.00 0.00 32.46 30.67 1aou n ARG 28 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1aou n GLY 29 N 2.77 0.71 3.45 2.89 0.00 -0.76 -5.00 105.19 109.25 1aou n GLY 29 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.09 4.50 -0.36 2.61 2.01 -1.25 -2.73 115.64 118.32 1aou s THR 30 Ca 0.00 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 61.63 1aou s THR 30 Cb 0.00 -4.57 0.10 0.00 0.01 0.00 0.00 72.50 68.03 1aou s THR 30 CO 0.00 -1.25 0.11 -0.36 -0.69 0.00 0.00 174.62 172.43 1aou s PHE 31 N 3.61 3.61 0.00 4.92 0.40 -1.26 0.46 117.98 129.72 1aou s PHE 31 Ca 0.21 -2.58 0.00 0.00 -0.60 0.00 0.00 56.93 53.96 1aou s PHE 31 Cb -0.18 -2.94 0.00 0.00 0.51 0.00 0.00 43.02 40.41 1aou s PHE 31 CO 0.11 -0.94 0.00 1.47 0.70 0.00 0.00 175.22 176.56 1aou n LEU 32 N 4.46 0.00 -4.31 -0.37 -0.00 0.14 -1.83 117.00 115.09 1aou n LEU 32 Ca -0.02 0.00 -0.17 0.00 -0.00 0.00 0.00 56.01 55.82 1aou n LEU 32 Cb 0.42 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.74 1aou n LEU 32 CO 0.28 -0.23 -0.22 -0.63 -0.00 0.00 0.00 177.39 176.58 1aou s ILE 33 N 0.34 0.33 0.00 1.47 1.01 0.11 0.20 121.20 124.66 1aou s ILE 33 Ca 0.00 -2.00 0.00 0.00 0.00 0.00 0.00 60.65 58.65 1aou s ILE 33 Cb 0.00 -2.55 0.00 0.00 0.01 0.00 0.00 42.46 39.92 1aou s ILE 33 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 174.94 172.83 1aou n ARG 34 N -0.50 0.00 -1.74 2.79 1.85 -0.57 -1.93 116.66 116.57 1aou n ARG 34 Ca 0.01 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.44 1aou n ARG 34 Cb 0.65 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 32.05 1aou n ARG 34 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1aou n GLU 35 N -0.04 2.54 -1.98 2.89 1.02 -0.90 -0.69 120.64 123.48 1aou n GLU 35 Ca 0.00 0.90 -0.31 0.00 -0.02 0.00 0.00 57.16 57.73 1aou n GLU 35 Cb 0.00 -2.63 0.00 0.00 -0.02 0.00 0.00 31.44 28.79 1aou n GLU 35 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1aou s SER 36 N 0.23 6.30 -0.07 1.62 0.01 -0.27 -4.32 113.70 117.20 1aou s SER 36 Ca 0.61 1.44 0.10 0.00 1.31 0.00 0.00 55.95 59.41 1aou s SER 36 Cb -0.52 -2.47 0.16 0.00 0.21 0.00 0.00 66.02 63.40 1aou s SER 36 CO 0.54 -0.81 1.06 -0.62 0.41 0.00 0.00 173.24 173.81 1aou n GLU 37 N -2.53 1.65 0.01 12.44 1.02 -1.26 -4.04 120.64 127.93 1aou n GLU 37 Ca 0.06 -2.00 -0.22 0.00 -0.02 0.00 0.00 57.16 54.99 1aou n GLU 37 Cb 0.54 -1.21 -0.14 0.00 -0.02 0.00 0.00 31.44 30.62 1aou n GLU 37 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1aou h THR 38 N 0.76 0.69 -4.83 2.62 1.03 -1.97 -3.48 112.91 107.73 1aou h THR 38 Ca 0.00 -2.36 -0.22 0.00 -0.01 0.00 0.00 66.41 63.82 1aou h THR 38 Cb 0.88 2.53 -0.01 0.00 -1.07 0.00 0.00 68.15 70.48 1aou h THR 38 CO 0.00 0.87 -0.09 1.07 -0.01 0.00 0.00 175.52 177.36 1aou n THR 39 N -3.56 0.00 -0.40 0.00 5.66 -1.26 -4.95 114.28 109.78 1aou n THR 39 Ca -0.31 -0.86 0.32 0.00 -3.05 0.00 0.00 64.05 60.15 1aou n THR 39 Cb 1.03 -0.44 0.60 0.00 -1.55 0.00 0.00 70.33 69.97 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 0.19 0.00 1.09 1.57 -1.93 -3.39 116.57 114.10 1aou h LYS 40 Ca -0.13 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1aou h LYS 40 Cb 0.51 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1aou h LYS 40 CO 0.20 0.12 0.00 0.41 -0.57 0.00 0.00 179.45 179.62 1aou n GLY 41 N -1.50 -1.75 0.00 3.86 0.00 -1.26 -5.04 105.19 99.50 1aou n GLY 41 Ca 0.33 0.69 0.00 0.00 0.00 0.00 0.00 46.02 47.04 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 -3.83 4.61 0.00 -1.26 -4.80 120.51 115.24 1aou n ALA 42 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1aou n ALA 42 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1aou n ALA 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1aou n TYR 43 N -0.02 0.09 -3.66 0.00 4.01 -0.62 -1.12 117.16 115.85 1aou n TYR 43 Ca 0.00 -0.65 -0.08 0.00 -0.16 0.00 0.00 57.90 57.01 1aou n TYR 43 Cb 0.00 -0.02 -0.02 0.00 -0.31 0.00 0.00 39.34 38.99 1aou n TYR 43 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1aou s SER 44 N -1.64 -0.34 -0.34 7.72 0.01 0.14 -0.46 113.70 118.78 1aou s SER 44 Ca 0.04 -0.30 -0.00 0.00 1.31 0.00 0.00 55.95 57.00 1aou s SER 44 Cb 0.00 0.58 0.11 0.00 0.21 0.00 0.00 66.02 66.92 1aou s SER 44 CO 0.03 -1.02 0.14 -0.22 0.41 0.00 0.00 173.24 172.59 1aou s LEU 45 N -2.81 2.02 0.49 2.44 0.20 -0.36 -1.51 118.68 119.15 1aou s LEU 45 Ca 0.08 -1.87 -0.19 0.00 0.69 0.00 0.00 54.13 52.83 1aou s LEU 45 Cb -0.03 -0.80 -0.09 0.00 -0.43 0.00 0.00 46.19 44.85 1aou s LEU 45 CO -0.02 -0.38 1.00 -0.44 -0.29 0.00 0.00 176.35 176.22 1aou s SER 46 N 1.34 6.55 0.06 3.68 0.01 0.13 -0.60 113.70 124.87 1aou s SER 46 Ca 0.12 1.74 0.01 0.00 1.31 0.00 0.00 55.95 59.13 1aou s SER 46 Cb -0.19 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 1aou s SER 46 CO -0.18 -0.63 -0.05 -0.51 0.41 0.00 0.00 173.24 172.27 1aou s ILE 47 N -2.28 0.44 -0.13 1.44 2.07 -0.48 0.25 121.20 122.51 1aou s ILE 47 Ca 0.63 -1.48 0.03 0.00 -1.41 0.00 0.00 60.65 58.41 1aou s ILE 47 Cb -0.12 -1.09 0.01 0.00 0.13 0.00 0.00 42.46 41.39 1aou s ILE 47 CO 0.23 -0.70 -0.21 -0.60 -1.91 0.00 0.00 174.94 171.75 1aou s ARG 48 N -2.80 2.90 -0.15 3.50 3.00 0.17 -0.76 118.95 124.81 1aou s ARG 48 Ca -0.00 -0.81 -0.04 0.00 -1.00 0.00 0.00 55.73 53.88 1aou s ARG 48 Cb -0.01 -2.33 0.07 0.00 0.00 0.00 0.00 34.95 32.67 1aou s ARG 48 CO -0.04 -0.00 0.19 0.34 0.00 0.00 0.00 175.30 175.79 1aou s ASP 49 N 0.79 1.11 0.38 -2.12 -1.08 -0.94 -1.83 116.67 112.98 1aou s ASP 49 Ca -0.08 0.05 -0.06 0.00 -0.52 0.00 0.00 52.55 51.94 1aou s ASP 49 Cb -0.16 0.32 -0.05 0.00 -1.46 0.00 0.00 42.92 41.58 1aou s ASP 49 CO -0.01 -0.29 0.67 0.86 0.52 0.00 0.00 175.17 176.93 1aou s TRP 50 N 2.31 3.50 0.08 -5.34 -0.00 -1.26 -2.19 118.94 116.04 1aou s TRP 50 Ca 0.04 0.75 0.02 0.00 -0.00 0.00 0.00 56.10 56.91 1aou s TRP 50 Cb -0.14 -2.21 -0.04 0.00 -0.00 0.00 0.00 