#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kbg s GLU 2 N 0.00 1.42 0.00 5.56 2.02 0.43 -4.98 118.70 123.15 2kbg s GLU 2 Ca 0.00 -2.41 0.00 0.00 0.02 0.00 0.00 54.97 52.58 2kbg s GLU 2 Cb 0.00 -2.18 0.00 0.00 0.10 0.00 0.00 34.13 32.05 2kbg s GLU 2 CO 0.00 -1.30 0.00 -0.35 0.02 0.00 0.00 175.26 173.63 2kbg n PRO 3 N 2.79 2.49 -3.60 0.39 -0.04 -1.24 -3.36 135.00 132.43 2kbg n PRO 3 Ca 0.22 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.64 2kbg n PRO 3 Cb 0.41 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.85 2kbg n PRO 3 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2kbg s SER 4 N -0.68 -0.17 0.92 3.54 0.15 -1.26 -4.81 113.70 111.39 2kbg s SER 4 Ca 0.00 -0.07 -0.17 0.00 0.70 0.00 0.00 55.95 56.41 2kbg s SER 4 Cb 0.00 0.23 -0.14 0.00 -1.71 0.00 0.00 66.02 64.40 2kbg s SER 4 CO 0.00 -0.39 -0.83 -2.65 1.20 0.00 0.00 173.24 170.57 2kbg n PRO 5 N -0.25 0.00 -0.87 5.44 -0.02 -1.26 -4.83 135.00 133.22 2kbg n PRO 5 Ca -0.04 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.11 2kbg n PRO 5 Cb 0.60 -0.92 0.03 0.00 -0.02 0.00 0.00 33.50 33.19 2kbg n PRO 5 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kbg n PRO 6 N 2.31 0.00 -2.70 0.52 -0.02 -1.26 -4.97 135.00 128.88 2kbg n PRO 6 Ca -0.02 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.39 2kbg n PRO 6 Cb 0.54 -0.87 0.07 0.00 -0.02 0.00 0.00 33.50 33.22 2kbg n PRO 6 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2kbg n SER 7 N 3.03 0.09 -3.99 2.55 2.88 -1.26 -5.04 113.62 111.88 2kbg n SER 7 Ca -0.02 -2.50 -0.22 0.00 -1.33 0.00 0.00 58.87 54.80 2kbg n SER 7 Cb 0.58 0.10 -0.16 0.00 -0.75 0.00 0.00 64.21 63.98 2kbg n SER 7 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2kbg s ILE 8 N -1.81 0.88 0.18 2.46 -1.09 -1.26 -1.12 121.20 119.44 2kbg s ILE 8 Ca 0.24 -0.36 0.02 0.00 -2.23 0.00 0.00 60.65 58.32 2kbg s ILE 8 Cb 0.42 -0.82 0.02 0.00 -1.58 0.00 0.00 42.46 40.50 2kbg s ILE 8 CO -0.03 0.29 0.15 1.41 -1.23 0.00 0.00 174.94 175.53 2kbg n HIS 9 N 3.69 -1.41 -3.24 3.97 8.25 -1.11 -4.95 115.22 120.42 2kbg n HIS 9 Ca -0.22 -0.74 0.03 0.00 -0.26 0.00 0.00 57.72 56.53 2kbg n HIS 9 Cb 0.52 -0.15 -0.04 0.00 1.12 0.00 0.00 29.99 31.45 2kbg n HIS 9 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2kbg s GLY 10 N -2.45 0.06 0.02 -1.41 0.00 -1.24 -3.96 107.32 98.34 2kbg s GLY 10 Ca 0.11 3.36 0.02 0.00 0.00 0.00 0.00 44.72 48.22 2kbg s GLY 10 CO 0.07 3.44 -0.07 1.20 0.00 0.00 0.00 173.10 177.74 2kbg s GLN 11 N 2.33 0.52 -1.10 2.90 -0.21 -1.16 -4.95 119.66 117.99 2kbg s GLN 11 Ca -0.01 -0.45 -0.22 0.00 0.02 0.00 0.00 55.36 54.70 2kbg s GLN 11 Cb -0.04 -0.42 0.01 0.00 1.00 0.00 0.00 33.01 33.56 2kbg s GLN 11 CO -0.15 0.10 1.74 -1.25 -2.12 0.00 0.00 175.29 173.61 2kbg s PRO 12 N -0.74 3.24 0.00 2.91 0.04 -1.26 -1.44 135.00 137.75 2kbg s PRO 12 Ca -0.02 -1.18 0.00 0.00 0.04 0.00 0.00 61.00 59.84 2kbg s PRO 12 Cb -0.05 -5.32 0.00 0.00 0.04 0.00 0.00 34.50 29.17 2kbg s PRO 12 CO 0.00 -2.84 0.55 0.45 0.04 0.00 0.00 177.00 175.20 2kbg n SER 13 N 11.01 0.00 -3.81 6.66 2.88 -1.23 -4.83 113.62 124.30 2kbg n SER 13 Ca 0.41 0.55 -0.13 0.00 -1.33 0.00 0.00 58.87 58.37 2kbg n SER 13 Cb 0.48 -0.05 -0.14 0.00 -0.75 0.00 0.00 64.21 63.75 2kbg n SER 13 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2kbg s SER 14 N -2.39 -0.09 1.20 -3.46 0.15 -1.26 -5.06 113.70 102.79 2kbg s SER 14 Ca 0.00 0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.85 