#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhq s HIS 2 N 0.00 3.06 -0.25 1.12 3.76 -0.02 -4.31 115.29 118.65 1yhq s HIS 2 Ca 0.00 -0.04 -0.07 0.00 -0.15 0.00 0.00 55.06 54.80 1yhq s HIS 2 Cb 0.00 -1.49 -0.03 0.00 1.11 0.00 0.00 32.58 32.17 1yhq s HIS 2 CO 0.00 0.52 0.07 0.00 -0.85 0.00 0.00 174.74 174.48 1yhq s ALA 3 N -1.66 3.18 -0.22 -1.40 0.00 0.85 -0.57 121.76 121.93 1yhq s ALA 3 Ca 0.29 -1.12 -0.08 0.00 0.00 0.00 0.00 51.96 51.06 1yhq s ALA 3 Cb -0.10 -2.08 -0.04 0.00 0.00 0.00 0.00 23.12 20.90 1yhq s ALA 3 CO 0.21 -0.47 0.09 -0.51 0.00 0.00 0.00 175.76 175.08 1yhq s LEU 4 N 1.58 3.72 -0.12 0.00 1.43 0.53 -2.93 118.68 122.89 1yhq s LEU 4 Ca 0.06 -0.03 -0.00 0.00 -1.03 0.00 0.00 54.13 53.13 1yhq s LEU 4 Cb -0.15 -1.98 0.02 0.00 0.03 0.00 0.00 46.19 44.12 1yhq s LEU 4 CO 0.04 0.07 -0.09 -0.69 0.23 0.00 0.00 176.35 175.90 1yhq s VAL 5 N 1.03 1.12 -0.05 -1.59 1.01 -0.42 -0.59 120.40 120.91 1yhq s VAL 5 Ca 0.05 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1yhq s VAL 5 Cb -0.14 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 1yhq s VAL 5 CO 0.03 0.38 1.25 -1.58 0.00 0.00 0.00 175.10 175.18 1yhq s GLN 6 N 1.64 4.33 -0.00 2.72 0.74 -1.02 -1.34 119.66 126.72 1yhq s GLN 6 Ca 0.04 1.73 0.06 0.00 0.05 0.00 0.00 55.36 57.24 1yhq s GLN 6 Cb -0.13 -3.57 -0.06 0.00 1.10 0.00 0.00 33.01 30.35 1yhq s GLN 6 CO -0.08 -0.49 0.24 1.28 -0.55 0.00 0.00 175.29 175.69 1yhq n LEU 7 N 5.32 0.26 -4.15 3.68 4.77 -0.75 -0.12 117.00 126.00 1yhq n LEU 7 Ca 0.12 -0.49 -0.29 0.00 -0.03 0.00 0.00 56.01 55.31 1yhq n LEU 7 Cb 0.46 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.38 1yhq n LEU 7 CO 0.56 0.07 -0.52 -0.13 -1.33 0.00 0.00 177.39 176.03 1yhq s ARG 8 N -1.54 2.39 1.20 3.23 0.52 -1.11 -4.93 118.95 118.71 1yhq s ARG 8 Ca 0.02 -0.69 -0.13 0.00 -0.52 0.00 0.00 55.73 54.40 1yhq s ARG 8 Cb 0.04 -1.89 0.30 0.00 0.52 0.00 0.00 34.95 33.92 1yhq s ARG 8 CO 0.23 0.16 1.02 0.20 0.02 0.00 0.00 175.30 176.92 1yhq s GLY 9 N 0.35 1.53 0.29 -3.53 0.00 -1.26 -4.92 107.32 99.78 1yhq s GLY 9 Ca -0.14 -0.20 0.13 0.00 0.00 0.00 0.00 44.72 44.51 1yhq s GLY 9 CO 0.06 0.55 1.61 1.05 0.00 0.00 0.00 173.10 176.37 1yhq h GLU 10 N -2.73 0.00 -6.40 2.90 4.11 -1.98 -3.43 114.58 107.06 1yhq h GLU 10 Ca -0.62 0.00 -0.56 0.00 0.07 0.00 0.00 59.36 58.24 1yhq h GLU 10 Cb 1.34 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.62 1yhq h GLU 10 CO 0.50 0.56 1.09 0.28 0.07 0.00 0.00 179.01 181.52 1yhq n VAL 11 N -3.61 0.47 -0.89 -1.06 0.31 -1.26 -1.38 118.33 110.92 1yhq n VAL 11 Ca -0.00 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1yhq n VAL 11 Cb 0.62 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.54 1yhq n VAL 11 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1yhq n ASN 12 N 6.08 0.00 -4.80 4.52 3.02 -1.26 -5.02 115.26 117.79 1yhq n ASN 12 Ca 0.20 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.38 1yhq n ASN 12 Cb 0.35 -0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 39.07 1yhq n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yhq s MET 13 N -0.15 4.37 0.33 3.52 0.23 -0.48 -4.98 119.30 122.14 1yhq s MET 13 Ca 0.00 0.99 -0.26 0.00 -1.03 0.00 0.00 55.69 55.39 1yhq s MET 13 Cb 0.00 -2.96 -0.13 0.00 -1.53 0.00 0.00 34.83 30.20 1yhq s MET 13 CO 0.00 0.43 0.92 0.72 -2.03 0.00 0.00 175.02 175.05 1yhq n HIS 14 N 0.92 0.92 -0.26 3.16 8.25 -1.26 -4.77 115.22 122.18 1yhq n HIS 14 Ca -0.03 0.68 -0.07 0.00 -0.26 0.00 0.00 57.72 58.04 1yhq n HIS 14 Cb 0.50 -2.19 0.05 0.00 1.12 0.00 0.00 29.99 29.47 1yhq n HIS 14 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1yhq h THR 15 N 1.68 1.26 0.00 1.59 2.02 -1.97 -1.22 112.91 116.27 1yhq h THR 15 Ca -0.40 -0.91 -0.02 0.00 0.77 0.00 0.00 