#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cxc s HIS 2 N 0.00 3.06 -0.20 1.12 3.76 -0.22 -4.33 115.29 118.49 3cxc s HIS 2 Ca 0.00 -0.03 -0.07 0.00 -0.15 0.00 0.00 55.06 54.81 3cxc s HIS 2 Cb 0.00 -1.50 -0.04 0.00 1.11 0.00 0.00 32.58 32.15 3cxc s HIS 2 CO 0.00 0.51 0.06 0.00 -0.85 0.00 0.00 174.74 174.47 3cxc s ALA 3 N -1.63 3.33 -0.10 -1.40 0.00 0.02 -0.64 121.76 121.34 3cxc s ALA 3 Ca 0.29 -0.84 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 3cxc s ALA 3 Cb -0.10 -1.94 -0.03 0.00 0.00 0.00 0.00 23.12 21.04 3cxc s ALA 3 CO 0.21 0.03 0.01 -0.51 0.00 0.00 0.00 175.76 175.50 3cxc s LEU 4 N 0.66 3.64 -0.16 0.00 1.43 0.23 -3.04 118.68 121.44 3cxc s LEU 4 Ca 0.03 0.15 -0.03 0.00 -1.03 0.00 0.00 54.13 53.25 3cxc s LEU 4 Cb -0.13 -1.85 0.05 0.00 0.03 0.00 0.00 46.19 44.29 3cxc s LEU 4 CO 0.02 0.35 0.04 -0.69 0.23 0.00 0.00 176.35 176.29 3cxc s VAL 5 N -0.71 0.39 0.16 -1.59 1.01 0.01 -0.84 120.40 118.83 3cxc s VAL 5 Ca 0.11 -0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 3cxc s VAL 5 Cb -0.12 -0.83 -0.08 0.00 0.00 0.00 0.00 36.38 35.36 3cxc s VAL 5 CO 0.02 -0.10 1.31 -1.58 0.00 0.00 0.00 175.10 174.76 3cxc s GLN 6 N 1.93 4.38 0.00 2.72 0.74 -1.02 -1.22 119.66 127.20 3cxc s GLN 6 Ca 0.01 2.01 0.00 0.00 0.05 0.00 0.00 55.36 57.43 3cxc s GLN 6 Cb -0.16 -3.23 0.00 0.00 1.10 0.00 0.00 33.01 30.72 3cxc s GLN 6 CO -0.07 -0.29 0.00 1.28 -0.55 0.00 0.00 175.29 175.66 3cxc n LEU 7 N 3.16 0.00 -4.24 3.68 4.77 -0.43 -1.09 117.00 122.86 3cxc n LEU 7 Ca 0.08 -0.47 -0.28 0.00 -0.03 0.00 0.00 56.01 55.31 3cxc n LEU 7 Cb 0.43 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.37 3cxc n LEU 7 CO 0.58 0.00 -0.54 -0.13 -1.33 0.00 0.00 177.39 175.97 3cxc s ARG 8 N -0.95 1.77 1.48 3.23 0.52 -1.10 -4.93 118.95 118.97 3cxc s ARG 8 Ca 0.00 -0.79 -0.24 0.00 -0.52 0.00 0.00 55.73 54.18 3cxc s ARG 8 Cb 0.00 -1.72 0.39 0.00 0.52 0.00 0.00 34.95 34.14 3cxc s ARG 8 CO 0.00 0.47 0.89 0.20 0.02 0.00 0.00 175.30 176.88 3cxc s GLY 9 N -0.52 1.37 -0.05 -3.53 0.00 -1.26 -4.86 107.32 98.47 3cxc s GLY 9 Ca 0.08 -0.86 0.01 0.00 0.00 0.00 0.00 44.72 43.96 3cxc s GLY 9 CO -0.01 0.20 0.66 1.05 0.00 0.00 0.00 173.10 175.00 3cxc h GLU 10 N -3.64 0.17 -6.17 2.90 4.11 -1.98 -3.44 114.58 106.52 3cxc h GLU 10 Ca -0.41 -0.29 -0.72 0.00 0.07 0.00 0.00 59.36 58.01 3cxc h GLU 10 Cb 1.35 0.11 0.02 0.00 0.50 0.00 0.00 28.75 30.73 3cxc h GLU 10 CO 0.25 0.94 0.82 0.28 0.07 0.00 0.00 179.01 181.38 3cxc n VAL 11 N -3.33 0.26 0.00 -1.06 0.31 -1.26 -1.35 118.33 111.90 3cxc n VAL 11 Ca -0.21 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 3cxc n VAL 11 Cb 1.04 -1.17 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 3cxc n VAL 11 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3cxc n ASN 12 N 4.88 0.00 -4.74 4.52 3.02 -1.26 -5.02 115.26 116.65 3cxc n ASN 12 Ca 0.25 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.39 3cxc n ASN 12 Cb 0.15 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.27 3cxc n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cxc s MET 13 N -0.07 4.71 0.29 3.52 0.23 -0.45 -4.96 119.30 122.56 3cxc s MET 13 Ca 0.00 1.38 -0.23 0.00 -1.03 0.00 0.00 55.69 55.81 3cxc s MET 13 Cb 0.00 -3.34 -0.15 0.00 -1.53 0.00 0.00 34.83 29.81 3cxc s MET 13 CO 0.00 0.34 0.28 0.72 -2.03 0.00 0.00 175.02 174.33 3cxc n HIS 14 N 2.30 -1.26 -0.12 3.16 8.25 -1.26 -4.70 115.22 121.60 3cxc n HIS 14 Ca -0.00 0.75 -0.10 0.00 -0.26 0.00 0.00 57.72 58.11 3cxc n HIS 14 Cb 0.49 -1.76 -0.02 0.00 1.12 0.00 0.00 29.99 29.82 3cxc n HIS 14 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3cxc h THR 15 N 0.61 1.20 0.00 1.59 2.02 -1.97 -1.97 112.91 114.40 3cxc h THR 15 Ca -0.31 -0.65 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 3cxc h THR 15 Cb 1.36 0.97 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 3cxc h THR 15 CO 0.49 0.23 -0.01 -2.24 0.37 0.00 0.00 175.52 174.36 3cxc h ASP 16 N 0.42 0.00 0.03 4.18 2.03 -1.99 0.15 116.42 121.25 3cxc h ASP 16 Ca 0.12 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.36 3cxc h ASP 16 Cb 0.24 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.74 3cxc h ASP 16 CO -0.01 0.01 -0.28 0.40 -1.03 0.00 0.00 179.24 178.33 3cxc h ILE 17 N 0.00 1.67 -0.55 4.15 2.04 -1.82 -2.91 117.51 120.10 3cxc h ILE 17 Ca -0.00 -2.38 0.06 0.00 1.00 0.00 0.00 64.86 63.54 3cxc h ILE 17 Cb 0.22 3.28 -0.05 0.00 -0.74 0.00 0.00 36.82 39.53 3cxc h ILE 17 CO 0.00 0.62 0.26 -0.61 0.00 0.00 0.00 178.15 178.42 3cxc h GLN 18 N -0.85 0.47 -0.41 2.37 4.15 -0.80 -1.63 115.11 118.42 3cxc h GLN 18 Ca -0.06 -0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.37 3cxc h GLN 18 Cb 1.18 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.72 3cxc h GLN 18 CO 0.02 0.31 0.18 -0.44 -1.93 0.00 0.00 178.83 176.98 3cxc h ASP 19 N 0.49 0.24 -0.44 -0.69 3.32 -0.82 -1.39 116.42 117.13 3cxc h ASP 19 Ca 0.26 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.38 3cxc h ASP 19 Cb 0.21 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 3cxc h ASP 19 CO -0.20 0.18 0.19 0.74 -1.72 0.00 0.00 179.24 178.42 3cxc h THR 20 N 0.37 0.91 -0.43 0.35 2.02 -1.15 0.19 112.91 115.18 3cxc h THR 20 Ca 0.18 -0.13 0.03 0.00 0.77 0.00 0.00 66.41 67.26 3cxc h THR 20 Cb 0.12 