#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ie4 s GLU 2 N 0.00 3.68 0.07 2.98 2.56 -1.26 -5.05 118.70 121.68 3ie4 s GLU 2 Ca 0.00 -0.49 -0.31 0.00 0.00 0.00 0.00 54.97 54.17 3ie4 s GLU 2 Cb 0.00 -3.75 -0.07 0.00 2.00 0.00 0.00 34.13 32.31 3ie4 s GLU 2 CO 0.00 -0.35 1.47 0.08 -0.56 0.00 0.00 175.26 175.90 3ie4 s VAL 3 N 1.77 3.33 0.42 3.70 1.01 -1.26 -4.94 120.40 124.43 3ie4 s VAL 3 Ca 0.07 0.85 -0.26 0.00 0.00 0.00 0.00 61.98 62.64 3ie4 s VAL 3 Cb -0.17 -3.55 -0.10 0.00 0.00 0.00 0.00 36.38 32.57 3ie4 s VAL 3 CO 0.11 0.03 1.41 -2.65 0.00 0.00 0.00 175.10 173.99 3ie4 n PRO 4 N 4.80 2.29 -2.18 2.72 -0.02 -1.26 -4.93 135.00 136.42 3ie4 n PRO 4 Ca 0.13 0.81 -0.42 0.00 -2.02 0.00 0.00 63.50 62.00 3ie4 n PRO 4 Cb 0.42 -2.57 -0.03 0.00 -0.02 0.00 0.00 33.50 31.30 3ie4 n PRO 4 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3ie4 s LYS 5 N -2.28 4.34 0.29 -0.52 2.47 -1.26 -4.97 119.74 117.81 3ie4 s LYS 5 Ca 0.59 2.08 -0.29 0.00 -1.56 0.00 0.00 55.97 56.79 3ie4 s LYS 5 Cb -0.48 -3.23 -0.10 0.00 -1.46 0.00 0.00 37.83 32.57 3ie4 s LYS 5 CO 0.59 -0.39 1.26 0.00 0.16 0.00 0.00 175.35 176.98 3ie4 s ALA 6 N 0.78 3.48 -0.20 3.13 0.00 -1.26 -4.85 121.76 122.83 3ie4 s ALA 6 Ca 0.62 1.14 -0.14 0.00 0.00 0.00 0.00 51.96 53.58 3ie4 s ALA 6 Cb -0.37 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.27 3ie4 s ALA 6 CO 0.33 -0.50 0.31 0.21 0.00 0.00 0.00 175.76 176.11 3ie4 s LYS 7 N -1.37 4.16 -0.19 0.00 2.20 0.07 -4.92 119.74 119.69 3ie4 s LYS 7 Ca 0.49 0.05 -0.00 0.00 -0.36 0.00 0.00 55.97 56.15 3ie4 s LYS 7 Cb -0.37 -3.51 0.01 0.00 -1.51 0.00 0.00 37.83 32.45 3ie4 s LYS 7 CO 0.47 0.05 -0.15 0.42 -0.36 0.00 0.00 175.35 175.77 3ie4 s ILE 8 N 1.06 2.41 -0.15 5.43 1.01 -1.26 -1.09 121.20 128.62 3ie4 s ILE 8 Ca 0.15 -0.85 -0.02 0.00 0.00 0.00 0.00 60.65 59.94 3ie4 s ILE 8 Cb -0.14 -2.06 -0.02 0.00 0.01 0.00 0.00 42.46 40.26 3ie4 s ILE 8 CO 0.06 0.49 -0.08 -1.81 0.00 0.00 0.00 174.94 173.59 3ie4 s ASP 9 N 1.33 4.34 -0.12 3.58 1.01 -0.20 -4.99 116.67 121.62 3ie4 s ASP 9 Ca 0.05 -0.26 -0.01 0.00 0.71 0.00 0.00 52.55 53.03 3ie4 s ASP 9 Cb -0.14 -1.69 -0.02 0.00 1.01 0.00 0.00 42.92 42.08 3ie4 s ASP 9 CO -0.10 0.14 -0.09 -0.69 0.21 0.00 0.00 175.17 174.64 3ie4 s VAL 10 N 0.52 3.48 0.13 -1.27 1.01 -1.26 -0.59 120.40 122.43 3ie4 s VAL 10 Ca -0.06 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.46 3ie4 s VAL 10 Cb -0.15 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 3ie4 s VAL 10 CO 0.03 0.53 0.04 -0.36 0.00 0.00 0.00 175.10 175.35 3ie4 s PHE 11 N 0.08 3.00 -0.13 5.22 0.40 -0.56 -0.17 117.98 125.82 3ie4 s PHE 11 Ca -0.03 -0.05 -0.03 0.00 -0.60 0.00 0.00 56.93 56.23 3ie4 s PHE 11 Cb -0.14 -1.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.87 3ie4 s PHE 11 CO 0.04 0.50 -0.04 -0.47 0.70 0.00 0.00 175.22 175.95 3ie4 s TYR 12 N -1.56 3.03 -0.98 0.36 5.04 0.98 -2.79 117.35 121.43 3ie4 s TYR 12 Ca 0.28 -0.18 0.27 0.00 -2.44 0.00 0.00 57.07 54.99 3ie4 s TYR 12 Cb -0.11 -1.90 0.81 0.00 0.35 0.00 0.00 41.96 41.12 3ie4 s TYR 12 CO 0.20 0.09 1.63 -0.35 -1.34 0.00 0.00 175.55 175.78 3ie4 n PRO 13 N 3.14 0.02 -3.80 4.97 -0.04 -1.26 -4.96 135.00 133.08 3ie4 n PRO 13 Ca -0.18 0.01 -0.10 0.00 -0.04 0.00 0.00 63.50 63.19 3ie4 n PRO 13 Cb 0.53 -1.52 -0.07 0.00 -0.04 0.00 0.00 33.50 32.40 3ie4 n PRO 13 