66.41 65.85 1yhq h THR 15 Cb 1.35 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 1yhq h THR 15 CO 0.58 0.35 -0.08 -2.24 0.37 0.00 0.00 175.52 174.50 1yhq h ASP 16 N 1.06 0.00 0.53 4.18 2.03 -1.99 0.69 116.42 122.92 1yhq h ASP 16 Ca 0.23 0.00 -0.29 0.00 -0.73 0.00 0.00 57.03 56.24 1yhq h ASP 16 Cb 0.32 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.82 1yhq h ASP 16 CO -0.01 0.08 -1.37 0.40 -1.03 0.00 0.00 179.24 177.32 1yhq h ILE 17 N 0.00 1.36 -0.21 4.15 2.04 -1.76 -2.93 117.51 120.16 1yhq h ILE 17 Ca -0.00 -2.94 -0.17 0.00 1.00 0.00 0.00 64.86 62.75 1yhq h ILE 17 Cb 0.39 2.89 -0.00 0.00 -0.74 0.00 0.00 36.82 39.35 1yhq h ILE 17 CO 0.01 0.86 -0.56 -0.61 0.00 0.00 0.00 178.15 177.85 1yhq h GLN 18 N 0.08 0.65 -0.21 2.37 4.15 -0.36 -2.71 115.11 119.08 1yhq h GLN 18 Ca -0.18 -0.42 -0.08 0.00 0.77 0.00 0.00 58.65 58.74 1yhq h GLN 18 Cb 2.01 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 29.74 1yhq h GLN 18 CO 0.20 1.04 -0.21 -0.44 -1.93 0.00 0.00 178.83 177.48 1yhq h ASP 19 N 0.49 0.37 -0.19 -0.69 3.32 -0.99 -2.06 116.42 116.67 1yhq h ASP 19 Ca 0.01 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 1yhq h ASP 19 Cb 1.13 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 1yhq h ASP 19 CO 0.11 0.60 0.05 0.74 -1.72 0.00 0.00 179.24 179.02 1yhq h THR 20 N 0.34 1.20 -0.62 0.35 2.02 -1.31 -0.89 112.91 114.00 1yhq h THR 20 Ca 0.06 -0.63 0.02 0.00 0.77 0.00 0.00 66.41 66.63 1yhq h THR 20 Cb 0.57 1.25 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 1yhq h THR 20 CO 0.04 0.20 0.41 -0.07 0.37 0.00 0.00 175.52 176.47 1yhq h LEU 21 N 0.13 0.68 -0.89 2.58 3.38 -1.22 -1.04 115.31 118.93 1yhq h LEU 21 Ca 0.06 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1yhq h LEU 21 Cb 0.25 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1yhq h LEU 21 CO -0.00 0.49 -0.47 -0.33 0.09 0.00 0.00 178.44 178.22 1yhq h GLU 22 N 0.80 0.20 0.00 1.13 5.08 -0.98 -0.39 114.58 120.42 1yhq h GLU 22 Ca 0.24 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 1yhq h GLU 22 Cb -0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1yhq h GLU 22 CO -0.06 0.63 -0.24 0.52 -1.00 0.00 0.00 179.01 178.87 1yhq h MET 23 N 0.16 0.00 -0.72 2.33 2.86 0.06 -1.48 114.93 118.15 1yhq h MET 23 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1yhq h MET 23 Cb 0.89 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1yhq h MET 23 CO 0.07 0.24 0.00 1.28 1.06 0.00 0.00 176.91 179.56 1yhq n LEU 24 N -3.41 3.79 -0.62 1.22 4.77 -0.65 -4.91 117.00 117.19 1yhq n LEU 24 Ca 0.00 -1.92 -0.08 0.00 -0.03 0.00 0.00 56.01 53.98 1yhq n LEU 24 Cb 0.43 -0.59 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 1yhq n LEU 24 CO 0.34 0.49 -0.08 0.59 -1.33 0.00 0.00 177.39 177.40 1yhq n ASN 25 N 0.43 -5.38 -4.59 -1.43 3.02 -0.56 -4.86 115.26 101.90 1yhq n ASN 25 Ca 0.17 0.20 -0.36 0.00 -0.03 0.00 0.00 54.58 54.56 1yhq n ASN 25 Cb 0.80 -3.59 -0.11 0.00 -0.61 0.00 0.00 39.78 36.27 1yhq n ASN 25 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1yhq s ILE 26 N -1.83 4.89 0.00 2.41 -4.36 -0.23 -4.74 121.20 117.34 1yhq s ILE 26 Ca 0.00 0.02 0.00 0.00 -0.26 0.00 0.00 60.65 60.41 1yhq s ILE 26 Cb 0.00 -3.27 0.00 0.00 1.25 0.00 0.00 42.46 40.44 1yhq s ILE 26 CO 0.00 0.37 0.59 1.41 0.24 0.00 0.00 174.94 177.55 1yhq n HIS 27 N 4.30 0.00 -3.91 1.37 8.25 -1.26 -3.52 115.22 120.44 1yhq n HIS 27 Ca -0.16 -0.14 -0.09 0.00 -0.26 0.00 0.00 57.72 57.08 1yhq n HIS 27 Cb 0.52 -0.01 -0.07 0.00 1.12 0.00 0.00 29.99 31.54 1yhq n HIS 27 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1yhq s HIS 28 N -0.27 0.28 0.36 4.41 3.76 -1.26 -5.08 115.29 117.49 1yhq s HIS 28 Ca 0.00 -0.69 -0.27 0.00 -0.15 0.00 0.00 55.06 53.95 1yhq s HIS 28 Cb 