#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hji s ALA 2 N 0.00 -1.33 -0.05 -1.46 0.00 -1.26 -4.79 121.76 112.87 2hji s ALA 2 Ca 0.00 0.71 -0.00 0.00 0.00 0.00 0.00 51.96 52.67 2hji s ALA 2 Cb 0.00 0.24 0.03 0.00 0.00 0.00 0.00 23.12 23.39 2hji s ALA 2 CO 0.00 -0.43 -0.01 -1.17 0.00 0.00 0.00 175.76 174.14 2hji s LEU 3 N -1.69 0.95 -0.03 0.00 2.96 -1.13 -2.84 118.68 116.91 2hji s LEU 3 Ca -0.08 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 53.78 2hji s LEU 3 Cb -0.01 -0.39 -0.00 0.00 0.50 0.00 0.00 46.19 46.28 2hji s LEU 3 CO 0.02 -0.13 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.92 2hji s THR 4 N 1.42 0.96 -0.14 3.68 2.01 -1.07 -2.46 115.64 120.04 2hji s THR 4 Ca -0.04 -0.47 -0.04 0.00 0.31 0.00 0.00 61.69 61.45 2hji s THR 4 Cb -0.13 -0.84 0.05 0.00 0.01 0.00 0.00 72.50 71.59 2hji s THR 4 CO -0.03 0.29 0.07 -0.63 -0.69 0.00 0.00 174.62 173.64 2hji s ILE 5 N 0.07 -0.02 0.42 1.82 1.01 -1.05 -1.11 121.20 122.33 2hji s ILE 5 Ca -0.02 -0.04 0.07 0.00 0.00 0.00 0.00 60.65 60.67 2hji s ILE 5 Cb -0.08 -0.51 -0.05 0.00 0.01 0.00 0.00 42.46 41.83 2hji s ILE 5 CO 0.01 -0.14 0.19 0.72 0.00 0.00 0.00 174.94 175.72 2hji s PHE 6 N 2.12 2.56 0.48 3.97 -0.71 -1.22 -3.29 117.98 121.89 2hji s PHE 6 Ca 0.03 -0.60 -0.11 0.00 -1.04 0.00 0.00 56.93 55.21 2hji s PHE 6 Cb -0.15 -1.96 -0.06 0.00 -1.21 0.00 0.00 43.02 39.64 2hji s PHE 6 CO -0.07 0.15 0.86 0.45 -1.34 0.00 0.00 175.22 175.27 2hji s SER 7 N -3.93 6.45 0.42 1.98 0.15 -1.22 -2.89 113.70 114.67 2hji s SER 7 Ca 0.40 1.24 0.29 0.00 0.70 0.00 0.00 55.95 58.58 2hji s SER 7 Cb 0.03 -2.37 1.47 0.00 -1.71 0.00 0.00 66.02 63.44 2hji s SER 7 CO 0.22 -0.54 1.89 -0.37 1.20 0.00 0.00 173.24 175.64 2hji h VAL 8 N 0.69 0.00 0.04 4.45 -1.51 -1.79 -2.55 116.25 115.58 2hji h VAL 8 Ca -0.47 -0.11 -0.36 0.00 -1.23 0.00 0.00 66.70 64.54 2hji h VAL 8 Cb 1.19 0.83 -0.05 0.00 -2.13 0.00 0.00 31.29 31.13 2hji h VAL 8 CO 0.63 0.00 -2.16 1.17 -1.23 0.00 0.00 177.57 175.97 2hji n LYS 9 N -2.56 0.69 -3.80 5.19 4.81 -1.26 -4.69 118.16 116.54 2hji n LYS 9 Ca -0.01 0.18 -0.32 0.00 -0.87 0.00 0.00 58.31 57.29 2hji n LYS 9 Cb 0.12 -1.63 -0.10 0.00 0.02 0.00 0.00 35.03 33.43 2hji n LYS 9 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2hji s ASP 10 N -6.35 5.23 0.00 3.14 1.01 -0.96 -4.88 116.67 113.86 2hji s ASP 10 Ca -0.19 -3.68 0.27 0.00 0.71 0.00 0.00 52.55 49.66 2hji s ASP 10 Cb 0.07 -1.75 0.85 0.00 1.01 0.00 0.00 42.92 43.11 2hji s ASP 10 CO 0.75 -0.15 1.66 -0.81 0.21 0.00 0.00 175.17 176.82 2hji n PRO 11 N 2.29 0.01 0.06 8.23 -0.04 -1.23 -3.41 135.00 140.92 2hji n PRO 11 Ca 0.18 -0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.62 2hji n PRO 11 Cb 0.36 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.25 2hji n PRO 11 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2hji h GLN 12 N 0.01 0.00 -3.52 0.54 4.20 -1.91 -3.42 115.11 111.00 2hji h GLN 12 Ca 0.00 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 58.11 2hji h GLN 12 Cb 0.50 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 27.88 2hji h GLN 12 CO 0.00 0.55 -0.75 -0.80 -0.67 0.00 0.00 178.83 177.16 2hji s ASN 13 N -6.25 4.00 0.40 1.46 0.01 -1.25 -5.11 114.94 108.19 2hji s ASN 13 Ca -0.00 -1.93 -0.24 0.00 -0.71 0.00 0.00 52.86 49.98 2hji s ASN 13 Cb 0.09 -0.97 -0.09 0.00 0.41 0.00 0.00 41.25 40.68 2hji s ASN 13 CO 0.79 -0.38 1.05 -0.44 -1.51 0.00 0.00 177.10 176.62 2hji s SER 14 N 1.24 6.74 -0.01 -1.22 0.01 -1.26 -4.78 113.70 114.42 2hji s SER 14 Ca 0.12 2.05 -0.01 0.00 1.31 0.00 0.00 55.95 59.42 2hji s SER 14 Cb -0.19 -2.59 -0.00 0.00 0.21 0.00 0.00 66.02 63.45 2hji s SER 14 CO -0.17 -0.50 0.12 0.25 0.41 0.00 0.00 173.24 173.35 2hji h LEU 15 N 2.49 -0.02 -8.69 2.44 5.85 -1.90 -3.43 115.31 112.05 2hji h LEU 15 Ca -0.48 0.00 -0.64 0.00 0.84 0.00 0.00 57.88 57.60 2hji h LEU 15 Cb 1.22 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 42.11 2hji h LEU 15 CO 0.62 0.05 0.20 0.86 -0.34 0.00 0.00 178.44 179.83 2hji s TRP 16 N -1.35 3.09 -0.09 1.25 -0.00 -1.25 -5.01 118.94 115.59 2hji s TRP 16 Ca -0.00 0.21 -0.04 0.00 -0.00 0.00 0.00 56.10 56.27 2hji s TRP 16 Cb 0.00 -3.32 0.05 0.00 -0.00 0.00 0.00 33.47 30.20 2hji s TRP 16 CO 0.01 -0.78 0.18 -1.58 -0.00 0.00 0.00 176.95 174.78 2hji s HIS 17 N 2.88 -0.22 0.07 5.86 2.46 -1.26 -2.54 115.29 122.54 2hji s HIS 17 Ca 0.25 0.66 -0.25 0.00 0.47 0.00 0.00 55.06 56.19 2hji s HIS 17 Cb -0.14 -0.19 0.06 0.00 -0.13 0.00 0.00 32.58 32.19 2hji s HIS 17 CO 0.18 -0.27 0.59 0.45 -2.47 0.00 0.00 174.74 173.22 2hji s SER 18 N 2.12 -0.55 -0.36 9.88 0.15 -1.03 -5.03 113.70 118.87 2hji s SER 18 Ca 0.01 0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.89 2hji s SER 18 Cb -0.12 0.55 0.12 0.00 -1.71 0.00 0.00 66.02 64.86 2hji s SER 18 CO -0.06 -0.80 0.15 0.42 1.20 0.00 0.00 173.24 174.15 2hji s THR 19 N -2.72 1.02 0.05 6.45 -4.23 -1.26 -2.82 115.64 112.13 2hji s THR 19 Ca -0.04 -1.84 0.01 0.00 -1.18 0.00 0.00 61.69 58.65 2hji s THR 19 Cb -0.01 -1.75 -0.03 0.00 1.34 0.00 0.00 72.50 72.06 2hji s THR 19 CO -0.04 -0.78 -0.06 0.21 -0.54 0.00 0.00 174.62 173.42 2hji s ASN 20 N 1.13 0.72 0.09 3.99 3.84 -1.26 -4.99 114.94 118.46 2hji s ASN 20 Ca 0.13 -0.67 -0.31 0.00 0.21 0.00 0.00 52.86 52.23 2hji s ASN 20 Cb -0.20 0.08 -0.14 0.00 -0.55 0.00 0.00 41.25 40.44 