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 3cxc h THR 20 CO -0.15 0.07 0.29 -0.07 0.37 0.00 0.00 175.52 176.03 3cxc h LEU 21 N 0.38 0.40 -0.60 2.58 3.38 -0.83 0.09 115.31 120.72 3cxc h LEU 21 Ca 0.20 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 3cxc h LEU 21 Cb 0.15 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3cxc h LEU 21 CO -0.17 0.28 -0.63 -0.33 0.09 0.00 0.00 178.44 177.67 3cxc h GLU 22 N 0.47 0.00 0.00 1.13 5.08 0.22 -0.20 114.58 121.28 3cxc h GLU 22 Ca 0.17 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 3cxc h GLU 22 Cb 0.12 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 3cxc h GLU 22 CO -0.04 0.63 -0.14 0.52 -1.00 0.00 0.00 179.01 178.98 3cxc h MET 23 N 0.00 0.00 -0.86 2.33 2.86 0.11 -2.50 114.93 116.88 3cxc h MET 23 Ca -0.01 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.39 3cxc h MET 23 Cb 1.20 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.72 3cxc h MET 23 CO 0.08 0.14 0.30 1.28 1.06 0.00 0.00 176.91 179.77 3cxc n LEU 24 N -3.20 5.52 -1.98 1.22 4.77 -0.43 -4.90 117.00 118.00 3cxc n LEU 24 Ca 0.02 -2.88 -0.18 0.00 -0.03 0.00 0.00 56.01 52.93 3cxc n LEU 24 Cb 0.48 -0.72 -0.04 0.00 -2.33 0.00 0.00 43.42 40.80 3cxc n LEU 24 CO 0.33 0.78 -0.21 0.59 -1.33 0.00 0.00 177.39 177.55 3cxc n ASN 25 N -0.26 -5.08 -4.29 -1.43 3.02 -0.94 -4.81 115.26 101.47 3cxc n ASN 25 Ca 0.37 0.25 -0.34 0.00 -0.03 0.00 0.00 54.58 54.83 3cxc n ASN 25 Cb 1.27 -4.39 -0.14 0.00 -0.61 0.00 0.00 39.78 35.90 3cxc n ASN 25 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3cxc s ILE 26 N -2.74 3.07 0.00 2.41 -4.36 -0.12 -4.66 121.20 114.79 3cxc s ILE 26 Ca 0.00 -0.61 0.00 0.00 -0.26 0.00 0.00 60.65 59.78 3cxc s ILE 26 Cb 0.00 -2.36 0.00 0.00 1.25 0.00 0.00 42.46 41.35 3cxc s ILE 26 CO 0.00 0.47 0.66 1.41 0.24 0.00 0.00 174.94 177.71 3cxc n HIS 27 N 4.46 0.00 -3.94 1.37 8.25 -1.26 -3.44 115.22 120.66 3cxc n HIS 27 Ca -0.19 -0.19 -0.08 0.00 -0.26 0.00 0.00 57.72 57.00 3cxc n HIS 27 Cb 0.51 -0.02 -0.08 0.00 1.12 0.00 0.00 29.99 31.52 3cxc n HIS 27 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3cxc s HIS 28 N -0.38 0.29 0.40 4.41 3.76 -1.26 -5.09 115.29 117.43 3cxc s HIS 28 Ca 0.00 -0.75 -0.25 0.00 -0.15 0.00 0.00 55.06 53.91 3cxc s HIS 28 Cb 0.00 -0.16 -0.08 0.00 1.11 0.00 0.00 32.58 33.45 3cxc s HIS 28 CO 0.00 -0.52 1.19 0.08 -0.85 0.00 0.00 174.74 174.65 3cxc s VAL 29 N -3.89 3.05 0.00 -0.90 1.01 -1.26 -2.84 120.40 115.57 3cxc s VAL 29 Ca 0.07 0.89 0.00 0.00 0.00 0.00 0.00 61.98 62.94 3cxc s VAL 29 Cb 0.06 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.93 3cxc s VAL 29 CO -0.09 0.09 0.00 0.59 0.00 0.00 0.00 175.10 175.68 3cxc n ASN 30 N 0.07 0.00 -4.79 3.32 3.02 -0.25 -4.97 115.26 111.66 3cxc n ASN 30 Ca 0.04 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.23 3cxc n ASN 30 Cb 0.46 -0.37 -0.07 0.00 -0.61 0.00 0.00 39.78 39.20 3cxc n ASN 30 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3cxc s HIS 31 N -3.49 3.60 0.04 3.10 3.76 -1.13 -2.40 115.29 118.77 3cxc s HIS 31 Ca 0.00 1.70 0.07 0.00 -0.15 0.00 0.00 55.06 56.67 3cxc s HIS 31 Cb 0.00 -2.87 -0.02 0.00 1.11 0.00 0.00 32.58 30.80 3cxc s HIS 31 CO 0.00 0.15 -0.19 0.00 -0.85 0.00 0.00 174.74 173.85 3cxc s THR 33 N -0.80 0.84 -0.39 0.00 -1.32 -0.02 0.51 115.64 114.46 3cxc s THR 33 Ca 0.06 -1.90 -0.05 0.00 -1.21 0.00 0.00 61.69 58.59 3cxc s THR 33 Cb -0.08 -1.65 0.09 0.00 -1.51 0.00 0.00 72.50 69.34 3cxc s THR 33 CO 0.02 -0.79 0.19 -0.76 -2.21 0.00 0.00 174.62 171.06 3cxc s LEU 34 N -2.95 4.96 -0.10 9.08 1.43 -1.26 0.76 118.68 130.59 3cxc s LEU 34 Ca 0.12 -1.69 -0.04 0.00 -1.03 0.00 0.00 54.13 51.48 3cxc s LEU 34 Cb 0.03 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 3cxc s LEU 34 CO -0.03 -0.49 0.05 0.54 0.23 0.00 0.00 176.35 176.65 3cxc s VAL 35 N 1.27 4.71 0.89 -1.59 0.11 0.19 -4.93 120.40 121.04 3cxc s VAL 35 Ca 0.04 -0.09 -0.11 0.00 -2.93 0.00 0.00 61.98 58.89 3cxc s VAL 35 Cb -0.22 -3.02 0.13 0.00 -1.53 0.00 0.00 36.38 31.74 3cxc s VAL 35 CO -0.01 0.60 1.10 -2.84 -3.33 0.00 0.00 175.10 170.62 3cxc s PRO 36 N -0.80 1.29 -1.03 1.54 0.02 -1.26 -1.06 135.00 133.70 3cxc s PRO 36 Ca 0.13 1.17 -0.08 0.00 0.02 0.00 0.00 61.00 62.24 3cxc s PRO 36 Cb -0.12 -1.79 0.26 0.00 0.02 0.00 0.00 34.50 32.88 3cxc s PRO 36 CO 0.03 -2.32 0.99 -1.21 -0.33 0.00 0.00 177.00 174.16 3cxc s GLU 37 N -4.78 3.93 0.37 5.54 2.02 -1.26 -4.73 118.70 119.79 3cxc s GLU 37 Ca 0.64 -3.12 0.08 0.00 0.02 0.00 0.00 54.97 52.60 3cxc s GLU 37 Cb -0.20 -4.42 -0.05 0.00 0.10 0.00 0.00 34.13 29.56 3cxc s GLU 37 CO 0.58 -1.25 0.10 0.99 0.02 0.00 0.00 175.26 175.70 3cxc s THR 38 N -1.06 2.56 0.11 3.63 2.01 -1.26 -4.94 115.64 116.68 3cxc s THR 38 Ca 0.28 -1.82 -0.20 0.00 0.31 0.00 0.00 61.69 60.27 3cxc s THR 38 Cb -0.10 -2.92 -0.08 0.00 0.01 0.00 0.00 72.50 69.42 3cxc s THR 38 CO -0.09 -0.11 1.71 0.44 -0.69 0.00 0.00 174.62 175.88 3cxc h ASP 39 N 1.61 0.25 -0.35 3.53 3.32 -1.98 0.27 116.42 123.07 3cxc h ASP 39 Ca -0.43 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.55 3cxc h ASP 39 Cb 1.25 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.72 3cxc h ASP 39 CO 0.68 0.25 0.23 0.00 -1.72 0.00 0.00 179.24 178.68 3cxc h ALA 40 N 1.01 0.45 -0.50 3.45 0.00 -1.98 -0.72 119.26 120.96 3cxc h ALA 40 Ca 0.07 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 3cxc h ALA 40 Cb 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3cxc h ALA 40 CO -0.01 -0.10 -0.16 1.88 0.00 0.00 0.00 179.25 180.87 3cxc h TYR 41 N 0.47 1.10 0.03 0.00 -1.99 -1.83 -2.92 116.97 111.83 3cxc h TYR 41 Ca 0.13 -0.24 0.02 0.00 2.00 0.00 0.00 58.73 60.64 3cxc h TYR 41 Cb -0.05 -0.27 -0.03 0.00 2.00 0.00 0.00 36.73 38.39 3cxc h TYR 41 CO -0.05 1.05 -0.17 -0.09 -0.00 0.00 0.00 178.16 178.89 3cxc h ARG 42 N 0.86 -0.28 -0.69 4.88 2.43 -0.02 -0.76 114.38 120.79 3cxc h ARG 42 Ca 0.12 0.02 0.16 0.00 -0.81 0.00 0.00 59.98 59.47 3cxc h ARG 42 Cb 0.72 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.29 3cxc h ARG 42 CO 0.05 -0.19 0.48 0.78 -1.51 0.00 0.00 179.97 179.58 3cxc h GLY 43 N -0.29 0.42 0.47 2.80 0.00 -1.07 -1.50 103.07 103.90 3cxc h GLY 43 Ca 0.04 -0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 3cxc h GLY 43 CO -0.14 0.03 -0.04 -0.33 0.00 0.00 0.00 176.54 176.06 3cxc h MET 44 N 0.24 -0.12 0.00 4.80 2.86 -0.99 -2.97 114.93 118.75 3cxc h MET 44 Ca 0.34 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.99 3cxc h MET 44 Cb 0.98 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.67 3cxc h MET 44 CO -0.07 0.35 0.00 -0.39 1.06 0.00 0.00 176.91 177.86 3cxc h VAL 45 N -0.66 0.00 -0.23 -2.22 -1.51 -0.79 -1.91 116.25 108.93 3cxc h VAL 45 Ca -0.01 -0.41 -0.08 0.00 -1.23 0.00 0.00 66.70 64.97 3cxc h VAL 45 Cb 0.52 1.38 -0.00 0.00 -2.13 0.00 0.00 31.29 31.06 3cxc h VAL 45 CO 0.02 0.00 -0.18 0.00 -1.23 0.00 0.00 177.57 176.18 3cxc h ALA 46 N 2.02 0.33 -0.39 5.19 0.00 -1.29 0.12 119.26 125.23 3cxc h ALA 46 Ca 0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 3cxc h ALA 46 Cb 0.42 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3cxc h ALA 46 CO 0.00 0.25 0.05 -0.22 0.00 0.00 0.00 179.25 179.32 3cxc h LYS 47 N 0.23 0.60 0.00 0.00 3.64 -1.21 -2.37 116.57 117.47 3cxc h LYS 47 Ca 0.04 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3cxc h LYS 47 Cb 0.71 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 3cxc h LYS 47 CO 0.05 0.59 -0.39 0.28 -2.27 0.00 0.00 179.45 177.70 3cxc n VAL 48 N -4.29 0.08 -0.16 2.00 0.31 -0.79 -4.58 118.33 110.90 3cxc n VAL 48 Ca 0.02 -0.06 0.05 0.00 -0.01 0.00 0.00 64.34 64.34 3cxc n VAL 48 Cb 0.23 -0.01 0.10 0.00 -0.91 0.00 0.00 33.84 33.25 3cxc n VAL 48 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3cxc n ASN 49 N -1.63 -0.11 -0.01 4.52 2.85 0.40 -1.41 115.26 119.87 3cxc n ASN 49 Ca 0.05 0.78 0.16 0.00 -0.11 0.00 0.00 54.58 55.46 3cxc n ASN 49 Cb 0.36 -0.26 0.90 0.00 1.24 0.00 0.00 39.78 42.02 3cxc n ASN 49 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3cxc n ASP 50 N -4.63 0.02 -0.04 1.20 8.00 -1.26 -3.19 116.55 116.65 3cxc n ASP 50 Ca 0.09 -0.79 0.02 0.00 0.71 0.00 0.00 54.79 54.81 3cxc n ASP 50 Cb 0.28 -0.07 0.02 0.00 -0.02 0.00 0.00 41.12 41.34 3cxc n ASP 50 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3cxc n PHE 51 N -1.06 0.00 -4.37 1.24 3.01 -0.50 -4.90 117.46 110.87 3cxc n PHE 51 Ca 0.22 -0.45 -0.21 0.00 1.01 0.00 0.00 57.45 58.01 3cxc n PHE 51 Cb 0.15 -0.06 -0.08 0.00 -0.01 0.00 0.00 39.48 39.48 3cxc n PHE 51 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3cxc s VAL 52 N -1.04 0.26 -0.03 -4.37 0.11 -1.22 -1.31 120.40 112.80 3cxc s VAL 52 Ca 0.05 -2.00 0.01 0.00 -2.93 0.00 0.00 61.98 57.11 3cxc s VAL 52 Cb 0.04 -2.44 0.02 0.00 -1.53 0.00 0.00 36.38 32.48 3cxc s VAL 52 CO 0.00 0.00 -0.02 0.00 -3.33 0.00 0.00 175.10 171.75 3cxc s ALA 53 N -3.41 0.48 0.16 1.54 0.00 -0.36 -1.07 121.76 119.11 3cxc s ALA 53 Ca 0.33 0.05 -0.11 0.00 0.00 0.00 0.00 51.96 52.24 3cxc s ALA 53 Cb 0.03 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.80 3cxc s ALA 53 CO 0.21 -0.03 0.33 -0.59 0.00 0.00 0.00 175.76 175.68 3cxc s PHE 54 N 0.90 0.25 0.00 0.00 -0.12 -0.93 -0.81 117.98 117.28 3cxc s PHE 54 Ca -0.11 -0.62 0.00 0.00 -0.05 0.00 0.00 56.93 56.16 3cxc s PHE 54 Cb -0.14 0.05 0.00 0.00 -0.63 0.00 0.00 43.02 42.30 3cxc s PHE 54 CO -0.01 -0.75 0.00 0.41 -0.05 0.00 0.00 175.22 174.83 3cxc n GLY 55 N -0.23 1.91 3.67 1.99 0.00 -1.17 0.17 105.19 111.54 3cxc n GLY 55 Ca -0.09 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 3cxc n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cxc s GLU 56 N -2.00 4.33 0.43 1.61 2.12 -1.26 -0.80 118.70 123.13 3cxc s GLU 56 Ca 0.00 1.14 -0.06 0.00 0.36 0.00 0.00 54.97 56.41 3cxc s GLU 56 Cb 0.00 -3.57 -0.05 0.00 0.26 0.00 0.00 34.13 30.78 3cxc s GLU 56 CO 0.00 -0.34 0.74 -1.25 -0.54 0.00 0.00 175.26 173.86 3cxc s PRO 57 N 2.18 3.61 0.51 4.30 0.04 -1.26 -4.24 135.00 140.14 3cxc s PRO 57 Ca 0.41 0.21 -0.17 0.00 0.04 0.00 0.00 61.00 61.49 3cxc s PRO 57 Cb -0.17 -2.43 -0.08 0.00 0.04 0.00 0.00 34.50 31.86 3cxc s PRO 57 CO 0.13 -0.09 1.00 -1.54 0.04 0.00 0.00 177.00 176.55 3cxc s SER 58 N -3.73 6.49 0.10 6.66 1.04 -1.26 -4.86 113.70 118.13 3cxc s SER 58 Ca 0.47 1.67 -0.25 0.00 0.48 0.00 0.00 55.95 58.32 3cxc s SER 58 Cb -0.10 -2.52 -0.08 0.00 0.10 0.00 0.00 66.02 63.41 3cxc s SER 58 CO 0.39 -0.68 1.42 -0.61 0.98 0.00 0.00 173.24 174.74 3cxc h GLN 59 N 1.03 -0.27 -0.61 4.02 5.75 -1.98 -1.49 115.11 121.56 3cxc h GLN 59 