#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 0.00 -4.23 0.03 2.13 -1.26 -5.12 120.64 112.19 3hck n GLU 2 Ca 0.00 -0.67 -0.17 0.00 0.66 0.00 0.00 57.16 56.98 3hck n GLU 2 Cb 0.00 0.25 -0.13 0.00 0.27 0.00 0.00 31.44 31.83 3hck n GLU 2 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 3hck s THR 3 N 0.00 0.79 -0.27 6.31 -4.23 -1.26 -5.13 115.64 111.86 3hck s THR 3 Ca 0.02 -0.85 -0.12 0.00 -1.18 0.00 0.00 61.69 59.56 3hck s THR 3 Cb 0.02 -0.74 -0.05 0.00 1.34 0.00 0.00 72.50 73.07 3hck s THR 3 CO -0.01 -0.08 0.23 -1.61 -0.54 0.00 0.00 174.62 172.61 3hck s GLU 4 N -1.04 4.00 -0.47 3.99 8.01 -1.26 -4.97 118.70 126.95 3hck s GLU 4 Ca -0.02 -0.22 0.04 0.00 0.01 0.00 0.00 54.97 54.79 3hck s GLU 4 Cb -0.07 -3.63 0.41 0.00 -4.31 0.00 0.00 34.13 26.54 3hck s GLU 4 CO 0.01 -0.14 1.20 0.39 0.01 0.00 0.00 175.26 176.73 3hck n GLU 5 N 4.90 3.37 0.13 1.61 1.02 -1.26 -4.68 120.64 125.74 3hck n GLU 5 Ca -0.13 -4.41 0.12 0.00 -0.02 0.00 0.00 57.16 52.73 3hck n GLU 5 Cb 0.52 -2.25 0.25 0.00 -0.02 0.00 0.00 31.44 29.93 3hck n GLU 5 CO 0.00 0.00 0.00 0.11 1.18 0.00 0.00 177.13 178.42 3hck h TRP 6 N 2.61 0.00 -3.19 -0.32 5.08 -1.93 -3.45 115.95 114.74 3hck h TRP 6 Ca 0.33 0.00 -0.59 0.00 1.08 0.00 0.00 58.89 59.71 3hck h TRP 6 Cb 0.85 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.95 3hck h TRP 6 CO 0.86 0.00 -0.15 0.12 -1.28 0.00 0.00 178.44 177.99 3hck s PHE 7 N -3.17 3.64 0.14 0.12 5.36 -1.26 -2.01 117.98 120.79 3hck s PHE 7 Ca 0.08 0.99 0.07 0.00 -0.96 0.00 0.00 56.93 57.10 3hck s PHE 7 Cb 0.10 -2.44 -0.04 0.00 -0.34 0.00 0.00 43.02 40.30 3hck s PHE 7 CO 0.66 0.42 -0.02 -0.06 -1.46 0.00 0.00 175.22 174.76 3hck s PHE 8 N -0.30 2.86 0.14 10.12 0.08 0.60 -4.97 117.98 126.51 3hck s PHE 8 Ca 0.25 -0.11 0.11 0.00 0.12 0.00 0.00 56.93 57.30 3hck s PHE 8 Cb -0.16 -1.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.82 3hck s PHE 8 CO 0.13 0.49 -0.26 -1.59 -0.10 0.00 0.00 175.22 173.88 3hck s LYS 9 N -2.64 1.43 -1.24 0.44 0.00 -1.26 -3.96 119.74 112.50 3hck s LYS 9 Ca 0.26 -1.37 -0.32 0.00 0.00 0.00 0.00 55.97 54.54 3hck s LYS 9 Cb -0.10 -1.90 0.04 0.00 0.00 0.00 0.00 37.83 35.87 3hck s LYS 9 CO 0.18 0.44 0.64 0.41 0.00 0.00 0.00 175.35 177.02 3hck n GLY 10 N 0.82 -0.79 3.36 0.59 0.00 -1.26 -4.95 105.19 102.96 3hck n GLY 10 Ca -0.17 0.33 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 3hck n GLY 10 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hck s ILE 11 N -3.59 1.89 0.39 -0.61 1.01 -1.26 -5.16 121.20 113.87 3hck s ILE 11 Ca 0.46 -2.06 0.03 0.00 0.00 0.00 0.00 60.65 59.07 3hck s ILE 11 Cb -0.25 -1.96 0.03 0.00 0.01 0.00 0.00 42.46 40.29 3hck s ILE 11 CO 0.97 -0.40 0.25 -1.54 0.00 0.00 0.00 174.94 174.22 3hck n SER 12 N -0.01 2.38 0.04 3.58 3.41 -1.26 -4.94 113.62 116.82 3hck n SER 12 Ca -0.11 -2.40 -0.04 0.00 -0.26 0.00 0.00 58.87 56.05 3hck n SER 12 Cb 0.58 0.01 -0.09 0.00 -0.26 0.00 0.00 64.21 64.45 3hck n SER 12 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3hck h ARG 13 N 0.00 0.00 0.00 4.33 1.12 -2.01 -2.51 114.38 115.31 3hck h ARG 13 Ca -0.26 0.00 -0.18 0.00 -1.11 0.00 0.00 59.98 58.43 3hck h ARG 13 Cb 0.92 0.00 -0.03 0.00 -0.01 0.00 0.00 29.97 30.85 3hck h ARG 13 CO 0.41 0.60 -0.87 0.87 -3.11 0.00 0.00 179.97 177.87 3hck h LYS 14 N 0.00 0.00 0.02 0.20 1.79 -1.99 -1.97 116.57 114.63 3hck h LYS 14 Ca -0.13 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.12 3hck h LYS 14 Cb 1.74 