2hji s ASN 20 CO -0.14 -0.32 1.62 0.00 -2.79 0.00 0.00 177.10 175.48 2hji h ALA 21 N 4.12 -0.73 0.00 1.71 0.00 -1.98 0.42 119.26 122.79 2hji h ALA 21 Ca -0.35 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 2hji h ALA 21 Cb 1.19 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 2hji h ALA 21 CO 0.48 -0.94 -0.42 1.05 0.00 0.00 0.00 179.25 179.41 2hji h GLU 22 N -0.72 0.00 -0.18 0.00 4.11 -1.98 -1.84 114.58 113.97 2hji h GLU 22 Ca -0.03 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.34 2hji h GLU 22 Cb 0.63 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 2hji h GLU 22 CO -0.03 0.42 -0.11 0.93 0.07 0.00 0.00 179.01 180.29 2hji h GLU 23 N 0.00 0.40 -0.44 1.06 5.08 -1.85 -0.66 114.58 118.16 2hji h GLU 23 Ca -0.00 -0.19 -0.14 0.00 -1.00 0.00 0.00 59.36 58.03 2hji h GLU 23 Cb 0.77 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 2hji h GLU 23 CO 0.06 0.72 -0.28 0.82 -1.00 0.00 0.00 179.01 179.33 2hji h ILE 24 N 0.08 1.27 -0.28 3.13 2.04 -0.86 -2.11 117.51 120.78 2hji h ILE 24 Ca 0.04 -1.45 -0.04 0.00 1.00 0.00 0.00 64.86 64.41 2hji h ILE 24 Cb 0.61 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 2hji h ILE 24 CO 0.03 0.49 0.01 -0.61 0.00 0.00 0.00 178.15 178.07 2hji h GLN 25 N 0.81 0.49 -0.53 2.37 4.15 -1.31 -0.84 115.11 120.25 2hji h GLN 25 Ca 0.09 -0.15 -0.05 0.00 0.77 0.00 0.00 58.65 59.31 2hji h GLN 25 Cb 0.86 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.49 2hji h GLN 25 CO 0.08 0.64 0.13 1.96 -1.93 0.00 0.00 178.83 179.70 2hji h GLN 26 N 0.29 0.84 -0.45 1.69 1.08 -1.11 -0.25 115.11 117.20 2hji h GLN 26 Ca 0.08 -0.20 -0.10 0.00 -1.45 0.00 0.00 58.65 56.97 2hji h GLN 26 Cb 0.41 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.71 2hji h GLN 26 CO 0.01 0.80 -0.13 1.96 -0.95 0.00 0.00 178.83 180.53 2hji h GLN 27 N 0.74 0.89 -0.52 1.46 1.08 -1.34 -1.66 115.11 115.76 2hji h GLN 27 Ca 0.17 -0.35 -0.11 0.00 -1.45 0.00 0.00 58.65 56.91 2hji h GLN 27 Cb 0.34 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.70 2hji h GLN 27 CO 0.00 0.99 -0.09 -0.07 -0.95 0.00 0.00 178.83 178.71 2hji h LEU 28 N 0.73 0.96 -1.00 1.46 3.38 -1.01 -2.68 115.31 117.14 2hji h LEU 28 Ca 0.11 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 2hji h LEU 28 Cb 0.68 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2hji h LEU 28 CO 0.05 1.07 -0.21 0.78 0.09 0.00 0.00 178.44 180.21 2hji h ASN 29 N 0.86 0.46 -0.00 -0.43 -0.26 -0.72 0.39 115.58 115.88 2hji h ASN 29 Ca 0.14 -0.14 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2hji h ASN 29 Cb 0.64 -0.12 -0.00 0.00 -1.06 0.00 0.00 38.32 37.77 2hji h ASN 29 CO 0.04 0.68 0.00 0.00 -1.06 0.00 0.00 177.43 177.10 2hji h ALA 30 N 1.36 1.39 -0.54 -0.83 0.00 -0.95 0.14 119.26 119.82 2hji h ALA 30 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2hji h ALA 30 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2hji h ALA 30 CO 0.04 -0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.92 2hji n LYS 31 N -3.64 2.61 -1.16 0.00 4.76 -0.80 -4.92 118.16 115.01 2hji n LYS 31 Ca -0.03 -2.40 0.00 0.00 -2.87 0.00 0.00 58.31 53.01 2hji n LYS 31 Cb 0.08 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.78 2hji n LYS 31 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2hji n GLY 32 N 1.38 0.46 3.55 0.72 0.00 0.48 -4.88 105.19 106.90 2hji n GLY 32 Ca 0.20 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 2hji n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hji s VAL 33 N -2.00 4.34 0.38 1.61 1.01 0.13 -4.27 120.40 121.60 2hji s VAL 33 Ca 0.00 -0.19 -0.13 0.00 0.00 0.00 0.00 61.98 61.67 2hji s VAL 33 Cb 0.00 -2.95 -0.08 0.00 0.00 0.00 0.00 36.38 33.35 2hji s VAL 33 CO 0.00 0.45 0.77 -0.13 0.00 0.00 0.00 175.10 176.19 2hji s ARG 34 N 0.59 3.88 -0.16 2.72 1.81 -0.93 -2.49 118.95 124.37 2hji s ARG 34 Ca 0.01 0.57 -0.13 0.00 -1.72 0.00 0.00 55.73 54.46 2hji s ARG 34 Cb -0.14 -2.40 0.05 0.00 -0.45 0.00 0.00 34.95 32.01 2hji s ARG 34 CO 0.02 0.03 0.41 0.12 -0.68 0.00 0.00 175.30 175.20 2hji s PHE 35 N -2.22 -0.50 0.13 -0.53 5.36 -1.26 -2.85 117.98 116.10 2hji s PHE 35 Ca 0.53 1.16 -0.05 0.00 -0.96 0.00 0.00 56.93 57.62 2hji s PHE 35 Cb -0.10 0.19 -0.02 0.00 -0.34 0.00 0.00 43.02 42.74 2hji s PHE 35 CO 0.26 -0.25 0.14 -1.21 -1.46 0.00 0.00 175.22 172.69 2hji s GLU 36 N 0.56 0.95 -0.31 10.12 0.41 -1.25 -4.98 118.70 124.19 2hji s GLU 36 Ca -0.03 -1.26 -0.06 0.00 -0.41 0.00 0.00 54.97 53.21 2hji s GLU 36 Cb -0.04 0.30 0.02 0.00 -1.78 0.00 0.00 34.13 32.63 2hji s GLU 36 CO -0.03 -0.30 0.09 1.03 -0.49 0.00 0.00 175.26 175.56 2hji s ARG 37 N -3.98 2.86 -0.08 1.61 0.52 -1.26 -1.55 118.95 117.06 2hji s ARG 37 Ca 0.17 -1.02 -0.03 0.00 -0.52 0.00 0.00 55.73 54.34 2hji s ARG 37 Cb 0.06 -3.40 -0.04 0.00 0.52 0.00 0.00 34.95 32.09 2hji s ARG 37 CO -0.02 -0.55 0.04 -1.58 0.02 0.00 0.00 175.30 173.21 2hji s TRP 38 N 1.45 3.27 -0.24 -0.53 0.52 -1.13 -4.98 118.94 117.30 2hji s TRP 38 Ca 0.00 0.27 -0.15 0.00 0.02 0.00 0.00 56.10 56.24 2hji s TRP 38 Cb -0.18 -1.81 -0.04 0.00 -1.15 0.00 0.00 33.47 30.29 2hji s TRP 38 CO 0.02 0.54 0.37 -1.14 0.02 0.00 0.00 176.95 176.76 2hji s GLN 39 N -1.03 4.08 -1.24 4.98 2.00 -1.26 -4.39 119.66 122.80 2hji s GLN 39 Ca 0.15 0.08 -0.06 0.00 -2.00 0.00 0.00 55.36 53.53 2hji s GLN 39 Cb -0.12 -3.60 0.19 0.00 0.80 0.00 0.00 