33.47 31.08 1aou s TRP 50 CO -0.09 -0.03 -0.07 0.34 -0.00 0.00 0.00 176.95 177.10 1aou s ASP 51 N -3.55 1.06 -0.22 5.86 -1.08 -0.65 -4.91 116.67 113.17 1aou s ASP 51 Ca 0.46 -0.90 -0.03 0.00 -0.52 0.00 0.00 52.55 51.56 1aou s ASP 51 Cb -0.10 0.08 -0.01 0.00 -1.46 0.00 0.00 42.92 41.43 1aou s ASP 51 CO 0.35 -0.41 2.72 -0.90 0.52 0.00 0.00 175.17 177.46 1aou n ASP 52 N 0.31 5.94 -0.45 -0.34 5.75 -1.26 -3.21 116.55 123.29 1aou n ASP 52 Ca -0.15 -2.84 -0.00 0.00 -0.01 0.00 0.00 54.79 51.79 1aou n ASP 52 Cb 0.59 -1.23 -0.00 0.00 -1.03 0.00 0.00 41.12 39.45 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 1.32 0.00 0.00 0.11 0.00 -1.26 -4.98 117.12 112.30 1aou n MET 53 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 57.70 58.04 1aou n MET 53 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.88 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 0.00 0.00 0.00 3.17 2.85 -1.24 -5.16 118.16 117.78 1aou n LYS 54 Ca -0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1aou n LYS 54 Cb 0.45 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.83 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 -0.07 0.41 3.57 2.58 0.00 -1.20 -5.02 105.19 105.47 1aou n GLY 55 Ca 0.00 -2.27 -0.29 0.00 0.00 0.00 0.00 46.02 43.46 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 1.22 0.12 1.61 1.11 -1.26 -1.64 116.67 113.82 1aou s ASP 56 Ca 0.00 0.96 -0.06 0.00 0.18 0.00 0.00 52.55 53.63 1aou s ASP 56 Cb 0.00 -1.44 0.02 0.00 1.07 0.00 0.00 42.92 42.57 1aou s ASP 56 CO 0.00 -3.98 0.30 1.41 1.18 0.00 0.00 175.17 174.08 1aou n HIS 57 N -4.71 -1.31 -3.64 4.23 8.25 -0.93 -4.78 115.22 112.33 1aou n HIS 57 Ca 0.09 -0.60 -0.06 0.00 -0.26 0.00 0.00 57.72 56.89 1aou n HIS 57 Cb 0.58 0.30 -0.07 0.00 1.12 0.00 0.00 29.99 31.92 1aou n HIS 57 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1aou s VAL 58 N -2.61 -0.13 0.06 1.59 1.01 -1.26 -2.21 120.40 116.86 1aou s VAL 58 Ca 0.06 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.05 1aou s VAL 58 Cb -0.02 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.37 1aou s VAL 58 CO 0.04 0.00 0.05 1.17 0.00 0.00 0.00 175.10 176.36 1aou n LYS 59 N 4.42 1.30 -3.50 2.72 3.00 0.06 -4.89 118.16 121.27 1aou n LYS 59 Ca -0.19 -0.35 -0.16 0.00 -0.00 0.00 0.00 58.31 57.61 1aou n LYS 59 Cb 0.58 0.02 -0.05 0.00 0.00 0.00 0.00 35.03 35.58 1aou n LYS 59 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1aou s HIS 60 N -0.05 -0.63 -0.39 5.64 3.76 -1.26 -1.39 115.29 120.98 1aou s HIS 60 Ca 0.04 0.93 0.01 0.00 -0.15 0.00 0.00 55.06 55.89 1aou s HIS 60 Cb -0.00 0.45 0.12 0.00 1.11 0.00 0.00 32.58 34.25 1aou s HIS 60 CO 0.03 -0.67 0.17 0.71 -0.85 0.00 0.00 174.74 174.13 1aou s TYR 61 N -1.83 2.11 -0.27 1.40 2.02 0.23 -4.92 117.35 116.10 1aou s TYR 61 Ca -0.08 -2.28 -0.37 0.00 -0.37 0.00 0.00 57.07 53.98 1aou s TYR 61 Cb -0.00 -1.97 -0.13 0.00 -0.40 0.00 0.00 41.96 39.46 1aou s TYR 61 CO 