#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hck n GLU 2 N 0.00 -3.94 -3.77 0.03 1.02 -1.26 -5.06 120.64 107.67 3hck n GLU 2 Ca 0.00 2.94 -0.13 0.00 -0.02 0.00 0.00 57.16 59.95 3hck n GLU 2 Cb 0.00 -3.93 -0.09 0.00 -0.02 0.00 0.00 31.44 27.39 3hck n GLU 2 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3hck s THR 3 N -0.49 0.04 -0.40 2.62 -4.23 -1.26 -5.13 115.64 106.80 3hck s THR 3 Ca -0.12 -0.33 -0.18 0.00 -1.18 0.00 0.00 61.69 59.88 3hck s THR 3 Cb 0.01 -0.56 0.01 0.00 1.34 0.00 0.00 72.50 73.30 3hck s THR 3 CO 0.32 -0.18 0.49 -1.61 -0.54 0.00 0.00 174.62 173.10 3hck s GLU 4 N -0.84 3.31 -0.56 3.99 8.01 -1.26 -4.95 118.70 126.40 3hck s GLU 4 Ca -0.09 -0.50 0.05 0.00 0.01 0.00 0.00 54.97 54.43 3hck s GLU 4 Cb -0.04 -3.91 0.35 0.00 -4.31 0.00 0.00 34.13 26.22 3hck s GLU 4 CO 0.03 -0.80 0.98 0.39 0.01 0.00 0.00 175.26 175.87 3hck n GLU 5 N 5.74 3.29 0.04 1.61 1.02 -1.26 -4.69 120.64 126.38 3hck n GLU 5 Ca -0.06 -4.80 0.11 0.00 -0.02 0.00 0.00 57.16 52.39 3hck n GLU 5 Cb 0.48 -2.24 -0.05 0.00 -0.02 0.00 0.00 31.44 29.61 3hck n GLU 5 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 3hck n TRP 6 N -0.29 0.37 -3.89 -0.32 4.27 -1.26 -4.43 117.44 111.89 3hck n TRP 6 Ca 0.32 0.11 -0.33 0.00 -3.89 0.00 0.00 57.50 53.72 3hck n TRP 6 Cb 0.44 -0.59 -0.05 0.00 -1.36 0.00 0.00 31.31 29.75 3hck n TRP 6 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 3hck s PHE 7 N -3.34 3.54 0.12 -2.67 5.36 -1.26 -1.09 117.98 118.64 3hck s PHE 7 Ca -0.01 0.35 0.03 0.00 -0.96 0.00 0.00 56.93 56.34 3hck s PHE 7 Cb 0.13 -1.83 -0.04 0.00 -0.34 0.00 0.00 43.02 40.94 3hck s PHE 7 CO 0.84 0.62 -0.08 -0.06 -1.46 0.00 0.00 175.22 175.07 3hck s PHE 8 N -1.40 1.05 0.97 10.12 0.40 -0.28 -4.91 117.98 123.94 3hck s PHE 8 Ca 0.30 -0.85 -0.16 0.00 -0.60 0.00 0.00 56.93 55.62 3hck s PHE 8 Cb -0.13 -0.57 0.25 0.00 0.51 0.00 0.00 43.02 43.08 3hck s PHE 8 CO 0.22 -0.05 0.62 1.63 0.70 0.00 0.00 175.22 178.34 3hck n LYS 9 N -0.11 -3.68 -1.07 0.44 4.01 -1.26 -4.47 118.16 112.01 3hck n LYS 9 Ca -0.11 -1.03 -0.42 0.00 -0.51 0.00 0.00 58.31 56.24 3hck n LYS 9 Cb 0.61 -1.26 -0.07 0.00 -0.51 0.00 0.00 35.03 33.80 3hck n LYS 9 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3hck n GLY 10 N -3.65 1.88 3.88 0.72 0.00 -1.26 -4.60 105.19 102.16 3hck n GLY 10 Ca 0.10 -1.11 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 3hck n GLY 10 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3hck s ILE 11 N 6.26 4.77 0.72 -0.61 2.07 -1.26 -5.04 121.20 128.10 3hck s ILE 11 Ca 0.62 0.69 -0.11 0.00 -1.41 0.00 0.00 60.65 60.43 3hck s ILE 11 Cb 0.13 -3.87 0.03 0.00 0.13 0.00 0.00 42.46 38.88 3hck s ILE 11 CO 0.18 -1.07 1.10 -0.94 -1.91 0.00 0.00 174.94 172.31 3hck s SER 12 N -4.16 5.28 0.37 4.50 1.04 -1.26 -4.90 113.70 114.56 3hck s SER 12 Ca 0.53 1.04 0.19 0.00 0.48 0.00 0.00 55.95 58.19 3hck s SER 12 Cb -0.11 -1.79 0.58 0.00 0.10 0.00 0.00 66.02 64.80 3hck s SER 12 CO 0.51 -1.43 1.68 -0.09 0.98 0.00 0.00 173.24 174.89 3hck h ARG 13 N -0.71 0.00 0.00 4.02 1.12 -1.98 -0.79 114.38 116.05 3hck h ARG 13 Ca -0.45 0.00 -0.19 0.00 -1.11 0.00 0.00 59.98 58.23 3hck h ARG 13 Cb 1.27 0.00 -0.03 0.00 -0.01 0.00 0.00 29.97 31.20 3hck h ARG 13 CO 0.64 0.36 -1.27 0.87 -3.11 0.00 0.00 179.97 177.47 3hck h LYS 14 N 0.00 0.00 0.04 0.20 1.57 -1.97 -2.50 116.57 113.90 3hck h LYS 14 Ca -0.00 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.52 3hck h LYS 14 Cb 0.99 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.31 3hck h LYS 14 CO 0.05 0.48 -1.05 -0.44 -0.57 0.00 0.00 179.45 177.92 3hck h ASP 15 N 0.00 0.65 0.81 0.86 3.32 -1.90 -2.18 116.42 117.99 3hck h ASP 15 Ca -0.14 -0.55 -0.16 0.00 0.02 0.00 0.00 57.03 56.19 3hck h ASP 15 Cb 1.68 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 41.01 3hck h ASP 15 CO 0.07 1.36 -0.77 0.00 -1.72 0.00 0.00 179.24 178.18 3hck h ALA 16 N 0.58 0.70 0.00 3.45 0.00 -1.25 -1.77 119.26 120.98 3hck h ALA 16 Ca -0.11 -0.70 -0.08 0.00 0.00 0.00 0.00 54.91 54.01 3hck h ALA 16 Cb 1.70 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 3hck h ALA 16 CO 0.19 0.97 -0.38 0.93 0.00 0.00 0.00 179.25 180.96 3hck h GLU 17 N 0.00 0.00 0.00 0.00 5.08 -1.42 -2.45 114.58 115.79 3hck h GLU 17 Ca -0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3hck h GLU 17 Cb 1.39 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.63 3hck h GLU 17 CO 0.10 0.38 -0.98 0.00 -1.00 0.00 0.00 179.01 177.51 3hck h ARG 18 N 0.00 0.00 0.02 2.33 2.47 -1.23 -2.64 114.38 115.33 3hck h ARG 18 Ca -0.00 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.50 3hck h ARG 18 Cb 0.98 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.29 3hck h ARG 18 CO 0.05 0.14 -0.95 1.96 0.56 0.00 0.00 179.97 181.73 3hck h GLN 19 N 0.00 0.24 0.12 0.04 4.20 -1.11 -1.64 115.11 116.96 3hck h GLN 19 Ca -0.05 -0.29 -0.29 0.00 0.06 0.00 0.00 58.65 58.08 3hck h GLN 19 Cb 1.22 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 29.09 3hck h GLN 19 CO 0.02 1.03 -1.41 -0.07 -0.67 0.00 0.00 178.83 177.73 3hck h LEU 20 N 0.12 0.38 -0.75 1.46 3.38 -1.55 -3.20 115.31 115.17 3hck h LEU 20 Ca -0.06 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.43 3hck h LEU 20 Cb 1.60 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.22 3hck h LEU 20 CO 0.15 1.39 0.00 -0.07 0.09 0.00 0.00 178.44 180.00 3hck h LEU 21 N 0.07 0.00 -9.85 1.67 3.38 -1.50 -3.43 115.31 105.65 3hck h LEU 21 Ca -0.20 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.21 3hck h LEU 21 Cb 1.99 0.00 0.17 0.00 0.09 0.00 0.00 40.66 42.92 3hck h LEU 21 CO 0.18 0.00 0.01 0.00 0.09 0.00 0.00 178.44 178.72 3hck n ALA 22 N -1.94 -0.32 0.98 1.53 0.00 -0.62 -4.85 120.51 115.30 3hck n ALA 22 Ca 0.02 -0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.45 3hck n ALA 22 Cb 0.34 -2.06 0.54 0.00 0.00 0.00 0.00 19.45 18.27 3hck n ALA 22 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3hck n PRO 23 N -1.32 0.24 0.05 0.00 -0.04 -1.26 -2.46 135.00 130.20 3hck n PRO 23 Ca 0.13 0.09 0.14 0.00 -0.04 0.00 0.00 63.50 63.81 3hck n PRO 23 Cb 0.49 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 32.96 3hck n PRO 23 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hck n GLY 24 N 0.66 -1.60 3.76 0.55 0.00 -1.26 -4.84 105.19 102.46 3hck n GLY 24 Ca 0.09 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3hck n GLY 24 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hck s ASN 25 N -3.74 4.18 0.15 1.61 0.01 -1.03 -4.90 114.94 111.22 3hck s ASN 25 Ca 0.12 -1.51 -0.13 0.00 -0.71 0.00 0.00 52.86 50.64 3hck s ASN 25 Cb 0.16 0.28 0.01 0.00 0.41 0.00 0.00 41.25 42.11 3hck s ASN 25 CO 0.56 -0.80 0.36 0.00 -1.51 0.00 0.00 177.10 175.72 3hck s MET 26 N -3.91 1.14 0.12 -0.60 0.23 -1.26 -4.91 119.30 110.12 3hck s MET 26 Ca 0.17 -0.94 -0.33 0.00 -1.03 0.00 0.00 55.69 53.56 3hck s MET 26 Cb 0.03 0.43 -0.18 0.00 -1.53 0.00 0.00 34.83 33.58 3hck s MET 26 CO 0.09 -0.44 0.80 -0.11 -2.03 0.00 0.00 175.02 173.33 3hck n LEU 27 N -0.23 -0.50 0.00 0.18 -0.00 -1.26 -1.02 117.00 114.18 3hck n LEU 27 Ca -0.11 1.14 0.00 0.00 -0.00 