33.01 30.28 2hji s GLN 39 CO 0.04 -0.17 2.03 0.00 -0.50 0.00 0.00 175.29 176.69 2hji n ALA 40 N 4.95 6.04 1.16 1.58 0.00 -1.26 -4.59 120.51 128.39 2hji n ALA 40 Ca -0.09 -4.33 0.13 0.00 0.00 0.00 0.00 53.44 49.15 2hji n ALA 40 Cb 0.51 -2.70 0.26 0.00 0.00 0.00 0.00 19.45 17.52 2hji n ALA 40 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2hji n ASP 41 N 2.08 2.47 -4.69 0.00 5.68 -1.26 -4.89 116.55 115.94 2hji n ASP 41 Ca 0.48 -1.82 -0.40 0.00 -0.50 0.00 0.00 54.79 52.55 2hji n ASP 41 Cb 0.30 -0.01 -0.05 0.00 -1.14 0.00 0.00 41.12 40.22 2hji n ASP 41 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2hji s ARG 42 N -1.98 4.33 -0.23 0.11 0.52 -1.26 -5.03 118.95 115.41 2hji s ARG 42 Ca 0.32 0.86 -0.19 0.00 -0.52 0.00 0.00 55.73 56.20 2hji s ARG 42 Cb 0.20 -3.53 -0.03 0.00 0.52 0.00 0.00 34.95 32.12 2hji s ARG 42 CO 0.31 -0.15 0.54 -0.51 0.02 0.00 0.00 175.30 175.50 2hji s ASP 43 N 1.03 6.53 0.00 0.23 1.01 -1.26 -4.92 116.67 119.29 2hji s ASP 43 Ca 0.35 0.64 0.20 0.00 0.71 0.00 0.00 52.55 54.45 2hji s ASP 43 Cb -0.17 -2.30 0.53 0.00 1.01 0.00 0.00 42.92 42.00 2hji s ASP 43 CO 0.14 -0.24 1.44 0.18 0.21 0.00 0.00 175.17 176.90 2hji n LEU 44 N 5.15 2.83 0.00 1.23 7.99 -1.26 -5.04 117.00 127.90 2hji n LEU 44 Ca -0.04 -1.31 0.00 0.00 -0.01 0.00 0.00 56.01 54.66 2hji n LEU 44 Cb 0.50 -0.27 0.00 0.00 -0.11 0.00 0.00 43.42 43.54 2hji n LEU 44 CO 0.42 0.65 0.00 0.61 -1.51 0.00 0.00 177.39 177.56 2hji n GLY 45 N 1.37 0.21 0.09 -0.72 0.00 -1.26 -4.85 105.19 100.03 2hji n GLY 45 Ca 0.18 -1.93 -0.11 0.00 0.00 0.00 0.00 46.02 44.17 2hji n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hji n ALA 46 N -1.00 0.69 -2.69 4.61 0.00 -1.26 -4.88 120.51 115.98 2hji n ALA 46 Ca 0.00 -0.60 -0.36 0.00 0.00 0.00 0.00 53.44 52.48 2hji n ALA 46 Cb 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 19.45 19.30 2hji n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hji s ALA 47 N -2.70 3.64 0.12 0.00 0.00 -1.26 -5.07 121.76 116.49 2hji s ALA 47 Ca -0.23 -0.80 -0.30 0.00 0.00 0.00 0.00 51.96 50.63 2hji s ALA 47 Cb 0.04 -2.27 -0.06 0.00 0.00 0.00 0.00 23.12 20.84 2hji s ALA 47 CO 0.36 -0.05 1.01 -1.25 0.00 0.00 0.00 175.76 175.83 2hji s PRO 48 N 0.78 4.66 0.47 0.00 0.04 -1.26 -5.03 135.00 134.65 2hji s PRO 48 Ca 0.08 1.53 0.02 0.00 0.04 0.00 0.00 61.00 62.67 2hji s PRO 48 Cb -0.12 -3.35 0.02 0.00 0.04 0.00 0.00 34.50 31.09 2hji s PRO 48 CO 0.02 0.15 0.18 2.41 0.04 0.00 0.00 177.00 179.81 2hji n THR 49 N 2.75 0.00 -0.06 1.26 -1.04 -1.26 -4.99 114.28 110.94 2hji n THR 49 Ca 0.03 -2.02 -0.13 0.00 -2.04 0.00 0.00 64.05 59.89 2hji n THR 49 Cb 0.48 0.17 -0.12 0.00 -1.82 0.00 0.00 70.33 69.04 2hji n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hji h ALA 50 N 0.95 -0.00 -0.71 2.41 0.00 -1.97 -2.72 119.26 117.22 2hji h ALA 50 Ca -0.34 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.10 2hji h ALA 50 Cb 1.13 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 2hji h ALA 50 CO 0.55 -0.02 0.34 0.93 0.00 0.00 0.00 179.25 181.05 2hji h GLU 51 N -0.97 1.03 0.70 0.00 3.07 -1.98 -1.63 114.58 114.80 2hji h GLU 51 Ca -0.00 -0.15 -0.03 0.00 -0.50 0.00 0.00 59.36 58.67 2hji h GLU 51 Cb 0.89 -0.18 0.01 0.00 -0.84 0.00 0.00 28.75 28.62 2hji h GLU 51 CO 0.00 0.81 -0.34 0.00 -1.40 0.00 0.00 179.01 178.09 2hji h THR 52 N 1.00 0.03 -1.35 1.13 1.03 -1.98 -1.67 112.91 111.09 2hji h THR 52 Ca 0.24 -0.31 0.39 0.00 -0.01 0.00 0.00 66.41 66.73 2hji h THR 52 Cb 0.12 0.04 -0.05 0.00 -1.07 0.00 0.00 68.15 67.19 2hji h THR 52 CO -0.03 0.00 0.97 0.58 -0.01 0.00 0.00 175.52 177.03 2hji h VAL 53 N -1.24 0.33 0.12 0.00 2.07 -1.43 0.26 116.25 116.35 2hji h VAL 53 Ca -0.10 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2hji h VAL 53 Cb 0.73 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2hji h VAL 53 CO 0.16 0.00 -0.06 0.40 0.02 0.00 0.00 177.57 178.09 2hji h ILE 54 N 0.00 0.99 -0.57 4.57 2.04 -0.89 -2.89 117.51 120.76 2hji h ILE 54 Ca 0.64 -1.22 -0.08 0.00 1.00 0.00 0.00 64.86 65.20 2hji h ILE 54 Cb 2.57 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 40.30 2hji h ILE 54 CO -0.01 0.26 0.04 0.00 0.00 0.00 0.00 178.15 178.44 2hji h ALA 55 N -0.16 0.77 0.54 1.87 0.00 -0.08 -1.52 119.26 120.67 2hji h ALA 55 Ca -0.02 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2hji h ALA 55 Cb 0.55 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.13 2hji h ALA 55 CO 0.03 0.56 -0.26 0.00 0.00 0.00 0.00 179.25 179.58 2hji h ALA 56 N 0.98 -0.73 0.00 0.00 0.00 -1.27 -2.77 119.26 115.48 2hji h ALA 56 Ca 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2hji h ALA 56 Cb 0.49 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2hji h ALA 56 CO 0.02 -0.71 0.00 0.66 0.00 0.00 0.00 179.25 179.22 2hji n TYR 57 N -5.27 0.00 -0.03 0.00 4.01 -1.09 -3.60 117.16 111.18 2hji n TYR 57 Ca -0.10 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.54 2hji n TYR 57 Cb 0.31 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.30 2hji n TYR 57 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 2hji h GLN 58 N 0.03 0.14 -0.22 -0.72 5.75 -0.96 -0.48 115.11 118.65 2hji h GLN 58 Ca 0.00 -0.01 0.06 0.00 -0.15 0.00 0.00 58.65 58.55 2hji h GLN 58 Cb 0.04 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 2hji h GLN 58 CO 0.00 0.10 0.20 1.12 -2.65 