2kbg s SER 14 Cb 0.00 0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 2kbg s SER 14 CO 0.00 -0.07 0.00 0.61 1.20 0.00 0.00 173.24 174.98 2kbg n GLY 15 N 3.42 2.36 0.60 9.45 0.00 -1.26 -2.40 105.19 117.36 2kbg n GLY 15 Ca -0.17 -0.41 0.13 0.00 0.00 0.00 0.00 46.02 45.57 2kbg n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kbg n LYS 16 N 13.36 1.74 -1.90 1.61 5.02 -1.26 -4.94 118.16 131.78 2kbg n LYS 16 Ca 0.00 -1.20 -0.34 0.00 -2.02 0.00 0.00 58.31 54.75 2kbg n LYS 16 Cb 0.00 -1.48 0.04 0.00 -0.02 0.00 0.00 35.03 33.57 2kbg n LYS 16 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2kbg s SER 17 N -2.09 5.23 -0.07 4.39 1.04 -1.01 -4.07 113.70 117.13 2kbg s SER 17 Ca 0.32 2.11 -0.01 0.00 0.48 0.00 0.00 55.95 58.86 2kbg s SER 17 Cb 0.20 -2.57 0.03 0.00 0.10 0.00 0.00 66.02 63.78 2kbg s SER 17 CO 0.36 -1.55 -0.02 0.12 0.98 0.00 0.00 173.24 173.13 2kbg s PHE 18 N -2.08 0.78 -0.76 5.02 5.36 -1.22 -3.50 117.98 121.58 2kbg s PHE 18 Ca 0.70 -0.24 -0.24 0.00 -0.96 0.00 0.00 56.93 56.18 2kbg s PHE 18 Cb -0.23 -0.81 0.05 0.00 -0.34 0.00 0.00 43.02 41.69 2kbg s PHE 18 CO 0.37 -0.31 1.18 0.21 -1.46 0.00 0.00 175.22 175.21 2kbg s LYS 19 N 1.64 3.25 -0.80 10.12 2.20 -0.52 -3.62 119.74 132.00 2kbg s LYS 19 Ca 0.00 -0.68 -0.16 0.00 -0.36 0.00 0.00 55.97 54.77 2kbg s LYS 19 Cb -0.13 -4.41 0.17 0.00 -1.51 0.00 0.00 37.83 31.95 2kbg s LYS 19 CO -0.04 -2.01 0.85 -0.51 -0.36 0.00 0.00 175.35 173.28 2kbg s LEU 20 N 4.83 5.99 0.11 5.43 1.43 -1.09 -3.01 118.68 132.37 2kbg s LEU 20 Ca 0.32 -2.24 -0.31 0.00 -1.03 0.00 0.00 54.13 50.87 2kbg s LEU 20 Cb -0.10 -2.28 -0.08 0.00 0.03 0.00 0.00 46.19 43.76 2kbg s LEU 20 CO 0.08 -0.83 1.50 -0.55 0.23 0.00 0.00 176.35 176.78 2kbg s SER 21 N 2.92 6.71 -0.41 2.29 0.15 -1.25 -3.58 113.70 120.53 2kbg s SER 21 Ca 0.21 2.42 -0.23 0.00 0.70 0.00 0.00 55.95 59.04 2kbg s SER 21 Cb -0.12 -2.58 0.02 0.00 -1.71 0.00 0.00 66.02 61.63 2kbg s SER 21 CO -0.06 -0.76 0.77 -0.63 1.20 0.00 0.00 173.24 173.76 2kbg s ILE 22 N 1.59 4.70 -0.05 6.45 -1.09 -1.08 -2.74 121.20 128.98 2kbg s ILE 22 Ca 0.68 0.62 -0.27 0.00 -2.23 0.00 0.00 60.65 59.46 2kbg s ILE 22 Cb -0.39 -4.26 -0.03 0.00 -1.58 0.00 0.00 42.46 36.20 2kbg s ILE 22 CO 0.30 -0.57 0.85 -0.89 -1.23 0.00 0.00 174.94 173.40 2kbg s THR 23 N 3.17 4.94 -0.59 2.92 2.01 -0.28 -4.59 115.64 123.23 2kbg s THR 23 Ca 0.30 1.76 -0.30 0.00 0.31 0.00 0.00 61.69 63.76 2kbg s THR 23 Cb -0.13 -4.19 -0.12 0.00 0.01 0.00 0.00 72.50 68.08 2kbg s THR 23 CO 0.20 0.18 2.43 2.29 -0.69 0.00 0.00 174.62 179.03 2kbg n LYS 24 N 4.05 0.79 -3.93 4.92 0.00 -1.26 -4.84 118.16 117.88 2kbg n LYS 24 Ca 0.03 0.09 -0.32 0.00 -0.00 0.00 0.00 58.31 58.11 2kbg n LYS 24 Cb 0.51 -2.65 -0.05 0.00 -0.00 0.00 0.00 35.03 32.84 2kbg n LYS 24 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 2kbg s GLN 25 N 7.90 3.38 -0.64 -1.58 -2.07 -1.26 -4.98 119.66 120.42 2kbg s GLN 25 Ca 1.12 -0.42 -0.30 0.00 -1.82 0.00 0.00 55.36 53.93 2kbg s GLN 25 Cb -0.66 -3.03 -0.14 0.00 -1.09 0.00 0.00 33.01 28.10 2kbg s GLN 25 CO 0.39 0.63 2.46 -3.47 -1.32 0.00 0.00 175.29 173.98 2kbg n ASP 26 N 0.55 1.53 -4.72 12.60 -0.08 -1.26 -4.83 116.55 120.33 2kbg n ASP 26 Ca -0.07 -0.03 -0.41 0.00 -1.51 0.00 0.00 54.79 52.77 2kbg n ASP 26 Cb 0.52 -1.26 0.01 0.00 2.34 0.00 0.00 41.12 42.72 2kbg n ASP 26 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2kbg n ASP 27 N 12.46 2.86 -0.34 1.67 