0.00 0.00 56.01 57.04 3hck n LEU 27 Cb 0.63 -0.96 0.00 0.00 -0.00 0.00 0.00 43.42 43.09 3hck n LEU 27 CO 0.20 -2.40 0.00 0.61 -0.00 0.00 0.00 177.39 175.80 3hck n GLY 28 N 1.78 2.84 3.72 -3.96 0.00 -1.24 -4.89 105.19 103.43 3hck n GLY 28 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 3hck n GLY 28 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hck n SER 29 N 0.00 3.45 -4.02 1.61 7.64 -0.18 -2.25 113.62 119.87 3hck n SER 29 Ca 0.00 1.14 -0.09 0.00 1.01 0.00 0.00 58.87 60.93 3hck n SER 29 Cb 0.00 -1.53 -0.11 0.00 -1.01 0.00 0.00 64.21 61.56 3hck n SER 29 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 3hck s PHE 30 N 0.05 0.39 0.00 1.43 -0.71 -1.05 -0.98 117.98 117.10 3hck s PHE 30 Ca 0.66 -0.70 -0.11 0.00 -1.04 0.00 0.00 56.93 55.74 3hck s PHE 30 Cb -0.55 -0.28 0.01 0.00 -1.21 0.00 0.00 43.02 40.99 3hck s PHE 30 CO 0.48 -0.24 0.22 0.00 -1.34 0.00 0.00 175.22 174.34 3hck s MET 31 N -2.29 0.59 0.01 1.99 0.23 0.66 -1.86 119.30 118.63 3hck s MET 31 Ca -0.08 -0.35 0.05 0.00 -1.03 0.00 0.00 55.69 54.29 3hck s MET 31 Cb -0.04 0.25 -0.03 0.00 -1.53 0.00 0.00 34.83 33.48 3hck s MET 31 CO -0.04 -0.16 -0.14 0.42 -2.03 0.00 0.00 175.02 173.08 3hck s ILE 32 N -1.53 3.08 -0.14 3.16 1.01 -0.25 -0.96 121.20 125.58 3hck s ILE 32 Ca -0.13 -0.95 -0.20 0.00 0.00 0.00 0.00 60.65 59.37 3hck s ILE 32 Cb -0.06 -2.28 0.05 0.00 0.01 0.00 0.00 42.46 40.18 3hck s ILE 32 CO 0.02 0.42 0.51 0.00 0.00 0.00 0.00 174.94 175.90 3hck s ARG 33 N -1.23 0.70 0.46 2.79 1.70 -0.84 -1.12 118.95 121.40 3hck s ARG 33 Ca 0.14 0.49 -0.21 0.00 -0.47 0.00 0.00 55.73 55.69 3hck s ARG 33 Cb -0.11 0.33 -0.09 0.00 -0.57 0.00 0.00 34.95 34.52 3hck s ARG 33 CO 0.05 -0.13 1.04 0.34 -1.08 0.00 0.00 175.30 175.51 3hck s ASP 34 N -0.24 6.46 0.08 -2.89 -1.08 -1.26 -0.92 116.67 116.83 3hck s ASP 34 Ca -0.04 1.95 -0.31 0.00 -0.52 0.00 0.00 52.55 53.63 3hck s ASP 34 Cb -0.03 -2.57 -0.07 0.00 -1.46 0.00 0.00 42.92 38.79 3hck s ASP 34 CO 0.03 -0.70 1.31 -0.55 0.52 0.00 0.00 175.17 175.78 3hck s SER 35 N -1.89 6.93 0.07 -0.34 0.15 -0.48 -4.77 113.70 113.37 3hck s SER 35 Ca 0.65 2.18 0.27 0.00 0.70 0.00 0.00 55.95 59.75 3hck s SER 35 Cb -0.17 -2.58 0.89 0.00 -1.71 0.00 0.00 66.02 62.45 3hck s SER 35 CO 0.21 -0.58 1.73 -1.84 1.20 0.00 0.00 173.24 173.96 3hck n GLU 36 N 4.04 0.11 0.00 5.44 0.28 -1.26 -4.24 120.64 125.01 3hck n GLU 36 Ca 0.11 0.07 0.00 0.00 -0.16 0.00 0.00 57.16 57.17 3hck n GLU 36 Cb 0.44 -1.61 0.00 0.00 1.43 0.00 0.00 31.44 31.70 3hck n GLU 36 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 3hck n THR 37 N -1.78 0.00 -2.72 3.84 -2.24 -1.26 -4.77 114.28 105.35 3hck n THR 37 Ca 0.06 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.42 3hck n THR 37 Cb 0.38 -0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 3hck n THR 37 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3hck s THR 38 N 0.00 4.26 0.27 4.28 2.01 -1.26 -4.98 115.64 120.22 3hck s THR 38 Ca 0.00 -1.06 -0.30 0.00 0.31 0.00 0.00 61.69 60.65 3hck s THR 38 Cb 0.00 -4.93 -0.13 0.00 0.01 0.00 0.00 72.50 67.45 3hck s THR 38 CO 0.00 -1.75 1.27 0.29 -0.69 0.00 0.00 174.62 173.74 3hck n LYS 39 N 7.90 1.83 0.00 4.92 5.02 -1.26 -2.35 118.16 134.23 3hck n LYS 39 Ca 0.27 0.65 0.00 0.00 -2.02 0.00 0.00 58.31 57.21 3hck n LYS 39 Cb 0.50 -2.21 0.00 0.00 -0.02 0.00 0.00 35.03 33.30 3hck n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hck n GLY 40 N 1.57 2.41 3.72 0.72 0.00 -1.26 -5.08 105.19 107.27 3hck n GLY 40 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 