0.00 0.00 178.83 177.60 2hji h HIS 59 N 0.15 0.00 -0.00 3.99 2.07 -1.76 0.14 115.15 119.74 2hji h HIS 59 Ca 0.08 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.42 2hji h HIS 59 Cb 0.04 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.01 2hji h HIS 59 CO -0.11 0.00 -0.81 0.00 -3.07 0.00 0.00 177.93 173.94 2hji h ALA 60 N 1.80 0.64 -0.41 6.11 0.00 -1.35 -3.14 119.26 122.91 2hji h ALA 60 Ca 0.10 -0.70 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 2hji h ALA 60 Cb 0.51 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2hji h ALA 60 CO -0.00 0.93 0.17 0.82 0.00 0.00 0.00 179.25 181.16 2hji h ILE 61 N 0.06 1.16 -0.53 0.00 2.04 -0.11 -2.34 117.51 117.79 2hji h ILE 61 Ca -0.02 -0.48 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 2hji h ILE 61 Cb 1.41 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 2hji h ILE 61 CO 0.11 0.19 0.20 -0.78 0.00 0.00 0.00 178.15 177.87 2hji h ASP 62 N 0.58 0.70 1.38 1.72 3.58 -1.49 -1.83 116.42 121.06 2hji h ASP 62 Ca 0.14 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2hji h ASP 62 Cb 0.11 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2hji h ASP 62 CO -0.01 0.64 -0.02 1.17 -2.88 0.00 0.00 179.24 178.14 2hji n LYS 63 N -4.33 0.22 0.00 0.28 3.00 -0.92 -4.18 118.16 112.23 2hji n LYS 63 Ca 0.04 0.18 0.00 0.00 -0.00 0.00 0.00 58.31 58.53 2hji n LYS 63 Cb 0.17 -1.76 0.00 0.00 0.00 0.00 0.00 35.03 33.44 2hji n LYS 63 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2hji n LEU 64 N -2.14 0.00 -3.69 3.14 0.00 -0.69 -4.76 117.00 108.86 2hji n LEU 64 Ca 0.06 0.72 -0.14 0.00 0.00 0.00 0.00 56.01 56.65 2hji n LEU 64 Cb 0.42 -0.22 -0.14 0.00 0.00 0.00 0.00 43.42 43.48 2hji n LEU 64 CO 0.30 -0.22 -0.15 0.54 0.00 0.00 0.00 177.39 177.86 2hji s VAL 65 N -1.87 -0.24 -0.54 1.96 0.11 -1.26 -5.09 120.40 113.47 2hji s VAL 65 Ca 0.00 0.24 -0.22 0.00 -2.93 0.00 0.00 61.98 59.07 2hji s VAL 65 Cb 0.00 -0.38 0.05 0.00 -1.53 0.00 0.00 36.38 34.52 2hji s VAL 65 CO 0.00 0.10 0.80 0.00 -3.33 0.00 0.00 175.10 172.68 2hji s ALA 66 N 1.91 3.26 -0.28 1.54 0.00 -1.26 -4.95 121.76 121.98 2hji s ALA 66 Ca -0.03 -1.52 -0.23 0.00 0.00 0.00 0.00 51.96 50.18 2hji s ALA 66 Cb -0.11 -3.58 0.12 0.00 0.00 0.00 0.00 23.12 19.54 2hji s ALA 66 CO -0.08 -2.25 0.97 -2.00 0.00 0.00 0.00 175.76 172.39 2hji s GLU 67 N 3.37 0.54 0.15 0.00 2.12 -1.26 -5.14 118.70 118.48 2hji s GLU 67 Ca 0.23 0.69 0.00 0.00 0.36 0.00 0.00 54.97 56.25 2hji s GLU 67 Cb -0.16 0.24 0.00 0.00 0.26 0.00 0.00 34.13 34.47 2hji s GLU 67 CO 0.15 -0.07 0.00 1.17 -0.54 0.00 0.00 175.26 175.97 2hji n LYS 68 N 2.56 -1.04 0.00 4.30 4.81 -1.26 -4.07 118.16 123.46 2hji n LYS 68 Ca -0.14 0.75 0.15 0.00 -0.87 0.00 0.00 58.31 58.20 2hji n LYS 68 Cb 0.56 -1.48 0.68 0.00 0.02 0.00 0.00 35.03 34.82 2hji n LYS 68 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2hji n GLY 69 N -2.45 -0.93 2.09 3.14 0.00 -1.26 -5.01 105.19 100.76 2hji n GLY 69 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2hji n GLY 69 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2hji n TYR 70 N -0.93 -3.88 0.00 1.61 4.02 -1.26 -4.80 117.16 111.92 2hji n TYR 70 Ca 0.16 2.33 0.00 0.00 -0.01 0.00 0.00 57.90 60.38 2hji n TYR 70 Cb 0.25 -3.06 0.00 0.00 -0.02 0.00 0.00 39.34 36.51 2hji n TYR 70 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2hji n GLN 71 N 1.88 0.00 -3.83 -0.72 6.02 -1.25 -4.91 117.38 114.57 2hji n GLN 71 Ca 0.00 0.39 -0.03 0.00 -0.01 0.00 0.00 57.00 57.35 2hji n GLN 71 Cb 0.00 -0.84 0.01 0.00 1.02 0.00 0.00 30.24 30.43 2hji n GLN 71 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2hji s SER 72 N -2.69 -0.05 0.03 1.08 1.04 -1.26 -5.11 113.70 106.74 2hji s SER 72 Ca 0.00 -0.54 0.03 0.00 0.48 0.00 0.00 55.95 55.92 2hji s SER 72 Cb 0.00 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 66.56 2hji s SER 72 CO 0.00 -0.89 -0.09 -1.66 0.98 0.00 0.00 173.24 171.59 2hji s TRP 73 N -2.49 0.74 0.11 5.02 -2.14 -1.26 -4.17 118.94 114.76 2hji s TRP 73 Ca 0.19 -0.38 -0.00 0.00 2.66 0.00 0.00 56.10 58.56 2hji s TRP 73 Cb -0.02 -0.44 -0.04 0.00 -3.10 0.00 0.00 33.47 29.87 2hji s TRP 73 CO 0.03 -0.04 0.01 -0.51 -2.66 0.00 0.00 176.95 173.78 2hji s ASP 74 N -1.20 0.65 0.15 -2.66 1.01 -1.15 -4.93 116.67 108.53 2hji s ASP 74 Ca -0.05 -1.12 0.05 0.00 0.71 0.00 0.00 52.55 52.14 2hji s ASP 74 Cb -0.08 0.21 -0.04 0.00 1.01 0.00 0.00 42.92 44.02 2hji s ASP 74 CO 0.01 -0.63 0.10 -0.69 0.21 0.00 0.00 175.17 174.16 2hji s VAL 75 N -3.88 4.34 -0.35 -1.27 1.01 -1.26 -1.52 120.40 117.48 2hji s VAL 75 Ca 0.18 -1.08 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2hji s VAL 75 Cb 0.07 -3.18 0.10 0.00 0.00 0.00 0.00 36.38 33.38 2hji s VAL 75 CO -0.02 -0.05 0.09 -0.63 0.00 0.00 0.00 175.10 174.49 2hji s ILE 76 N -1.66 1.73 -0.02 2.22 1.01 -1.13 -4.94 121.20 118.41 2hji s ILE 76 Ca 0.30 -2.07 0.07 0.00 0.00 0.00 0.00 60.65 58.95 2hji s ILE 76 Cb -0.10 -2.28 -0.02 0.00 0.01 0.00 0.00 42.46 40.07 2hji s ILE 76 CO 0.22 -0.66 -0.23 -0.44 0.00 0.00 0.00 174.94 173.83 2hji s SER 77 N 1.06 3.28 -0.23 3.58 0.01 -1.25 -3.53 113.70 116.62 2hji s SER 77 Ca 0.11 -0.42 -0.11 0.00 1.31 0.00 0.00 55.95 56.84 2hji s SER 77 Cb -0.19 -0.45 -0.05 0.00 0.21 0.00 0.00 66.02 65.54 2hji s SER 77 CO -0.13 0.32 0.17 -0.76 0.41 0.00 0.00 173.24 173.24 2hji s LEU 