0.04 -0.83 1.98 1.17 -1.57 0.00 0.00 175.55 176.34 1aou n LYS 62 N 4.04 1.36 -3.00 -0.62 0.00 -1.26 -1.22 118.16 117.45 1aou n LYS 62 Ca 0.04 0.45 -0.40 0.00 0.00 0.00 0.00 58.31 58.41 1aou n LYS 62 Cb 0.38 -2.39 -0.05 0.00 0.00 0.00 0.00 35.03 32.97 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 5.36 4.79 0.01 3.15 1.01 0.39 -4.62 121.20 131.29 1aou s ILE 63 Ca 1.02 1.58 0.02 0.00 0.00 0.00 0.00 60.65 63.27 1aou s ILE 63 Cb -0.89 -4.09 -0.01 0.00 0.01 0.00 0.00 42.46 37.47 1aou s ILE 63 CO 0.55 0.35 -0.06 -0.60 0.00 0.00 0.00 174.94 175.18 1aou s ARG 64 N 0.06 0.46 -0.20 2.79 6.06 -1.06 -1.59 118.95 125.47 1aou s ARG 64 Ca 0.38 -0.42 -0.05 0.00 -2.50 0.00 0.00 55.73 53.14 1aou s ARG 64 Cb -0.20 -0.35 -0.03 0.00 0.06 0.00 0.00 34.95 34.43 1aou s ARG 64 CO 0.22 0.08 0.01 0.21 -2.50 0.00 0.00 175.30 173.33 1aou s LYS 65 N -0.72 3.66 0.00 5.12 2.20 -1.26 -1.22 119.74 127.53 1aou s LYS 65 Ca -0.03 -0.50 -0.22 0.00 -0.36 0.00 0.00 55.97 54.87 1aou s LYS 65 Cb -0.05 -3.11 -0.05 0.00 -1.51 0.00 0.00 37.83 33.10 1aou s LYS 65 CO 0.00 0.03 0.64 -0.51 -0.36 0.00 0.00 175.35 175.15 1aou s LEU 66 N 0.96 4.42 0.19 5.43 1.02 0.12 -4.90 118.68 125.92 1aou s LEU 66 Ca 0.02 1.22 0.22 0.00 0.02 0.00 0.00 54.13 55.61 1aou s LEU 66 Cb -0.14 -3.00 0.90 0.00 0.02 0.00 0.00 46.19 43.97 1aou s LEU 66 CO 0.02 0.07 1.68 0.47 0.02 0.00 0.00 176.35 178.61 1aou n ASP 67 N 2.79 0.53 -0.01 2.29 8.00 -1.26 -1.27 116.55 127.61 1aou n ASP 67 Ca -0.06 0.62 0.13 0.00 0.71 0.00 0.00 54.79 56.19 1aou n ASP 67 Cb 0.51 -0.74 0.47 0.00 -0.02 0.00 0.00 41.12 41.35 1aou n ASP 67 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1aou n ASN 68 N -2.07 0.26 0.00 -2.24 3.02 -1.26 -4.86 115.26 108.10 1aou n ASN 68 Ca 0.03 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 1aou n ASN 68 Cb 0.24 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 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 1.47 -0.32 0.00 7.41 0.00 -0.40 -5.16 105.19 108.20 1aou n GLY 69 Ca 0.07 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 0.58 3.60 -0.02 0.00 -1.06 -4.86 105.19 103.43 1aou n GLY 70 Ca 0.00 0.41 -0.26 0.00 0.00 0.00 0.00 46.02 46.17 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 1.69 2.49 0.00 1.61 1.51 -0.66 0.12 117.35 124.11 1aou s TYR 71 Ca 0.00 -0.55 0.00 0.00 -1.01 0.00 0.00 57.07 55.51 1aou s TYR 71 Cb 0.00 -1.59 0.00 0.00 -0.11 0.00 0.00 41.96 40.26 1aou s TYR 71 CO 0.00 0.49 0.00 2.48 -1.11 0.00 0.00 175.55 177.41 1aou n TYR 72 N -0.92 0.00 0.01 2.71 4.11 -0.36 0.23 117.16 122.93 1aou n TYR 72 Ca -0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 57.90 57.83 1aou n TYR 72 Cb 0.65 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.88 1aou n TYR 72 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.86 175.97 1aou n ILE 73 N -0.03 1.30 -4.47 -3.48 5.41 -1.26 -2.55 119.36 114.27 1aou n ILE 73 Ca 0.00 -0.73 -0.21 0.00 