Ca -0.47 0.02 0.06 0.00 -0.15 0.00 0.00 58.65 58.10 3cxc h GLN 59 Cb 1.19 0.06 -0.09 0.00 1.07 0.00 0.00 27.48 29.72 3cxc h GLN 59 CO 0.60 -0.18 -0.50 0.93 -2.65 0.00 0.00 178.83 177.03 3cxc h GLU 60 N -0.28 -0.17 -0.53 1.69 5.08 -1.98 0.33 114.58 118.72 3cxc h GLU 60 Ca 0.06 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.54 3cxc h GLU 60 Cb 0.45 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.63 3cxc h GLU 60 CO -0.49 -0.12 -0.26 1.15 -1.00 0.00 0.00 179.01 178.29 3cxc h THR 61 N -0.18 0.27 -0.56 1.13 2.02 -1.84 0.41 112.91 114.16 3cxc h THR 61 Ca 0.10 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.36 3cxc h THR 61 Cb 0.44 0.27 -0.06 0.00 -1.74 0.00 0.00 68.15 67.06 3cxc h THR 61 CO -0.67 0.00 0.21 0.25 0.37 0.00 0.00 175.52 175.69 3cxc h LEU 62 N -0.14 0.23 -0.44 2.58 5.85 -0.22 -0.65 115.31 122.51 3cxc h LEU 62 Ca 0.23 0.07 0.04 0.00 0.84 0.00 0.00 57.88 59.07 3cxc h LEU 62 Cb 0.51 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 3cxc h LEU 62 CO -0.61 0.15 0.20 -0.33 -0.34 0.00 0.00 178.44 177.50 3cxc h GLU 63 N 0.40 0.38 -0.05 1.25 5.08 0.15 0.22 114.58 122.02 3cxc h GLU 63 Ca 0.28 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3cxc h GLU 63 Cb 0.31 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 3cxc h GLU 63 CO -0.27 0.25 0.02 1.15 -1.00 0.00 0.00 179.01 179.17 3cxc h THR 64 N 0.40 1.00 -0.00 1.13 2.02 0.79 -0.88 112.91 117.38 3cxc h THR 64 Ca 0.20 -0.02 0.01 0.00 0.77 0.00 0.00 66.41 67.37 3cxc h THR 64 Cb 0.14 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 3cxc h THR 64 CO -0.17 0.01 -0.06 0.58 0.37 0.00 0.00 175.52 176.25 3cxc h VAL 65 N 0.05 0.83 -0.56 3.16 2.07 -0.83 0.05 116.25 121.02 3cxc h VAL 65 Ca 0.02 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.63 3cxc h VAL 65 Cb -0.00 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 30.53 3cxc h VAL 65 CO -0.01 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.68 3cxc h LEU 66 N -0.11 0.13 -0.71 2.57 3.38 -0.40 1.25 115.31 121.41 3cxc h LEU 66 Ca 0.03 0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 3cxc h LEU 66 Cb 0.15 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3cxc h LEU 66 CO -0.07 0.09 -0.00 0.00 0.09 0.00 0.00 178.44 178.55 3cxc h ALA 67 N 1.41 0.91 0.08 1.53 0.00 -0.87 -2.04 119.26 120.28 3cxc h ALA 67 Ca 0.28 -0.30 -0.32 0.00 0.00 0.00 0.00 54.91 54.58 3cxc h ALA 67 Cb 0.36 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3cxc h ALA 67 CO -0.32 0.65 -1.70 0.00 0.00 0.00 0.00 179.25 177.88 3cxc h THR 68 N 0.91 0.93 0.00 0.00 1.03 -0.08 -3.43 112.91 112.27 3cxc h THR 68 Ca 0.17 -2.66 0.00 0.00 -0.01 0.00 0.00 66.41 63.91 3cxc h THR 68 Cb 0.53 2.59 0.00 0.00 -1.07 0.00 0.00 68.15 70.20 3cxc h THR 68 CO 0.03 0.75 -0.15 0.54 -0.01 0.00 0.00 175.52 176.67 3cxc n ARG 69 N -3.33 0.97 -3.49 0.00 5.12 0.42 -5.05 116.66 111.29 3cxc n ARG 69 Ca -0.20 -1.97 -0.31 0.00 -1.93 0.00 0.00 57.85 53.43 3cxc n ARG 69 Cb 1.04 -1.14 -0.05 0.00 -1.16 0.00 0.00 32.46 31.16 3cxc n ARG 69 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3cxc s ALA 70 N -1.81 3.65 0.06 7.54 0.00 -0.77 -3.97 121.76 126.47 3cxc s ALA 70 Ca 0.19 -0.39 0.01 0.00 0.00 0.00 0.00 51.96 51.77 3cxc s ALA 70 Cb 0.17 -2.32 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 3cxc s ALA 70 CO 0.02 0.54 -0.05 -1.21 0.00 0.00 0.00 175.76 175.05 3cxc s GLU 71 N -2.83 0.63 0.75 0.00 2.02 -1.26 -4.19 118.70 113.82 3cxc s GLU 71 Ca 0.45 -1.09 -0.11 0.00 0.02 0.00 0.00 54.97 54.24 3cxc s GLU 71 Cb -0.11 -0.05 0.04 0.00 0.10 0.00 0.00 34.13 34.11 3cxc s GLU 71 CO 0.23 -0.04 1.08 -2.14 0.02 0.00 0.00 175.26 174.42 3cxc s PRO 72 N -3.10 2.42 0.33 0.39 0.02 -1.26 -0.79 135.00 133.01 3cxc s PRO 72 Ca 0.02 1.13 0.17 0.00 0.02 0.00 0.00 61.00 62.34 3cxc s PRO 72 Cb 0.01 -1.92 0.90 0.00 0.02 0.00 0.00 34.50 33.51 3cxc s PRO 72 CO -0.05 -1.52 1.44 -0.11 -0.33 0.00 0.00 177.00 176.44 3cxc n LEU 73 N -3.41 0.43 -3.64 -5.54 7.94 -0.27 -3.92 117.00 108.59 3cxc n LEU 73 Ca 0.09 0.64 -0.10 0.00 -1.11 0.00 0.00 56.01 55.52 3cxc n LEU 73 Cb 0.53 -0.63 -0.07 0.00 0.53 0.00 0.00 43.42 43.78 3cxc n LEU 73 CO 0.54 -0.78 0.39 -1.61 -1.11 0.00 0.00 177.39 174.82 3cxc s GLU 74 N -3.42 0.76 0.00 1.96 2.02 -1.26 -4.84 118.70 113.91 3cxc s GLU 74 Ca -0.02 1.11 0.00 0.00 0.02 0.00 0.00 54.97 56.08 3cxc s GLU 74 Cb 0.05 0.26 0.00 0.00 0.10 0.00 0.00 34.13 34.54 3cxc s GLU 74 CO 0.15 -0.13 0.00 0.41 0.02 0.00 0.00 175.26 175.72 3cxc n GLY 75 N 3.56 1.34 0.16 -1.39 0.00 -1.26 -4.79 105.19 102.81 3cxc n GLY 75 Ca -0.17 -1.91 0.03 0.00 0.00 0.00 0.00 46.02 43.97 3cxc n GLY 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3cxc h ASP 76 N 0.00 0.00 -0.19 1.61 3.32 -2.02 -3.38 116.42 115.77 3cxc h ASP 76 Ca 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 3cxc h ASP 76 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3cxc h ASP 76 CO 0.00 0.48 0.12 0.00 -1.72 0.00 0.00 179.24 178.12 3cxc n ALA 77 N -2.30 -0.29 -2.04 3.45 0.00 -1.26 -4.83 120.51 113.24 3cxc n ALA 77 Ca 0.00 0.09 -0.41 0.00 0.00 0.00 0.00 53.44 53.12 3cxc n ALA 77 Cb 0.61 -0.35 -0.03 0.00 0.00 0.00 0.00 19.45 19.67 3cxc n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3cxc s ASP 78 N 0.53 6.89 -0.86 0.00 -0.00 -1.26 -4.30 116.67 117.66 3cxc s ASP 78 Ca 0.19 2.38 -0.16 0.00 -0.00 0.00 0.00 52.55 54.96 3cxc s ASP 78 Cb -0.28 -2.61 0.17 0.00 -0.00 0.00 0.00 42.92 40.21 3cxc s ASP 78 CO 0.15 -0.55 0.93 -0.69 -0.00 0.00 0.00 175.17 175.02 3cxc s VAL 79 N 0.29 5.16 0.55 -1.27 1.01 -1.26 -4.69 120.40 120.20 3cxc s VAL 79 Ca 0.58 -1.98 0.04 0.00 0.00 0.00 0.00 61.98 60.62 3cxc s VAL 79 Cb -0.36 -4.62 0.03 0.00 0.00 0.00 0.00 36.38 31.43 3cxc s VAL 79 CO 0.37 -1.26 0.29 1.51 0.00 0.00 0.00 175.10 176.01 3cxc s ASP 80 N 2.92 4.47 0.17 3.32 1.47 -1.26 -4.47 116.67 123.29 3cxc s ASP 80 Ca 0.25 -1.42 -0.25 0.00 1.18 0.00 0.00 52.55 52.31 3cxc s ASP 80 Cb -0.08 0.58 0.05 0.00 -0.34 0.00 0.00 42.92 43.13 3cxc s ASP 80 CO -0.08 -1.09 1.58 0.44 0.68 0.00 0.00 175.17 176.69 3cxc h ASP 81 N 0.87 -1.37 -0.35 2.11 3.32 -1.94 0.16 116.42 119.22 3cxc h ASP 81 Ca -0.38 0.23 0.08 0.00 0.02 0.00 0.00 57.03 56.97 3cxc h ASP 81 Cb 1.31 0.63 -0.08 0.00 0.22 0.00 0.00 39.33 41.41 3cxc h ASP 81 CO 0.62 -0.34 -0.21 -0.08 -1.72 0.00 0.00 179.24 177.51 3cxc h GLU 82 N -0.24 -0.16 0.01 3.56 4.81 -1.96 0.15 114.58 120.76 3cxc h GLU 82 Ca 0.18 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.45 3cxc h GLU 82 Cb 0.56 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.93 3cxc h GLU 82 CO -0.65 -0.11 -0.34 2.35 -0.73 0.00 0.00 179.01 179.53 3cxc h TRP 83 N -0.16 -0.95 -0.59 0.92 7.01 -1.41 0.13 115.95 120.89 3cxc h TRP 83 Ca 0.18 0.03 0.12 0.00 2.11 0.00 0.00 58.89 61.32 3cxc h TRP 83 Cb 0.44 0.42 -0.12 0.00 -2.10 0.00 0.00 29.16 27.80 3cxc h TRP 83 CO -0.43 -0.44 -0.22 0.28 -2.79 0.00 0.00 178.44 174.84 3cxc h VAL 84 N -0.51 0.29 0.17 2.65 2.07 0.43 -0.72 116.25 120.63 3cxc h VAL 84 Ca 0.05 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 3cxc h VAL 84 Cb 0.59 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3cxc h VAL 84 CO -0.27 0.00 -0.08 0.00 0.02 0.00 0.00 177.57 177.24 3cxc h ALA 85 N 1.37 -0.23 0.00 1.67 0.00 0.02 0.73 119.26 122.81 3cxc h ALA 85 Ca 0.27 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3cxc h ALA 85 Cb 0.50 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3cxc h ALA 85 CO -0.65 -0.48 0.00 0.39 0.00 0.00 0.00 179.25 178.51 3cxc n GLU 86 N -5.06 0.04 0.00 0.00 1.02 0.40 -3.77 120.64 113.27 3cxc n GLU 86 Ca -0.09 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 3cxc n GLU 86 Cb 0.22 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 3cxc n GLU 86 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3cxc n HIS 87 N -1.45 0.00 -3.58 -0.32 8.25 -0.30 -5.07 115.22 112.75 3cxc n HIS 87 Ca 0.03 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.26 3cxc n HIS 87 Cb 0.12 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.25 3cxc n HIS 87 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3cxc s THR 88 N -1.77 1.82 -1.63 1.59 2.01 0.25 -4.96 115.64 112.96 3cxc s THR 88 Ca 0.00 -1.31 0.29 0.00 0.31 0.00 0.00 61.69 60.98 3cxc s THR 88 Cb 0.00 -2.13 0.63 0.00 0.01 0.00 0.00 72.50 71.01 3cxc s THR 88 CO 0.00 0.00 2.05 0.47 -0.69 0.00 0.00 174.62 176.45 3cxc n ASP 89 N -1.94 0.00 -3.89 3.53 8.00 -1.26 -4.75 116.55 116.24 3cxc n ASP 89 Ca 0.05 -0.42 -0.15 0.00 0.71 0.00 0.00 54.79 54.99 3cxc n ASP 89 Cb 0.63 -0.19 0.03 0.00 -0.02 0.00 0.00 41.12 41.57 3cxc n ASP 89 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3cxc n TYR 90 N -1.19 -1.84 -0.01 1.24 4.02 -1.26 -5.06 117.16 113.06 3cxc n TYR 90 Ca 0.17 -1.44 0.03 0.00 -0.01 0.00 0.00 57.90 56.65 3cxc n TYR 90 Cb 0.19 -0.33 -0.08 0.00 -0.02 0.00 0.00 39.34 39.09 3cxc n TYR 90 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3cxc n ASP 91 N -2.28 2.48 -3.31 7.72 8.00 -1.26 -4.18 116.55 123.72 3cxc n ASP 91 Ca 0.06 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.47 3cxc n ASP 91 Cb 0.40 1.35 0.00 0.00 -0.02 0.00 0.00 41.12 42.85 3cxc n ASP 91 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 3cxc s ASP 92 N -3.48 -0.01 0.14 -2.24 -4.77 -1.26 -4.06 116.67 101.00 3cxc s ASP 92 Ca -0.04 -0.99 -0.19 0.00 -3.30 0.00 0.00 52.55 48.02 3cxc s ASP 92 Cb 0.06 0.78 0.02 0.00 -1.09 0.00 0.00 42.92 42.70 3cxc s ASP 92 CO 0.45 -1.52 1.68 0.40 0.70 0.00 0.00 175.17 176.88 3cxc h ILE 93 N 2.03 0.66 -0.82 2.11 2.04 -1.86 -1.67 117.51 119.99 3cxc h ILE 93 Ca -0.27 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.72 3cxc h ILE 93 Cb 1.25 0.66 -0.09 0.00 -0.74 0.00 0.00 36.82 37.90 3cxc h ILE 93 CO 0.35 0.00 0.42 0.28 0.00 0.00 0.00 178.15 179.20 3cxc h SER 94 N -0.05 0.53 -0.66 1.72 0.02 -1.97 0.19 113.55 113.32 3cxc h SER 94 Ca 0.13 0.08 0.04 0.00 -0.84 0.00 0.00 61.79 61.21 3cxc h SER 94 Cb 0.26 -0.01 -0.05 0.00 0.14 0.00 0.00 62.40 62.74 3cxc h SER 94 CO -0.30 0.25 0.39 1.23 -1.14 0.00 0.00 176.83 177.26 3cxc h GLY 95 N 0.64 0.96 0.49 -3.77 0.00 -1.73 -1.40 103.07 98.26 3cxc h GLY 95 Ca 0.43 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 3cxc h GLY 95 CO -0.33 0.21 -0.23 -2.00 0.00 0.00 0.00 176.54 174.19 3cxc h LEU 96 N 0.75 -0.56 -0.95 3.11 5.85 -0.05 -3.00 115.31 120.46 3cxc h LEU 96 Ca 0.28 0.02 0.17 0.00 0.84 0.00 0.00 57.88 59.19 3cxc h LEU 96 Cb 0.10 0.14 -0.17 0.00 0.37 0.00 0.00 40.66 41.10 3cxc h LEU 96 CO -0.14 -0.33 -0.30 0.00 -0.34 0.00 