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 3ie4 s LYS 14 N -3.01 0.80 0.00 0.54 -2.85 -1.12 -4.44 119.74 109.66 3ie4 s LYS 14 Ca 0.12 -0.66 0.00 0.00 -1.00 0.00 0.00 55.97 54.43 3ie4 s LYS 14 Cb 0.18 0.34 0.00 0.00 -2.06 0.00 0.00 37.83 36.29 3ie4 s LYS 14 CO 0.63 -0.25 0.00 0.41 0.10 0.00 0.00 175.35 176.23 3ie4 n GLY 15 N 0.41 1.83 3.46 0.59 0.00 0.60 -4.54 105.19 107.55 3ie4 n GLY 15 Ca -0.18 -1.95 -0.11 0.00 0.00 0.00 0.00 46.02 43.78 3ie4 n GLY 15 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ie4 s PHE 16 N -2.50 -0.47 0.00 1.61 -0.12 -0.34 -1.50 117.98 114.66 3ie4 s PHE 16 Ca 0.00 0.28 0.05 0.00 -0.05 0.00 0.00 56.93 57.21 3ie4 s PHE 16 Cb 0.00 0.56 -0.01 0.00 -0.63 0.00 0.00 43.02 42.93 3ie4 s PHE 16 CO 0.00 -0.77 -0.15 -1.21 -0.05 0.00 0.00 175.22 173.04 3ie4 s GLU 17 N -3.57 1.18 -0.12 1.99 2.02 0.25 -0.62 118.70 119.83 3ie4 s GLU 17 Ca 0.02 -0.60 0.02 0.00 0.02 0.00 0.00 54.97 54.43 3ie4 s GLU 17 Cb -0.01 -1.16 0.01 0.00 0.10 0.00 0.00 34.13 33.07 3ie4 s GLU 17 CO -0.11 0.31 -0.19 0.08 0.02 0.00 0.00 175.26 175.37 3ie4 s VAL 18 N -0.47 1.78 0.07 2.63 1.01 -0.04 -1.03 120.40 124.35 3ie4 s VAL 18 Ca 0.05 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.11 3ie4 s VAL 18 Cb -0.06 -1.59 0.01 0.00 0.00 0.00 0.00 36.38 34.73 3ie4 s VAL 18 CO -0.00 0.50 0.23 -0.94 0.00 0.00 0.00 175.10 174.89 3ie4 s SER 19 N 0.84 0.02 0.12 3.32 1.04 -0.25 -0.18 113.70 118.60 3ie4 s SER 19 Ca -0.08 -0.46 0.05 0.00 0.48 0.00 0.00 55.95 55.94 3ie4 s SER 19 Cb -0.15 0.34 -0.04 0.00 0.10 0.00 0.00 66.02 66.27 3ie4 s SER 19 CO -0.00 -0.67 -0.13 0.27 0.98 0.00 0.00 173.24 173.68 3ie4 s ILE 20 N -3.27 1.21 0.40 -1.02 -4.36 -0.70 -0.75 121.20 112.71 3ie4 s ILE 20 Ca 0.00 -1.71 -0.24 0.00 -0.26 0.00 0.00 60.65 58.45 3ie4 s ILE 20 Cb 0.02 -1.49 -0.09 0.00 1.25 0.00 0.00 42.46 42.15 3ie4 s ILE 20 CO -0.08 -0.47 1.06 -2.16 0.24 0.00 0.00 174.94 173.53 3ie4 s PRO 21 N -2.74 4.15 0.60 0.37 0.04 -1.26 -0.83 135.00 135.32 3ie4 s PRO 21 Ca 0.08 1.53 -0.14 0.00 0.04 0.00 0.00 61.00 62.51 3ie4 s PRO 21 Cb -0.04 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 3ie4 s PRO 21 CO 0.02 -0.16 1.03 0.34 0.04 0.00 0.00 177.00 178.27 3ie4 s ASP 22 N -1.54 6.02 0.25 6.66 2.15 -0.12 -4.80 116.67 125.29 3ie4 s ASP 22 Ca 0.58 1.64 -0.13 0.00 0.43 0.00 0.00 52.55 55.07 3ie4 s ASP 22 Cb -0.23 -2.51 -0.00 0.00 -0.30 0.00 0.00 42.92 39.88 3ie4 s ASP 22 CO 0.28 -1.00 0.48 -1.83 -0.17 0.00 0.00 175.17 172.93 3ie4 s GLU 23 N -4.46 1.55 0.20 4.34 -1.05 -1.26 -4.96 118.70 113.07 3ie4 s GLU 23 Ca 0.60 -1.25 -0.32 0.00 -0.15 0.00 0.00 54.97 53.85 3ie4 s GLU 23 Cb -0.13 0.47 -0.14 0.00 -0.44 0.00 0.00 34.13 33.89 3ie4 s GLU 23 CO 0.42 -0.65 1.36 -1.91 0.95 0.00 0.00 175.26 175.43 3ie4 n GLU 24 N -0.38 1.77 0.00 -4.83 0.00 -1.26 -2.44 120.64 113.50 3ie4 n GLU 24 Ca -0.02 0.63 0.00 0.00 0.00 0.00 0.00 57.16 57.78 3ie4 n GLU 24 Cb 0.62 -2.26 0.00 0.00 0.00 0.00 0.00 31.44 29.80 3ie4 n GLU 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3ie4 n GLY 25 N 2.28 3.32 3.70 8.31 0.00 -1.26 -4.90 105.19 116.65 3ie4 n GLY 25 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3ie4 n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ie4 s ILE 26 N -2.88 4.61 0.00 -0.61 1.01 -1.02 -0.67 121.20 121.64 3ie4 s ILE 26 Ca 0.00 1.88 0.00 0.00 0.00 0.00 0.00 