3hck n GLY 40 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hck s SER 41 N -1.68 5.24 0.23 1.61 0.01 -0.99 -4.87 113.70 113.26 3hck s SER 41 Ca 0.00 -0.10 0.08 0.00 1.31 0.00 0.00 55.95 57.24 3hck s SER 41 Cb 0.00 -1.32 -0.04 0.00 0.21 0.00 0.00 66.02 64.87 3hck s SER 41 CO 0.00 0.18 0.03 -0.31 0.41 0.00 0.00 173.24 173.54 3hck s TYR 42 N -1.34 2.81 -0.05 2.43 1.51 -1.03 -1.38 117.35 120.29 3hck s TYR 42 Ca 0.27 -0.18 -0.01 0.00 -1.01 0.00 0.00 57.07 56.14 3hck s TYR 42 Cb -0.12 -1.29 0.03 0.00 -0.11 0.00 0.00 41.96 40.47 3hck s TYR 42 CO 0.20 0.57 0.02 -1.12 -1.11 0.00 0.00 175.55 174.10 3hck s SER 43 N -3.46 1.11 0.05 2.29 0.01 -0.09 -0.66 113.70 112.96 3hck s SER 43 Ca 0.30 -0.02 -0.05 0.00 1.31 0.00 0.00 55.95 57.49 3hck s SER 43 Cb -0.08 -0.30 -0.05 0.00 0.21 0.00 0.00 66.02 65.81 3hck s SER 43 CO 0.20 -0.18 0.29 -0.22 0.41 0.00 0.00 173.24 173.75 3hck s LEU 44 N 1.72 4.34 -0.03 2.44 2.96 0.18 -1.99 118.68 128.30 3hck s LEU 44 Ca 0.00 0.53 0.01 0.00 -0.22 0.00 0.00 54.13 54.46 3hck s LEU 44 Cb -0.13 -2.88 0.01 0.00 0.50 0.00 0.00 46.19 43.70 3hck s LEU 44 CO -0.03 0.19 -0.04 -0.44 -1.32 0.00 0.00 176.35 174.70 3hck s SER 45 N -1.99 0.75 0.08 3.68 0.01 -0.13 0.12 113.70 116.22 3hck s SER 45 Ca 0.32 -0.10 0.03 0.00 1.31 0.00 0.00 55.95 57.51 3hck s SER 45 Cb -0.13 -0.29 -0.03 0.00 0.21 0.00 0.00 66.02 65.78 3hck s SER 45 CO 0.20 -0.02 -0.10 -0.69 0.41 0.00 0.00 173.24 173.04 3hck s VAL 46 N 0.58 0.84 -0.05 3.43 1.01 -0.89 -0.24 120.40 125.08 3hck s VAL 46 Ca -0.07 -1.52 -0.18 0.00 0.00 0.00 0.00 61.98 60.20 3hck s VAL 46 Cb -0.10 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 3hck s VAL 46 CO -0.00 -0.52 0.50 -0.60 0.00 0.00 0.00 175.10 174.48 3hck s ARG 47 N -2.55 4.24 0.06 2.72 3.00 -0.16 0.35 118.95 126.62 3hck s ARG 47 Ca 0.02 0.54 -0.03 0.00 -1.00 0.00 0.00 55.73 55.27 3hck s ARG 47 Cb -0.04 -3.36 -0.03 0.00 0.00 0.00 0.00 34.95 31.52 3hck s ARG 47 CO -0.00 0.35 0.02 0.34 0.00 0.00 0.00 175.30 176.01 3hck s ASP 48 N -0.04 0.40 0.07 -2.12 2.15 -0.13 -3.71 116.67 113.29 3hck s ASP 48 Ca 0.27 -0.93 0.04 0.00 0.43 0.00 0.00 52.55 52.36 3hck s ASP 48 Cb -0.17 0.24 -0.03 0.00 -0.30 0.00 0.00 42.92 42.66 3hck s ASP 48 CO 0.13 -0.63 -0.11 -0.47 -0.17 0.00 0.00 175.17 173.92 3hck s TYR 49 N -3.91 1.02 0.02 -5.34 6.14 -1.26 0.31 117.35 114.33 3hck s TYR 49 Ca 0.07 -0.52 0.05 0.00 0.64 0.00 0.00 57.07 57.31 3hck s TYR 49 Cb 0.07 -0.58 -0.02 0.00 0.42 0.00 0.00 41.96 41.86 3hck s TYR 49 CO -0.10 0.00 -0.14 -0.51 0.64 0.00 0.00 175.55 175.45 3hck s ASP 50 N -1.86 1.62 0.00 4.32 1.01 0.36 -4.94 116.67 117.18 3hck s ASP 50 Ca -0.03 -0.38 0.23 0.00 0.71 0.00 0.00 52.55 53.09 3hck s ASP 50 Cb -0.08 -0.13 1.22 0.00 1.01 0.00 0.00 42.92 44.94 3hck s ASP 50 CO 0.01 0.08 1.76 -0.81 0.21 0.00 0.00 175.17 176.42 3hck n PRO 51 N 2.21 0.43 -0.10 8.23 -0.04 -1.26 -0.14 135.00 144.33 3hck n PRO 51 Ca -0.17 0.05 -0.13 0.00 -0.04 0.00 0.00 63.50 63.22 3hck n PRO 51 Cb 0.55 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.47 3hck n PRO 51 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3hck n ARG 52 N -1.21 0.53 -0.08 0.54 3.00 -1.26 -4.80 116.66 113.38 3hck n ARG 52 Ca 0.13 0.26 -0.12 0.00 -0.01 0.00 0.00 57.85 58.11 3hck n ARG 52 Cb 0.16 -1.47 -0.07 0.00 0.00 0.00 0.00 32.46 31.08 3hck n ARG 52 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 3hck h GLN 53 N -1.00 0.00 0.00 5.56 4.20 -1.99 -3.51 115.11 118.38 3hck h GLN 53 Ca -0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.58 3hck h GLN 53 Cb 1.