0.00 178.44 177.33 3cxc n ALA 97 N -2.43 0.08 -0.22 1.25 0.00 0.37 0.86 120.51 120.42 3cxc n ALA 97 Ca -0.08 1.01 0.02 0.00 0.00 0.00 0.00 53.44 54.39 3cxc n ALA 97 Cb 0.26 -0.54 0.14 0.00 0.00 0.00 0.00 19.45 19.30 3cxc n ALA 97 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3cxc h PHE 98 N 0.00 0.37 -0.37 0.00 3.57 -1.27 0.56 116.94 119.79 3cxc h PHE 98 Ca 0.40 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.90 3cxc h PHE 98 Cb 0.64 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 3cxc h PHE 98 CO -0.78 0.04 0.07 0.00 -2.23 0.00 0.00 178.31 175.41 3cxc h ALA 99 N 1.49 1.43 0.19 2.41 0.00 0.61 -0.25 119.26 125.15 3cxc h ALA 99 Ca 0.35 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3cxc h ALA 99 Cb 0.50 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3cxc h ALA 99 CO -0.38 0.41 -0.09 -0.07 0.00 0.00 0.00 179.25 179.12 3cxc h LEU 100 N 0.54 -0.22 -0.37 0.00 3.38 0.07 0.15 115.31 118.87 3cxc h LEU 100 Ca 0.12 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.86 3cxc h LEU 100 Cb 0.24 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 3cxc h LEU 100 CO -0.00 0.21 0.08 -0.07 0.09 0.00 0.00 178.44 178.75 3cxc h LEU 101 N -0.70 0.04 0.00 1.67 3.38 -0.78 0.19 115.31 119.11 3cxc h LEU 101 Ca -0.03 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3cxc h LEU 101 Cb 0.49 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3cxc h LEU 101 CO 0.04 0.06 0.00 -1.54 0.09 0.00 0.00 178.44 177.09 3cxc n SER 102 N -5.08 0.00 -4.01 -0.43 3.41 -0.12 -4.32 113.62 103.07 3cxc n SER 102 Ca 0.02 -1.18 -0.28 0.00 -0.26 0.00 0.00 58.87 57.18 3cxc n SER 102 Cb 0.16 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.09 3cxc n SER 102 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3cxc n GLU 103 N -0.65 -3.30 0.01 4.33 1.02 0.67 -4.88 120.64 117.85 3cxc n GLU 103 Ca 0.05 0.40 0.10 0.00 -0.02 0.00 0.00 57.16 57.69 3cxc n GLU 103 Cb 0.02 -4.65 -0.13 0.00 -0.02 0.00 0.00 31.44 26.67 3cxc n GLU 103 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 3cxc n GLU 104 N -4.41 0.65 -3.93 3.49 4.07 0.49 -5.01 120.64 115.99 3cxc n GLU 104 Ca -0.23 -0.10 -0.12 0.00 -0.06 0.00 0.00 57.16 56.65 3cxc n GLU 104 Cb 0.64 -1.60 -0.00 0.00 -0.06 0.00 0.00 31.44 30.42 3cxc n GLU 104 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 3cxc s THR 105 N -3.42 0.00 0.34 6.31 -1.32 -1.21 -5.05 115.64 111.29 3cxc s THR 105 Ca -0.06 -1.26 0.04 0.00 -1.21 0.00 0.00 61.69 59.20 3cxc s THR 105 Cb 0.12 -2.83 -0.03 0.00 -1.51 0.00 0.00 72.50 68.25 3cxc s THR 105 CO 0.88 0.00 0.16 0.42 -2.21 0.00 0.00 174.62 173.87 3cxc s THR 106 N -2.51 0.40 0.35 5.08 -4.23 -1.26 -4.52 115.64 108.95 3cxc s THR 106 Ca 0.22 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.86 3cxc s THR 106 Cb -0.03 -2.47 0.07 0.00 1.34 0.00 0.00 72.50 71.42 3cxc s THR 106 CO 0.16 0.00 1.79 -0.07 -0.54 0.00 0.00 174.62 175.96 3cxc h LEU 107 N 2.06 0.00 0.17 4.79 3.38 -1.90 -3.06 115.31 120.74 3cxc h LEU 107 Ca -0.33 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 3cxc h LEU 107 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 3cxc h LEU 107 CO 0.52 0.41 -0.08 0.03 0.09 0.00 0.00 178.44 179.41 3cxc h ARG 108 N 0.00 -0.22 -0.86 1.13 3.08 -1.85 0.85 114.38 116.52 3cxc h ARG 108 Ca -0.00 0.02 0.25 0.00 0.07 0.00 0.00 59.98 60.31 3cxc h ARG 108 Cb 0.74 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.81 3cxc h ARG 108 CO 0.05 0.20 0.87 0.93 -1.07 0.00 0.00 179.97 180.96 3cxc h GLU 109 N -0.81 0.00 -0.59 0.04 5.08 -1.86 1.71 114.58 118.16 3cxc h GLU 109 Ca -0.02 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 3cxc h GLU 109 Cb 0.52 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.70 3cxc h GLU 109 CO 0.04 0.00 0.13 1.04 -1.00 0.00 0.00 179.01 179.22 3cxc n GLN 110 N -3.59 3.76 -2.24 2.33 1.13 -1.16 -4.92 117.38 112.69 3cxc n GLN 110 Ca 0.18 -3.08 -0.19 0.00 -1.94 0.00 0.00 57.00 51.98 3cxc n GLN 110 Cb 1.16 -2.14 -0.02 0.00 0.11 0.00 0.00 30.24 29.35 3cxc n GLN 110 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3cxc n GLY 111 N -0.10 -0.08 3.56 1.08 0.00 0.58 -4.78 105.19 105.45 3cxc n GLY 111 Ca 0.34 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 3cxc n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cxc s LEU 112 N -5.26 3.07 0.22 0.99 1.43 0.30 -1.12 118.68 118.31 3cxc s LEU 112 Ca 0.00 -0.11 -0.32 0.00 -1.03 0.00 0.00 54.13 52.68 3cxc s LEU 112 Cb 0.00 -1.70 -0.14 0.00 0.03 0.00 0.00 46.19 44.38 3cxc s LEU 112 CO 0.00 0.33 1.39 -0.24 0.23 0.00 0.00 176.35 178.06 3cxc n SER 113 N 1.99 2.60 0.00 2.29 2.88 0.03 -3.06 113.62 120.34 3cxc n SER 113 Ca -0.17 1.14 0.05 0.00 -1.33 0.00 0.00 58.87 58.55 3cxc n SER 113 Cb 0.53 -1.40 0.23 0.00 -0.75 0.00 0.00 64.21 62.81 3cxc n SER 113 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3cxc n PRO 114 N 2.10 0.11 -4.93 -1.46 -0.02 -1.26 -4.68 135.00 124.86 3cxc n PRO 114 Ca 0.12 0.23 -0.33 0.00 -2.02 0.00 0.00 63.50 61.51 3cxc n PRO 114 Cb 0.30 -1.50 -0.14 0.00 -0.02 0.00 0.00 33.50 32.14 3cxc n PRO 114 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3cxc s THR 115 N -2.66 2.88 -0.42 3.45 2.01 -1.26 -4.45 115.64 115.19 3cxc s THR 115 Ca 0.08 -0.77 -0.09 0.00 0.31 0.00 0.00 61.69 