60.65 62.53 3ie4 s ILE 26 Cb 0.00 -4.20 0.00 0.00 0.01 0.00 0.00 42.46 38.27 3ie4 s ILE 26 CO 0.00 0.10 0.41 0.35 0.00 0.00 0.00 174.94 175.80 3ie4 n THR 27 N 4.11 0.12 -3.57 2.92 -2.24 0.00 -4.91 114.28 110.70 3ie4 n THR 27 Ca 0.08 -0.38 -0.16 0.00 -2.27 0.00 0.00 64.05 61.32 3ie4 n THR 27 Cb 0.49 1.24 -0.06 0.00 -2.10 0.00 0.00 70.33 69.90 3ie4 n THR 27 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3ie4 s LEU 28 N -0.12 -0.67 -0.04 3.22 2.96 -1.24 -4.84 118.68 117.94 3ie4 s LEU 28 Ca 0.00 0.99 0.03 0.00 -0.22 0.00 0.00 54.13 54.93 3ie4 s LEU 28 Cb 0.00 2.45 0.01 0.00 0.50 0.00 0.00 46.19 49.15 3ie4 s LEU 28 CO 0.00 -0.44 -0.11 0.12 -1.32 0.00 0.00 176.35 174.60 3ie4 s PHE 29 N -0.52 1.20 0.04 5.38 5.36 -0.84 -1.89 117.98 126.70 3ie4 s PHE 29 Ca -0.06 -0.35 0.06 0.00 -0.96 0.00 0.00 56.93 55.62 3ie4 s PHE 29 Cb -0.02 -0.86 -0.02 0.00 -0.34 0.00 0.00 43.02 41.77 3ie4 s PHE 29 CO 0.05 -0.16 -0.16 0.00 -1.46 0.00 0.00 175.22 173.49 3ie4 s ALA 30 N 0.34 1.38 -0.06 11.12 0.00 0.28 0.01 121.76 134.84 3ie4 s ALA 30 Ca -0.07 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.06 3ie4 s ALA 30 Cb -0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 3ie4 s ALA 30 CO 0.02 0.29 -0.23 0.12 0.00 0.00 0.00 175.76 175.95 3ie4 s PHE 31 N -0.79 2.25 -0.07 0.00 5.36 -0.73 -1.63 117.98 122.37 3ie4 s PHE 31 Ca 0.04 -0.69 0.00 0.00 -0.96 0.00 0.00 56.93 55.32 3ie4 s PHE 31 Cb -0.08 -1.49 0.02 0.00 -0.34 0.00 0.00 43.02 41.13 3ie4 s PHE 31 CO 0.01 -0.22 -0.05 -1.01 -1.46 0.00 0.00 175.22 172.49 3ie4 s HIS 32 N -0.05 0.94 0.09 10.12 3.76 -0.67 -1.43 115.29 128.04 3ie4 s HIS 32 Ca -0.05 -0.33 -0.12 0.00 -0.15 0.00 0.00 55.06 54.41 3ie4 s HIS 32 Cb -0.14 -0.85 0.01 0.00 1.11 0.00 0.00 32.58 32.71 3ie4 s HIS 32 CO 0.04 -0.30 0.27 0.20 -0.85 0.00 0.00 174.74 174.10 3ie4 s GLY 33 N 1.32 -0.05 0.03 -2.22 0.00 0.14 -1.18 107.32 105.37 3ie4 s GLY 33 Ca -0.04 -0.31 -0.05 0.00 0.00 0.00 0.00 44.72 44.32 3ie4 s GLY 33 CO -0.02 -0.52 0.07 0.54 0.00 0.00 0.00 173.10 173.16 3ie4 s LYS 34 N -3.49 0.55 -0.25 2.90 1.02 0.17 -0.41 119.74 120.23 3ie4 s LYS 34 Ca 0.02 -0.75 -0.09 0.00 0.02 0.00 0.00 55.97 55.17 3ie4 s LYS 34 Cb 0.02 0.21 -0.04 0.00 -0.52 0.00 0.00 37.83 37.51 3ie4 s LYS 34 CO -0.09 -0.13 0.11 -1.17 -0.92 0.00 0.00 175.35 173.15 3ie4 s LEU 35 N -2.06 3.74 -1.76 3.17 2.96 -1.26 -0.55 118.68 122.92 3ie4 s LEU 35 Ca -0.06 -0.07 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 3ie4 s LEU 35 Cb -0.02 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.66 3ie4 s LEU 35 CO -0.04 0.00 0.00 0.59 -1.32 0.00 0.00 176.35 175.58 3ie4 n ASN 36 N 4.70 -5.09 -3.69 3.68 3.02 0.10 -4.94 115.26 113.04 3ie4 n ASN 36 Ca -0.15 0.33 -0.12 0.00 -0.03 0.00 0.00 54.58 54.61 3ie4 n ASN 36 Cb 0.52 -4.13 -0.09 0.00 -0.61 0.00 0.00 39.78 35.47 3ie4 n ASN 36 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3ie4 s GLU 37 N -3.77 0.54 0.65 3.52 2.12 -1.26 -5.03 118.70 115.47 3ie4 s GLU 37 Ca 0.00 0.79 -0.16 0.00 0.36 0.00 0.00 54.97 55.96 3ie4 s GLU 37 Cb 0.00 0.17 -0.00 0.00 0.26 0.00 0.00 34.13 34.55 3ie4 s GLU 37 CO 0.00 -0.11 1.15 -1.21 -0.54 0.00 0.00 175.26 174.56 3ie4 s GLU 38 N 0.81 2.71 0.30 4.30 2.02 -1.26 -4.64 118.70 122.94 3ie4 s GLU 38 Ca -0.04 1.59 -0.28 0.00 0.02 0.00 0.00 54.97 56.26 3ie4 s GLU 38 Cb -0.05 -1.92 -0.09 