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.85 3hck h GLN 53 CO -0.08 0.50 0.00 0.41 -0.67 0.00 0.00 178.83 178.99 3hck n GLY 54 N 1.57 0.54 3.72 3.46 0.00 0.80 -4.95 105.19 110.32 3hck n GLY 54 Ca -0.16 -0.96 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 3hck n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hck s ASP 55 N -4.00 7.28 0.21 1.61 1.01 -1.26 0.13 116.67 121.65 3hck s ASP 55 Ca 0.00 1.86 -0.08 0.00 0.71 0.00 0.00 52.55 55.04 3hck s ASP 55 Cb 0.00 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 41.33 3hck s ASP 55 CO 0.00 -0.30 0.31 0.42 0.21 0.00 0.00 175.17 175.81 3hck s THR 56 N 0.69 0.02 -0.03 -1.27 -4.23 0.15 -4.91 115.64 106.06 3hck s THR 56 Ca 0.53 -1.61 -0.01 0.00 -1.18 0.00 0.00 61.69 59.42 3hck s THR 56 Cb -0.25 -2.21 0.03 0.00 1.34 0.00 0.00 72.50 71.40 3hck s THR 56 CO 0.30 -0.08 0.03 -0.69 -0.54 0.00 0.00 174.62 173.64 3hck s VAL 57 N -4.05 0.02 0.52 2.29 1.01 -1.26 -0.95 120.40 117.98 3hck s VAL 57 Ca 0.27 0.25 -0.02 0.00 0.00 0.00 0.00 61.98 62.48 3hck s VAL 57 Cb 0.03 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 36.22 3hck s VAL 57 CO 0.08 0.15 0.78 -0.54 0.00 0.00 0.00 175.10 175.57 3hck s LYS 58 N 1.54 2.92 -0.25 2.72 -0.14 0.16 -4.93 119.74 121.76 3hck s LYS 58 Ca -0.03 -0.32 -0.02 0.00 -1.36 0.00 0.00 55.97 54.24 3hck s LYS 58 Cb -0.13 -2.43 0.13 0.00 -1.68 0.00 0.00 37.83 33.73 3hck s LYS 58 CO -0.03 -0.52 0.35 -1.01 -0.76 0.00 0.00 175.35 173.38 3hck s HIS 59 N -2.77 -0.72 0.22 3.18 3.76 -1.26 -2.09 115.29 115.61 3hck s HIS 59 Ca 0.52 0.50 0.00 0.00 -0.15 0.00 0.00 55.06 55.93 3hck s HIS 59 Cb -0.10 -0.14 -0.04 0.00 1.11 0.00 0.00 32.58 33.41 3hck s HIS 59 CO 0.41 -0.78 0.40 0.71 -0.85 0.00 0.00 174.74 174.64 3hck s TYR 60 N 2.48 3.48 0.05 1.40 2.02 0.32 -4.92 117.35 122.19 3hck s TYR 60 Ca 0.11 0.29 0.00 0.00 -0.37 0.00 0.00 57.07 57.10 3hck s TYR 60 Cb -0.15 -1.82 -0.04 0.00 -0.40 0.00 0.00 41.96 39.55 3hck s TYR 60 CO -0.20 0.36 0.19 0.15 -1.57 0.00 0.00 175.55 174.48 3hck s LYS 61 N -3.51 3.36 -0.30 -0.62 -0.14 -1.26 0.50 119.74 117.77 3hck s LYS 61 Ca 0.38 -0.46 0.01 0.00 -1.36 0.00 0.00 55.97 54.54 3hck s LYS 61 Cb -0.11 -3.00 0.09 0.00 -1.68 0.00 0.00 37.83 33.13 3hck s LYS 61 CO 0.30 0.61 0.04 0.42 -0.76 0.00 0.00 175.35 175.96 3hck s ILE 62 N -1.47 1.50 0.32 2.17 1.01 0.17 -4.57 121.20 120.33 3hck s ILE 62 Ca 0.33 -1.63 -0.03 0.00 0.00 0.00 0.00 60.65 59.32 3hck s ILE 62 Cb -0.13 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.28 3hck s ILE 62 CO 0.26 -0.48 0.57 -0.13 0.00 0.00 0.00 174.94 175.16 3hck s ARG 63 N 1.33 3.57 0.30 2.79 1.81 -1.04 -2.48 118.95 125.23 3hck s ARG 63 Ca 0.05 -0.10 0.08 0.00 -1.72 0.00 0.00 55.73 54.05 3hck s ARG 63 Cb -0.18 -2.63 -0.04 0.00 -0.45 0.00 0.00 34.95 31.65 3hck s ARG 63 CO -0.14 0.16 0.11 0.95 -0.68 0.00 0.00 175.30 175.70 3hck s THR 64 N -2.21 3.45 0.89 0.02 -4.23 -1.26 -0.82 115.64 111.49 3hck s THR 64 Ca 0.43 -1.70 -0.11 0.00 -1.18 0.00 0.00 61.69 59.12 3hck s THR 64 Cb -0.10 -3.02 0.20 0.00 1.34 0.00 0.00 72.50 70.92 3hck s THR 64 CO 0.33 -0.28 1.22 0.18 -0.54 0.00 0.00 174.62 175.53 3hck n LEU 65 N -1.08 0.00 -2.04 4.79 4.77 0.11 -4.94 117.00 118.61 3hck n LEU 65 Ca -0.05 -1.66 -0.22 0.00 -0.03 0.00 0.00 56.01 54.05 3hck n LEU 65 Cb 0.60 -0.89 0.12 0.00 -2.33 0.00 0.00 43.42 40.92 3hck n LEU 65 CO 0.42 -1.30 1.20 0.47 -1.33 0.00 0.00 177.39 176.85 3hck n ASP 66 N -3.55 4.53 0.00 -1.43 8.00 -1.26 -4.22 116.55 118.62 3hck n ASP 66 Ca 0.17 -3.36 0.00 0.00 0.71 