78 N -0.71 4.13 -0.05 2.44 1.43 -1.26 -4.95 118.68 119.72 2hji s LEU 78 Ca 0.11 0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 53.34 2hji s LEU 78 Cb -0.10 -2.13 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 2hji s LEU 78 CO -0.00 0.08 0.07 -0.13 0.23 0.00 0.00 176.35 176.59 2hji s ARG 79 N 0.96 3.11 0.00 1.70 0.52 -1.26 -4.40 118.95 119.58 2hji s ARG 79 Ca 0.08 -0.40 0.14 0.00 -0.52 0.00 0.00 55.73 55.03 2hji s ARG 79 Cb -0.13 -2.90 0.73 0.00 0.52 0.00 0.00 34.95 33.17 2hji s ARG 79 CO 0.04 0.68 1.35 0.00 0.02 0.00 0.00 175.30 177.39 2hji n ALA 80 N 1.58 1.84 -1.00 2.13 0.00 -1.26 -4.03 120.51 119.77 2hji n ALA 80 Ca -0.16 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2hji n ALA 80 Cb 0.53 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.76 2hji n ALA 80 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2hji n ASP 81 N -1.24 0.00 -4.82 0.00 2.03 -1.26 -4.85 116.55 106.41 2hji n ASP 81 Ca 0.07 0.05 -0.32 0.00 0.52 0.00 0.00 54.79 55.11 2hji n ASP 81 Cb 0.10 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.52 2hji n ASP 81 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2hji s ASN 82 N -1.36 5.72 0.00 1.67 4.22 -1.26 -4.86 114.94 119.07 2hji s ASN 82 Ca 0.00 1.68 0.00 0.00 -2.14 0.00 0.00 52.86 52.40 2hji s ASN 82 Cb 0.00 -2.51 0.00 0.00 1.28 0.00 0.00 41.25 40.02 2hji s ASN 82 CO 0.00 -1.21 0.60 -0.81 -2.04 0.00 0.00 177.10 173.64 2hji n PRO 83 N -2.53 0.43 0.00 3.55 -0.04 -1.26 -4.04 135.00 131.10 2hji n PRO 83 Ca 0.08 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.67 2hji n PRO 83 Cb 0.53 -1.29 0.73 0.00 -0.04 0.00 0.00 33.50 33.44 2hji n PRO 83 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hji n GLN 84 N 1.19 0.60 0.06 0.54 10.64 -1.26 -2.58 117.38 126.56 2hji n GLN 84 Ca 0.00 0.02 -0.19 0.00 -1.83 0.00 0.00 57.00 55.00 2hji n GLN 84 Cb 0.21 -1.50 -0.14 0.00 -0.86 0.00 0.00 30.24 27.95 2hji n GLN 84 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.06 176.80 2hji h LYS 85 N 0.00 0.30 0.02 2.61 2.10 -1.80 -3.08 116.57 116.72 2hji h LYS 85 Ca 0.00 -0.51 -0.10 0.00 -2.00 0.00 0.00 60.65 58.04 2hji h LYS 85 Cb 0.13 0.19 -0.01 0.00 -0.90 0.00 0.00 32.23 31.64 2hji h LYS 85 CO 0.00 1.17 -0.53 1.05 -2.00 0.00 0.00 179.45 179.14 2hji h GLU 86 N 0.08 0.05 0.00 0.07 4.11 -1.88 -3.33 114.58 113.67 2hji h GLU 86 Ca -0.30 -0.08 -0.04 0.00 0.07 0.00 0.00 59.36 59.00 2hji h GLU 86 Cb 2.05 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 31.33 2hji h GLU 86 CO 0.16 1.04 -0.17 0.00 0.07 0.00 0.00 179.01 180.10 2hji h ALA 87 N -0.13 1.41 0.00 1.06 0.00 -1.70 -1.83 119.26 118.08 2hji h ALA 87 Ca -0.13 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2hji h ALA 87 Cb 1.21 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2hji h ALA 87 CO -0.04 0.22 -0.07 -0.07 0.00 0.00 0.00 179.25 179.29 2hji h LEU 88 N 0.00 0.00 0.76 0.00 -0.00 -1.64 -2.34 115.31 112.08 2hji h LEU 88 Ca -0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.84 2hji h LEU 88 Cb 0.38 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.05 2hji h LEU 88 CO 0.02 0.07 -0.36 0.03 -0.00 0.00 0.00 178.44 178.20 2hji h ARG 89 N 0.00 -0.98 0.00 1.13 2.47 -1.45 0.53 114.38 116.08 2hji h ARG 89 Ca -0.00 0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.78 2hji h ARG 89 Cb 0.32 0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.86 2hji h ARG 89 CO 0.01 -0.63 -0.05 0.93 0.56 0.00 0.00 179.97 180.79 2hji h GLU 90 N -1.12 0.00 -0.30 0.04 3.07 -1.69 0.35 114.58 114.94 2hji h GLU 90 Ca -0.10 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.64 2hji h GLU 90 Cb 0.80 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.70 2hji h GLU 90 CO 0.17 0.05 -0.26 -0.22 -1.40 0.00 0.00 179.01 177.35 2hji h LYS 91 N 0.00 0.70 0.00 2.33 1.63 -0.85 -3.24 116.57 117.14 2hji h LYS 91 Ca -0.00 -0.35 -0.01 0.00 -0.85 0.00 0.00 60.65 59.43 2hji h LYS 91 Cb 0.11 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.75 2hji h LYS 91 CO 0.01 0.97 -1.84 1.19 -3.45 0.00 0.00 179.45 176.32 2hji n PHE 92 N -4.28 0.00 1.37 1.91 3.72 0.12 -4.36 117.46 115.94 2hji n PHE 92 Ca -0.04 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.41 2hji n PHE 92 Cb 0.45 -0.43 0.17 0.00 -0.94 0.00 0.00 39.48 38.74 2hji n PHE 92 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2hji n LEU 93 N -2.15 1.11 -5.00 4.37 4.77 0.12 -2.48 117.00 117.74 2hji n LEU 93 Ca -0.04 -0.54 -0.18 0.00 -0.03 0.00 0.00 56.01 55.22 2hji n LEU 93 Cb 0.49 -0.13 0.02 0.00 -2.33 0.00 0.00 43.42 41.47 2hji n LEU 93 CO 0.38 0.27 0.21 0.54 -1.33 0.00 0.00 177.39 177.45 2hji s ASN 94 N -1.12 5.55 -0.09 -1.43 2.20 -1.22 -4.87 114.94 113.95 2hji s ASN 94 Ca 0.18 -0.32 -0.30 0.00 -0.94 0.00 0.00 52.86 51.48 2hji s ASN 94 Cb 0.09 -0.70 -0.03 0.00 -2.00 0.00 0.00 41.25 38.61 2hji s ASN 94 CO 0.13 -0.87 1.36 -1.61 -2.94 0.00 0.00 177.10 173.17 2hji s GLU 95 N -4.46 4.25 -0.05 3.55 2.02 -1.26 -4.76 118.70 117.99 2hji s GLU 95 Ca 0.56 1.83 -0.02 0.00 0.02 0.00 0.00 54.97 57.36 2hji s GLU 95 Cb -0.10 -3.74 0.03 0.00 0.10 0.00 0.00 34.13 30.42 2hji s GLU 95 CO 0.34 -0.67 0.03 -1.58 0.02 0.00 0.00 175.26 173.41 2hji s HIS 96 N 3.20 0.32 0.09 1.61 5.65 -1.26 -5.08 115.29 119.81 2hji s HIS 96 Ca 0.60 0.07 0.04 0.00 0.25 0.00 0.00 55.06 56.03 2hji s HIS 