0.00 0.10 0.00 0.00 34.13 32.16 3ie4 s GLU 38 CO -0.06 -1.36 1.06 -1.64 0.02 0.00 0.00 175.26 173.28 3ie4 s MET 39 N -3.81 4.56 -0.69 1.61 -1.94 -1.26 -5.01 119.30 112.75 3ie4 s MET 39 Ca 0.71 1.66 -0.17 0.00 -1.71 0.00 0.00 55.69 56.19 3ie4 s MET 39 Cb -0.25 -3.03 0.14 0.00 2.01 0.00 0.00 34.83 33.71 3ie4 s MET 39 CO 0.39 0.18 0.74 -2.00 -0.01 0.00 0.00 175.02 174.32 3ie4 s GLU 40 N -1.68 3.26 3.92 2.03 2.12 -1.26 -4.96 118.70 122.12 3ie4 s GLU 40 Ca 0.47 -1.77 0.00 0.00 0.36 0.00 0.00 54.97 54.03 3ie4 s GLU 40 Cb -0.28 -4.40 0.00 0.00 0.26 0.00 0.00 34.13 29.71 3ie4 s GLU 40 CO 0.36 -1.46 0.00 0.41 -0.54 0.00 0.00 175.26 174.02 3ie4 n GLY 41 N 4.95 0.93 2.27 -1.50 0.00 -1.26 -3.40 105.19 107.17 3ie4 n GLY 41 Ca 0.00 -0.64 -0.23 0.00 0.00 0.00 0.00 46.02 45.16 3ie4 n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ie4 n LEU 42 N 0.00 6.35 -4.76 0.99 4.77 -1.26 -4.95 117.00 118.14 3ie4 n LEU 42 Ca 0.00 -3.76 -0.30 0.00 -0.03 0.00 0.00 56.01 51.92 3ie4 n LEU 42 Cb 0.00 -1.20 0.12 0.00 -2.33 0.00 0.00 43.42 40.01 3ie4 n LEU 42 CO 0.00 1.58 0.69 -1.83 -1.33 0.00 0.00 177.39 176.50 3ie4 s GLU 43 N -1.49 1.54 0.25 3.23 -1.05 -1.22 -4.97 118.70 115.00 3ie4 s GLU 43 Ca 0.51 0.65 0.05 0.00 -0.15 0.00 0.00 54.97 56.03 3ie4 s GLU 43 Cb 0.34 -1.86 0.30 0.00 -0.44 0.00 0.00 34.13 32.47 3ie4 s GLU 43 CO -0.14 -2.00 1.60 0.00 0.95 0.00 0.00 175.26 175.67 3ie4 h ALA 44 N -1.37 0.92 -0.07 -0.84 0.00 -1.93 -3.47 119.26 112.50 3ie4 h ALA 44 Ca -0.49 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 53.92 3ie4 h ALA 44 Cb 1.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3ie4 h ALA 44 CO 0.58 0.69 0.00 0.41 0.00 0.00 0.00 179.25 180.93 3ie4 n GLY 45 N 0.14 -1.16 0.12 0.00 0.00 -1.26 -3.75 105.19 99.27 3ie4 n GLY 45 Ca -0.02 -1.24 -0.20 0.00 0.00 0.00 0.00 46.02 44.55 3ie4 n GLY 45 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ie4 h THR 46 N 0.00 1.36 -3.39 2.61 2.02 -1.13 -3.45 112.91 110.93 3ie4 h THR 46 Ca 0.00 -2.48 -0.66 0.00 0.77 0.00 0.00 66.41 64.04 3ie4 h THR 46 Cb 0.00 3.03 -0.27 0.00 -1.74 0.00 0.00 68.15 69.17 3ie4 h THR 46 CO 0.00 0.70 -0.78 0.26 0.37 0.00 0.00 175.52 176.07 3ie4 s TRP 47 N -2.43 2.77 -0.18 3.16 0.51 -0.86 -5.00 118.94 116.91 3ie4 s TRP 47 Ca -0.16 -0.65 -0.08 0.00 -2.12 0.00 0.00 56.10 53.09 3ie4 s TRP 47 Cb 0.02 -1.81 0.07 0.00 -0.81 0.00 0.00 33.47 30.94 3ie4 s TRP 47 CO 0.80 -0.20 0.39 0.00 -0.51 0.00 0.00 176.95 177.43 3ie4 s ALA 48 N 0.25 -1.03 -0.21 0.98 0.00 -1.26 -0.68 121.76 119.82 3ie4 s ALA 48 Ca -0.10 1.44 -0.16 0.00 0.00 0.00 0.00 51.96 53.14 3ie4 s ALA 48 Cb -0.16 -1.10 0.06 0.00 0.00 0.00 0.00 23.12 21.92 3ie4 s ALA 48 CO 0.06 -0.52 0.54 0.50 0.00 0.00 0.00 175.76 176.34 3ie4 s ARG 49 N 2.03 0.59 -0.09 0.00 3.52 -0.52 -5.00 118.95 119.48 3ie4 s ARG 49 Ca -0.05 0.87 -0.24 0.00 -0.13 0.00 0.00 55.73 56.18 3ie4 s ARG 49 Cb -0.10 0.19 -0.03 0.00 -1.56 0.00 0.00 34.95 33.44 3ie4 s ARG 49 CO -0.12 -0.11 0.73 -0.51 -0.81 0.00 0.00 175.30 174.47 3ie4 s ASP 50 N 0.88 6.97 -0.27 -2.12 1.01 -1.26 -1.78 116.67 120.09 3ie4 s ASP 50 Ca -0.05 1.17 -0.07 0.00 0.71 0.00 0.00 52.55 54.32 3ie4 s ASP 50 Cb -0.05 -2.42 -0.01 0.00 1.01 0.00 0.00 42.92 41.45 3ie4 s ASP 50 CO -0.07 -0.19 0.07 -0.63 0.21 0.00 0.00 175.17 174.55 3ie4 s ILE 51 N 1.17 4.05 -1.57 0.77 -1.09 0.10 -4.99 