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 32.37 3hck h LYS 14 CO 0.08 0.87 -1.06 -0.44 -1.08 0.00 0.00 179.45 177.83 3hck h ASP 15 N 0.00 0.06 1.58 0.86 5.19 -1.97 -2.75 116.42 119.40 3hck h ASP 15 Ca -0.01 -0.07 -0.02 0.00 -0.62 0.00 0.00 57.03 56.31 3hck h ASP 15 Cb 1.56 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 41.04 3hck h ASP 15 CO 0.11 1.06 -0.11 0.00 -3.12 0.00 0.00 179.24 177.18 3hck h ALA 16 N 0.93 0.95 0.17 3.45 0.00 -1.40 -1.13 119.26 122.24 3hck h ALA 16 Ca -0.04 -0.10 -0.30 0.00 0.00 0.00 0.00 54.91 54.47 3hck h ALA 16 Cb 1.81 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.60 3hck h ALA 16 CO 0.14 0.14 -1.33 0.93 0.00 0.00 0.00 179.25 179.13 3hck h GLU 17 N 0.00 0.37 0.01 0.00 5.08 -1.30 -2.84 114.58 115.91 3hck h GLU 17 Ca -0.00 -0.63 -0.21 0.00 -1.00 0.00 0.00 59.36 57.52 3hck h GLU 17 Cb 0.93 0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 3hck h GLU 17 CO 0.01 1.30 -0.98 0.07 -1.00 0.00 0.00 179.01 178.42 3hck h ARG 18 N 0.10 0.04 -0.20 2.33 0.11 -1.42 -2.19 114.38 113.14 3hck h ARG 18 Ca -0.18 -0.07 -0.03 0.00 0.10 0.00 0.00 59.98 59.80 3hck h ARG 18 Cb 2.04 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 33.14 3hck h ARG 18 CO 0.23 0.98 -0.00 1.96 0.10 0.00 0.00 179.97 183.24 3hck h GLN 19 N 0.02 0.36 -0.08 0.08 4.20 -1.27 1.42 115.11 119.84 3hck h GLN 19 Ca -0.03 -0.12 -0.12 0.00 0.06 0.00 0.00 58.65 58.45 3hck h GLN 19 Cb 1.70 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.44 3hck h GLN 19 CO 0.13 0.57 -0.48 -0.07 -0.67 0.00 0.00 178.83 178.31 3hck h LEU 20 N 0.12 0.20 -0.01 1.46 3.38 -1.57 -2.08 115.31 116.81 3hck h LEU 20 Ca 0.06 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3hck h LEU 20 Cb 0.40 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3hck h LEU 20 CO 0.01 0.66 -0.31 0.18 0.09 0.00 0.00 178.44 179.07 3hck n LEU 21 N -3.97 0.33 -4.64 1.67 4.77 -0.82 -4.50 117.00 109.84 3hck n LEU 21 Ca -0.02 0.18 -0.31 0.00 -0.03 0.00 0.00 56.01 55.83 3hck n LEU 21 Cb 0.52 -0.34 0.18 0.00 -2.33 0.00 0.00 43.42 41.46 3hck n LEU 21 CO 0.42 0.08 0.65 0.00 -1.33 0.00 0.00 177.39 177.22 3hck s ALA 22 N -2.98 1.14 -0.75 -1.18 0.00 0.48 -4.86 121.76 113.62 3hck s ALA 22 Ca 0.13 0.49 -0.26 0.00 0.00 0.00 0.00 51.96 52.32 3hck s ALA 22 Cb 0.18 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.88 3hck s ALA 22 CO 0.63 -2.96 1.60 -1.25 0.00 0.00 0.00 175.76 173.78 3hck s PRO 23 N -4.61 2.96 0.00 0.00 0.04 -1.26 -3.30 135.00 128.82 3hck s PRO 23 Ca 0.67 -0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.66 3hck s PRO 23 Cb -0.23 -4.52 0.00 0.00 0.04 0.00 0.00 34.50 29.79 3hck s PRO 23 CO 0.59 -2.52 0.00 0.41 0.04 0.00 0.00 177.00 175.52 3hck n GLY 24 N 5.88 1.47 3.81 0.56 0.00 -1.26 -5.13 105.19 110.52 3hck n GLY 24 Ca 0.18 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 7.07 0.14 1.61 0.01 -1.21 -5.07 114.94 117.49 3hck s ASN 25 Ca 0.00 1.42 0.01 0.00 -0.71 0.00 0.00 52.86 53.58 3hck s ASN 25 Cb 0.00 -2.42 -0.04 0.00 0.41 0.00 0.00 41.25 39.20 3hck s ASN 25 CO 0.00 0.05 -0.01 0.00 -1.51 0.00 0.00 177.10 175.63 3hck s MET 26 N -1.90 0.99 -0.61 -0.60 0.23 -1.26 -4.80 119.30 111.35 3hck s MET 26 Ca 0.42 -1.45 -0.41 0.00 -1.03 0.00 0.00 55.69 53.22 3hck s MET 26 Cb -0.17 -0.17 -0.20 0.00 -1.53 0.00 0.00 34.83 32.76 3hck s MET 26 CO 0.21 -0.11 2.27 1.28 -2.03 0.00 0.00 175.02 176.64 3hck n LEU 27 N -0.15 0.67 0.00 0.18 4.77 -1.26 -0.67 117.00 120.54 3hck n LEU 27 Ca -0.08 