0.00 0.00 54.79 52.31 3hck n ASP 66 Cb 0.58 -0.83 0.00 0.00 -0.02 0.00 0.00 41.12 40.84 3hck n ASP 66 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3hck n ASN 67 N -0.74 0.00 0.00 -2.24 5.15 -1.26 -5.15 115.26 111.03 3hck n ASN 67 Ca 0.49 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.47 3hck n ASN 67 Cb 1.24 0.24 0.00 0.00 -0.53 0.00 0.00 39.78 40.73 3hck n ASN 67 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hck n GLY 68 N -1.42 3.37 0.00 8.20 0.00 -1.26 -5.19 105.19 108.89 3hck n GLY 68 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3hck n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hck n GLY 69 N -0.23 3.89 3.28 -0.02 0.00 -1.26 -4.68 105.19 106.18 3hck n GLY 69 Ca 0.00 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.16 3hck n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hck s PHE 70 N -2.05 2.20 -0.04 1.61 0.40 0.21 -0.71 117.98 119.60 3hck s PHE 70 Ca 0.00 -0.43 -0.07 0.00 -0.60 0.00 0.00 56.93 55.83 3hck s PHE 70 Cb 0.00 -1.42 0.01 0.00 0.51 0.00 0.00 43.02 42.12 3hck s PHE 70 CO 0.00 -0.05 0.18 1.52 0.70 0.00 0.00 175.22 177.57 3hck s TYR 71 N -0.55 -0.12 -0.25 0.36 1.13 0.00 -1.67 117.35 116.26 3hck s TYR 71 Ca 0.09 0.26 -0.06 0.00 -1.41 0.00 0.00 57.07 55.95 3hck s TYR 71 Cb -0.10 0.03 -0.16 0.00 -1.10 0.00 0.00 41.96 40.63 3hck s TYR 71 CO -0.01 -0.18 -0.19 -0.89 -2.51 0.00 0.00 175.55 171.76 3hck n ILE 72 N 2.33 1.53 -4.71 -3.49 5.41 -1.26 -2.49 119.36 116.68 3hck n ILE 72 Ca -0.17 -0.48 -0.30 0.00 1.00 0.00 0.00 62.75 62.80 3hck n ILE 72 Cb 0.57 -1.65 -0.14 0.00 -0.71 0.00 0.00 39.64 37.71 3hck n ILE 72 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 3hck s SER 73 N -6.94 3.25 -0.73 4.38 0.15 -1.26 -4.93 113.70 107.62 3hck s SER 73 Ca -0.35 -0.64 -0.06 0.00 0.70 0.00 0.00 55.95 55.59 3hck s SER 73 Cb 0.11 -0.28 -0.12 0.00 -1.71 0.00 0.00 66.02 64.02 3hck s SER 73 CO 0.58 0.23 2.63 -0.81 1.20 0.00 0.00 173.24 177.06 3hck n PRO 74 N 1.44 2.27 0.12 5.44 -0.04 -1.26 -3.55 135.00 139.42 3hck n PRO 74 Ca -0.17 -1.37 0.00 0.00 -0.04 0.00 0.00 63.50 61.92 3hck n PRO 74 Cb 0.52 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.67 3hck n PRO 74 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3hck n ARG 75 N 3.41 0.00 -3.96 0.54 5.12 -1.26 -5.06 116.66 115.45 3hck n ARG 75 Ca 0.48 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 56.10 3hck n ARG 75 Cb 0.38 -0.03 -0.15 0.00 -1.16 0.00 0.00 32.46 31.50 3hck n ARG 75 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 3hck s SER 76 N -4.89 4.12 0.46 0.55 0.01 -1.23 -5.12 113.70 107.60 3hck s SER 76 Ca 0.00 -1.41 0.05 0.00 1.31 0.00 0.00 55.95 55.90 3hck s SER 76 Cb 0.00 -1.29 0.02 0.00 0.21 0.00 0.00 66.02 64.95 3hck s SER 76 CO 0.00 -0.26 0.64 0.42 0.41 0.00 0.00 173.24 174.45 3hck s THR 77 N 1.28 3.02 -0.02 1.44 -4.23 -1.26 -4.66 115.64 111.20 3hck s THR 77 Ca -0.03 -0.85 -0.02 0.00 -1.18 0.00 0.00 61.69 59.61 3hck s THR 77 Cb -0.19 -3.06 0.01 0.00 1.34 0.00 0.00 72.50 70.60 3hck s THR 77 CO -0.08 -0.03 0.07 -0.36 -0.54 0.00 0.00 174.62 173.68 3hck s PHE 78 N -2.49 -0.06 0.02 3.99 0.40 -0.67 -5.02 117.98 114.14 3hck s PHE 78 Ca 0.55 0.16 0.22 0.00 -0.60 0.00 0.00 56.93 57.25 3hck s PHE 78 Cb -0.10 0.02 0.67 0.00 0.51 0.00 0.00 43.02 44.12 3hck s PHE 78 CO 0.35 -0.05 1.72 0.77 0.70 0.00 0.00 175.22 178.71 3hck h SER 79 N 5.95 0.00 -4.38 1.36 0.02 -1.88 0.61 113.55 115.23 3hck h SER 79 Ca -0.25 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.39 3hck h SER 79 Cb 1.20 