0.00 -0.10 -0.09 0.00 1.11 0.00 0.00 32.58 33.50 1yhq s HIS 28 CO 0.00 -0.59 1.22 0.08 -0.85 0.00 0.00 174.74 174.60 1yhq s VAL 29 N -3.91 3.00 0.00 -0.90 1.01 -1.26 -2.60 120.40 115.75 1yhq s VAL 29 Ca 0.10 0.92 0.00 0.00 0.00 0.00 0.00 61.98 63.00 1yhq s VAL 29 Cb 0.05 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1yhq s VAL 29 CO -0.07 0.15 0.00 0.59 0.00 0.00 0.00 175.10 175.77 1yhq n ASN 30 N 0.44 -0.84 -4.75 3.32 3.02 0.83 -4.97 115.26 112.31 1yhq n ASN 30 Ca 0.02 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.17 1yhq n ASN 30 Cb 0.45 -0.53 -0.05 0.00 -0.61 0.00 0.00 39.78 39.03 1yhq n ASN 30 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1yhq s HIS 31 N -3.12 3.75 0.19 3.10 3.76 -1.07 -2.48 115.29 119.41 1yhq s HIS 31 Ca 0.00 1.47 0.09 0.00 -0.15 0.00 0.00 55.06 56.47 1yhq s HIS 31 Cb 0.00 -2.80 -0.04 0.00 1.11 0.00 0.00 32.58 30.85 1yhq s HIS 31 CO 0.00 0.30 -0.08 0.00 -0.85 0.00 0.00 174.74 174.11 1yhq s THR 33 N -1.75 0.15 -0.20 0.00 -1.32 0.24 0.10 115.64 112.86 1yhq s THR 33 Ca 0.26 -1.27 -0.04 0.00 -1.21 0.00 0.00 61.69 59.42 1yhq s THR 33 Cb -0.09 -1.38 -0.02 0.00 -1.51 0.00 0.00 72.50 69.51 1yhq s THR 33 CO 0.16 -0.69 -0.02 -0.76 -2.21 0.00 0.00 174.62 171.10 1yhq s LEU 34 N -2.87 3.15 -0.07 9.08 1.43 -1.26 -0.35 118.68 127.79 1yhq s LEU 34 Ca 0.06 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 52.94 1yhq s LEU 34 Cb 0.05 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.49 1yhq s LEU 34 CO -0.11 0.06 -0.16 0.54 0.23 0.00 0.00 176.35 176.91 1yhq s VAL 35 N 1.01 1.43 0.64 -1.59 0.11 0.26 -4.97 120.40 117.29 1yhq s VAL 35 Ca 0.01 -0.67 -0.17 0.00 -2.93 0.00 0.00 61.98 58.22 1yhq s VAL 35 Cb -0.14 -1.27 -0.01 0.00 -1.53 0.00 0.00 36.38 33.43 1yhq s VAL 35 CO 0.01 0.42 1.21 -2.84 -3.33 0.00 0.00 175.10 170.57 1yhq s PRO 36 N 0.45 2.73 -1.01 1.54 0.02 -1.26 -0.84 135.00 136.63 1yhq s PRO 36 Ca -0.14 1.79 -0.15 0.00 0.02 0.00 0.00 61.00 62.53 1yhq s PRO 36 Cb -0.15 -1.90 0.18 0.00 0.02 0.00 0.00 34.50 32.65 1yhq s PRO 36 CO 0.05 -1.39 1.12 -1.21 -0.33 0.00 0.00 177.00 175.24 1yhq s GLU 37 N -3.54 3.82 0.41 5.54 2.02 -1.26 -4.74 118.70 120.95 1yhq s GLU 37 Ca 0.76 -2.36 0.07 0.00 0.02 0.00 0.00 54.97 53.46 1yhq s GLU 37 Cb -0.30 -4.79 -0.07 0.00 0.10 0.00 0.00 34.13 29.08 1yhq s GLU 37 CO 0.37 -1.58 0.06 0.99 0.02 0.00 0.00 175.26 175.13 1yhq s THR 38 N 1.20 2.13 0.18 3.63 2.01 -1.26 -4.99 115.64 118.54 1yhq s THR 38 Ca 0.32 -1.90 -0.09 0.00 0.31 0.00 0.00 61.69 60.32 1yhq s THR 38 Cb -0.06 -2.98 0.06 0.00 0.01 0.00 0.00 72.50 69.53 1yhq s THR 38 CO -0.07 -0.01 1.63 0.44 -0.69 0.00 0.00 174.62 175.92 1yhq h ASP 39 N 1.66 1.05 -0.03 3.53 3.32 -1.98 0.14 116.42 124.11 1yhq h ASP 39 Ca -0.43 -0.31 -0.00 0.00 0.02 0.00 0.00 57.03 56.30 1yhq h ASP 39 Cb 1.24 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 40.51 1yhq h ASP 39 CO 0.76 1.11 0.02 0.00 -1.72 0.00 0.00 179.24 179.41 1yhq h ALA 40 N 0.98 0.03 -0.01 3.45 0.00 -1.97 -2.57 119.26 119.18 1yhq h ALA 40 Ca 0.17 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 1yhq h ALA 40 Cb 0.58 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1yhq h ALA 40 CO 0.03 -0.44 -0.50 1.88 0.00 0.00 0.00 179.25 180.22 1yhq h TYR 41 N -0.02 0.02 -0.76 0.00 -1.99 -1.83 -3.12 116.97 109.28 1yhq h TYR 41 Ca 0.01 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1yhq h TYR 41 Cb 0.06 -0.01 -0.04 0.00 2.00 0.00 0.00 36.73 38.75 1yhq h TYR 41 CO -0.06 0.52 0.48 -0.09 -0.00 0.00 0.00 178.16 179.01 1yhq h ARG 42 N 0.02 1.01 -0.50 4.88 2.43 -0.41 -2.14 114.38 119.66 1yhq h ARG 42 Ca -0.00 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 1yhq h ARG 42 Cb 0.90 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.21 