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 3hck n LEU 27 Cb 0.62 -0.91 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 3hck n LEU 27 CO 0.32 -0.76 0.00 0.61 -1.33 0.00 0.00 177.39 176.23 3hck n GLY 28 N 7.26 1.24 3.70 -0.72 0.00 -1.26 -5.02 105.19 110.40 3hck n GLY 28 Ca 0.57 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.17 3hck n GLY 28 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hck s SER 29 N -0.49 7.29 0.32 1.61 0.01 0.16 -2.61 113.70 119.99 3hck s SER 29 Ca 0.00 1.69 0.10 0.00 1.31 0.00 0.00 55.95 59.06 3hck s SER 29 Cb 0.00 -2.57 -0.06 0.00 0.21 0.00 0.00 66.02 63.60 3hck s SER 29 CO 0.00 -0.34 -0.13 0.72 0.41 0.00 0.00 173.24 173.89 3hck s PHE 30 N 1.28 2.36 0.09 2.43 -0.12 -1.05 -2.49 117.98 120.48 3hck s PHE 30 Ca 0.52 -0.43 -0.13 0.00 -0.05 0.00 0.00 56.93 56.85 3hck s PHE 30 Cb -0.22 -1.23 0.02 0.00 -0.63 0.00 0.00 43.02 40.96 3hck s PHE 30 CO 0.26 0.64 0.30 0.00 -0.05 0.00 0.00 175.22 176.36 3hck s MET 31 N -3.57 0.91 -0.04 1.99 0.23 0.64 0.46 119.30 119.92 3hck s MET 31 Ca 0.32 -0.74 0.02 0.00 -1.03 0.00 0.00 55.69 54.26 3hck s MET 31 Cb -0.01 0.39 0.01 0.00 -1.53 0.00 0.00 34.83 33.70 3hck s MET 31 CO 0.16 -0.32 -0.08 0.42 -2.03 0.00 0.00 175.02 173.17 3hck s ILE 32 N -3.46 0.78 0.04 3.16 1.01 -0.85 -1.34 121.20 120.54 3hck s ILE 32 Ca 0.01 -0.30 0.02 0.00 0.00 0.00 0.00 60.65 60.39 3hck s ILE 32 Cb 0.02 -0.73 -0.02 0.00 0.01 0.00 0.00 42.46 41.74 3hck s ILE 32 CO -0.09 0.26 -0.08 0.00 0.00 0.00 0.00 174.94 175.03 3hck s ARG 33 N 0.58 0.54 0.42 2.79 1.70 -0.67 -0.29 118.95 124.01 3hck s ARG 33 Ca -0.10 -0.77 -0.03 0.00 -0.47 0.00 0.00 55.73 54.37 3hck s ARG 33 Cb -0.13 -0.31 -0.04 0.00 -0.57 0.00 0.00 34.95 33.91 3hck s ARG 33 CO 0.01 0.05 0.68 0.34 -1.08 0.00 0.00 175.30 175.30 3hck s ASP 34 N -1.60 6.29 0.69 -2.89 2.15 -1.25 -0.60 116.67 119.45 3hck s ASP 34 Ca -0.10 0.72 -0.13 0.00 0.43 0.00 0.00 52.55 53.48 3hck s ASP 34 Cb -0.10 -2.15 0.01 0.00 -0.30 0.00 0.00 42.92 40.38 3hck s ASP 34 CO 0.00 -0.44 1.08 -0.55 -0.17 0.00 0.00 175.17 175.10 3hck s SER 35 N -4.02 5.13 -0.06 -0.34 0.15 -0.15 -4.81 113.70 109.60 3hck s SER 35 Ca 0.44 1.81 0.02 0.00 0.70 0.00 0.00 55.95 58.93 3hck s SER 35 Cb -0.10 -2.52 -0.05 0.00 -1.71 0.00 0.00 66.02 61.63 3hck s SER 35 CO 0.40 -1.61 -0.03 1.21 1.20 0.00 0.00 173.24 174.41 3hck n GLU 36 N -2.84 1.33 -0.08 5.44 2.13 -1.26 -4.53 120.64 120.83 3hck n GLU 36 Ca 0.09 0.02 -0.21 0.00 0.66 0.00 0.00 57.16 57.73 3hck n GLU 36 Cb 0.53 -1.13 -0.12 0.00 0.27 0.00 0.00 31.44 30.98 3hck n GLU 36 CO 0.00 0.00 0.00 1.79 -0.41 0.00 0.00 177.13 178.51 3hck h THR 37 N 0.00 1.05 -2.62 6.31 1.35 -1.99 -3.40 112.91 113.61 3hck h THR 37 Ca -0.15 -2.23 -0.75 0.00 -0.55 0.00 0.00 66.41 62.73 3hck h THR 37 Cb 1.27 2.47 -0.32 0.00 -1.73 0.00 0.00 68.15 69.84 3hck h THR 37 CO -0.01 0.43 0.45 0.41 -0.25 0.00 0.00 175.52 176.54 3hck n THR 38 N -4.36 4.70 -1.40 6.82 -1.04 -1.26 -5.05 114.28 112.69 3hck n THR 38 Ca -0.28 -5.78 -0.39 0.00 -2.04 0.00 0.00 64.05 55.57 3hck n THR 38 Cb 0.69 -1.96 0.03 0.00 -1.82 0.00 0.00 70.33 67.26 3hck n THR 38 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 3hck n LYS 39 N 0.91 0.35 0.00 -2.82 2.85 -1.26 -2.36 118.16 115.83 3hck n LYS 39 Ca 0.30 0.14 0.00 0.00 -1.05 0.00 0.00 58.31 57.70 3hck n LYS 39 Cb 0.34 -1.47 0.00 0.00 -0.65 0.00 0.00 35.03 33.26 3hck n LYS 39 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3hck n GLY 40 N 2.01 2.42 3.77 