121.20 119.64 3ie4 s ILE 51 Ca 0.37 -0.47 0.18 0.00 -2.23 0.00 0.00 60.65 58.51 3ie4 s ILE 51 Cb -0.17 -2.99 -0.02 0.00 -1.58 0.00 0.00 42.46 37.69 3ie4 s ILE 51 CO 0.17 0.21 0.91 1.33 -1.23 0.00 0.00 174.94 176.33 3ie4 n VAL 52 N 4.89 0.00 -4.09 2.92 0.24 -1.26 -1.99 118.33 119.03 3ie4 n VAL 52 Ca -0.15 -0.29 -0.17 0.00 -2.04 0.00 0.00 64.34 61.69 3ie4 n VAL 52 Cb 0.50 1.19 -0.15 0.00 -1.47 0.00 0.00 33.84 33.90 3ie4 n VAL 52 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3ie4 s LYS 53 N -2.14 0.48 0.20 7.34 -0.14 -1.26 -4.87 119.74 119.35 3ie4 s LYS 53 Ca 0.14 -0.08 -0.29 0.00 -1.36 0.00 0.00 55.97 54.38 3ie4 s LYS 53 Cb 0.14 -0.53 -0.08 0.00 -1.68 0.00 0.00 37.83 35.69 3ie4 s LYS 53 CO 0.48 -0.01 0.91 0.00 -0.76 0.00 0.00 175.35 175.97 3ie4 s ALA 54 N 0.48 3.35 -0.03 5.17 0.00 -1.26 -4.73 121.76 124.73 3ie4 s ALA 54 Ca -0.05 0.55 0.02 0.00 0.00 0.00 0.00 51.96 52.48 3ie4 s ALA 54 Cb -0.09 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.87 3ie4 s ALA 54 CO -0.00 0.19 -0.07 0.15 0.00 0.00 0.00 175.76 176.02 3ie4 s LYS 55 N -0.96 0.84 -1.41 0.00 1.02 0.11 -4.77 119.74 114.57 3ie4 s LYS 55 Ca 0.41 -0.24 -0.09 0.00 0.02 0.00 0.00 55.97 56.07 3ie4 s LYS 55 Cb -0.25 -0.80 0.05 0.00 -0.52 0.00 0.00 37.83 36.32 3ie4 s LYS 55 CO 0.30 0.07 0.62 0.09 -0.92 0.00 0.00 175.35 175.52 3ie4 n ASN 56 N 3.38 -4.69 -0.13 2.83 5.03 -1.26 -1.89 115.26 118.54 3ie4 n ASN 56 Ca -0.19 -0.43 -0.02 0.00 0.87 0.00 0.00 54.58 54.82 3ie4 n ASN 56 Cb 0.54 -3.82 -0.01 0.00 -1.02 0.00 0.00 39.78 35.48 3ie4 n ASN 56 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3ie4 n GLY 57 N -1.38 0.50 3.09 7.41 0.00 -1.26 -5.00 105.19 108.55 3ie4 n GLY 57 Ca -0.03 -0.26 -0.08 0.00 0.00 0.00 0.00 46.02 45.65 3ie4 n GLY 57 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ie4 s ARG 58 N -1.11 0.62 -0.23 1.61 0.52 -0.79 -0.95 118.95 118.62 3ie4 s ARG 58 Ca 0.00 -1.19 -0.06 0.00 -0.52 0.00 0.00 55.73 53.96 3ie4 s ARG 58 Cb 0.00 0.14 -0.03 0.00 0.52 0.00 0.00 34.95 35.58 3ie4 s ARG 58 CO 0.00 -0.09 0.04 -1.58 0.02 0.00 0.00 175.30 173.69 3ie4 s TRP 59 N -3.67 3.07 -0.06 -0.53 0.52 -0.01 -0.71 118.94 117.55 3ie4 s TRP 59 Ca 0.06 -0.44 0.01 0.00 0.02 0.00 0.00 56.10 55.75 3ie4 s TRP 59 Cb 0.06 -2.18 0.02 0.00 -1.15 0.00 0.00 33.47 30.22 3ie4 s TRP 59 CO -0.08 -0.31 -0.05 0.99 0.02 0.00 0.00 176.95 177.51 3ie4 s THR 60 N 1.36 0.69 -0.15 2.01 2.01 -1.26 -1.72 115.64 118.58 3ie4 s THR 60 Ca 0.05 -0.17 -0.12 0.00 0.31 0.00 0.00 61.69 61.76 3ie4 s THR 60 Cb -0.15 -0.72 -0.05 0.00 0.01 0.00 0.00 72.50 71.59 3ie4 s THR 60 CO 0.02 0.28 0.26 0.12 -0.69 0.00 0.00 174.62 174.61 3ie4 s PHE 61 N 1.21 3.49 -0.06 4.92 5.36 0.74 -4.97 117.98 128.67 3ie4 s PHE 61 Ca -0.06 0.58 0.03 0.00 -0.96 0.00 0.00 56.93 56.52 3ie4 s PHE 61 Cb -0.14 -2.26 0.01 0.00 -0.34 0.00 0.00 43.02 40.28 3ie4 s PHE 61 CO -0.02 0.34 -0.15 0.50 -1.46 0.00 0.00 175.22 174.43 3ie4 s ARG 62 N 0.15 1.81 -0.08 10.12 3.52 -1.26 -0.86 118.95 132.36 3ie4 s ARG 62 Ca 0.15 -0.51 0.03 0.00 -0.13 0.00 0.00 55.73 55.27 3ie4 s ARG 62 Cb -0.13 -1.51 -0.02 0.00 -1.56 0.00 0.00 34.95 31.74 3ie4 s ARG 62 CO 0.04 0.11 -0.18 0.34 -0.81 0.00 0.00 175.30 174.80 3ie4 s ASP 63 N 0.41 3.67 -0.01 -2.12 2.15 0.21 -5.00 116.67 115.97 3ie4 s ASP 63 Ca -0.11 -0.36 0.03 0.00 0.43 0.00 0.00 52.55 52.54 