1yhq h ARG 42 CO 0.07 0.70 0.19 0.78 -1.51 0.00 0.00 179.97 180.19 1yhq h GLY 43 N 1.03 0.81 0.79 2.80 0.00 -1.41 -2.05 103.07 105.05 1yhq h GLY 43 Ca 0.27 -0.45 0.03 0.00 0.00 0.00 0.00 47.33 47.18 1yhq h GLY 43 CO -0.05 0.43 0.10 -0.33 0.00 0.00 0.00 176.54 176.68 1yhq h MET 44 N 0.67 0.21 -0.18 4.80 2.86 -1.44 -1.28 114.93 120.57 1yhq h MET 44 Ca 0.17 -0.01 -0.09 0.00 -2.06 0.00 0.00 59.70 57.70 1yhq h MET 44 Cb 0.22 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 1yhq h MET 44 CO -0.01 0.14 -0.28 -0.39 1.06 0.00 0.00 176.91 177.43 1yhq h VAL 45 N 0.22 1.26 -0.44 -2.22 -1.51 -1.33 -2.27 116.25 109.96 1yhq h VAL 45 Ca 0.12 -1.24 -0.05 0.00 -1.23 0.00 0.00 66.70 64.29 1yhq h VAL 45 Cb 0.08 1.43 -0.02 0.00 -2.13 0.00 0.00 31.29 30.65 1yhq h VAL 45 CO -0.11 0.38 0.07 0.00 -1.23 0.00 0.00 177.57 176.68 1yhq h ALA 46 N 1.41 1.30 -0.03 5.19 0.00 -0.83 0.15 119.26 126.45 1yhq h ALA 46 Ca 0.04 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 1yhq h ALA 46 Cb 0.65 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1yhq h ALA 46 CO 0.05 0.49 -0.58 -0.22 0.00 0.00 0.00 179.25 178.99 1yhq h LYS 47 N 0.66 0.09 -0.02 0.00 3.64 -0.70 -3.03 116.57 117.21 1yhq h LYS 47 Ca 0.14 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1yhq h LYS 47 Cb 0.30 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 1yhq h LYS 47 CO 0.00 0.65 -0.19 0.28 -2.27 0.00 0.00 179.45 177.92 1yhq n VAL 48 N -3.87 0.00 -0.67 2.00 0.31 -0.92 -4.61 118.33 110.57 1yhq n VAL 48 Ca -0.02 -0.30 0.51 0.00 -0.01 0.00 0.00 64.34 64.52 1yhq n VAL 48 Cb 0.59 0.97 0.78 0.00 -0.91 0.00 0.00 33.84 35.27 1yhq n VAL 48 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1yhq n ASN 49 N 0.29 0.00 -0.39 4.52 2.85 0.49 -0.79 115.26 122.22 1yhq n ASN 49 Ca 0.13 0.95 0.13 0.00 -0.11 0.00 0.00 54.58 55.68 1yhq n ASN 49 Cb 0.46 -0.47 0.28 0.00 1.24 0.00 0.00 39.78 41.29 1yhq n ASN 49 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1yhq n ASP 50 N -3.82 1.48 -0.08 1.20 8.00 -1.26 -2.85 116.55 119.22 1yhq n ASP 50 Ca 0.42 -1.21 0.04 0.00 0.71 0.00 0.00 54.79 54.75 1yhq n ASP 50 Cb 1.93 0.19 0.05 0.00 -0.02 0.00 0.00 41.12 43.27 1yhq n ASP 50 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1yhq n PHE 51 N -0.24 0.00 -4.22 1.24 3.01 0.03 -4.91 117.46 112.37 1yhq n PHE 51 Ca 0.13 -0.57 -0.15 0.00 1.01 0.00 0.00 57.45 57.86 1yhq n PHE 51 Cb 0.40 -0.08 -0.09 0.00 -0.01 0.00 0.00 39.48 39.70 1yhq n PHE 51 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1yhq s VAL 52 N -1.47 0.00 -0.06 -4.37 0.11 -1.18 -1.82 120.40 111.62 1yhq s VAL 52 Ca 0.12 -1.96 0.02 0.00 -2.93 0.00 0.00 61.98 57.22 1yhq s VAL 52 Cb 0.10 -2.50 0.02 0.00 -1.53 0.00 0.00 36.38 32.47 1yhq s VAL 52 CO 0.01 0.00 -0.10 0.00 -3.33 0.00 0.00 175.10 171.69 1yhq s ALA 53 N -3.83 1.07 0.08 1.54 0.00 -0.45 -0.80 121.76 119.37 1yhq s ALA 53 Ca 0.39 -0.30 -0.12 0.00 0.00 0.00 0.00 51.96 51.93 1yhq s ALA 53 Cb 0.05 -0.53 0.01 0.00 0.00 0.00 0.00 23.12 22.65 1yhq s ALA 53 CO 0.18 0.05 0.27 -0.59 0.00 0.00 0.00 175.76 175.68 1yhq s PHE 54 N 0.78 -0.01 0.00 0.00 -0.12 -1.05 -1.30 117.98 116.28 1yhq s PHE 54 Ca -0.13 -0.30 0.00 0.00 -0.05 0.00 0.00 56.93 56.45 1yhq s PHE 54 Cb -0.15 0.06 0.00 0.00 -0.63 0.00 0.00 43.02 42.30 1yhq s PHE 54 CO 0.02 -0.57 0.00 0.41 -0.05 0.00 0.00 175.22 175.04 1yhq n GLY 55 N 0.11 0.65 3.62 1.99 0.00 -1.15 0.12 105.19 110.52 1yhq n GLY 55 Ca -0.16 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 1yhq n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yhq s GLU 56 N -2.00 4.05 0.67 1.61 2.12 -1.26 -0.11 118.70 123.78 1yhq s GLU 56 Ca 0.00 0.66 -0.10 0.00 0.36 0.00 0.00 54.97 55.89 1yhq s GLU 56 Cb 0.00 -3.69 0.01 0.00 