96 Cb -0.26 -0.60 -0.03 0.00 -1.18 0.00 0.00 32.58 30.50 2hji s HIS 96 CO 0.21 -0.24 -0.12 0.99 -0.65 0.00 0.00 174.74 174.93 2hji s THR 97 N 2.02 1.02 0.10 0.89 2.01 -1.26 -4.07 115.64 116.35 2hji s THR 97 Ca 0.04 -1.52 0.02 0.00 0.31 0.00 0.00 61.69 60.54 2hji s THR 97 Cb -0.12 -1.25 -0.04 0.00 0.01 0.00 0.00 72.50 71.09 2hji s THR 97 CO -0.04 -0.43 -0.06 -1.38 -0.69 0.00 0.00 174.62 172.01 2hji s HIS 98 N -2.00 0.88 -0.25 4.92 -3.43 -1.26 -5.03 115.29 109.12 2hji s HIS 98 Ca 0.03 -0.92 0.02 0.00 -0.80 0.00 0.00 55.06 53.40 2hji s HIS 98 Cb -0.06 -0.51 0.29 0.00 -1.43 0.00 0.00 32.58 30.87 2hji s HIS 98 CO 0.01 -0.15 1.34 0.41 -2.00 0.00 0.00 174.74 174.35 2hji n GLY 99 N -0.03 2.94 3.12 -1.38 0.00 -1.26 -2.87 105.19 105.71 2hji n GLY 99 Ca -0.12 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.34 2hji n GLY 99 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2hji s GLU 100 N -1.44 0.52 0.00 1.61 -6.30 -1.26 -4.84 118.70 106.98 2hji s GLU 100 Ca 0.24 -0.46 0.00 0.00 -2.50 0.00 0.00 54.97 52.25 2hji s GLU 100 Cb 0.20 0.21 0.00 0.00 0.00 0.00 0.00 34.13 34.54 2hji s GLU 100 CO 0.05 -0.13 0.00 -0.40 0.02 0.00 0.00 175.26 174.80 2hji n ASP 101 N 1.29 -1.06 -3.60 -1.70 5.68 -1.26 -4.10 116.55 111.81 2hji n ASP 101 Ca -0.22 -0.39 -0.13 0.00 -0.50 0.00 0.00 54.79 53.55 2hji n ASP 101 Cb 0.56 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.49 2hji n ASP 101 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 2hji s GLU 102 N -2.75 1.02 0.00 0.11 -1.05 -0.78 -4.87 118.70 110.39 2hji s GLU 102 Ca 0.00 -0.35 0.00 0.00 -0.15 0.00 0.00 54.97 54.48 2hji s GLU 102 Cb 0.00 0.46 -0.00 0.00 -0.44 0.00 0.00 34.13 34.15 2hji s GLU 102 CO 0.00 -0.37 -0.02 0.08 0.95 0.00 0.00 175.26 175.90 2hji s VAL 103 N -2.70 0.11 -0.04 1.83 1.01 -0.19 -2.74 120.40 117.69 2hji s VAL 103 Ca -0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.82 2hji s VAL 103 Cb -0.00 -0.11 0.02 0.00 0.00 0.00 0.00 36.38 36.28 2hji s VAL 103 CO -0.04 0.01 0.10 -0.13 0.00 0.00 0.00 175.10 175.04 2hji s ARG 104 N -0.09 0.09 -0.18 2.72 0.52 -1.04 -0.32 118.95 120.64 2hji s ARG 104 Ca -0.00 0.20 -0.01 0.00 -0.52 0.00 0.00 55.73 55.40 2hji s ARG 104 Cb -0.01 -0.04 0.00 0.00 0.52 0.00 0.00 34.95 35.43 2hji s ARG 104 CO -0.00 -0.07 -0.14 0.12 0.02 0.00 0.00 175.30 175.23 2hji s PHE 105 N 0.44 2.83 -0.22 -0.53 5.36 -0.74 -3.26 117.98 121.86 2hji s PHE 105 Ca -0.03 -1.24 -0.18 0.00 -0.96 0.00 0.00 56.93 54.52 2hji s PHE 105 Cb -0.05 -1.96 -0.03 0.00 -0.34 0.00 0.00 43.02 40.64 2hji s PHE 105 CO -0.02 -0.62 0.48 -0.06 -1.46 0.00 0.00 175.22 173.54 2hji s PHE 106 N 1.19 3.35 -0.13 10.12 0.08 -1.26 -0.84 117.98 130.49 2hji s PHE 106 Ca 0.02 0.69 0.11 0.00 0.12 0.00 0.00 56.93 57.88 2hji s PHE 106 Cb -0.14 -2.64 -0.16 0.00 -0.57 0.00 0.00 43.02 39.51 2hji s PHE 106 CO -0.06 -0.12 0.04 1.33 -0.10 0.00 0.00 175.22 176.31 2hji n VAL 107 N 4.64 0.89 -2.98 -0.44 0.24 -1.24 -3.74 118.33 115.70 2hji n VAL 107 Ca -0.06 -0.54 -0.14 0.00 -2.04 0.00 0.00 64.34 61.56 2hji n VAL 107 Cb 0.50 -0.67 0.01 0.00 -1.47 0.00 0.00 33.84 32.22 2hji n VAL 107 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2hji n GLU 108 N -2.49 1.02 -3.65 7.34 -0.58 -1.24 -4.81 120.64 116.24 2hji n GLU 108 Ca -0.21 -2.97 -0.01 0.00 -0.42 0.00 0.00 57.16 53.54 2hji n GLU 108 Cb 0.92 -1.40 -0.07 0.00 -0.57 0.00 0.00 31.44 30.32 2hji n GLU 108 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2hji s GLY 109 N -2.23 0.37 -0.17 0.62 0.00 -1.16 0.14 107.32 104.89 2hji s GLY 109 Ca 0.33 3.52 -0.05 0.00 0.00 0.00 0.00 44.72 48.53 2hji s GLY 109 CO -0.06 2.39 -0.01 0.00 0.00 0.00 0.00 173.10 175.42 2hji s ALA 110 N 0.68 3.06 0.01 3.20 0.00 -1.26 -3.94 121.76 123.51 2hji s ALA 110 Ca -0.02 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.08 2hji s ALA 110 Cb -0.04 -1.67 -0.01 0.00 0.00 0.00 0.00 23.12 21.41 2hji s ALA 110 CO -0.12 0.09 -0.04 0.20 0.00 0.00 0.00 175.76 175.90 2hji s GLY 111 N 0.56 0.23 -0.18 0.00 0.00 -0.99 -4.72 107.32 102.23 2hji s GLY 111 Ca -0.02 -0.34 -0.19 0.00 0.00 0.00 0.00 44.72 44.18 2hji s GLY 111 CO 0.02 -0.35 0.52 -2.27 0.00 0.00 0.00 173.10 171.02 2hji s LEU 112 N -0.63 4.18 -0.32 0.66 2.96 0.92 -2.49 118.68 123.95 2hji s LEU 112 Ca -0.04 0.73 -0.08 0.00 -0.22 0.00 0.00 54.13 54.52 2hji s LEU 112 Cb -0.05 -2.73 0.02 0.00 0.50 0.00 0.00 46.19 43.94 2hji s LEU 112 CO -0.00 -0.14 0.12 0.12 -1.32 0.00 0.00 176.35 175.12 2hji s PHE 113 N 1.40 3.19 0.02 5.38 2.19 -0.91 -1.42 117.98 127.83 2hji s PHE 113 Ca 0.25 -1.01 0.09 0.00 0.33 0.00 0.00 56.93 56.58 2hji s PHE 113 Cb -0.15 -2.31 -0.02 0.00 -1.31 0.00 0.00 43.02 39.22 2hji s PHE 113 CO 0.10 -0.61 -0.25 0.00 1.83 0.00 0.00 175.22 176.29 2hji s LEU 115 N -0.97 2.13 -0.27 0.00 2.34 -1.18 -3.13 118.68 117.61 2hji s LEU 115 Ca 0.11 -0.48 -0.16 0.00 0.06 0.00 0.00 54.13 53.65 2hji s LEU 115 Cb -0.10 0.21 -0.03 0.00 -0.56 0.00 0.00 46.19 45.71 2hji s LEU 115 CO 0.01 -0.33 0.44 -2.28 -1.06 0.00 0.00 176.35 173.12 2hji s HIS 116 N -1.60 3.25 -0.31 3.48 2.46 -1.25 -2.96 115.29 118.37 2hji s HIS 116 Ca -0.14 0.51 0.03 0.00 0.47 0.00 0.00 55.06 55.93 2hji s HIS 116 Cb -0.09 -2.64 0.09 0.00 -0.13 0.00 0.00 32.58 29.81 2hji s HIS 116 CO -0.01 -0.25 -0.00 0.42 -2.47 0.00 0.00 174.74 172.42 2hji s ILE 117 N 2.17 