3ie4 s ASP 63 Cb -0.14 -1.12 0.08 0.00 -0.30 0.00 0.00 42.92 41.44 3ie4 s ASP 63 CO 0.04 0.25 1.06 0.54 -0.17 0.00 0.00 175.17 176.89 3ie4 n ARG 64 N 2.96 2.89 0.00 4.34 1.74 -1.26 -1.20 116.66 126.13 3ie4 n ARG 64 Ca -0.18 -1.68 0.00 0.00 -0.77 0.00 0.00 57.85 55.23 3ie4 n ARG 64 Cb 0.52 -1.09 0.00 0.00 -1.02 0.00 0.00 32.46 30.88 3ie4 n ARG 64 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 3ie4 n ILE 65 N -0.34 0.00 -3.17 0.55 -5.35 -1.26 -4.49 119.36 105.30 3ie4 n ILE 65 Ca 0.03 -0.04 -0.40 0.00 -0.27 0.00 0.00 62.75 62.07 3ie4 n ILE 65 Cb 0.31 0.44 -0.07 0.00 -1.74 0.00 0.00 39.64 38.58 3ie4 n ILE 65 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 3ie4 s THR 66 N -1.37 5.04 -0.63 7.28 2.01 -1.26 -4.69 115.64 122.02 3ie4 s THR 66 Ca 0.00 1.04 -0.22 0.00 0.31 0.00 0.00 61.69 62.82 3ie4 s THR 66 Cb 0.00 -3.89 0.07 0.00 0.01 0.00 0.00 72.50 68.69 3ie4 s THR 66 CO 0.00 0.09 0.93 0.00 -0.69 0.00 0.00 174.62 174.95 3ie4 s ALA 67 N 2.17 3.15 0.21 7.40 0.00 -1.26 -0.29 121.76 133.13 3ie4 s ALA 67 Ca 0.25 -1.75 -0.12 0.00 0.00 0.00 0.00 51.96 50.34 3ie4 s ALA 67 Cb -0.16 -3.80 -0.07 0.00 0.00 0.00 0.00 23.12 19.10 3ie4 s ALA 67 CO 0.09 -2.65 0.57 -0.51 0.00 0.00 0.00 175.76 173.26 3ie4 s LEU 68 N 3.91 4.22 0.15 0.00 1.43 -1.26 -5.02 118.68 122.10 3ie4 s LEU 68 Ca 0.23 1.01 0.07 0.00 -1.03 0.00 0.00 54.13 54.41 3ie4 s LEU 68 Cb -0.17 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 3ie4 s LEU 68 CO 0.12 -0.03 -0.16 -1.59 0.23 0.00 0.00 176.35 174.92 3ie4 s LYS 69 N -2.54 1.17 0.23 1.70 -2.85 -1.26 -4.96 119.74 111.23 3ie4 s LYS 69 Ca 0.45 -1.34 -0.32 0.00 -1.00 0.00 0.00 55.97 53.76 3ie4 s LYS 69 Cb -0.12 -1.15 -0.14 0.00 -2.06 0.00 0.00 37.83 34.36 3ie4 s LYS 69 CO 0.20 0.23 1.42 -2.30 0.10 0.00 0.00 175.35 175.00 3ie4 n PRO 70 N 0.39 2.02 0.00 1.78 -0.02 -1.26 -1.61 135.00 136.29 3ie4 n PRO 70 Ca -0.14 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 3ie4 n PRO 70 Cb 0.57 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 3ie4 n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ie4 n GLY 71 N 2.30 3.42 3.71 -1.23 0.00 0.45 -4.98 105.19 108.85 3ie4 n GLY 71 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 3ie4 n GLY 71 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ie4 n ASP 72 N 0.01 2.19 -4.10 1.61 8.00 -0.63 -4.73 116.55 118.89 3ie4 n ASP 72 Ca 0.00 0.93 -0.31 0.00 0.71 0.00 0.00 54.79 56.12 3ie4 n ASP 72 Cb 0.00 -1.53 -0.17 0.00 -0.02 0.00 0.00 41.12 39.40 3ie4 n ASP 72 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3ie4 s THR 73 N -1.34 1.77 -0.19 -3.53 2.01 -1.26 -0.32 115.64 112.77 3ie4 s THR 73 Ca 0.74 -0.79 -0.19 0.00 0.31 0.00 0.00 61.69 61.75 3ie4 s THR 73 Cb -0.42 -1.59 -0.03 0.00 0.01 0.00 0.00 72.50 70.47 3ie4 s THR 73 CO 0.48 0.49 0.56 -0.76 -0.69 0.00 0.00 174.62 174.70 3ie4 s LEU 74 N 0.99 4.16 -0.11 4.42 1.43 0.29 0.01 118.68 129.86 3ie4 s LEU 74 Ca -0.05 0.75 -0.04 0.00 -1.03 0.00 0.00 54.13 53.77 3ie4 s LEU 74 Cb -0.15 -2.78 -0.03 0.00 0.03 0.00 0.00 46.19 43.26 3ie4 s LEU 74 CO -0.03 -0.20 0.02 -0.31 0.23 0.00 0.00 176.35 176.06 3ie4 s TYR 75 N 1.65 3.21 0.19 0.29 1.51 0.29 -0.63 117.35 123.85 3ie4 s TYR 75 Ca 0.26 0.15 -0.23 0.00 -1.01 0.00 0.00 57.07 56.25 3ie4 s TYR 75 Cb -0.16 -1.87 0.05 0.00 -0.11 0.00 0.00 41.96 39.87 3ie4 s TYR 75 CO 