0.26 0.00 0.00 34.13 30.71 1yhq s GLU 56 CO 0.00 -0.58 1.04 -1.25 -0.54 0.00 0.00 175.26 173.93 1yhq s PRO 57 N 2.82 2.96 0.48 4.30 0.04 -1.26 -4.31 135.00 140.03 1yhq s PRO 57 Ca 0.31 0.37 -0.12 0.00 0.04 0.00 0.00 61.00 61.61 1yhq s PRO 57 Cb -0.15 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 32.24 1yhq s PRO 57 CO 0.10 -0.89 0.88 -1.54 0.04 0.00 0.00 177.00 175.59 1yhq s SER 58 N -4.32 6.47 0.19 6.66 1.04 -1.26 -4.89 113.70 117.59 1yhq s SER 58 Ca 0.57 1.29 -0.14 0.00 0.48 0.00 0.00 55.95 58.14 1yhq s SER 58 Cb -0.11 -2.39 0.20 0.00 0.10 0.00 0.00 66.02 63.82 1yhq s SER 58 CO 0.50 -0.56 1.65 -0.61 0.98 0.00 0.00 173.24 175.21 1yhq h GLN 59 N 0.76 0.03 0.33 4.02 5.75 -1.97 -0.98 115.11 123.05 1yhq h GLN 59 Ca -0.46 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.02 1yhq h GLN 59 Cb 1.19 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.73 1yhq h GLN 59 CO 0.62 0.02 -0.20 0.93 -2.65 0.00 0.00 178.83 177.56 1yhq h GLU 60 N 0.03 -0.48 -0.28 1.69 5.08 -1.99 -1.64 114.58 117.00 1yhq h GLU 60 Ca 0.27 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.72 1yhq h GLU 60 Cb 0.41 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.72 1yhq h GLU 60 CO -0.53 -0.32 -0.09 1.15 -1.00 0.00 0.00 179.01 178.22 1yhq h THR 61 N -0.50 0.67 -0.97 1.13 2.02 -1.85 0.18 112.91 113.59 1yhq h THR 61 Ca -0.04 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.25 1yhq h THR 61 Cb 0.41 0.67 -0.08 0.00 -1.74 0.00 0.00 68.15 67.42 1yhq h THR 61 CO 0.04 0.00 0.62 0.25 0.37 0.00 0.00 175.52 176.80 1yhq h LEU 62 N -0.03 0.89 -0.60 2.58 5.85 -1.08 -0.43 115.31 122.50 1yhq h LEU 62 Ca 0.14 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.81 1yhq h LEU 62 Cb 0.24 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1yhq h LEU 62 CO -0.30 0.50 0.04 -0.33 -0.34 0.00 0.00 178.44 178.00 1yhq h GLU 63 N 0.97 1.03 -0.06 1.25 5.08 -0.01 0.89 114.58 123.74 1yhq h GLU 63 Ca 0.46 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1yhq h GLU 63 Cb 0.43 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1yhq h GLU 63 CO -0.22 1.00 0.02 1.15 -1.00 0.00 0.00 179.01 179.96 1yhq h THR 64 N 0.93 1.13 -0.64 1.13 2.02 0.73 -1.58 112.91 116.63 1yhq h THR 64 Ca 0.17 -0.39 -0.06 0.00 0.77 0.00 0.00 66.41 66.90 1yhq h THR 64 Cb 0.51 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 1yhq h THR 64 CO 0.02 0.11 0.16 0.58 0.37 0.00 0.00 175.52 176.76 1yhq h VAL 65 N -0.06 1.25 -0.38 3.16 2.07 -1.05 -0.52 116.25 120.72 1yhq h VAL 65 Ca 0.02 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 1yhq h VAL 65 Cb 0.16 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1yhq h VAL 65 CO -0.00 0.35 0.22 -0.07 0.02 0.00 0.00 177.57 178.09 1yhq h LEU 66 N 0.94 0.47 0.17 2.57 3.38 -0.74 0.86 115.31 122.96 1yhq h LEU 66 Ca 0.20 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1yhq h LEU 66 Cb 0.36 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1yhq h LEU 66 CO 0.00 0.40 -0.08 0.00 0.09 0.00 0.00 178.44 178.85 1yhq h ALA 67 N 1.09 -0.23 -0.21 1.53 0.00 -1.11 -1.26 119.26 119.07 1yhq h ALA 67 Ca 0.14 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 1yhq h ALA 67 Cb 0.03 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1yhq h ALA 67 CO -0.02 -0.57 -0.57 0.00 0.00 0.00 0.00 179.25 178.09 1yhq h THR 68 N -0.34 1.31 0.00 0.00 1.03 -0.91 -3.40 112.91 110.60 1yhq h THR 68 Ca -0.02 -1.80 0.00 0.00 -0.01 0.00 0.00 66.41 64.58 1yhq h THR 68 Cb 0.27 1.75 0.00 0.00 -1.07 0.00 0.00 68.15 69.10 1yhq h THR 68 CO 0.04 0.57 0.00 0.54 -0.01 0.00 0.00 175.52 176.66 1yhq n ARG 69 N -3.97 1.07 -2.35 0.00 5.12 0.30 -5.05 116.66 111.77 1yhq n ARG 69 Ca -0.04 -0.95 -0.33 0.00 -1.93 0.00 0.00 57.85 54.61 1yhq n ARG 69 Cb 