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.57 3hck h SER 79 CO 0.46 0.27 -0.73 0.42 -1.14 0.00 0.00 176.83 176.12 3hck s THR 80 N -3.45 0.92 -0.17 -2.27 -4.23 -1.26 -4.11 115.64 101.07 3hck s THR 80 Ca 0.02 -1.70 0.17 0.00 -1.18 0.00 0.00 61.69 59.00 3hck s THR 80 Cb 0.09 -1.42 0.12 0.00 1.34 0.00 0.00 72.50 72.63 3hck s THR 80 CO 0.66 -0.61 1.51 -0.07 -0.54 0.00 0.00 174.62 175.57 3hck h LEU 81 N 3.45 0.00 -1.11 4.79 3.38 -1.92 -3.07 115.31 120.83 3hck h LEU 81 Ca -0.37 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.51 3hck h LEU 81 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 3hck h LEU 81 CO 0.55 0.40 -0.41 -0.61 0.09 0.00 0.00 178.44 178.46 3hck h GLN 82 N 0.00 0.00 0.00 1.13 5.75 -1.99 0.14 115.11 120.15 3hck h GLN 82 Ca -0.00 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.44 3hck h GLN 82 Cb 1.27 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.81 3hck h GLN 82 CO 0.05 0.41 -0.49 0.93 -2.65 0.00 0.00 178.83 177.09 3hck h GLU 83 N 0.00 0.00 0.00 1.69 4.39 -1.96 -2.72 114.58 115.97 3hck h GLU 83 Ca -0.00 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.45 3hck h GLU 83 Cb 0.80 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.41 3hck h GLU 83 CO 0.05 0.22 -1.33 1.25 -1.16 0.00 0.00 179.01 178.04 3hck h LEU 84 N 0.00 0.00 -0.35 1.33 6.46 -1.36 -2.58 115.31 118.81 3hck h LEU 84 Ca -0.02 0.00 -0.19 0.00 -0.12 0.00 0.00 57.88 57.55 3hck h LEU 84 Cb 1.21 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.14 3hck h LEU 84 CO 0.03 0.98 -0.79 0.58 -0.62 0.00 0.00 178.44 178.63 3hck h VAL 85 N 0.00 1.40 -0.17 1.05 2.07 -1.00 -2.05 116.25 117.54 3hck h VAL 85 Ca -0.14 -2.26 -0.20 0.00 0.82 0.00 0.00 66.70 64.91 3hck h VAL 85 Cb 1.87 2.22 0.01 0.00 -1.52 0.00 0.00 31.29 33.87 3hck h VAL 85 CO 0.10 0.68 -0.68 0.44 0.02 0.00 0.00 177.57 178.13 3hck h ASP 86 N 0.23 0.89 -0.19 0.57 5.19 -1.56 -1.74 116.42 119.81 3hck h ASP 86 Ca -0.04 -0.61 -0.03 0.00 -0.62 0.00 0.00 57.03 55.72 3hck h ASP 86 Cb 1.38 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 40.61 3hck h ASP 86 CO 0.13 1.35 0.04 -0.74 -3.12 0.00 0.00 179.24 176.90 3hck h HIS 87 N 0.47 0.42 0.00 4.55 2.76 -1.43 -1.32 115.15 120.60 3hck h HIS 87 Ca -0.04 -0.03 -0.13 0.00 -2.20 0.00 0.00 60.37 57.97 3hck h HIS 87 Cb 1.31 -0.13 -0.02 0.00 1.55 0.00 0.00 27.41 30.12 3hck h HIS 87 CO 0.09 0.40 -0.63 1.88 -1.30 0.00 0.00 177.93 178.36 3hck h TYR 88 N 0.41 0.00 0.00 5.26 -1.99 -1.24 -2.42 116.97 116.98 3hck h TYR 88 Ca 0.10 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.77 3hck h TYR 88 Cb 0.22 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.94 3hck h TYR 88 CO 0.01 0.63 -0.25 0.87 -0.00 0.00 0.00 178.16 179.42 3hck h LYS 89 N 0.00 0.00 0.00 4.88 1.57 -0.34 -1.45 116.57 121.23 3hck h LYS 89 Ca -0.01 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.56 3hck h LYS 89 Cb 1.31 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.58 3hck h LYS 89 CO 0.08 0.25 -1.21 0.87 -0.57 0.00 0.00 179.45 178.87 3hck h LYS 90 N 0.00 0.00 0.00 3.15 1.57 -1.17 -3.43 116.57 116.69 3hck h LYS 90 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hck h LYS 90 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 3hck h LYS 90 CO 0.03 0.63 0.00 0.41 -0.57 0.00 0.00 179.45 179.95 3hck n GLY 91 N 1.40 1.16 0.05 3.86 0.00 -0.93 -5.03 105.19 105.70 3hck n GLY 91 Ca -0.07 -0.56 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 3hck n GLY 91 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 3hck h ASN 92 N 0.00 