8.00 -1.25 -3.70 116.55 136.24 2kbg n ASP 27 Ca 0.49 1.13 0.28 0.00 0.71 0.00 0.00 54.79 57.40 2kbg n ASP 27 Cb 0.28 -1.53 0.43 0.00 -0.02 0.00 0.00 41.12 40.28 2kbg n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kbg n GLY 28 N 0.72 -0.57 0.00 0.44 0.00 -1.21 -4.04 105.19 100.52 2kbg n GLY 28 Ca 0.06 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2kbg n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kbg n GLY 29 N -1.51 -0.01 3.46 -0.02 0.00 -1.26 0.16 105.19 106.02 2kbg n GLY 29 Ca 0.24 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.11 2kbg n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kbg s ALA 30 N 0.00 -1.63 0.33 4.61 0.00 -1.26 -5.01 121.76 118.81 2kbg s ALA 30 Ca 0.00 0.85 -0.29 0.00 0.00 0.00 0.00 51.96 52.52 2kbg s ALA 30 Cb 0.00 0.45 -0.11 0.00 0.00 0.00 0.00 23.12 23.47 2kbg s ALA 30 CO 0.00 -0.57 1.44 -1.25 0.00 0.00 0.00 175.76 175.38 2kbg s PRO 31 N -2.52 4.21 0.05 0.00 0.04 -1.26 -4.68 135.00 130.84 2kbg s PRO 31 Ca -0.05 2.42 -0.23 0.00 0.04 0.00 0.00 61.00 63.18 2kbg s PRO 31 Cb -0.01 -3.03 -0.06 0.00 0.04 0.00 0.00 34.50 31.45 2kbg s PRO 31 CO -0.02 -0.42 0.71 0.42 0.04 0.00 0.00 177.00 177.72 2kbg s ILE 32 N -0.81 4.73 -0.10 0.56 1.01 -1.26 -4.11 121.20 121.22 2kbg s ILE 32 Ca 0.54 1.50 -0.16 0.00 0.00 0.00 0.00 60.65 62.53 2kbg s ILE 32 Cb -0.44 -4.05 -0.27 0.00 0.01 0.00 0.00 42.46 37.71 2kbg s ILE 32 CO 0.55 0.41 0.57 -0.07 0.00 0.00 0.00 174.94 176.40 2kbg h LEU 33 N 5.40 0.39 -7.98 2.97 3.38 -1.43 -3.38 115.31 114.67 2kbg h LEU 33 Ca -0.45 -0.86 -0.10 0.00 0.09 0.00 0.00 57.88 56.56 2kbg h LEU 33 Cb 1.20 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 41.69 2kbg h LEU 33 CO 0.69 1.62 -0.39 -1.61 0.09 0.00 0.00 178.44 178.84 2kbg s GLU 34 N -2.48 0.94 -0.20 1.13 2.02 -1.24 0.18 118.70 119.06 2kbg s GLU 34 Ca -0.19 -1.08 -0.02 0.00 0.02 0.00 0.00 54.97 53.69 2kbg s GLU 34 Cb 0.04 0.34 -0.00 0.00 0.10 0.00 0.00 34.13 34.61 2kbg s GLU 34 CO 0.77 -0.31 -0.09 0.71 0.02 0.00 0.00 175.26 176.37 2kbg s TYR 35 N -3.92 2.90 -0.38 1.61 1.51 0.11 -1.28 117.35 117.91 2kbg s TYR 35 Ca 0.11 -0.99 -0.14 0.00 -1.01 0.00 0.00 57.07 55.03 2kbg s TYR 35 Cb 0.05 -2.02 0.01 0.00 -0.11 0.00 0.00 41.96 39.88 2kbg s TYR 35 CO -0.06 -0.52 0.30 0.42 -1.11 0.00 0.00 175.55 174.57 2kbg s ILE 36 N 1.22 5.25 -0.17 2.71 1.01 0.14 -0.68 121.20 130.68 2kbg s ILE 36 Ca 0.02 -0.44 -0.02 0.00 0.00 0.00 0.00 60.65 60.21 2kbg s ILE 36 Cb -0.14 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.45 2kbg s ILE 36 CO -0.03 -0.21 -0.08 -0.69 0.00 0.00 0.00 174.94 173.94 2kbg s VAL 37 N 1.76 3.39 -0.02 2.92 1.01 0.17 -0.32 120.40 129.30 2kbg s VAL 37 Ca 0.06 -0.52 0.06 0.00 0.00 0.00 0.00 61.98 61.58 2kbg s VAL 37 Cb -0.18 -2.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 2kbg s VAL 37 CO 0.11 0.48 -0.20 -0.54 0.00 0.00 0.00 175.10 174.95 2kbg s LYS 38 N 0.71 1.68 0.06 2.72 1.02 0.00 0.16 119.74 126.09 2kbg s LYS 38 Ca -0.04 -0.72 -0.08 0.00 0.02 0.00 0.00 55.97 55.16 2kbg s LYS 38 Cb -0.15 -1.60 -0.01 0.00 -0.52 0.00 0.00 37.83 35.56 2kbg s LYS 38 CO 0.02 0.42 0.15 1.52 -0.92 0.00 0.00 175.35 176.54 2kbg s TYR 39 N -0.42 0.17 0.24 3.18 1.13 -0.94 0.66 117.35 121.38 2kbg s TYR 39 Ca 0.06 -0.54 -0.02 0.00 -1.41 0.00 0.00 57.07 55.17 2kbg s TYR 39 Cb -0.08 -0.10 0.01 0.00 -1.10 0.00 0.00 41.96 40.69 2kbg s TYR 39 CO -0.00 -0.47 0.35 2.89 -2.51 0.00 0.00 175.55 175.81 2kbg