0.62 -0.92 -0.02 0.00 -1.16 0.00 0.00 32.46 30.98 1yhq n ARG 69 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1yhq s ALA 70 N -0.48 2.91 0.05 7.54 0.00 -0.47 -4.09 121.76 127.22 1yhq s ALA 70 Ca 0.00 0.36 -0.03 0.00 0.00 0.00 0.00 51.96 52.29 1yhq s ALA 70 Cb 0.00 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.91 1yhq s ALA 70 CO 0.00 -0.41 0.03 -1.21 0.00 0.00 0.00 175.76 174.18 1yhq s GLU 71 N -3.80 0.58 0.87 0.00 2.02 -1.26 -4.31 118.70 112.80 1yhq s GLU 71 Ca 0.63 -0.95 -0.11 0.00 0.02 0.00 0.00 54.97 54.55 1yhq s GLU 71 Cb -0.13 0.22 0.11 0.00 0.10 0.00 0.00 34.13 34.43 1yhq s GLU 71 CO 0.29 -0.13 1.09 -2.14 0.02 0.00 0.00 175.26 174.39 1yhq s PRO 72 N -3.13 1.48 0.50 0.39 0.02 -1.26 -0.41 135.00 132.60 1yhq s PRO 72 Ca -0.00 0.80 0.18 0.00 0.02 0.00 0.00 61.00 62.00 1yhq s PRO 72 Cb 0.02 -1.84 1.24 0.00 0.02 0.00 0.00 34.50 33.95 1yhq s PRO 72 CO -0.07 -2.08 2.07 1.25 -0.33 0.00 0.00 177.00 177.84 1yhq h LEU 73 N -1.43 0.09 -7.55 -5.54 5.85 -1.57 -3.30 115.31 101.86 1yhq h LEU 73 Ca -0.49 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.05 1yhq h LEU 73 Cb 1.28 -0.02 -0.27 0.00 0.37 0.00 0.00 40.66 42.02 1yhq h LEU 73 CO 0.55 0.06 -0.52 -1.61 -0.34 0.00 0.00 178.44 176.58 1yhq s GLU 74 N -5.13 0.19 0.00 1.25 2.02 -1.26 -4.82 118.70 110.95 1yhq s GLU 74 Ca -0.06 0.25 0.00 0.00 0.02 0.00 0.00 54.97 55.18 1yhq s GLU 74 Cb 0.18 0.08 0.00 0.00 0.10 0.00 0.00 34.13 34.49 1yhq s GLU 74 CO 0.71 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 176.36 1yhq n GLY 75 N 3.07 1.03 0.14 -1.39 0.00 -1.26 -4.83 105.19 101.95 1yhq n GLY 75 Ca -0.13 -1.96 -0.23 0.00 0.00 0.00 0.00 46.02 43.70 1yhq n GLY 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1yhq h ASP 76 N 0.00 0.78 0.00 1.61 3.32 -2.01 -3.39 116.42 116.73 1yhq h ASP 76 Ca 0.00 -0.81 0.00 0.00 0.02 0.00 0.00 57.03 56.24 1yhq h ASP 76 Cb 0.00 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.30 1yhq h ASP 76 CO 0.00 1.63 0.00 0.00 -1.72 0.00 0.00 179.24 179.15 1yhq n ALA 77 N -2.68 -0.09 -1.76 3.45 0.00 -1.26 -4.84 120.51 113.33 1yhq n ALA 77 Ca -0.15 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.92 1yhq n ALA 77 Cb 1.08 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.54 1yhq n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yhq s ASP 78 N 0.00 5.77 -0.81 0.00 -0.00 -1.26 -4.40 116.67 115.97 1yhq s ASP 78 Ca 0.00 2.43 -0.06 0.00 -0.00 0.00 0.00 52.55 54.92 1yhq s ASP 78 Cb 0.00 -2.61 0.21 0.00 -0.00 0.00 0.00 42.92 40.52 1yhq s ASP 78 CO 0.00 -1.20 0.69 -0.69 -0.00 0.00 0.00 175.17 173.97 1yhq s VAL 79 N -1.50 4.67 0.55 -1.27 1.01 -1.26 -4.78 120.40 117.82 1yhq s VAL 79 Ca 0.68 -3.11 0.05 0.00 0.00 0.00 0.00 61.98 59.60 1yhq s VAL 79 Cb -0.32 -3.92 0.05 0.00 0.00 0.00 0.00 36.38 32.19 1yhq s VAL 79 CO 0.37 -1.01 0.40 -0.90 0.00 0.00 0.00 175.10 173.97 1yhq n ASP 80 N 3.24 2.78 -0.14 3.32 5.68 -1.26 -4.43 116.55 125.74 1yhq n ASP 80 Ca 0.15 -2.91 -0.03 0.00 -0.50 0.00 0.00 54.79 51.50 1yhq n ASP 80 Cb 0.40 -0.03 0.04 0.00 -1.14 0.00 0.00 41.12 40.39 1yhq n ASP 80 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1yhq h ASP 81 N 0.67 -0.27 -0.49 -1.12 3.32 -1.95 0.19 116.42 116.76 1yhq h ASP 81 Ca -0.35 0.12 0.06 0.00 0.02 0.00 0.00 57.03 56.88 1yhq h ASP 81 Cb 1.28 0.22 -0.05 0.00 0.22 0.00 0.00 39.33 41.00 1yhq h ASP 81 CO 0.55 -0.09 0.19 -0.08 -1.72 0.00 0.00 179.24 178.08 1yhq h GLU 82 N 0.07 0.36 0.10 3.56 4.81 -1.96 0.36 114.58 121.89 1yhq h GLU 82 Ca 0.23 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1yhq h GLU 82 Cb 0.35 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1yhq h GLU 82 CO -0.42 0.24 -0.06 2.35 -0.73 0.00 0.00 179.01 180.39 1yhq h TRP 83 N 0.37 -0.15 -0.82 0.92 7.01 -1.52 0.11 115.95 121.88 1yhq h TRP 83 Ca 0.24 -0.00 0.10 0.00 2.11 0.00 0.00 58.89 61.34 1yhq h TRP 83 Cb 0.24 0.05 -0.08 0.00 -2.10 0.00 0.00 29.16 27.27 1yhq h TRP 83 CO -0.15 -0.10 0.45 0.28 -2.79 0.00 0.00 178.44 176.13 1yhq h VAL 84 N -0.16 0.87 -0.45 2.65 2.07 0.02 -1.06 116.25 120.19 1yhq h VAL 84 Ca -0.01 -0.25 -0.14 0.00 0.82 0.00 0.00 66.70 67.12 1yhq h VAL 84 Cb 0.13 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.95 1yhq h VAL 84 CO 0.01 0.14 -0.26 0.00 0.02 0.00 0.00 177.57 177.48 1yhq h ALA 85 N 1.47 0.63 -0.08 1.67 0.00 0.25 0.11 119.26 123.32 1yhq h ALA 85 Ca 0.40 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yhq h ALA 85 Cb 0.41 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1yhq h ALA 85 CO -0.27 0.65 0.00 0.39 0.00 0.00 0.00 179.25 180.02 1yhq n GLU 86 N -4.12 1.48 0.00 0.00 1.02 0.35 -4.34 120.64 115.03 1yhq n GLU 86 Ca -0.01 -0.71 0.00 0.00 -0.02 0.00 0.00 57.16 56.42 1yhq n GLU 86 Cb 0.48 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.50 1yhq n GLU 86 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1yhq n HIS 87 N -0.09 0.00 -4.40 -0.32 8.25 -0.46 -5.05 115.22 113.15 1yhq n HIS 87 Ca 0.17 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.34 1yhq n HIS 87 Cb 0.25 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.29 1yhq n HIS 87 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1yhq s THR 88 N -0.20 1.69 -1.47 1.59 2.01 0.37 -4.84 115.64 114.78 1yhq s THR 88 Ca 0.00 -1.82 0.03 0.00 0.31 0.00 0.00 61.69 60.21 1yhq s THR 88 Cb 0.00 -2.50 0.10 0.00 0.01 0.00 0.00 72.50 70.11 1yhq s THR 88 CO 0.00 0.00 0.88 0.47 -0.69 0.00 0.00 174.62 175.28 1yhq n ASP 89 N -1.32 1.07 -4.56 3.53 8.00 -1.26 -4.79 116.55 117.23 1yhq n ASP 89 Ca -0.09 -2.06 -0.26 0.00 0.71 0.00 0.00 54.79 53.09 1yhq n ASP 89 Cb 0.66 -0.29 -0.11 0.00 -0.02 0.00 0.00 41.12 41.36 1yhq n ASP 89 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1yhq s TYR 90 N -1.57 2.36 -0.18 1.24 1.51 -1.26 -5.05 117.35 114.40 1yhq s TYR 90 Ca 0.07 -0.65 0.22 0.00 -1.01 0.00 0.00 57.07 55.70 1yhq s TYR 90 Cb 0.05 -1.52 -0.14 0.00 -0.11 0.00 0.00 41.96 40.23 1yhq s TYR 90 CO 0.03 0.43 0.81 -0.25 -1.11 0.00 0.00 175.55 175.46 1yhq n ASP 91 N -0.84 0.48 -3.64 2.29 8.00 -1.26 -4.00 116.55 117.58 1yhq n ASP 91 Ca -0.05 0.15 -0.04 0.00 0.71 0.00 0.00 54.79 55.56 1yhq n ASP 91 Cb 0.65 1.12 -0.01 0.00 -0.02 0.00 0.00 41.12 42.87 1yhq n ASP 91 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1yhq s ASP 92 N -4.90 -0.14 0.19 -2.24 -4.77 -1.26 -4.25 116.67 99.29 1yhq s ASP 92 Ca -0.03 -0.52 -0.16 0.00 -3.30 0.00 0.00 52.55 48.54 1yhq s ASP 92 Cb 0.12 0.53 0.16 0.00 -1.09 0.00 0.00 42.92 42.64 1yhq s ASP 92 CO 0.84 -1.01 1.64 0.40 0.70 0.00 0.00 175.17 177.74 1yhq h ILE 93 N 2.00 0.42 -0.73 2.11 2.04 -1.87 -1.41 117.51 120.08 1yhq h ILE 93 Ca -0.25 0.00 0.16 0.00 1.00 0.00 0.00 64.86 65.77 1yhq h ILE 93 Cb 1.23 0.42 -0.11 0.00 -0.74 0.00 0.00 36.82 37.62 1yhq h ILE 93 CO 0.28 0.00 0.16 0.28 0.00 0.00 0.00 178.15 178.87 1yhq h SER 94 N -0.04 -0.02 -0.60 1.72 0.02 -1.96 0.67 113.55 113.33 1yhq h SER 94 Ca 0.25 0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 61.33 1yhq h SER 94 Cb 0.42 0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 1yhq h SER 94 CO -0.55 -0.05 0.31 1.23 -1.14 0.00 0.00 176.83 176.63 1yhq h GLY 95 N 0.25 0.95 0.54 -3.77 0.00 -1.67 1.00 103.07 100.36 1yhq h GLY 95 Ca 0.41 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1yhq h GLY 95 CO -0.52 0.42 -0.11 -2.00 0.00 0.00 0.00 176.54 174.32 1yhq h LEU 96 N 0.89 -0.27 -0.62 3.11 5.85 -0.02 -2.34 115.31 121.90 1yhq h LEU 96 Ca 0.22 -0.25 0.12 0.00 0.84 0.00 0.00 57.88 58.81 1yhq h LEU 96 Cb 0.08 