1.00 0.00 0.00 62.75 62.81 1aou n ILE 73 Cb 0.00 -0.79 -0.14 0.00 -0.71 0.00 0.00 39.64 38.00 1aou n ILE 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1aou s THR 74 N -2.81 1.08 -2.00 1.39 -1.32 -1.26 -4.82 115.64 105.90 1aou s THR 74 Ca -0.04 -0.80 0.10 0.00 -1.21 0.00 0.00 61.69 59.75 1aou s THR 74 Cb 0.08 -0.94 0.29 0.00 -1.51 0.00 0.00 72.50 70.42 1aou s THR 74 CO 0.82 0.14 1.04 0.35 -2.21 0.00 0.00 174.62 174.76 1aou n THR 75 N 2.30 0.00 1.16 5.08 -2.24 -1.26 -1.86 114.28 117.45 1aou n THR 75 Ca -0.16 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.74 1aou n THR 75 Cb 0.55 -0.76 0.23 0.00 -2.10 0.00 0.00 70.33 68.25 1aou n THR 75 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1aou n ARG 76 N -0.94 1.78 -3.15 -0.78 0.00 -1.26 -4.80 116.66 107.50 1aou n ARG 76 Ca 0.08 -1.34 0.04 0.00 -0.00 0.00 0.00 57.85 56.63 1aou n ARG 76 Cb 0.04 -1.47 -0.00 0.00 0.00 0.00 0.00 32.46 31.02 1aou n ARG 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1aou s ALA 77 N -2.14 -2.58 0.31 5.13 0.00 -0.78 -5.16 121.76 116.54 1aou s ALA 77 Ca 0.28 1.22 0.04 0.00 0.00 0.00 0.00 51.96 53.50 1aou s ALA 77 Cb 0.20 -2.51 0.04 0.00 0.00 0.00 0.00 23.12 20.84 1aou s ALA 77 CO 0.38 -1.77 0.30 1.04 0.00 0.00 0.00 175.76 175.71 1aou n GLN 78 N 5.39 0.95 -0.36 0.00 1.13 -1.25 -4.26 117.38 118.98 1aou n GLN 78 Ca 0.04 -1.83 0.00 0.00 -1.94 0.00 0.00 57.00 53.27 1aou n GLN 78 Cb 0.54 0.08 0.00 0.00 0.11 0.00 0.00 30.24 30.97 1aou n GLN 78 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1aou n PHE 79 N -1.38 -0.16 -0.06 1.08 3.01 0.13 -4.87 117.46 115.21 1aou n PHE 79 Ca 0.02 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.44 1aou n PHE 79 Cb 0.34 0.00 -0.12 0.00 -0.01 0.00 0.00 39.48 39.69 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 1.28 -4.05 -1.08 0.00 -1.26 -1.65 120.64 113.88 1aou n GLU 80 Ca 0.00 -0.03 -0.15 0.00 0.00 0.00 0.00 57.16 56.98 1aou n GLU 80 Cb 0.00 -1.40 -0.03 0.00 0.00 0.00 0.00 31.44 30.02 1aou n GLU 80 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1aou n THR 81 N -2.48 0.00 0.09 3.84 5.66 -1.26 -4.52 114.28 115.60 1aou n THR 81 Ca -0.21 -1.77 -0.14 0.00 -3.05 0.00 0.00 64.05 58.88 1aou n THR 81 Cb 0.90 1.13 -0.08 0.00 -1.55 0.00 0.00 70.33 70.72 1aou n THR 81 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1aou h LEU 82 N 0.00 0.49 -0.37 1.09 3.38 -1.99 -2.69 115.31 115.22 1aou h LEU 82 Ca -0.29 -0.44 -0.19 0.00 0.09 0.00 0.00 57.88 57.05 1aou h LEU 82 Cb 1.24 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1aou h LEU 82 CO 0.39 1.28 -0.79 1.56 0.09 0.00 0.00 178.44 180.97 1aou h GLN 83 N 0.16 0.32 -0.26 1.13 4.20 -1.96 -1.31 115.11 117.39 1aou h GLN 83 Ca -0.10 -0.29 -0.11 0.00 0.06 0.00 0.00 58.65 58.21 1aou h GLN 83 Cb 1.74 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.58 1aou h GLN 83 CO 0.18 0.96 -0.28 1.96 -0.67 0.00 0.00 178.83 180.97 1aou h GLN 84 