n ARG 40 N 0.30 0.50 -3.41 -3.49 1.85 -0.90 -0.75 116.66 110.76 2kbg n ARG 40 Ca -0.17 -1.91 -0.38 0.00 -1.00 0.00 0.00 57.85 54.39 2kbg n ARG 40 Cb 0.61 1.86 -0.06 0.00 -1.05 0.00 0.00 32.46 33.82 2kbg n ARG 40 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2kbg s SER 41 N -2.49 6.85 0.29 2.89 1.04 -1.26 -1.55 113.70 119.47 2kbg s SER 41 Ca 0.20 1.02 0.03 0.00 0.48 0.00 0.00 55.95 57.67 2kbg s SER 41 Cb -0.01 -2.29 0.46 0.00 0.10 0.00 0.00 66.02 64.28 2kbg s SER 41 CO 0.14 0.25 1.75 0.11 0.98 0.00 0.00 173.24 176.48 2kbg h LYS 42 N 5.03 0.47 -0.47 4.02 1.57 -1.68 -2.76 116.57 122.74 2kbg h LYS 42 Ca -0.49 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.13 2kbg h LYS 42 Cb 1.21 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 2kbg h LYS 42 CO 0.64 0.66 0.31 0.22 -0.57 0.00 0.00 179.45 180.72 2kbg h ASP 43 N 0.42 0.54 -3.16 0.86 1.82 -1.94 -3.44 116.42 111.52 2kbg h ASP 43 Ca 0.07 -0.01 -0.13 0.00 -0.39 0.00 0.00 57.03 56.57 2kbg h ASP 43 Cb 0.60 -0.13 -0.03 0.00 0.68 0.00 0.00 39.33 40.45 2kbg h ASP 43 CO 0.04 0.39 -0.10 0.29 -1.61 0.00 0.00 179.24 178.25 2kbg n LYS 44 N -4.47 1.21 -2.68 0.28 5.02 -1.04 -5.11 118.16 111.38 2kbg n LYS 44 Ca 0.04 -0.75 -0.05 0.00 -2.02 0.00 0.00 58.31 55.54 2kbg n LYS 44 Cb 0.06 0.32 0.10 0.00 -0.02 0.00 0.00 35.03 35.48 2kbg n LYS 44 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2kbg n GLU 45 N -0.22 0.29 0.00 1.97 2.13 -1.26 -4.55 120.64 119.00 2kbg n GLU 45 Ca -0.03 -0.92 0.00 0.00 0.66 0.00 0.00 57.16 56.87 2kbg n GLU 45 Cb 0.13 -0.37 0.00 0.00 0.27 0.00 0.00 31.44 31.47 2kbg n GLU 45 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2kbg n ASP 46 N 0.86 0.10 -4.01 4.31 8.00 -1.26 -5.08 116.55 119.47 2kbg n ASP 46 Ca -0.01 -0.39 -0.08 0.00 0.71 0.00 0.00 54.79 55.01 2kbg n ASP 46 Cb 0.73 0.35 -0.10 0.00 -0.02 0.00 0.00 41.12 42.08 2kbg n ASP 46 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2kbg s GLN 47 N -0.35 0.50 -0.20 -1.24 -1.52 -1.26 -5.14 119.66 110.44 2kbg s GLN 47 Ca 0.00 -0.88 -0.04 0.00 -1.95 0.00 0.00 55.36 52.49 2kbg s GLN 47 Cb 0.00 0.18 0.07 0.00 -0.22 0.00 0.00 33.01 33.04 2kbg s GLN 47 CO 0.00 -0.10 0.08 -1.58 -0.25 0.00 0.00 175.29 173.44 2kbg s TRP 48 N -2.71 0.60 0.76 0.91 0.52 -1.26 -4.67 118.94 113.10 2kbg s TRP 48 Ca -0.04 -0.67 -0.11 0.00 0.02 0.00 0.00 56.10 55.30 2kbg s TRP 48 Cb -0.01 -0.90 0.05 0.00 -1.15 0.00 0.00 33.47 31.46 2kbg s TRP 48 CO -0.05 -0.61 1.09 -0.51 0.02 0.00 0.00 176.95 176.88 2kbg s LEU 49 N 2.00 3.05 0.07 2.99 1.43 0.07 -4.82 118.68 123.47 2kbg s LEU 49 Ca 0.02 1.82 0.08 0.00 -1.03 0.00 0.00 54.13 55.03 2kbg s LEU 49 Cb -0.16 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.50 2kbg s LEU 49 CO -0.13 -1.99 -0.21 -1.61 0.23 0.00 0.00 176.35 172.64 2kbg s GLU 50 N -4.88 1.86 -0.19 1.70 2.02 -1.26 -2.20 118.70 115.75 2kbg s GLU 50 Ca 0.61 -1.10 -0.04 0.00 0.02 0.00 0.00 54.97 54.46 2kbg s GLU 50 Cb -0.17 -2.08 0.09 0.00 0.10 0.00 0.00 34.13 32.07 2kbg s GLU 50 CO 0.55 0.51 0.26 0.21 0.02 0.00 0.00 175.26 176.81 2kbg s LYS 51 N -1.60 0.21 -0.07 1.61 2.47 0.42 -4.96 119.74 117.81 2kbg s LYS 51 Ca 0.14 0.41 -0.05 0.00 -1.56 0.00 0.00 55.97 54.92 2kbg s LYS 51 Cb -0.10 -0.75 -0.04 0.00 -1.46 0.00 0.00 37.83 35.47 2kbg s LYS 51 CO 0.05 -0.55 0.15 0.15 0.16 0.00 0.00 175.35 175.31 2kbg s LYS 52 N 2.39 3.41 0.09 4.03 -0.14 -1.26 0.41 119.74 128.67 2kbg s LYS 52 Ca 0.06 -0.22 0.00 0.00 -1.36 0.00 0.00 55.97 54.45 2kbg s LYS 52 Cb -0.15 -3.13 -0.04 0.00 -1.68 0.00 0.00 37.83 32.83 2kbg s LYS 52 CO -0.12 0.73 -0.03 0.08 -0.76 0.00 0.00 175.35 175.25 2kbg s VAL 53 N -1.15 0.42 0.53 3.17 1.01 0.14 -4.96 120.40 119.56 2kbg s VAL 53 Ca 0.20 -1.88 -0.19 0.00 0.00 0.00 0.00 61.98 60.11 2kbg s VAL 53 Cb -0.12 -1.68 -0.06 0.00 0.00 0.00 0.00 36.38 34.52 2kbg s VAL 53 CO 0.10 -0.86 1.08 -1.58 0.00 0.00 0.00 175.10 173.84 2kbg s GLN 54 N -3.90 3.51 0.00 2.72 2.00 -1.26 0.07 119.66 122.80 2kbg s GLN 54 Ca 0.12 1.42 0.00 0.00 -2.00 0.00 0.00 55.36 54.90 2kbg s GLN 54 Cb 0.07 -2.05 0.00 0.00 0.80 0.00 0.00 33.01 31.83 2kbg s GLN 54 CO -0.06 -0.68 0.26 0.41 -0.50 0.00 0.00 175.29 174.72 2kbg n GLY 55 N -0.24 -0.08 0.00 2.59 0.00 0.47 -1.72 105.19 106.21 2kbg n GLY 55 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2kbg n GLY 55 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2kbg n ASN 56 N -0.25 0.00 -0.06 1.61 5.15 -1.26 -4.73 115.26 115.72 2kbg n ASN 56 Ca 0.00 -1.00 -0.11 0.00 -0.60 0.00 0.00 54.58 52.87 2kbg n ASN 56 Cb 0.02 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.23 2kbg n ASN 56 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 2kbg h LYS 57 N 0.00 0.30 -3.35 1.20 1.63 -1.70 -3.46 116.57 111.19 2kbg h LYS 57 Ca 0.00 -0.06 -0.41 0.00 -0.85 0.00 0.00 60.65 59.33 2kbg h LYS 57 Cb 0.63 -0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.21 2kbg h LYS 57 CO 0.00 0.38 -0.54 -3.47 -3.45 0.00 0.00 179.45 172.37 2kbg n ASP 58 N -4.82 -5.85 0.00 4.20 2.03 -1.26 -4.94 116.55 105.91 2kbg n ASP 58 Ca -0.04 -0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.21 2kbg n ASP 58 Cb 0.13 -4.85 0.00 0.00 -0.72 0.00 0.00 41.12 35.69 2kbg n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kbg n HIS 59 N -4.08 0.00 -3.75 -0.67 1.44 -1.26 -2.62 115.22 104.28 2kbg n HIS 59 Ca -0.22 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.36 2kbg n HIS 59 Cb 0.67 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.69 2kbg n HIS 59 CO 0.00 0.00 0.00 0.96 -2.81 0.00 0.00 176.34 174.49 2kbg s ILE 60 N -2.00 0.04 -0.28 0.61 -4.36 -1.24 -4.92 121.20 109.05 2kbg s ILE 60 Ca 0.00 -0.35 0.02 0.00 -0.26 0.00 0.00 60.65 60.06 2kbg s ILE 60 Cb 0.00 -0.60 0.06 0.00 1.25 0.00 0.00 42.46 43.17 2kbg s ILE 60 CO 0.00 -0.19 -0.06 -0.63 0.24 0.00 0.00 174.94 174.30 2kbg s ILE 61 N -0.97 2.41 -0.49 8.37 -1.09 -1.26 -2.66 121.20 125.51 2kbg s ILE 61 Ca -0.10 -1.67 -0.19 0.00 -2.23 0.00 0.00 60.65 56.46 2kbg s ILE 61 Cb -0.04 -2.46 0.05 0.00 -1.58 0.00 0.00 42.46 38.43 2kbg s ILE 61 CO 0.04 -0.13 0.60 -0.76 -1.23 0.00 0.00 174.94 173.45 2kbg s LEU 62 N 1.12 4.92 0.29 2.97 1.02 -1.24 -4.95 118.68 122.80 2kbg s LEU 62 Ca -0.05 -0.83 -0.17 0.00 0.02 0.00 0.00 54.13 53.09 2kbg s LEU 62 Cb -0.20 -2.47 -0.09 0.00 0.02 0.00 0.00 46.19 43.46 2kbg s LEU 62 CO -0.04 -0.83 0.75 -1.61 0.02 0.00 0.00 176.35 174.63 2kbg s GLU 63 N 2.56 4.13 -0.22 1.70 2.02 -1.26 -3.40 118.70 124.23 2kbg s GLU 63 Ca 0.15 0.79 -0.06 0.00 0.02 0.00 0.00 54.97 55.88 2kbg s GLU 63 Cb -0.18 -2.62 0.01 0.00 0.10 0.00 0.00 34.13 31.44 2kbg s GLU 63 CO 0.13 0.25 0.28 1.58 0.02 0.00 0.00 175.26 177.52 2kbg n HIS 64 N 0.10 -1.52 0.25 1.61 -0.00 -1.26 -4.98 115.22 109.42 2kbg n HIS 64 Ca 0.01 0.61 0.03 0.00 0.46 0.00 0.00 57.72 58.83 2kbg n HIS 64 Cb 0.52 -2.67 0.00 0.00 -0.12 0.00 0.00 29.99 27.73 2kbg n HIS 64 