2.58 0.00 -1.26 -5.04 105.19 109.68 3hck n GLY 40 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.35 5.36 0.23 1.61 0.01 -0.99 -4.84 113.70 113.73 3hck s SER 41 Ca 0.00 -0.20 0.10 0.00 1.31 0.00 0.00 55.95 57.16 3hck s SER 41 Cb 0.00 -1.35 -0.05 0.00 0.21 0.00 0.00 66.02 64.84 3hck s SER 41 CO 0.00 0.06 -0.18 -0.31 0.41 0.00 0.00 173.24 173.22 3hck s TYR 42 N -1.79 2.04 -0.04 2.43 1.51 -1.08 -0.98 117.35 119.46 3hck s TYR 42 Ca 0.30 -0.43 -0.01 0.00 -1.01 0.00 0.00 57.07 55.92 3hck s TYR 42 Cb -0.10 -0.93 0.03 0.00 -0.11 0.00 0.00 41.96 40.85 3hck s TYR 42 CO 0.23 0.54 0.04 -1.12 -1.11 0.00 0.00 175.55 174.12 3hck s SER 43 N -3.27 0.80 0.20 2.29 0.01 0.23 -0.57 113.70 113.38 3hck s SER 43 Ca 0.25 0.05 -0.03 0.00 1.31 0.00 0.00 55.95 57.53 3hck s SER 43 Cb -0.04 -0.14 -0.05 0.00 0.21 0.00 0.00 66.02 66.00 3hck s SER 43 CO 0.11 -0.20 0.41 -0.22 0.41 0.00 0.00 173.24 173.75 3hck s LEU 44 N 1.75 4.21 -0.10 2.44 2.96 0.16 -1.67 118.68 128.43 3hck s LEU 44 Ca -0.00 0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 54.35 3hck s LEU 44 Cb -0.12 -3.27 0.04 0.00 0.50 0.00 0.00 46.19 43.33 3hck s LEU 44 CO -0.03 -0.04 0.24 -0.44 -1.32 0.00 0.00 176.35 174.76 3hck s SER 45 N -2.93 -0.25 0.04 3.68 0.01 -0.45 0.15 113.70 113.96 3hck s SER 45 Ca 0.40 0.49 0.01 0.00 1.31 0.00 0.00 55.95 58.16 3hck s SER 45 Cb -0.11 0.43 -0.03 0.00 0.21 0.00 0.00 66.02 66.52 3hck s SER 45 CO 0.28 -0.13 -0.05 -0.69 0.41 0.00 0.00 173.24 173.06 3hck s VAL 46 N 0.73 0.33 0.24 3.43 1.01 0.08 -0.26 120.40 125.96 3hck s VAL 46 Ca -0.05 -1.28 -0.25 0.00 0.00 0.00 0.00 61.98 60.40 3hck s VAL 46 Cb -0.06 -0.81 -0.09 0.00 0.00 0.00 0.00 36.38 35.42 3hck s VAL 46 CO -0.04 -0.62 0.83 -0.60 0.00 0.00 0.00 175.10 174.67 3hck s ARG 47 N -2.32 4.53 0.12 2.72 3.52 -1.04 0.06 118.95 126.54 3hck s ARG 47 Ca -0.06 1.17 -0.12 0.00 -0.13 0.00 0.00 55.73 56.60 3hck s ARG 47 Cb -0.04 -3.03 0.01 0.00 -1.56 0.00 0.00 34.95 30.33 3hck s ARG 47 CO -0.03 0.44 0.30 0.34 -0.81 0.00 0.00 175.30 175.54 3hck s ASP 48 N -1.42 -0.03 0.08 -2.12 2.15 -0.13 -4.24 116.67 110.97 3hck s ASP 48 Ca 0.42 -0.58 0.04 0.00 0.43 0.00 0.00 52.55 52.87 3hck s ASP 48 Cb -0.21 0.42 -0.03 0.00 -0.30 0.00 0.00 42.92 42.80 3hck s ASP 48 CO 0.25 -0.83 -0.12 -0.47 -0.17 0.00 0.00 175.17 173.83 3hck s TYR 49 N -3.87 1.12 0.01 -5.34 6.14 -1.26 0.09 117.35 114.24 3hck s TYR 49 Ca 0.07 -0.55 0.05 0.00 0.64 0.00 0.00 57.07 57.28 3hck s TYR 49 Cb 0.03 -0.62 -0.02 0.00 0.42 0.00 0.00 41.96 41.78 3hck s TYR 49 CO -0.08 0.03 -0.16 -0.51 0.64 0.00 0.00 175.55 175.47 3hck s ASP 50 N -2.08 1.91 0.00 4.32 1.01 0.25 -4.94 116.67 117.14 3hck s ASP 50 Ca 0.01 -0.37 0.24 0.00 0.71 0.00 0.00 52.55 53.14 3hck s ASP 50 Cb -0.07 -0.18 1.35 0.00 1.01 0.00 0.00 42.92 45.04 3hck s ASP 50 CO 0.01 0.15 1.78 -0.81 0.21 0.00 0.00 175.17 176.51 3hck n PRO 51 N 2.34 0.64 -0.03 8.23 -0.04 -1.26 -0.97 135.00 143.91 3hck n PRO 51 Ca -0.16 0.02 -0.07 0.00 -0.04 0.00 0.00 63.50 63.25 3hck n PRO 51 Cb 0.54 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.48 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 -1.07 0.27 -0.05 0.54 1.74 -1.26 -4.86 116.66 111.97 3hck n ARG 52 Ca 0.16 0.11 -0.01 0.00 -0.77 0.00 0.00 57.85 57.34 3hck n ARG 52 Cb 0.11 -0.98 -0.01 0.00 -1.02 0.00 0.00 32.46 30.56 3hck n ARG 52 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3hck h GLN 53 N -0.51 0.00 0.00 5.56 4.20 -1.98 -3.51 115.11 118.87 3hck h GLN 53 Ca -0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.64 3hck h GLN 53 Cb 0.67 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 3hck h GLN 53 CO -0.04 0.09 0.00 0.41 -0.67 0.00 0.00 178.83 178.62 3hck n GLY 54 N 1.76 0.33 3.68 3.46 0.00 -0.14 -4.94 105.19 109.34 3hck n GLY 54 Ca -0.01 -1.18 -0.42 0.00 0.00 0.00 0.00 46.02 44.41 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 6.93 0.20 1.61 1.01 -1.26 0.87 116.67 122.03 3hck s ASP 55 Ca 0.00 1.91 -0.02 0.00 0.71 0.00 0.00 52.55 55.15 3hck s ASP 55 Cb 0.00 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.34 3hck s ASP 55 CO 0.00 -0.70 0.14 0.42 0.21 0.00 0.00 175.17 175.25 3hck s THR 56 N 2.73 0.01 -0.04 -1.27 -4.23 0.11 -4.94 115.64 108.01 3hck s THR 56 Ca 0.59 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 3hck s THR 56 Cb -0.27 -2.46 0.02 0.00 1.34 0.00 0.00 72.50 71.14 3hck s THR 56 CO 0.22 -0.03 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.56 3hck s VAL 57 N -4.15 0.38 0.13 2.29 1.01 -1.26 -0.95 120.40 117.85 3hck s VAL 57 Ca 0.37 -0.00 -0.03 0.00 0.00 0.00 0.00 61.98 62.32 3hck s VAL 57 Cb 0.07 -0.45 -0.05 0.00 0.00 0.00 0.00 36.38 35.94 3hck s VAL 57 CO 0.11 0.20 0.34 -0.54 0.00 0.00 0.00 175.10 175.21 3hck s LYS 58 N 1.14 3.56 -0.17 2.72 -0.14 0.11 -4.93 119.74 122.02 3hck s LYS 58 Ca -0.08 -0.22 -0.04 0.00 -1.36 0.00 0.00 55.97 54.28 3hck s LYS 58 Cb -0.14 -2.89 0.06 0.00 -1.68 0.00 0.00 37.83 33.17 3hck s LYS 58 CO -0.01 0.49 0.06 -1.01 -0.76 0.00 0.00 175.35 174.12 3hck s HIS 59 N -1.65 0.59 0.30 3.18 3.76 -1.26 -0.74 115.29 119.47 3hck s HIS 59 Ca 0.39 -0.52 0.03 0.00 -0.15 0.00 0.00 55.06 54.81 3hck s HIS 59 Cb -0.12 -0.84 -0.03 0.00 1.11 0.00 0.00 32.58 32.70 3hck s HIS 59 CO 0.26 -0.53 0.47 0.71 -0.85 0.00 0.00 174.74 174.80 3hck s TYR 60 N 2.00 3.45 0.03 1.40 1.51 0.41 -4.92 117.35 121.23 3hck s TYR 60 Ca 0.01 0.15 0.01 0.00 -1.01 0.00 0.00 57.07 56.23 3hck s TYR 60 Cb -0.16 -1.78 -0.04 0.00 -0.11 0.00 0.00 41.96 39.87 3hck s TYR 60 CO -0.08 0.23 0.11 0.15 -1.11 0.00 0.00 175.55 174.85 3hck s LYS 61 N -4.17 3.09 -0.28 -0.62 -0.14 -1.26 0.38 119.74 116.74 3hck s LYS 61 Ca 0.38 -0.53 0.02 0.00 -1.36 0.00 0.00 55.97 54.48 3hck s LYS 61 Cb -0.09 -2.86 0.07 0.00 -1.68 0.00 0.00 37.83 33.27 3hck s LYS 61 CO 0.33 0.62 -0.03 0.42 -0.76 0.00 0.00 175.35 175.93 3hck s ILE 62 N -1.30 1.85 0.34 2.17 1.01 0.26 -4.51 121.20 121.01 3hck s ILE 62 Ca 0.27 -1.65 -0.05 0.00 0.00 0.00 0.00 60.65 59.22 3hck s ILE 62 Cb -0.12 -2.15 -0.05 0.00 0.01 0.00 0.00 42.46 40.15 3hck s ILE 62 CO 0.19 -0.26 0.61 -0.13 0.00 0.00 0.00 174.94 175.34 3hck s ARG 63 N 1.20 3.62 0.13 2.79 1.81 -0.12 -2.63 118.95 125.75 3hck s ARG 63 Ca -0.01 0.04 0.07 0.00 -1.72 0.00 0.00 55.73 54.11 3hck s ARG 63 Cb -0.19 -2.58 -0.04 0.00 -0.45 0.00 0.00 34.95 31.69 3hck s ARG 63 CO -0.08 0.12 -0.06 0.95 -0.68 0.00 0.00 175.30 175.55 3hck s THR 64 N -2.24 3.53 0.02 0.02 -4.23 -1.26 -0.11 115.64 111.37 3hck s THR 64 Ca 0.45 -1.32 -0.01 0.00 -1.18 0.00 0.00 61.69 59.62 3hck s THR 64 Cb -0.10 -2.70 -0.04 0.00 1.34 0.00 0.00 72.50 70.99 3hck s THR 64 CO 0.33 0.03 0.19 -0.76 -0.54 0.00 0.00 174.62 173.87 3hck s LEU 65 N -2.49 4.35 0.16 4.79 1.43 -1.15 -4.96 118.68 120.82 3hck s LEU 65 Ca 0.24 0.31 -0.23 0.00 -1.03 0.00 0.00 54.13 53.42 3hck s LEU 65 Cb -0.10 -2.76 0.04 0.00 0.03 0.00 0.00 46.19 43.39 3hck s LEU 65 CO 0.16 0.22 1.61 0.44 0.23 0.00 0.00 176.35 179.01 3hck h ASP 66 N 3.49 -0.98 -2.15 