61.22 3cxc s THR 115 Cb 0.06 -2.14 0.08 0.00 0.01 0.00 0.00 72.50 70.51 3cxc s THR 115 CO 0.15 0.57 0.27 -0.76 -0.69 0.00 0.00 174.62 174.15 3cxc s LEU 116 N -0.32 5.18 -0.67 4.42 1.43 0.18 -4.66 118.68 124.25 3cxc s LEU 116 Ca 0.02 -1.52 -0.26 0.00 -1.03 0.00 0.00 54.13 51.35 3cxc s LEU 116 Cb -0.13 -1.99 0.04 0.00 0.03 0.00 0.00 46.19 44.14 3cxc s LEU 116 CO 0.02 -0.55 1.17 -0.13 0.23 0.00 0.00 176.35 177.10 3cxc s ARG 117 N 1.43 3.27 0.91 1.70 0.52 -1.25 0.18 118.95 125.70 3cxc s ARG 117 Ca 0.03 -0.22 -0.14 0.00 -0.52 0.00 0.00 55.73 54.88 3cxc s ARG 117 Cb -0.23 -4.13 0.17 0.00 0.52 0.00 0.00 34.95 31.27 3cxc s ARG 117 CO 0.02 -1.91 1.27 -0.51 0.02 0.00 0.00 175.30 174.18 3cxc s LEU 118 N 5.09 2.68 0.25 2.53 1.43 -1.01 -4.91 118.68 124.75 3cxc s LEU 118 Ca 0.34 0.36 0.06 0.00 -1.03 0.00 0.00 54.13 53.86 3cxc s LEU 118 Cb -0.10 -2.54 -0.03 0.00 0.03 0.00 0.00 46.19 43.55 3cxc s LEU 118 CO 0.17 -2.48 0.30 -2.28 0.23 0.00 0.00 176.35 172.29 3cxc s HIS 119 N -3.77 3.29 0.40 0.29 5.65 -0.23 -4.85 115.29 116.08 3cxc s HIS 119 Ca 0.71 -0.07 -0.27 0.00 0.25 0.00 0.00 55.06 55.68 3cxc s HIS 119 Cb -0.06 -1.52 -0.10 0.00 -1.18 0.00 0.00 32.58 29.72 3cxc s HIS 119 CO 0.51 0.45 1.45 -2.30 -0.65 0.00 0.00 174.74 174.21 3cxc n PRO 120 N -1.32 2.48 -1.67 2.88 -0.02 -1.26 -4.43 135.00 131.65 3cxc n PRO 120 Ca -0.08 0.87 -0.46 0.00 -2.02 0.00 0.00 63.50 61.81 3cxc n PRO 120 Cb 0.57 -2.63 -0.04 0.00 -0.02 0.00 0.00 33.50 31.38 3cxc n PRO 120 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3cxc n PRO 121 N 0.21 2.22 -2.27 0.52 -0.04 -1.26 -4.57 135.00 129.81 3cxc n PRO 121 Ca 0.03 0.80 -0.43 0.00 -0.04 0.00 0.00 63.50 63.87 3cxc n PRO 121 Cb 0.40 -2.60 -0.02 0.00 -0.04 0.00 0.00 33.50 31.23 3cxc n PRO 121 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3cxc s ARG 122 N 1.74 4.23 0.00 0.54 0.52 -0.61 -1.63 118.95 123.75 3cxc s ARG 122 Ca 0.82 1.87 0.00 0.00 -0.52 0.00 0.00 55.73 57.90 3cxc s ARG 122 Cb -0.66 -3.80 0.00 0.00 0.52 0.00 0.00 34.95 31.01 3cxc s ARG 122 CO 0.41 -0.72 0.00 0.41 0.02 0.00 0.00 175.30 175.42 3cxc n GLY 123 N 3.77 0.71 0.84 -3.53 0.00 -1.26 -4.91 105.19 100.81 3cxc n GLY 123 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.27 3cxc n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cxc n GLY 124 N -2.54 -2.54 3.28 -0.02 0.00 -0.65 -5.00 105.19 97.72 3cxc n GLY 124 Ca 0.00 -1.25 -0.18 0.00 0.00 0.00 0.00 46.02 44.58 3cxc n GLY 124 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3cxc n HIS 125 N -3.51 -1.80 1.31 1.61 1.44 -1.26 -4.93 115.22 108.08 3cxc n HIS 125 Ca -0.03 -1.86 0.02 0.00 -2.01 0.00 0.00 57.72 53.84 3cxc n HIS 125 Cb 0.40 -0.44 0.06 0.00 0.12 0.00 0.00 29.99 30.13 3cxc n HIS 125 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 3cxc n ASP 126 N -2.23 1.04 0.00 4.39 8.00 -1.26 -4.98 116.55 121.51 3cxc n ASP 126 Ca 0.08 -2.05 0.00 0.00 0.71 0.00 0.00 54.79 53.53 3cxc n ASP 126 Cb 0.52 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.40 3cxc n ASP 126 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cxc n GLY 127 N 0.54 2.59 1.52 0.44 0.00 -1.26 -4.10 105.19 104.92 3cxc n GLY 127 Ca 0.05 -1.60 -0.10 0.00 0.00 0.00 0.00 46.02 44.37 3cxc n GLY 127 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3cxc n VAL 128 N 1.27 2.77 0.13 1.61 0.24 -1.26 -0.92 118.33 122.16 3cxc n VAL 128 Ca 0.00 -2.42 0.01 0.00 -2.04 0.00 0.00 64.34 59.90 3cxc n VAL 128 Cb 0.00 -0.37 -0.02 0.00 -1.47 0.00 0.00 33.84 31.99 3cxc n VAL 128 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3cxc n LYS 129 N -1.07 5.84 -4.01 7.34 5.02 -1.26 -5.01 118.16 125.01 3cxc n LYS 129 Ca 0.41 -0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.62 3cxc n LYS 129 Cb 1.25 -0.65 -0.11 0.00 -0.02 0.00 0.00 35.03 35.50 3cxc n LYS 129 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3cxc s HIS 130 N -1.30 0.34 0.56 2.13 3.76 -1.26 -5.08 115.29 114.44 3cxc s HIS 130 Ca 0.01 -0.70 -0.10 0.00 -0.15 0.00 0.00 55.06 54.12 3cxc s HIS 130 Cb 0.02 -0.25 0.13 0.00 1.11 0.00 0.00 32.58 33.59 3cxc s HIS 130 CO 0.12 -0.26 0.72 -0.35 -0.85 0.00 0.00 174.74 174.12 3cxc n PRO 131 N 1.10 -0.94 -0.03 8.40 -0.04 -1.26 -2.03 135.00 140.20 3cxc n PRO 131 Ca -0.21 -1.11 -0.13 0.00 -0.04 0.00 0.00 63.50 62.01 3cxc n PRO 131 Cb 0.57 -0.78 -0.08 0.00 -0.04 0.00 0.00 33.50 33.17 3cxc n PRO 131 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3cxc h VAL 132 N -1.54 1.32 0.00 0.52 2.07 -1.54 0.72 116.25 117.80 3cxc h VAL 132 Ca -0.24 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.24 3cxc h VAL 132 Cb 0.66 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 3cxc h VAL 132 CO 0.17 0.29 0.09 0.29 0.02 0.00 0.00 177.57 178.43 3cxc n LYS 133 N -4.76 0.09 -0.02 1.57 5.02 -1.26 -0.31 118.16 118.48 3cxc n LYS 133 Ca -0.07 0.56 0.07 0.00 -2.02 0.00 0.00 58.31 56.85 3cxc n LYS 133 Cb 0.26 -1.89 0.07 0.00 -0.02 0.00 0.00 35.03 33.45 3cxc n LYS 133 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3cxc n GLU 134 N -1.98 1.09 -0.17 1.97 1.02 -1.12 -4.97 120.64 116.49 3cxc n GLU 134 Ca -0.01 -1.40 0.00 0.00 -0.02 0.00 0.00 57.16 55.73 3cxc n GLU 134 Cb 0.12 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 3cxc n GLU 134 