N 0.21 0.53 0.14 1.46 7.50 -1.95 -2.08 115.11 120.92 1aou h GLN 84 Ca -0.04 -0.22 -0.29 0.00 0.50 0.00 0.00 58.65 58.60 1aou h GLN 84 Cb 1.37 -0.02 0.00 0.00 0.05 0.00 0.00 27.48 28.89 1aou h GLN 84 CO 0.13 0.76 -1.36 1.37 -1.50 0.00 0.00 178.83 178.23 1aou h LEU 85 N 0.46 0.46 -2.59 1.46 8.10 -1.42 -2.20 115.31 119.59 1aou h LEU 85 Ca 0.06 -0.53 -0.00 0.00 0.11 0.00 0.00 57.88 57.52 1aou h LEU 85 Cb 0.73 -0.15 -0.00 0.00 -0.44 0.00 0.00 40.66 40.80 1aou h LEU 85 CO 0.06 1.42 -0.01 -0.37 -4.11 0.00 0.00 178.44 175.43 1aou h VAL 86 N 0.08 0.12 0.02 0.15 -1.51 -1.12 0.46 116.25 114.46 1aou h VAL 86 Ca -0.18 -0.13 -0.15 0.00 -1.23 0.00 0.00 66.70 65.01 1aou h VAL 86 Cb 2.01 1.11 0.01 0.00 -2.13 0.00 0.00 31.29 32.29 1aou h VAL 86 CO 0.20 0.01 -0.59 -0.61 -1.23 0.00 0.00 177.57 175.35 1aou h GLN 87 N 0.00 0.36 -0.43 5.19 4.15 -1.08 -0.17 115.11 123.13 1aou h GLN 87 Ca -0.00 -0.42 -0.11 0.00 0.77 0.00 0.00 58.65 58.90 1aou h GLN 87 Cb 0.11 0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 1aou h GLN 87 CO 0.00 1.10 -0.15 1.25 -1.93 0.00 0.00 178.83 179.11 1aou h HIS 88 N -0.20 0.98 0.00 3.99 2.76 -0.60 -2.22 115.15 119.86 1aou h HIS 88 Ca -0.08 -0.23 0.00 0.00 -2.20 0.00 0.00 60.37 57.87 1aou h HIS 88 Cb 1.32 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 30.05 1aou h HIS 88 CO 0.16 0.99 0.00 1.88 -1.30 0.00 0.00 177.93 179.66 1aou h TYR 89 N 0.69 0.00 -0.90 5.26 -1.99 -1.04 -1.31 116.97 117.68 1aou h TYR 89 Ca 0.10 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.82 1aou h TYR 89 Cb 0.70 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.39 1aou h TYR 89 CO 0.05 0.00 0.51 0.77 -0.00 0.00 0.00 178.16 179.49 1aou h SER 90 N 0.00 1.11 -0.01 3.88 0.02 -0.37 -2.77 113.55 115.42 1aou h SER 90 Ca 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1aou h SER 90 Cb 0.70 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1aou h SER 90 CO 0.00 0.88 -0.58 -0.62 -1.14 0.00 0.00 176.83 175.37 1aou n GLU 91 N -4.35 1.56 -4.17 3.45 1.02 -1.18 -4.96 120.64 112.01 1aou n GLU 91 Ca 0.10 -0.40 -0.11 0.00 -0.02 0.00 0.00 57.16 56.72 1aou n GLU 91 Cb 0.09 -1.30 -0.10 0.00 -0.02 0.00 0.00 31.44 30.11 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 -2.31 1.08 -0.11 3.49 1.81 -0.50 -5.09 118.95 117.32 1aou s ARG 92 Ca 0.10 -1.53 -0.07 0.00 -1.72 0.00 0.00 55.73 52.51 1aou s ARG 92 Cb 0.13 0.26 -0.02 0.00 -0.45 0.00 0.00 34.95 34.87 1aou s ARG 92 CO 0.57 -0.33 -0.14 0.00 -0.68 0.00 0.00 175.30 174.72 1aou n ALA 93 N -0.19 0.34 0.00 2.13 0.00 -1.26 -3.95 120.51 117.58 1aou n ALA 93 Ca -0.02 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1aou n ALA 93 Cb 0.65 0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1aou n ALA 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aou n ALA 94 N -3.30 0.00 0.00 0.00 0.00 -1.26 -4.12 120.51 111.83 1aou n ALA 94 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1aou