0.03 -6.74 1.61 -1.07 -1.83 -3.32 115.58 104.27 3hck h ASN 92 Ca 0.00 -0.04 -0.55 0.00 0.07 0.00 0.00 56.30 55.78 3hck h ASN 92 Cb 0.00 -0.01 -0.04 0.00 -2.07 0.00 0.00 38.32 36.21 3hck h ASN 92 CO 0.00 0.06 -0.97 -0.67 0.07 0.00 0.00 177.43 175.92 3hck n ASP 93 N -5.05 -2.81 0.00 6.14 2.03 -1.26 -2.56 116.55 113.04 3hck n ASP 93 Ca -0.07 -1.19 0.00 0.00 0.52 0.00 0.00 54.79 54.06 3hck n ASP 93 Cb 0.05 -2.26 0.00 0.00 -0.72 0.00 0.00 41.12 38.19 3hck n ASP 93 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hck n GLY 94 N -2.08 3.69 2.45 0.27 0.00 -1.26 -5.04 105.19 103.23 3hck n GLY 94 Ca -0.18 -0.92 -0.23 0.00 0.00 0.00 0.00 46.02 44.70 3hck n GLY 94 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hck n LEU 95 N 0.00 0.00 0.01 0.99 4.77 -1.06 -4.97 117.00 116.74 3hck n LEU 95 Ca 0.00 -0.72 -0.22 0.00 -0.03 0.00 0.00 56.01 55.04 3hck n LEU 95 Cb 0.00 -0.75 -0.14 0.00 -2.33 0.00 0.00 43.42 40.20 3hck n LEU 95 CO 0.00 -2.33 -0.57 0.00 -1.33 0.00 0.00 177.39 173.16 3hck s GLN 97 N -2.51 0.06 0.98 0.00 -0.21 -1.26 -5.02 119.66 111.70 3hck s GLN 97 Ca -0.21 0.16 -0.13 0.00 0.02 0.00 0.00 55.36 55.20 3hck s GLN 97 Cb 0.05 -0.06 0.07 0.00 1.00 0.00 0.00 33.01 34.08 3hck s GLN 97 CO 0.77 -0.07 0.48 0.36 -2.12 0.00 0.00 175.29 174.71 3hck n LYS 98 N 3.49 -0.60 -3.01 2.91 2.85 -1.26 -4.71 118.16 117.83 3hck n LYS 98 Ca -0.18 -0.14 -0.39 0.00 -1.05 0.00 0.00 58.31 56.55 3hck n LYS 98 Cb 0.56 -1.92 -0.06 0.00 -0.65 0.00 0.00 35.03 32.96 3hck n LYS 98 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3hck s LEU 99 N -2.17 4.57 0.00 -5.58 1.43 -0.57 -4.82 118.68 111.53 3hck s LEU 99 Ca 0.59 1.61 0.00 0.00 -1.03 0.00 0.00 54.13 55.29 3hck s LEU 99 Cb -0.20 -3.30 0.00 0.00 0.03 0.00 0.00 46.19 42.71 3hck s LEU 99 CO 0.66 0.20 0.00 -1.54 0.23 0.00 0.00 176.35 175.89 3hck n SER 100 N 1.51 0.00 -3.97 2.29 3.41 -0.95 -4.56 113.62 111.35 3hck n SER 100 Ca -0.06 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.46 3hck n SER 100 Cb 0.49 -0.14 -0.10 0.00 -0.26 0.00 0.00 64.21 64.20 3hck n SER 100 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3hck s VAL 101 N -0.29 0.12 0.46 -3.33 -7.23 -1.25 -5.02 120.40 103.86 3hck s VAL 101 Ca 0.00 -1.03 -0.21 0.00 -1.81 0.00 0.00 61.98 58.93 3hck s VAL 101 Cb 0.00 -0.58 -0.09 0.00 0.56 0.00 0.00 36.38 36.27 3hck s VAL 101 CO 0.00 -0.57 1.04 -2.16 -0.31 0.00 0.00 175.10 173.10 3hck s PRO 102 N -2.01 3.89 0.66 4.82 0.04 -1.26 -2.52 135.00 138.62 3hck s PRO 102 Ca -0.11 1.40 -0.17 0.00 0.04 0.00 0.00 61.00 62.16 3hck s PRO 102 Cb -0.05 -2.21 -0.12 0.00 0.04 0.00 0.00 34.50 32.16 3hck s PRO 102 CO -0.02 -0.36 -0.08 0.00 0.04 0.00 0.00 177.00 176.58 3hck s MET 104 N -1.68 4.46 -0.31 0.00 -1.94 -1.26 -4.84 119.30 113.73 3hck s MET 104 Ca 0.56 1.01 0.00 0.00 -1.71 0.00 0.00 55.69 55.56 3hck s MET 104 Cb -0.40 -3.30 0.07 0.00 2.01 0.00 0.00 34.83 33.21 3hck s MET 104 CO 0.67 0.46 0.01 0.45 -0.01 0.00 0.00 175.02 176.60 3hck s SER 105 N -0.65 4.81 -0.00 3.03 0.15 -1.26 -5.09 113.70 114.68 3hck s SER 105 Ca 0.35 -1.55 0.05 0.00 0.70 0.00 0.00 55.95 55.50 3hck s SER 105 Cb -0.21 -1.67 -0.01 0.00 -1.71 0.00 0.00 66.02 62.41 3hck s SER 105 CO 0.23 -0.30 -0.16 -0.55 1.20 0.00 0.00 173.24 173.66 3hck s SER 106 N 1.24 1.90 0.00 5.45 0.15 -1.26 -5.19 113.70 115.99 3hck s SER 106 Ca -0.02 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.30 3hck s SER 106 Cb -0.20 -0.20 0.00 0.00 -1.71 0.00 0.00 66.02 63.91 3hck s SER 106 CO -0.04 0.18 0.46 0.29 1.20 0.00 0.00 173.24 175.33