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cxc n GLY 135 N 0.78 0.74 0.00 0.62 0.00 0.57 -4.90 105.19 103.00 3cxc n GLY 135 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3cxc n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cxc n GLY 136 N -2.08 0.90 0.00 -0.02 0.00 0.25 -4.72 105.19 99.51 3cxc n GLY 136 Ca 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.19 3cxc n GLY 136 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3cxc n GLN 137 N 0.00 1.49 -3.08 1.61 -0.06 -0.10 -4.21 117.38 113.03 3cxc n GLN 137 Ca 0.00 -1.00 -0.28 0.00 -2.00 0.00 0.00 57.00 53.72 3cxc n GLN 137 Cb 0.00 -0.82 -0.02 0.00 -4.06 0.00 0.00 30.24 25.34 3cxc n GLN 137 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 3cxc s LEU 138 N -0.53 3.91 0.00 1.69 1.43 -1.06 -4.58 118.68 119.53 3cxc s LEU 138 Ca 0.00 0.84 0.00 0.00 -1.03 0.00 0.00 54.13 53.94 3cxc s LEU 138 Cb 0.00 -3.70 0.00 0.00 0.03 0.00 0.00 46.19 42.52 3cxc s LEU 138 CO 0.00 -0.33 0.00 0.61 0.23 0.00 0.00 176.35 176.86 3cxc n GLY 139 N -1.38 -1.64 3.76 -3.19 0.00 -0.23 -1.87 105.19 100.64 3cxc n GLY 139 Ca -0.01 -1.34 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 3cxc n GLY 139 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3cxc s LYS 140 N 0.00 4.52 0.51 1.61 2.20 -1.26 -2.19 119.74 125.14 3cxc s LYS 140 Ca 0.00 1.98 0.02 0.00 -0.36 0.00 0.00 55.97 57.61 3cxc s LYS 140 Cb 0.00 -3.14 -0.01 0.00 -1.51 0.00 0.00 37.83 33.17 3cxc s LYS 140 CO 0.00 0.04 0.04 -1.01 -0.36 0.00 0.00 175.35 174.07 3cxc s HIS 141 N -1.15 1.85 0.61 4.03 3.76 0.13 -4.72 115.29 119.80 3cxc s HIS 141 Ca 0.46 -0.94 -0.07 0.00 -0.15 0.00 0.00 55.06 54.37 3cxc s HIS 141 Cb -0.35 -1.65 0.01 0.00 1.11 0.00 0.00 32.58 31.70 3cxc s HIS 141 CO 0.46 0.16 0.94 -0.51 -0.85 0.00 0.00 174.74 174.94 3cxc s ASP 142 N -3.92 5.53 0.39 1.40 1.01 -1.26 -4.70 116.67 115.12 3cxc s ASP 142 Ca 0.09 0.77 0.17 0.00 0.71 0.00 0.00 52.55 54.28 3cxc s ASP 142 Cb 0.01 -1.71 0.79 0.00 1.01 0.00 0.00 42.92 43.02 3cxc s ASP 142 CO 0.05 -1.13 1.82 0.74 0.21 0.00 0.00 175.17 176.85 3cxc h THR 143 N -0.27 1.06 0.00 -1.27 2.02 -1.98 0.33 112.91 112.80 3cxc h THR 143 Ca -0.45 -1.31 -0.12 0.00 0.77 0.00 0.00 66.41 65.30 3cxc h THR 143 Cb 1.26 1.74 -0.02 0.00 -1.74 0.00 0.00 68.15 69.39 3cxc h THR 143 CO 0.61 0.35 -0.83 -0.08 0.37 0.00 0.00 175.52 175.94 3cxc h GLU 144 N 0.00 0.00 -0.03 6.66 4.81 -1.93 -2.85 114.58 121.24 3cxc h GLU 144 Ca -0.00 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 3cxc h GLU 144 Cb 0.72 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.10 3cxc h GLU 144 CO 0.05 0.39 -0.24 0.78 -0.73 0.00 0.00 179.01 179.25 3cxc h GLY 145 N 3.61 0.23 1.13 1.92 0.00 -1.60 -2.78 103.07 105.59 3cxc h GLY 145 Ca -0.06 -0.36 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 3cxc h GLY 145 CO 0.05 0.32 0.17 -2.22 0.00 0.00 0.00 176.54 174.86 3cxc h ILE 146 N -0.39 1.26 -0.63 2.60 1.08 -0.52 -2.79 117.51 118.12 3cxc h ILE 146 Ca -0.02 -0.94 0.02 0.00 -0.39 0.00 0.00 64.86 63.52 3cxc h ILE 146 Cb 0.94 0.56 -0.04 0.00 -3.07 0.00 0.00 36.82 35.21 3cxc h ILE 146 CO 0.05 0.36 0.40 0.44 -0.69 0.00 0.00 178.15 178.71 3cxc h ASP 147 N 1.02 0.67 -0.39 1.72 5.19 -1.56 0.15 116.42 123.22 3cxc h ASP 147 Ca 0.21 -0.01 0.04 0.00 -0.62 0.00 0.00 57.03 56.66 3cxc h ASP 147 Cb 0.36 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.67 3cxc h ASP 147 CO 0.00 0.48 0.16 0.44 -3.12 0.00 0.00 179.24 177.19 3cxc h ASP 148 N 0.80 0.19 0.28 6.45 3.32 -1.23 0.38 116.42 126.61 3cxc h ASP 148 Ca 0.24 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.32 3cxc h ASP 148 Cb -0.03 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3cxc h ASP 148 CO -0.08 0.15 -0.13 0.25 -1.72 0.00 0.00 179.24 177.70 3cxc h LEU 149 N 0.33 -0.31 -0.73 1.55 5.85 -1.28 -0.46 115.31 120.25 3cxc h LEU 149 Ca 0.18 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.81 3cxc h LEU 149 Cb 0.14 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 3cxc h LEU 149 CO -0.16 0.01 0.40 -0.07 -0.34 0.00 0.00 178.44 178.28 3cxc h LEU 150 N -0.66 0.57 -0.57 2.25 3.38 -0.57 -1.36 115.31 118.34 3cxc h LEU 150 Ca -0.04 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 3cxc h LEU 150 Cb 0.46 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3cxc h LEU 150 CO 0.06 0.35 -0.05 -0.33 0.09 0.00 0.00 178.44 178.56 3cxc h GLU 151 N 0.71 1.05 -0.02 1.13 5.08 -0.20 0.79 114.58 123.12 3cxc h GLU 151 Ca 0.34 -0.36 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 3cxc h GLU 151 Cb 0.28 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 3cxc h GLU 151 CO -0.22 1.06 -0.22 0.00 -1.00 0.00 0.00 179.01 178.62 3cxc h ALA 152 N 0.96 1.59 -0.02 3.43 0.00 -0.42 -1.99 119.26 122.80 3cxc h ALA 152 Ca 0.16 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3cxc h ALA 152 Cb 0.62 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3cxc h ALA 152 CO 0.04 0.31 -0.03 -1.33 0.00 0.00 0.00 179.25 178.24 3cxc n MET 153 N -4.26 2.04 0.00 0.00 2.81 -0.57 -1.57 117.12 115.57 3cxc n MET 153 Ca -0.02 -1.55 0.00 0.00 -1.81 0.00 0.00 57.70 54.32 3cxc n MET 153 Cb 0.29 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 3cxc n MET 153 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35