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2kbg n LEU 65 N -0.61 1.00 -1.81 0.27 4.77 -1.26 -5.05 117.00 114.31 2kbg n LEU 65 Ca 0.04 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 55.22 2kbg n LEU 65 Cb 0.27 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2kbg n LEU 65 CO 0.22 0.21 -0.26 0.00 -1.33 0.00 0.00 177.39 176.23 2kbg n GLN 66 N -0.25 -3.04 0.28 3.23 6.02 -1.26 -4.45 117.38 117.91 2kbg n GLN 66 Ca 0.03 2.16 0.13 0.00 -0.01 0.00 0.00 57.00 59.30 2kbg n GLN 66 Cb 0.12 -2.57 0.81 0.00 1.02 0.00 0.00 30.24 29.62 2kbg n GLN 66 CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 2kbg h TRP 67 N 3.54 0.00 -0.57 1.08 4.06 -1.92 -2.52 115.95 119.62 2kbg h TRP 67 Ca 0.00 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.84 2kbg h TRP 67 Cb 0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 28.09 2kbg h TRP 67 CO 0.00 0.04 0.12 0.25 -3.56 0.00 0.00 178.44 175.29 2kbg n THR 68 N -3.93 2.74 -3.63 1.49 -2.24 -1.26 -3.98 114.28 103.46 2kbg n THR 68 Ca -0.03 -1.72 -0.14 0.00 -2.27 0.00 0.00 64.05 59.90 2kbg n THR 68 Cb 0.13 -0.31 -0.13 0.00 -2.10 0.00 0.00 70.33 67.91 2kbg n THR 68 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2kbg s MET 69 N -2.93 0.16 0.65 -0.78 -1.94 -0.95 -5.06 119.30 108.46 2kbg s MET 69 Ca 0.52 0.69 -0.11 0.00 -1.71 0.00 0.00 55.69 55.08 2kbg s MET 69 Cb 0.41 -0.16 -0.01 0.00 2.01 0.00 0.00 34.83 37.08 2kbg s MET 69 CO 0.12 -0.34 1.04 0.20 -0.01 0.00 0.00 175.02 176.04 2kbg s GLY 70 N 2.42 1.63 -0.22 -0.03 0.00 -1.26 -4.28 107.32 105.58 2kbg s GLY 70 Ca 0.02 -0.28 -0.14 0.00 0.00 0.00 0.00 44.72 44.32 2kbg s GLY 70 CO -0.09 0.03 0.55 -2.52 0.00 0.00 0.00 173.10 171.07 2kbg s TYR 71 N -3.23 -0.78 0.34 1.90 1.13 -1.25 -1.69 117.35 113.76 2kbg s TYR 71 Ca 0.56 1.66 -0.12 0.00 -1.41 0.00 0.00 57.07 57.76 2kbg s TYR 71 Cb -0.11 0.40 -0.07 0.00 -1.10 0.00 0.00 41.96 41.07 2kbg s TYR 71 CO 0.52 -0.40 0.71 -1.21 -2.51 0.00 0.00 175.55 172.65 2kbg s GLU 72 N 1.27 3.86 -0.04 -3.49 2.02 -0.60 -4.17 118.70 117.55 2kbg s GLU 72 Ca -0.08 0.49 0.04 0.00 0.02 0.00 0.00 54.97 55.44 2kbg s GLU 72 Cb -0.06 -2.46 0.00 0.00 0.10 0.00 0.00 34.13 31.71 2kbg s GLU 72 CO -0.13 0.11 -0.15 0.08 0.02 0.00 0.00 175.26 175.19 2kbg s VAL 73 N -2.11 1.29 -0.27 2.63 1.01 0.90 -2.11 120.40 121.74 2kbg s VAL 73 Ca 0.51 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.89 2kbg s VAL 73 Cb -0.10 -1.12 0.07 0.00 0.00 0.00 0.00 36.38 35.23 2kbg s VAL 73 CO 0.24 0.38 -0.02 -1.58 0.00 0.00 0.00 175.10 174.11 2kbg s GLN 74 N 0.16 1.59 -0.08 2.72 0.74 0.21 0.33 119.66 125.33 2kbg s GLN 74 Ca -0.06 -1.23 -0.18 0.00 0.05 0.00 0.00 55.36 53.94 2kbg s GLN 74 Cb -0.12 -2.69 -0.05 0.00 1.10 0.00 0.00 33.01 31.25 2kbg s GLN 74 CO 0.02 -0.71 0.48 0.42 -0.55 0.00 0.00 175.29 174.96 2kbg s ILE 75 N 1.27 5.12 -0.07 -2.34 1.09 0.81 -0.82 121.20 126.26 2kbg s ILE 75 Ca -0.01 0.97 -0.01 0.00 -1.10 0.00 0.00 60.65 60.50 2kbg s ILE 75 Cb -0.19 -3.81 0.03 0.00 -1.06 0.00 0.00 42.46 37.42 2kbg s ILE 75 CO -0.09 0.38 -0.02 -0.89 -0.10 0.00 0.00 174.94 174.23 2kbg s THR 76 N 0.21 0.51 -0.22 2.92 2.01 0.56 0.83 115.64 122.46 2kbg s THR 76 Ca 0.26 0.02 -0.16 0.00 0.31 0.00 0.00 61.69 62.12 2kbg s THR 76 Cb -0.16 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.69 2kbg s THR 76 CO 0.12 0.27 0.40 0.00 -0.69 0.00 0.00 174.62 174.72 2kbg s ALA 77 N 1.77 3.56 -0.42 7.40 0.00 -1.26 0.25 121.76 133.06 2kbg s ALA 77 Ca 0.03 -0.58 -0.15 0.00 0.00 0.00 0.00 51.96 51.26 2kbg s ALA 77 Cb -0.13 -2.66 0.03 0.00 0.00 0.00 0.00 23.12 20.37 2kbg s ALA 77 CO -0.05 -0.38 0.32 0.00 0.00 0.00 0.00 175.76 175.65 2kbg s ALA 78 N 1.48 3.49 0.00 0.00 0.00 -0.40 0.35 121.76 126.68 2kbg s ALA 78 Ca 0.18 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.33 2kbg s ALA 78 Cb -0.15 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.05 2kbg s ALA 78 CO 0.08 -1.52 0.00 0.27 0.00 0.00 0.00 175.76 174.59 2kbg n ASN 79 N 5.16 1.58 -0.08 0.00 6.94 -1.25 -1.13 115.26 126.48 2kbg n ASN 79 Ca -0.11 -0.49 0.24 0.00 -0.02 0.00 0.00 54.58 54.19 2kbg n ASN 79 Cb 0.46 0.00 0.70 0.00 -2.36 0.00 0.00 39.78 38.58 2kbg n ASN 79 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 2kbg h ARG 80 N 0.00 0.01 -0.79 -3.83 2.43 -1.84 0.82 114.38 111.18 2kbg h ARG 80 Ca 0.00 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2kbg h ARG 80 Cb 0.00 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.51 2kbg h ARG 80 CO 0.00 0.01 0.36 -0.07 -1.51 0.00 0.00 179.97 178.76 2kbg h LEU 81 N 0.01 1.05 0.00 3.80 4.07 -1.93 -3.47 115.31 118.83 2kbg h LEU 81 Ca 0.33 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 58.15 2kbg h LEU 81 Cb 1.30 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.77 2kbg h LEU 81 CO -0.01 0.90 0.00 0.61 -1.08 0.00 0.00 178.44 178.86 2kbg n GLY 82 N -1.00 3.43 3.46 0.83 0.00 0.28 -5.00 105.19 107.19 2kbg n GLY 82 Ca 0.08 -1.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.02 2kbg n GLY 82 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2kbg s TYR 83 N 0.00 -1.01 0.54 1.61 1.51 -1.26 -3.89 117.35 114.85 2kbg s TYR 83 Ca 0.00 1.88 -0.05 0.00 -1.01 0.00 0.00 57.07 57.89 2kbg s TYR 83 Cb 0.00 0.53 -0.01 0.00 -0.11 0.00 0.00 41.96 42.38 2kbg s TYR 83 CO 0.00 -0.54 0.84 -1.54 -1.11 0.00 0.00 175.55 173.20 2kbg s SER 84 N 2.43 5.81 -0.43 2.29 1.04 0.16 -4.92 113.70 120.08 2kbg s SER 84 Ca -0.05 0.72 -0.41 0.00 0.48 0.00 0.00 55.95 56.69 2kbg s SER 84 Cb -0.11 -1.83 -0.16 0.00 0.10 0.00 0.00 66.02 64.02 2kbg s SER 84 CO -0.16 -0.88 2.07 -0.62 0.98 0.00 0.00 173.24 174.63 2kbg n GLU 85 N -2.43 0.46 -1.36 4.02 1.02 -1.26 -4.31 120.64 116.78 2kbg n GLU 85 Ca 0.03 0.14 -0.31 0.00 -0.02 0.00 0.00 57.16 57.00 2kbg n GLU 85 Cb 0.57 -1.87 0.08 0.00 -0.02 0.00 0.00 31.44 30.20 2kbg n GLU 85 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2kbg s PRO 86 N 5.59 2.42 -0.28 3.49 0.04 -1.26 -4.79 135.00 140.22 2kbg s PRO 86 Ca 1.13 1.07 -0.07 0.00 0.04 0.00 0.00 61.00 63.17 2kbg s PRO 86 Cb -1.25 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 31.36 2kbg s PRO 86 CO 0.62 -1.50 0.08 0.99 0.04 0.00 0.00 177.00 177.23 2kbg s THR 87 N -2.96 4.14 -0.70 1.26 2.01 0.24 -4.91 115.64 114.73 2kbg s THR 87 Ca 0.60 -0.49 -0.18 0.00 0.31 0.00 0.00 61.69 61.94 2kbg s THR 87 Cb -0.16 -3.06 0.13 0.00 0.01 0.00 0.00 72.50 69.42 2kbg s THR 87 CO 0.56 0.17 0.79 -0.69 -0.69 0.00 0.00 174.62 174.76 2kbg s VAL 88 N 1.55 4.97 -0.26 3.82 1.01 -1.26 -0.13 120.40 130.10 2kbg s VAL 88 Ca 0.04 -1.42 -0.11 0.00 0.00 0.00 0.00 61.98 60.50 2kbg s VAL 88 Cb -0.16 -4.54 -0.05 0.00 0.00 0.00 0.00 36.38 31.63 2kbg s VAL 88 CO 0.03 -1.17 0.17 -0.47 0.00 0.00 0.00 175.10 173.66 2kbg s TYR 89 N 2.14 3.24 -0.09 5.22 5.04 0.15 -4.97 117.35 128.09 2kbg s TYR 89 Ca 0.16 0.12 0.03 0.00 -2.44 0.00 0.00 57.07 54.95 2kbg s TYR 89 Cb -0.18 -2.33 0.00 0.00 0.35 0.00 0.00 41.96 39.80 2kbg