2.29 3.32 -2.00 -3.13 116.42 117.25 3hck h ASP 66 Ca -0.47 0.17 -0.57 0.00 0.02 0.00 0.00 57.03 56.18 3hck h ASP 66 Cb 1.17 0.45 -0.41 0.00 0.22 0.00 0.00 39.33 40.77 3hck h ASP 66 CO 0.72 -0.32 -0.80 0.59 -1.72 0.00 0.00 179.24 177.72 3hck n ASN 67 N -5.41 2.84 0.00 6.45 3.02 -1.26 -5.00 115.26 115.91 3hck n ASN 67 Ca -0.00 -3.31 0.00 0.00 -0.03 0.00 0.00 54.58 51.24 3hck n ASN 67 Cb 0.32 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 3hck n ASN 67 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hck n GLY 68 N 0.54 3.19 0.00 7.41 0.00 -1.18 -5.17 105.19 109.98 3hck n GLY 68 Ca 0.28 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 0.00 2.44 2.97 -0.02 0.00 -1.22 -4.86 105.19 104.50 3hck n GLY 69 Ca 0.00 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 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 1.55 -0.20 0.05 1.61 0.40 0.92 -2.91 117.98 119.40 3hck s PHE 70 Ca 0.00 0.53 0.04 0.00 -0.60 0.00 0.00 56.93 56.90 3hck s PHE 70 Cb 0.00 -0.03 -0.02 0.00 0.51 0.00 0.00 43.02 43.47 3hck s PHE 70 CO 0.00 -0.16 -0.13 1.52 0.70 0.00 0.00 175.22 177.15 3hck s TYR 71 N 0.99 1.11 -0.22 0.36 1.13 0.84 -2.26 117.35 119.29 3hck s TYR 71 Ca -0.07 -0.40 -0.04 0.00 -1.41 0.00 0.00 57.07 55.15 3hck s TYR 71 Cb -0.09 -0.64 -0.13 0.00 -1.10 0.00 0.00 41.96 40.00 3hck s TYR 71 CO -0.05 0.02 -0.23 -0.89 -2.51 0.00 0.00 175.55 171.89 3hck n ILE 72 N 1.66 1.25 -4.68 -3.49 5.41 -1.26 -0.94 119.36 117.30 3hck n ILE 72 Ca -0.20 -0.42 -0.30 0.00 1.00 0.00 0.00 62.75 62.83 3hck n ILE 72 Cb 0.55 -1.49 -0.13 0.00 -0.71 0.00 0.00 39.64 37.86 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 -6.49 3.65 -0.78 4.38 0.15 -1.26 -4.87 113.70 108.47 3hck s SER 73 Ca -0.30 -0.48 -0.06 0.00 0.70 0.00 0.00 55.95 55.80 3hck s SER 73 Cb 0.09 -0.52 -0.12 0.00 -1.71 0.00 0.00 66.02 63.77 3hck s SER 73 CO 0.46 0.25 2.61 -0.81 1.20 0.00 0.00 173.24 176.95 3hck n PRO 74 N 1.53 2.32 0.04 5.44 -0.04 -1.26 -3.68 135.00 139.35 3hck n PRO 74 Ca -0.16 -1.41 0.00 0.00 -0.04 0.00 0.00 63.50 61.89 3hck n PRO 74 Cb 0.52 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 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 3.46 0.00 -4.00 0.54 5.12 -1.26 -5.06 116.66 115.46 3hck n ARG 75 Ca 0.50 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 56.10 3hck n ARG 75 Cb 0.36 -0.01 -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 -4.31 4.39 0.47 0.55 0.01 -1.24 -5.11 113.70 108.45 3hck s SER 76 Ca 0.00 -1.60 -0.02 0.00 1.31 0.00 0.00 55.95 55.64 3hck s SER 76 Cb 0.00 -1.44 -0.01 0.00 0.21 0.00 0.00 66.02 64.77 3hck s SER 76 CO 0.00 -0.27 0.73 0.42 0.41 0.00 0.00 173.24 174.52 3hck s THR 77 N 1.14 4.29 0.12 1.44 -4.23 -1.26 -4.72 115.64 112.42 3hck s THR 77 Ca -0.01 -0.24 0.07 0.00 -1.18 0.00 0.00 61.69 60.33 3hck s THR 77 Cb -0.19 -3.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.00 3hck s THR 77 CO -0.08 -0.51 -0.16 -0.36 -0.54 0.00 0.00 174.62 172.98 3hck s PHE 78 N -2.65 1.50 -0.18 3.99 0.40 -0.96 -5.01 117.98 115.07 3hck s PHE 78 Ca 0.48 -0.51 0.19 0.00 -0.60 0.00 0.00 56.93 56.49 3hck s PHE 78 Cb -0.10 -0.79 -0.06 0.00 0.51 0.00 0.00 43.02 42.58 3hck s PHE 78 CO 0.41 0.17 0.96 0.77 0.70 0.00 0.00 175.22 178.23 3hck h SER 79 N 3.62 0.00 -5.03 1.36 0.02 -1.90 0.26 113.55 111.88 3hck h SER 79 Ca -0.41 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.38 3hck h SER 79 Cb 1.20 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.54 3hck