2.18 0.00 0.89 1.01 -0.99 -4.74 121.20 121.72 2hji s ILE 117 Ca 0.18 -2.06 0.00 0.00 0.00 0.00 0.00 60.65 58.77 2hji s ILE 117 Cb -0.16 -2.50 0.00 0.00 0.01 0.00 0.00 42.46 39.81 2hji s ILE 117 CO 0.10 -0.41 0.00 0.61 0.00 0.00 0.00 174.94 175.24 2hji n GLY 118 N 4.34 2.08 0.93 6.18 0.00 -1.26 -2.52 105.19 114.94 2hji n GLY 118 Ca -0.02 -0.53 0.08 0.00 0.00 0.00 0.00 46.02 45.55 2hji n GLY 118 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2hji n ASP 119 N 2.81 2.70 -4.54 1.61 5.75 -1.26 -4.88 116.55 118.75 2hji n ASP 119 Ca 0.00 -1.98 -0.28 0.00 -0.01 0.00 0.00 54.79 52.52 2hji n ASP 119 Cb 0.00 -0.33 -0.10 0.00 -1.03 0.00 0.00 41.12 39.66 2hji n ASP 119 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2hji s GLU 120 N -1.35 1.96 -0.21 0.11 8.01 -1.05 -2.03 118.70 124.14 2hji s GLU 120 Ca 0.34 -1.22 -0.02 0.00 0.01 0.00 0.00 54.97 54.08 2hji s GLU 120 Cb 0.18 -2.15 0.01 0.00 -4.31 0.00 0.00 34.13 27.86 2hji s GLU 120 CO 0.24 0.46 -0.10 0.08 0.01 0.00 0.00 175.26 175.94 2hji s VAL 121 N -1.48 2.78 -0.01 2.63 1.01 -1.14 -2.35 120.40 121.83 2hji s VAL 121 Ca 0.22 -0.78 -0.15 0.00 0.00 0.00 0.00 61.98 61.27 2hji s VAL 121 Cb -0.10 -2.27 -0.06 0.00 0.00 0.00 0.00 36.38 33.96 2hji s VAL 121 CO 0.13 0.41 0.40 -0.36 0.00 0.00 0.00 175.10 175.69 2hji s PHE 122 N 1.37 3.71 -0.30 5.22 0.40 -1.15 -3.37 117.98 123.87 2hji s PHE 122 Ca 0.04 0.97 0.03 0.00 -0.60 0.00 0.00 56.93 57.37 2hji s PHE 122 Cb -0.14 -2.29 0.08 0.00 0.51 0.00 0.00 43.02 41.18 2hji s PHE 122 CO -0.07 0.62 -0.00 -1.14 0.70 0.00 0.00 175.22 175.33 2hji s GLN 123 N -0.98 1.58 -0.19 0.44 0.74 -0.26 -3.11 119.66 117.87 2hji s GLN 123 Ca 0.23 -1.48 -0.04 0.00 0.05 0.00 0.00 55.36 54.12 2hji s GLN 123 Cb -0.16 -2.86 -0.02 0.00 1.10 0.00 0.00 33.01 31.07 2hji s GLN 123 CO 0.13 -0.80 -0.03 0.08 -0.55 0.00 0.00 175.29 174.12 2hji s VAL 124 N 1.13 3.69 0.25 1.34 1.01 -1.01 -2.59 120.40 124.22 2hji s VAL 124 Ca 0.03 -0.40 -0.23 0.00 0.00 0.00 0.00 61.98 61.37 2hji s VAL 124 Cb -0.19 -2.66 -0.09 0.00 0.00 0.00 0.00 36.38 33.45 2hji s VAL 124 CO -0.09 0.44 0.82 -0.76 0.00 0.00 0.00 175.10 175.51 2hji s LEU 125 N 1.01 4.40 -0.06 3.92 1.02 -1.13 -2.14 118.68 125.70 2hji s LEU 125 Ca 0.01 1.64 0.04 0.00 0.02 0.00 0.00 54.13 55.83 2hji s LEU 125 Cb -0.15 -3.70 0.00 0.00 0.02 0.00 0.00 46.19 42.37 2hji s LEU 125 CO 0.01 0.03 -0.18 0.00 0.02 0.00 0.00 176.35 176.23 2hji s GLU 127 N 0.27 0.77 0.00 0.00 2.02 -1.26 -2.34 118.70 118.16 2hji s GLU 127 Ca -0.10 -1.31 0.00 0.00 0.02 0.00 0.00 54.97 53.57 2hji s GLU 127 Cb -0.14 0.23 0.00 0.00 0.10 0.00 0.00 34.13 34.32 2hji s GLU 127 CO 0.04 -0.19 0.33 0.36 0.02 0.00 0.00 175.26 175.82 2hji n LYS 128 N 0.01 0.00 0.14 1.61 2.85 -1.25 -2.18 118.16 119.35 2hji n LYS 128 Ca -0.10 0.00 -0.08 0.00 -1.05 0.00 0.00 58.31 57.08 2hji n LYS 128 Cb 0.62 -1.43 -0.04 0.00 -0.65 0.00 0.00 35.03 33.53 2hji n LYS 128 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 177.40 174.40 2hji h ASN 129 N 0.00 -0.38 0.00 -5.58 -1.07 -1.84 -3.40 115.58 103.31 2hji h ASN 129 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 56.30 56.31 2hji h ASN 129 Cb 0.00 0.10 0.00 0.00 -2.07 0.00 0.00 38.32 36.35 2hji h ASN 129 CO 0.00 0.09 0.00 0.47 0.07 0.00 0.00 177.43 178.06 2hji n ASP 130 N -5.07 0.00 -3.91 6.14 8.00 -0.93 -2.84 116.55 117.95 2hji n ASP 130 Ca -0.07 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.33 2hji n ASP 130 Cb 0.21 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.21 2hji n ASP 130 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2hji s LEU 131 N 0.00 1.73 -0.02 0.64 0.20 -0.60 -4.31 118.68 116.33 2hji s LEU 131 Ca 0.00 -0.39 0.02 0.00 0.69 0.00 0.00 54.13 54.45 2hji s LEU 131 Cb 0.00 0.59 0.00 0.00 -0.43 0.00 0.00 46.19 46.35 2hji s LEU 131 CO 0.00 -0.43 -0.08 -0.51 -0.29 0.00 0.00 176.35 175.04 2hji s ILE 132 N -1.97 0.66 -0.10 6.68 1.10 -1.20 -3.79 121.20 122.59 2hji s ILE 132 Ca -0.10 -0.32 -0.04 0.00 -0.51 0.00 0.00 60.65 59.68 2hji s ILE 132 Cb -0.05 -0.58 0.05 0.00 0.15 0.00 0.00 42.46 42.03 2hji s ILE 132 CO -0.02 0.20 0.18 -0.94 -2.11 0.00 0.00 174.94 172.26 2hji s SER 133 N 0.07 0.79 0.33 4.50 1.04 -1.13 -2.50 113.70 116.80 2hji s SER 133 Ca -0.01 0.30 0.08 0.00 0.48 0.00 0.00 55.95 56.80 2hji s SER 133 Cb -0.06 0.32 -0.03 0.00 0.10 0.00 0.00 66.02 66.35 2hji s SER 133 CO -0.00 -0.25 0.22 0.68 0.98 0.00 0.00 173.24 174.87 2hji s VAL 134 N 2.31 3.33 0.77 5.02 -7.23 -1.11 -2.19 120.40 121.31 2hji s VAL 134 Ca 0.03 -1.52 -0.10 0.00 -1.81 0.00 0.00 61.98 58.58 2hji s VAL 134 Cb -0.12 -3.10 0.17 0.00 0.56 0.00 0.00 36.38 33.89 2hji s VAL 134 CO -0.07 -0.18 1.05 -0.81 -0.31 0.00 0.00 175.10 174.78 2hji n PRO 135 N -1.26 -0.80 -2.32 4.82 -0.05 -1.26 -1.86 135.00 132.26 2hji n PRO 135 Ca -0.03 -1.90 -0.23 0.00 -0.05 0.00 0.00 63.50 61.29 2hji n PRO 135 Cb 0.60 -1.00 0.13 0.00 -0.05 0.00 0.00 33.50 33.18 2hji n PRO 135 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2hji n ALA 136 N -3.51 -0.16 -0.42 0.55 0.00 -1.26 -4.12 120.51 111.59 2hji n ALA 136 Ca -0.17 -1.81 0.00 0.00 0.00 0.00 0.00 53.44 51.46 2hji n ALA 136 Cb 0.49 0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.17 2hji n ALA 136 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2hji n HIS 137 N -2.99 0.00 -3.75 0.00 