s TYR 89 CO 0.00 -0.09 -0.21 -1.83 -1.34 0.00 0.00 175.55 172.08 2kbg s GLU 90 N 1.51 2.68 -0.29 4.97 -1.05 -1.26 -0.07 118.70 125.19 2kbg s GLU 90 Ca 0.07 -0.75 -0.15 0.00 -0.15 0.00 0.00 54.97 53.99 2kbg s GLU 90 Cb -0.15 -2.05 0.12 0.00 -0.44 0.00 0.00 34.13 31.60 2kbg s GLU 90 CO 0.08 0.14 0.83 -0.59 0.95 0.00 0.00 175.26 176.67 2kbg s PHE 91 N 0.44 -0.85 0.75 4.83 -0.71 -1.26 -5.04 117.98 116.14 2kbg s PHE 91 Ca -0.18 1.65 -0.11 0.00 -1.04 0.00 0.00 56.93 57.25 2kbg s PHE 91 Cb -0.17 0.51 0.05 0.00 -1.21 0.00 0.00 43.02 42.19 2kbg s PHE 91 CO 0.07 -0.42 1.13 -1.54 -1.34 0.00 0.00 175.22 173.12 2kbg s SER 92 N 1.69 4.96 0.14 1.98 1.04 -1.26 -3.82 113.70 118.43 2kbg s SER 92 Ca -0.09 0.92 -0.08 0.00 0.48 0.00 0.00 55.95 57.18 2kbg s SER 92 Cb -0.05 -1.57 -0.06 0.00 0.10 0.00 0.00 66.02 64.44 2kbg s SER 92 CO -0.18 -1.62 0.44 -0.04 0.98 0.00 0.00 173.24 172.82 2kbg s MET 93 N -5.45 3.74 0.72 4.02 -1.94 -1.26 -4.93 119.30 114.19 2kbg s MET 93 Ca 0.60 0.13 -0.11 0.00 -1.71 0.00 0.00 55.69 54.60 2kbg s MET 93 Cb -0.11 -2.86 0.02 0.00 2.01 0.00 0.00 34.83 33.89 2kbg s MET 93 CO 0.50 0.47 1.07 -1.25 -0.01 0.00 0.00 175.02 175.80 2kbg s PRO 94 N -2.37 2.77 0.71 2.03 0.04 -1.26 -4.74 135.00 132.17 2kbg s PRO 94 Ca 0.39 0.75 -0.15 0.00 0.04 0.00 0.00 61.00 62.03 2kbg s PRO 94 Cb -0.13 -1.99 0.03 0.00 0.04 0.00 0.00 34.50 32.45 2kbg s PRO 94 CO 0.21 -1.17 1.18 -1.25 0.04 0.00 0.00 177.00 176.01 2kbg s PRO 95 N -5.15 2.33 0.04 0.56 0.04 -1.26 -4.52 135.00 127.04 2kbg s PRO 95 Ca 0.58 1.66 -0.30 0.00 0.04 0.00 0.00 61.00 62.98 2kbg s PRO 95 Cb -0.13 -1.87 -0.16 0.00 0.04 0.00 0.00 34.50 32.39 2kbg s PRO 95 CO 0.54 -1.67 0.76 1.17 0.04 0.00 0.00 177.00 177.84 2kbg n LYS 96 N -2.62 0.00 -2.18 4.56 3.00 -1.26 -4.83 118.16 114.82 2kbg n LYS 96 Ca 0.13 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 58.04 2kbg n LYS 96 Cb 0.51 -1.12 -0.02 0.00 0.00 0.00 0.00 35.03 34.40 2kbg n LYS 96 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2kbg s PRO 97 N -0.18 4.25 0.00 1.64 0.04 -1.26 -4.92 135.00 134.57 2kbg s PRO 97 Ca 0.68 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.80 2kbg s PRO 97 Cb -0.96 -2.94 0.00 0.00 0.04 0.00 0.00 34.50 30.64 2kbg s PRO 97 CO 0.46 -0.23 0.00 0.09 0.04 0.00 0.00 177.00 177.36 2kbg n ASN 98 N 0.56 3.56 -0.23 6.66 5.03 -1.26 -4.76 115.26 124.82 2kbg n ASN 98 Ca 0.01 0.00 0.04 0.00 0.87 0.00 0.00 54.58 55.50 2kbg n ASN 98 Cb 0.43 0.16 0.05 0.00 -1.02 0.00 0.00 39.78 39.41 2kbg n ASN 98 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 2kbg n ILE 99 N -2.08 0.85 0.00 2.41 -5.35 -1.26 -5.10 119.36 108.83 2kbg n ILE 99 Ca 0.00 -1.00 0.00 0.00 -0.27 0.00 0.00 62.75 61.48 2kbg n ILE 99 Cb 0.41 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.57 2kbg n ILE 99 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kbg n ILE 100 N -0.62 0.00 0.03 7.28 0.13 -1.26 -4.93 119.36 119.99 2kbg n ILE 100 Ca 0.06 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.71 2kbg n ILE 100 Cb 0.61 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.41 2kbg n ILE 100 CO 0.00 0.00 0.00 0.29 2.80 0.00 0.00 176.55 179.64 2kbg n LYS 101 N 0.57 0.00 0.00 9.51 5.02 -1.26 -5.19 118.16 126.81 2kbg n LYS 101 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2kbg n LYS 101 Cb 0.00 -0.26 0.00 0.00 -0.02 0.00 0.00 35.03 34.75 2kbg n LYS 101 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41