h SER 79 CO 0.48 0.33 -0.70 0.42 -1.14 0.00 0.00 176.83 176.23 3hck s THR 80 N -3.11 0.14 0.12 -2.27 -4.23 -1.26 -4.42 115.64 100.61 3hck s THR 80 Ca -0.01 -1.12 0.22 0.00 -1.18 0.00 0.00 61.69 59.60 3hck s THR 80 Cb 0.09 -0.55 0.20 0.00 1.34 0.00 0.00 72.50 73.58 3hck s THR 80 CO 0.80 -0.61 1.78 -0.07 -0.54 0.00 0.00 174.62 175.97 3hck h LEU 81 N 4.30 0.00 -1.23 4.79 3.38 -1.92 -2.52 115.31 122.12 3hck h LEU 81 Ca -0.33 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 3hck h LEU 81 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 3hck h LEU 81 CO 0.47 0.27 -0.25 -0.61 0.09 0.00 0.00 178.44 178.41 3hck h GLN 82 N 0.00 0.22 0.00 1.13 5.75 -1.98 0.21 115.11 120.44 3hck h GLN 82 Ca -0.00 -0.07 -0.14 0.00 -0.15 0.00 0.00 58.65 58.28 3hck h GLN 82 Cb 0.82 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.33 3hck h GLN 82 CO 0.04 0.46 -0.95 0.93 -2.65 0.00 0.00 178.83 176.66 3hck h GLU 83 N 0.20 0.00 0.06 1.69 4.39 -1.90 -2.58 114.58 116.44 3hck h GLU 83 Ca 0.03 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.48 3hck h GLU 83 Cb 0.55 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.21 3hck h GLU 83 CO 0.04 0.46 -1.09 1.25 -1.16 0.00 0.00 179.01 178.50 3hck h LEU 84 N 0.00 0.57 -0.50 1.33 6.46 -1.01 -0.97 115.31 121.19 3hck h LEU 84 Ca -0.08 -0.51 -0.16 0.00 -0.12 0.00 0.00 57.88 57.01 3hck h LEU 84 Cb 1.51 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 41.24 3hck h LEU 84 CO 0.06 1.34 -0.74 0.58 -0.62 0.00 0.00 178.44 179.06 3hck h VAL 85 N 0.19 1.51 -0.05 1.05 2.07 -0.67 -2.36 116.25 118.00 3hck h VAL 85 Ca -0.12 -2.47 -0.06 0.00 0.82 0.00 0.00 66.70 64.87 3hck h VAL 85 Cb 1.76 2.34 0.00 0.00 -1.52 0.00 0.00 31.29 33.87 3hck h VAL 85 CO 0.19 0.71 -0.20 0.44 0.02 0.00 0.00 177.57 178.74 3hck h ASP 86 N 0.04 0.25 -0.38 0.57 3.32 -1.44 -1.69 116.42 117.10 3hck h ASP 86 Ca -0.01 -0.64 0.05 0.00 0.02 0.00 0.00 57.03 56.44 3hck h ASP 86 Cb 1.31 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 3hck h ASP 86 CO 0.10 0.86 0.26 -0.74 -1.72 0.00 0.00 179.24 177.99 3hck h HIS 87 N -0.33 0.31 0.00 4.55 2.76 -1.18 0.12 115.15 121.39 3hck h HIS 87 Ca -0.01 0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 58.07 3hck h HIS 87 Cb 0.84 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.69 3hck h HIS 87 CO 0.14 0.18 -0.45 1.88 -1.30 0.00 0.00 177.93 178.37 3hck h TYR 88 N 0.32 0.00 0.00 5.26 0.05 -1.33 -2.62 116.97 118.65 3hck h TYR 88 Ca 0.16 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.87 3hck h TYR 88 Cb 0.24 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 3hck h TYR 88 CO -0.00 0.45 -0.32 0.87 -1.05 0.00 0.00 178.16 178.11 3hck h LYS 89 N 0.00 0.00 0.04 4.88 1.57 0.19 -1.05 116.57 122.20 3hck h LYS 89 Ca -0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.51 3hck h LYS 89 Cb 1.22 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.50 3hck h LYS 89 CO 0.06 0.32 -1.35 0.87 -0.57 0.00 0.00 179.45 178.78 3hck h LYS 90 N 0.00 0.08 -1.07 3.15 1.57 -1.22 -3.42 116.57 115.67 3hck h LYS 90 Ca -0.00 -0.14 0.25 0.00 -1.87 0.00 0.00 60.65 58.89 3hck h LYS 90 Cb 0.94 0.05 -0.27 0.00 0.08 0.00 0.00 32.23 33.03 3hck h LYS 90 CO 0.04 0.90 0.95 0.20 -0.57 0.00 0.00 179.45 180.98 3hck s GLY 91 N -4.89 0.05 0.16 3.86 0.00 -1.00 -5.02 107.32 100.49 3hck s GLY 91 Ca -0.04 2.73 -0.17 0.00 0.00 0.00 0.00 44.72 47.25 3hck s GLY 91 CO 0.83 1.06 1.69 3.45 0.00 0.00 0.00 173.10 180.13 3hck h ASN 92 N 2.05 -0.25 -7.07 1.64 -1.07 -1.82 -3.33 115.58 105.74 3hck h ASN 92 Ca -0.08 0.10 -0.61 0.00 0.07 0.00 0.00 56.30 55.78 3hck h ASN 92 Cb 1.18 0.19 -0.28 0.00 -2.07 0.00 0.00 38.32 37.34 3hck h ASN 92 CO 0.22 -0.08 -0.92 -0.67 0.07 0.00 0.00 177.43 176.04 3hck n ASP 93 N -5.24 -0.86 0.00 6.14 2.03 -1.26 -2.41 116.55 114.95 3hck n ASP 93 Ca 0.02 -1.22 0.00 0.00 0.52 0.00 0.00 54.79 54.11 3hck n ASP 93 Cb 0.20 -1.82 0.00 0.00 -0.72 0.00 0.00 41.12 38.78 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 -1.72 3.18 3.44 0.27 0.00 -1.26 -5.06 105.19 104.03 3hck n GLY 94 Ca -0.08 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 3hck n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hck s LEU 95 N 0.00 0.18 0.18 0.99 1.43 -1.01 -4.92 118.68 115.52 3hck s LEU 95 Ca 0.00 1.25 0.01 0.00 -1.03 0.00 0.00 54.13 54.36 3hck s LEU 95 Cb 0.00 -2.99 0.05 0.00 0.03 0.00 0.00 46.19 43.27 3hck s LEU 95 CO 0.00 -4.57 1.42 0.00 0.23 0.00 0.00 176.35 173.42 3hck s GLN 97 N -3.40 0.52 1.07 0.00 -0.21 -1.26 -5.03 119.66 111.35 3hck s GLN 97 Ca -0.04 0.28 -0.16 0.00 0.02 0.00 0.00 55.36 55.46 3hck s GLN 97 Cb 0.10 0.24 0.12 0.00 1.00 0.00 0.00 33.01 34.47 3hck s GLN 97 CO 0.83 -0.10 0.34 0.36 -2.12 0.00 0.00 175.29 174.59 3hck n LYS 98 N 2.32 -1.31 -3.52 2.91 2.85 -1.26 -4.62 118.16 115.54 3hck n LYS 98 Ca -0.16 -0.35 -0.37 0.00 -1.05 0.00 0.00 58.31 56.38 3hck n LYS 98 Cb 0.57 -1.85 -0.07 0.00 -0.65 0.00 0.00 35.03 33.03 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 -2.44 4.26 -0.01 -5.58 1.43 -0.42 -4.86 118.68 111.06 3hck s LEU 99 Ca 0.59 0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 54.24 3hck s LEU 99 Cb -0.17 -2.41 -0.00 0.00 0.03 0.00 0.00 46.19 43.63 3hck s LEU 99 CO 0.66 0.10 -0.02 -1.54 0.23 0.00 0.00 176.35 175.78 3hck n SER 100 N 3.47 0.14 -4.07 2.29 3.41 -1.07 -4.42 113.62 113.37 3hck n SER 100 Ca -0.12 0.12 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 3hck n SER 100 Cb 0.52 -0.52 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 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 -1.12 0.52 0.69 -3.33 -7.23 -1.24 -5.06 120.40 103.63 3hck s VAL 101 Ca -0.02 -1.20 -0.11 0.00 -1.81 0.00 0.00 61.98 58.84 3hck s VAL 101 Cb 0.00 -0.75 0.01 0.00 0.56 0.00 0.00 36.38 36.20 3hck s VAL 101 CO 0.03 -0.48 1.06 -2.16 -0.31 0.00 0.00 175.10 173.24 3hck s PRO 102 N -1.94 2.95 1.01 4.82 0.04 -1.26 -2.53 135.00 138.09 3hck s PRO 102 Ca -0.07 0.97 -0.16 0.00 0.04 0.00 0.00 61.00 61.77 3hck s PRO 102 Cb -0.07 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.48 3hck s PRO 102 CO -0.01 -1.09 -0.06 0.00 0.04 0.00 0.00 177.00 175.89 3hck s MET 104 N -3.19 3.44 0.09 0.00 -1.94 -1.26 -4.79 119.30 111.65 3hck s MET 104 Ca 0.52 -0.55 0.06 0.00 -1.71 0.00 0.00 55.69 54.01 3hck s MET 104 Cb -0.16 -2.77 -0.03 0.00 2.01 0.00 0.00 34.83 33.89 3hck s MET 104 CO 0.70 0.26 -0.16 -1.12 -0.01 0.00 0.00 175.02 174.69 3hck s SER 105 N -4.02 1.92 -0.03 3.03 0.01 -1.26 -5.08 113.70 108.26 3hck s SER 105 Ca 0.38 -0.66 -0.06 0.00 1.31 0.00 0.00 55.95 56.92 3hck s SER 105 Cb -0.09 -0.07 0.01 0.00 0.21 0.00 0.00 66.02 66.07 3hck s SER 105 CO 0.33 -0.06 0.13 -0.44 0.41 0.00 0.00 173.24 173.61 3hck s SER 106 N -1.89 -0.07 0.00 2.44 0.01 -1.26 -5.23 113.70 107.70 3hck s SER 106 Ca 0.02 0.07 0.05 0.00 1.31 0.00 0.00 55.95 57.40 3hck s SER 106 Cb -0.09 0.26 0.04 0.00 0.21 0.00 0.00 66.02 66.44 3hck s SER 106 CO 0.03 -0.18 0.67 2.29 0.41 0.00 0.00 173.24 176.46