8.25 -1.14 -4.88 115.22 110.72 2hji n HIS 137 Ca 0.16 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.24 2hji n HIS 137 Cb 0.56 -1.40 -0.12 0.00 1.12 0.00 0.00 29.99 30.14 2hji n HIS 137 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2hji s THR 138 N -0.97 3.96 0.30 1.59 2.01 -1.26 -5.07 115.64 116.19 2hji s THR 138 Ca 0.00 -0.83 -0.29 0.00 0.31 0.00 0.00 61.69 60.88 2hji s THR 138 Cb 0.00 -3.11 -0.11 0.00 0.01 0.00 0.00 72.50 69.30 2hji s THR 138 CO 0.00 -0.01 1.47 -2.84 -0.69 0.00 0.00 174.62 172.54 2hji s PRO 139 N 1.48 4.21 0.00 4.92 0.02 -1.26 -4.88 135.00 139.49 2hji s PRO 139 Ca 0.01 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.45 2hji s PRO 139 Cb -0.18 -3.05 -0.00 0.00 0.02 0.00 0.00 34.50 31.29 2hji s PRO 139 CO 0.03 -0.46 -0.02 -3.38 -0.33 0.00 0.00 177.00 172.84 2hji s HIS 140 N -0.44 0.16 0.08 6.54 -3.43 -1.26 -3.84 115.29 113.10 2hji s HIS 140 Ca 0.57 -0.09 0.08 0.00 -0.80 0.00 0.00 55.06 54.82 2hji s HIS 140 Cb -0.44 -0.10 -0.03 0.00 -1.43 0.00 0.00 32.58 30.58 2hji s HIS 140 CO 0.50 -0.02 -0.22 1.67 -2.00 0.00 0.00 174.74 174.67 2hji s TRP 141 N -0.23 1.89 0.58 0.38 -2.14 -1.18 -4.15 118.94 114.09 2hji s TRP 141 Ca -0.02 -0.40 -0.05 0.00 2.66 0.00 0.00 56.10 58.29 2hji s TRP 141 Cb -0.02 -1.07 0.01 0.00 -3.10 0.00 0.00 33.47 29.29 2hji s TRP 141 CO -0.00 0.17 0.88 -0.06 -2.66 0.00 0.00 176.95 175.28 2hji s PHE 142 N -0.99 3.25 -0.29 1.66 0.40 -1.04 -3.67 117.98 117.31 2hji s PHE 142 Ca 0.08 0.62 0.01 0.00 -0.60 0.00 0.00 56.93 57.03 2hji s PHE 142 Cb -0.10 -2.70 0.19 0.00 0.51 0.00 0.00 43.02 40.92 2hji s PHE 142 CO 0.03 -0.79 0.57 0.34 0.70 0.00 0.00 175.22 176.08 2hji s ASP 143 N -4.30 -1.25 -1.13 1.36 2.15 -0.51 -4.51 116.67 108.47 2hji s ASP 143 Ca 0.53 0.59 -0.09 0.00 0.43 0.00 0.00 52.55 54.01 2hji s ASP 143 Cb -0.10 2.01 0.26 0.00 -0.30 0.00 0.00 42.92 44.79 2hji s ASP 143 CO 0.45 -0.28 1.21 0.23 -0.17 0.00 0.00 175.17 176.61 2hji n MET 144 N 5.42 3.60 -0.41 4.34 2.81 -1.26 0.31 117.12 131.93 2hji n MET 144 Ca 0.00 -4.36 0.34 0.00 -1.81 0.00 0.00 57.70 51.88 2hji n MET 144 Cb 0.52 -2.63 0.56 0.00 -0.71 0.00 0.00 33.22 30.96 2hji n MET 144 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2hji n GLY 145 N 2.78 -0.70 3.71 3.03 0.00 -1.26 -3.58 105.19 109.17 2hji n GLY 145 Ca 0.26 0.60 -0.36 0.00 0.00 0.00 0.00 46.02 46.52 2hji n GLY 145 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2hji s SER 146 N -4.26 6.35 0.17 1.61 0.15 -1.26 -4.97 113.70 111.49 2hji s SER 146 Ca -0.06 0.40 0.08 0.00 0.70 0.00 0.00 55.95 57.08 2hji s SER 146 Cb 0.24 -2.16 -0.02 0.00 -1.71 0.00 0.00 66.02 62.38 2hji s SER 146 CO 0.67 0.08 1.39 -0.08 1.20 0.00 0.00 173.24 176.50 2hji h GLU 147 N 6.90 0.00 -5.05 5.44 4.81 -1.98 -3.47 114.58 121.24 2hji h GLU 147 Ca -0.40 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.75 2hji h GLU 147 Cb 1.16 0.00 0.04 0.00 0.63 0.00 0.00 28.75 30.58 2hji h GLU 147 CO 0.74 0.86 -0.45 -2.30 -0.73 0.00 0.00 179.01 177.14 2hji n PRO 148 N -3.50 0.00 -2.35 0.92 -0.01 -1.26 -4.84 135.00 123.96 2hji n PRO 148 Ca -0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 63.50 63.08 2hji n PRO 148 Cb 0.83 -0.98 -0.03 0.00 -0.01 0.00 0.00 33.50 33.31 2hji n PRO 148 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 175.50 176.03 2hji s ASN 149 N -0.98 7.08 -0.05 2.55 2.20 -1.26 -4.83 114.94 119.65 2hji s ASN 149 Ca 0.06 2.38 -0.04 0.00 -0.94 0.00 0.00 52.86 54.32 2hji s ASN 149 Cb 0.02 -2.63 0.02 0.00 -2.00 0.00 0.00 41.25 36.66 2hji s ASN 149 CO 0.11 -0.31 0.14 0.72 -2.94 0.00 0.00 177.10 174.81 2hji s PHE 150 N -0.88 -0.15 -0.16 1.54 -0.71 -1.26 -4.84 117.98 111.52 2hji s PHE 150 Ca 0.48 0.39 -0.06 0.00 -1.04 0.00 0.00 56.93 56.70 2hji s PHE 150 Cb -0.34 0.02 -0.04 0.00 -1.21 0.00 0.00 43.02 41.45 2hji s PHE 150 CO 0.43 -0.10 0.03 0.99 -1.34 0.00 0.00 175.22 175.23 2hji s THR 151 N 0.35 4.49 0.08 -4.49 2.01 0.36 -3.86 115.64 114.59 2hji s THR 151 Ca -0.02 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 61.87 2hji s THR 151 Cb -0.04 -2.99 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 2hji s THR 151 CO -0.01 0.50 -0.10 0.00 -0.69 0.00 0.00 174.62 174.31 2hji s ALA 152 N 0.14 1.03 -0.19 7.40 0.00 -1.23 -2.96 121.76 125.95 2hji s ALA 152 Ca 0.03 -1.09 -0.04 0.00 0.00 0.00 0.00 51.96 50.86 2hji s ALA 152 Cb -0.13 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 2hji s ALA 152 CO 0.01 -0.00 -0.04 0.42 0.00 0.00 0.00 175.76 176.15 2hji s ILE 153 N -2.08 3.57 -0.22 0.00 -1.09 -0.02 -2.85 121.20 118.52 2hji s ILE 153 Ca 0.02 -0.45 -0.09 0.00 -2.23 0.00 0.00 60.65 57.91 2hji s ILE 153 Cb -0.05 -2.60 -0.04 0.00 -1.58 0.00 0.00 42.46 38.19 2hji s ILE 153 CO 0.00 0.45 0.10 -0.60 -1.23 0.00 0.00 174.94 173.66 2hji s ARG 154 N 1.03 3.95 -0.04 2.79 3.52 -0.57 -1.80 118.95 127.82 2hji s ARG 154 Ca 0.01 -0.34 -0.02 0.00 -0.13 0.00 0.00 55.73 55.25 2hji s ARG 154 Cb -0.15 -3.36 0.03 0.00 -1.56 0.00 0.00 34.95 29.91 2hji s ARG 154 CO 0.00 0.10 0.06 0.42 -0.81 0.00 0.00 175.30 175.07 2hji s ILE 155 N 0.88 -0.09 0.00 4.11 1.01 0.56 -2.94 121.20 124.72 2hji s ILE 155 Ca 0.05 0.41 0.00 0.00 0.00 0.00 0.00 60.65 61.11 2hji s ILE 155 Cb -0.13 -0.16 0.00 0.00 0.01 0.00 0.00 42.46 42.18 2hji s ILE 155 CO 0.03 0.18 0.00 2.22 0.00 0.00 0.00 174.94 177.37