n ALA 94 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 -0.49 1.02 0.00 0.00 0.00 -1.26 -4.99 105.19 99.47 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 -0.10 0.99 -0.00 -1.26 -4.95 117.00 111.67 1aou n LEU 96 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 55.91 1aou n LEU 96 Cb 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.26 1aou n LEU 96 CO 0.00 0.00 -1.16 -0.24 -0.00 0.00 0.00 177.39 175.99 1aou n SER 97 N 0.00 0.04 0.00 1.45 2.88 -1.26 -4.95 113.62 111.79 1aou n SER 97 Ca 0.00 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1aou n SER 97 Cb 0.00 0.99 0.00 0.00 -0.75 0.00 0.00 64.21 64.45 1aou n SER 97 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1aou n SER 98 N -2.75 0.00 0.00 -3.46 2.88 -1.26 -5.14 113.62 103.89 1aou n SER 98 Ca -0.33 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.21 1aou n SER 98 Cb 1.15 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.61 1aou n SER 98 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1aou n ARG 99 N 0.00 0.00 -0.12 -1.46 1.74 -1.26 -4.77 116.66 110.79 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 1.47 -1.52 0.00 0.00 177.63 177.58 1aou n LEU 100 N 0.00 0.00 -4.52 0.55 -0.00 -1.26 -4.98 117.00 106.79 1aou n LEU 100 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.58 1aou n LEU 100 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1aou n LEU 100 CO 0.00 -0.04 0.32 0.55 -0.00 0.00 0.00 177.39 178.22 1aou n VAL 101 N -0.08 2.05 -1.77 1.47 3.14 -0.76 -4.56 118.33 117.81 1aou n VAL 101 Ca 0.00 -0.50 -0.40 0.00 -2.96 0.00 0.00 64.34 60.48 1aou n VAL 101 Cb 0.00 -0.78 0.01 0.00 -1.06 0.00 0.00 33.84 32.01 1aou n VAL 101 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 1aou n VAL 102 N -0.48 2.43 0.22 1.55 0.31 -1.11 -4.88 118.33 116.37 1aou n VAL 102 Ca 0.11 -0.50 0.10 0.00 -0.01 0.00 0.00 64.34 64.04 1aou n VAL 102 Cb 0.37 -1.92 0.33 0.00 -0.91 0.00 0.00 33.84 31.71 1aou n VAL 102 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1aou h PRO 103 N 2.61 0.00 -1.20 5.55 0.13 -1.94 -3.29 132.00 133.86 1aou h PRO 103 Ca -0.51 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.14 1aou h PRO 103 Cb 1.26 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.97 1aou h PRO 103 CO 0.62 0.17 -0.93 -1.13 -0.23 0.00 0.00 178.00 176.51 1aou n SER 104 N -3.21 3.36 -0.13 1.44 3.41 -1.26 -4.87 113.62 112.36 1aou n SER 104 Ca 0.02 -3.26 -0.08 0.00 -0.26 0.00 0.00 58.87 55.29 1aou n SER 104 Cb 0.50 -0.48 -0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1aou n SER 104 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 1aou h HIS 105 N 2.70 0.51 0.00 7.33 2.07 -1.95 -3.55 115.15 122.26 1aou h HIS 105 Ca 0.13 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.66 1aou h HIS 105 Cb 1.09 -0.17 0.00 0.00 2.57 0.00 0.00 27.41 30.90 1aou h HIS 105 CO 0.69 0.35 0.00 1.17 -3.07 0.00 0.00 177.93 177.06