0.10 0.39 0.67 1.52 -1.11 0.00 0.00 175.55 177.12 3ie4 s TYR 76 N -0.54 -0.39 0.02 2.71 -0.85 -0.51 -0.66 117.35 117.13 3ie4 s TYR 76 Ca 0.10 0.10 0.00 0.00 -0.52 0.00 0.00 57.07 56.74 3ie4 s TYR 76 Cb -0.12 0.61 -0.02 0.00 0.38 0.00 0.00 41.96 42.82 3ie4 s TYR 76 CO 0.02 -0.97 -0.03 1.67 -1.52 0.00 0.00 175.55 174.72 3ie4 s TRP 77 N -3.75 0.27 0.30 -3.49 1.48 -0.33 -0.97 118.94 112.45 3ie4 s TRP 77 Ca 0.05 -0.49 0.10 0.00 -1.06 0.00 0.00 56.10 54.70 3ie4 s TRP 77 Cb -0.03 -0.19 -0.06 0.00 -1.16 0.00 0.00 33.47 32.04 3ie4 s TRP 77 CO -0.05 -0.17 -0.12 0.95 -4.06 0.00 0.00 176.95 173.49 3ie4 s THR 78 N -1.35 2.16 -0.01 0.66 -4.23 -0.31 -1.68 115.64 110.88 3ie4 s THR 78 Ca -0.14 -2.25 0.00 0.00 -1.18 0.00 0.00 61.69 58.11 3ie4 s THR 78 Cb -0.09 -2.46 0.01 0.00 1.34 0.00 0.00 72.50 71.30 3ie4 s THR 78 CO -0.01 -0.31 0.00 -0.47 -0.54 0.00 0.00 174.62 173.29 3ie4 s TYR 79 N -2.68 0.11 -0.05 3.99 5.04 -0.64 -1.28 117.35 121.84 3ie4 s TYR 79 Ca 0.30 0.03 0.02 0.00 -2.44 0.00 0.00 57.07 54.98 3ie4 s TYR 79 Cb 0.00 -0.17 0.01 0.00 0.35 0.00 0.00 41.96 42.15 3ie4 s TYR 79 CO 0.14 -0.05 -0.09 0.08 -1.34 0.00 0.00 175.55 174.30 3ie4 s VAL 80 N 0.49 0.83 -0.39 3.14 1.01 0.36 -0.55 120.40 125.28 3ie4 s VAL 80 Ca -0.04 -0.32 -0.17 0.00 0.00 0.00 0.00 61.98 61.44 3ie4 s VAL 80 Cb -0.07 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.55 3ie4 s VAL 80 CO -0.01 0.28 0.45 -0.63 0.00 0.00 0.00 175.10 175.18 3ie4 s ILE 81 N 0.61 5.08 -0.15 2.22 1.01 -0.79 -0.46 121.20 128.70 3ie4 s ILE 81 Ca -0.10 -0.12 0.01 0.00 0.00 0.00 0.00 60.65 60.43 3ie4 s ILE 81 Cb -0.13 -3.99 0.02 0.00 0.01 0.00 0.00 42.46 38.37 3ie4 s ILE 81 CO 0.02 -0.33 -0.17 -0.47 0.00 0.00 0.00 174.94 173.98 3ie4 s TYR 82 N 2.20 2.41 -1.64 3.97 5.04 -0.01 -0.82 117.35 128.49 3ie4 s TYR 82 Ca 0.14 -1.34 -0.13 0.00 -2.44 0.00 0.00 57.07 53.29 3ie4 s TYR 82 Cb -0.16 -1.71 0.12 0.00 0.35 0.00 0.00 41.96 40.55 3ie4 s TYR 82 CO 0.14 -0.69 0.62 0.09 -1.34 0.00 0.00 175.55 174.37 3ie4 n ASN 83 N 4.56 -2.12 0.00 4.32 3.02 0.16 -2.07 115.26 123.13 3ie4 n ASN 83 Ca -0.19 -1.06 0.00 0.00 -0.03 0.00 0.00 54.58 53.30 3ie4 n ASN 83 Cb 0.50 -2.60 0.00 0.00 -0.61 0.00 0.00 39.78 37.07 3ie4 n ASN 83 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ie4 n GLY 84 N -1.60 1.02 3.32 7.41 0.00 -1.26 -5.04 105.19 109.03 3ie4 n GLY 84 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 3ie4 n GLY 84 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ie4 s LEU 85 N 0.00 2.18 0.18 0.99 2.96 -0.88 -5.11 118.68 118.99 3ie4 s LEU 85 Ca 0.00 -0.58 -0.20 0.00 -0.22 0.00 0.00 54.13 53.13 3ie4 s LEU 85 Cb 0.00 -1.19 -0.08 0.00 0.50 0.00 0.00 46.19 45.42 3ie4 s LEU 85 CO 0.00 0.23 0.68 -0.83 -1.32 0.00 0.00 176.35 175.11 3ie4 s GLY 86 N -1.28 2.65 0.03 7.98 0.00 -1.26 -0.83 107.32 114.60 3ie4 s GLY 86 Ca 0.11 0.13 0.01 0.00 0.00 0.00 0.00 44.72 44.97 3ie4 s GLY 86 CO 0.02 0.51 -0.05 -0.19 0.00 0.00 0.00 173.10 173.39 3ie4 s TYR 87 N -1.39 0.46 0.11 1.90 1.51 0.39 -4.98 117.35 115.36 3ie4 s TYR 87 Ca 0.39 -0.47 0.06 0.00 -1.01 0.00 0.00 57.07 56.04 3ie4 s TYR 87 Cb -0.18 -0.29 -0.04 0.00 -0.11 0.00 0.00 41.96 41.34 3ie4 s TYR 87 CO 0.21 -0.12 -0.15 -0.98 -1.11 0.00 0.00 175.55 173.40 3ie4 s ARG 88 N -1.39 1.00 -0.27 -0.62 1.70 -1.26 -0.49 118.95 117.63 3ie4 s ARG 88 Ca -0.11 -1.16 -0.01 0.00 -0.47 0.00 0.00 55.73 53.97 3ie4 s ARG 88 Cb -0.09 -0.97 0.04 0.00 -0.57 0.00 0.00 34.95 33.35 3ie4 s ARG 88 CO -0.00 0.20 -0.05 -2.00 -1.08 0.00 0.00 175.30 172.37 3ie4 s GLU 89 N -2.33 2.62 0.34 3.89 2.56 -0.40 -4.89 118.70 120.49 3ie4 s GLU 89 Ca 0.06 -1.12 0.03 0.00 0.00 0.00 0.00 54.97 53.94 3ie4 s GLU 89 Cb -0.07 -3.04 0.03 0.00 2.00 0.00 0.00 34.13 33.05 3ie4 s GLU 89 CO 0.03 -0.50 0.24 -0.40 -0.56 0.00 0.00 175.26 174.07 3ie4 n ASP 90 N 4.63 2.12 -2.22 -1.70 3.85 -1.26 -1.17 116.55 120.79 3ie4 n ASP 90 Ca -0.15 -2.18 -0.17 0.00 -0.71 0.00 0.00 54.79 51.59 3ie4 n ASP 90 Cb 0.45 -0.01 -0.02 0.00 -1.35 0.00 0.00 41.12 40.19 3ie4 n ASP 90 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 3ie4 n ASP 91 N -1.86 -4.83 -4.77 -1.12 8.00 -1.24 -4.95 116.55 105.78 3ie4 n ASP 91 Ca -0.02 0.16 -0.41 0.00 0.71 0.00 0.00 54.79 55.23 3ie4 n ASP 91 Cb 0.39 -4.11 -0.02 0.00 -0.02 0.00 0.00 41.12 37.35 3ie4 n ASP 91 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3ie4 s GLY 92 N -2.12 2.92 -0.14 0.44 0.00 -0.14 -4.93 107.32 103.35 3ie4 s GLY 92 Ca 0.00 1.25 -0.10 0.00 0.00 0.00 0.00 44.72 45.88 3ie4 s GLY 92 CO 0.00 1.94 0.34 -1.35 0.00 0.00 0.00 173.10 174.03 3ie4 s SER 93 N -0.38 -0.38 -0.06 1.64 1.04 -1.26 -1.43 113.70 112.87 3ie4 s SER 93 Ca 0.50 0.71 -0.01 0.00 0.48 0.00 0.00 55.95 57.63 3ie4 s SER 93 Cb -0.40 0.66 0.03 0.00 0.10 0.00 0.00 66.02 66.41 3ie4 s SER 93 CO 0.51 -0.15 0.01 0.12 0.98 0.00 0.00 173.24 174.71 3ie4 s PHE 94 N 0.77 0.55 -0.24 5.02 5.36 0.20 -4.98 117.98 124.65 3ie4 s PHE 94 Ca -0.05 -0.09 -0.18 0.00 -0.96 0.00 0.00 56.93 55.65 3ie4 s PHE 94 Cb -0.06 -0.70 -0.03 0.00 -0.34 0.00 0.00 43.02 41.89 3ie4 s PHE 94 CO -0.05 -0.28 0.54 0.08 -1.46 0.00 0.00 175.22 174.05 3ie4 s VAL 95 N 1.83 5.06 0.17 3.12 1.01 -1.26 -0.54 120.40 129.78 3ie4 s VAL 95 Ca 0.02 0.95 -0.31 0.00 0.00 0.00 0.00 61.98 62.64 3ie4 s VAL 95 Cb -0.12 -3.85 -0.09 0.00 0.00 0.00 0.00 36.38 32.31 3ie4 s VAL 95 CO -0.04 0.10 1.50 -0.69 0.00 0.00 0.00 175.10 175.96 3ie4 s VAL 96 N 2.18 2.82 0.00 2.92 1.01 0.56 -4.88 120.40 125.01 3ie4 s VAL 96 Ca 0.23 0.60 0.02 0.00 0.00 0.00 0.00 61.98 62.83 3ie4 s VAL 96 Cb -0.16 -3.39 0.03 0.00 0.00 0.00 0.00 36.38 32.87 3ie4 s VAL 96 CO 0.09 0.06 0.99 0.59 0.00 0.00 0.00 175.10 176.83 3ie4 n ASN 97 N 3.68 0.07 0.00 3.32 3.02 -1.26 -0.41 115.26 123.68 3ie4 n ASN 97 Ca 0.12 -1.95 0.00 0.00 -0.03 0.00 0.00 54.58 52.71 3ie4 n ASN 97 Cb 0.40 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 3ie4 n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ie4 n GLY 98 N 0.04 4.57 3.80 7.41 0.00 -1.26 -5.04 105.19 114.71 3ie4 n GLY 98 Ca 0.00 -1.21 -0.27 0.00 0.00 0.00 0.00 46.02 44.55 3ie4 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ie4 s TYR 99 N -2.00 3.16 -0.18 1.61 2.02 -1.26 -4.59 117.35 116.11 3ie4 s TYR 99 Ca 0.00 -0.01 0.18 0.00 -0.37 0.00 0.00 57.07 56.88 3ie4 s TYR 99 Cb 0.00 -1.52 -0.25 0.00 -0.40 0.00 0.00 41.96 39.78 3ie4 s TYR 99 CO 0.00 0.52 0.12 0.43 -1.57 0.00 0.00 175.55 175.05 3ie4 n SER 100 N -0.29 0.03 0.00 2.29 7.64 0.76 -4.95 113.62 119.09 3ie4 n SER 100 Ca -0.08 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.81 3ie4 n SER 100 Cb 0.54 1.03 0.00 0.00 -1.01 0.00 0.00 64.21 64.78 3ie4 n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64