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.09 1yhq h LEU 96 CO -0.03 0.17 0.11 0.00 -0.34 0.00 0.00 178.44 178.35 1yhq h ALA 97 N -0.22 0.73 -0.50 1.25 0.00 0.37 -0.29 119.26 120.60 1yhq h ALA 97 Ca -0.03 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1yhq h ALA 97 Cb 0.51 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1yhq h ALA 97 CO 0.05 -0.33 0.32 0.35 0.00 0.00 0.00 179.25 179.65 1yhq h PHE 98 N 0.24 0.60 -0.57 0.00 3.57 -0.80 -0.61 116.94 119.38 1yhq h PHE 98 Ca 0.33 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.79 1yhq h PHE 98 Cb 0.51 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 1yhq h PHE 98 CO -0.27 0.37 0.13 0.00 -2.23 0.00 0.00 178.31 176.31 1yhq h ALA 99 N 1.20 1.17 0.43 2.41 0.00 -0.68 -0.28 119.26 123.51 1yhq h ALA 99 Ca 0.19 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1yhq h ALA 99 Cb -0.04 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1yhq h ALA 99 CO -0.06 0.57 -0.21 -0.07 0.00 0.00 0.00 179.25 179.48 1yhq h LEU 100 N 0.84 -0.49 -1.17 0.00 3.38 -0.64 0.21 115.31 117.44 1yhq h LEU 100 Ca 0.18 -0.09 0.15 0.00 0.09 0.00 0.00 57.88 58.22 1yhq h LEU 100 Cb 0.31 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.11 1yhq h LEU 100 CO -0.00 -0.18 0.60 -0.07 0.09 0.00 0.00 178.44 178.88 1yhq h LEU 101 N -0.82 0.74 -0.79 1.67 3.38 -0.99 0.56 115.31 119.06 1yhq h LEU 101 Ca -0.06 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1yhq h LEU 101 Cb 0.55 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1yhq h LEU 101 CO 0.10 0.35 0.00 -1.54 0.09 0.00 0.00 178.44 177.44 1yhq n SER 102 N -4.61 1.16 -3.80 -0.43 3.41 -0.13 -4.14 113.62 105.08 1yhq n SER 102 Ca 0.19 -1.82 -0.25 0.00 -0.26 0.00 0.00 58.87 56.74 1yhq n SER 102 Cb 0.47 -0.11 0.02 0.00 -0.26 0.00 0.00 64.21 64.33 1yhq n SER 102 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1yhq n GLU 103 N 0.06 -4.93 -0.01 4.33 1.02 0.20 -4.90 120.64 116.41 1yhq n GLU 103 Ca 0.11 0.59 0.10 0.00 -0.02 0.00 0.00 57.16 57.94 1yhq n GLU 103 Cb 0.21 -5.21 -0.14 0.00 -0.02 0.00 0.00 31.44 26.28 1yhq n GLU 103 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1yhq n GLU 104 N -4.42 0.49 -2.66 3.49 4.07 0.61 -5.02 120.64 117.20 1yhq n GLU 104 Ca -0.18 -0.11 -0.06 0.00 -0.06 0.00 0.00 57.16 56.74 1yhq n GLU 104 Cb 0.63 -1.48 -0.00 0.00 -0.06 0.00 0.00 31.44 30.52 1yhq n GLU 104 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 1yhq n THR 105 N -1.92 0.00 -3.97 6.31 5.66 -1.24 -5.04 114.28 114.07 1yhq n THR 105 Ca -0.01 -0.76 -0.08 0.00 -3.05 0.00 0.00 64.05 60.15 1yhq n THR 105 Cb 0.45 0.54 -0.09 0.00 -1.55 0.00 0.00 70.33 69.68 1yhq n THR 105 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1yhq s THR 106 N -2.60 0.16 0.46 1.09 -4.23 -1.26 -4.64 115.64 104.62 1yhq s THR 106 Ca 0.12 -1.32 0.23 0.00 -1.18 0.00 0.00 61.69 59.55 1yhq s THR 106 Cb -0.01 -1.10 0.42 0.00 1.34 0.00 0.00 72.50 73.15 1yhq s THR 106 CO 0.09 -0.73 1.86 -0.07 -0.54 0.00 0.00 174.62 175.23 1yhq h LEU 107 N 3.46 0.26 -0.02 4.79 3.38 -1.91 -1.91 115.31 123.35 1yhq h LEU 107 Ca -0.33 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 1yhq h LEU 107 Cb 1.18 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1yhq h LEU 107 CO 0.55 0.09 -0.01 0.03 0.09 0.00 0.00 178.44 179.19 1yhq h ARG 108 N 0.25 0.05 -0.56 1.13 3.08 -1.87 0.51 114.38 116.98 1yhq h ARG 108 Ca 0.47 -0.02 0.16 0.00 0.07 0.00 0.00 59.98 60.66 1yhq h ARG 108 Cb 1.41 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.44 1yhq h ARG 108 CO -0.13 0.48 0.41 0.93 -1.07 0.00 0.00 179.97 180.59 1yhq h GLU 109 N -0.38 0.00 -0.64 0.04 5.08 -1.67 0.13 114.58 117.14 1yhq h GLU 109 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1yhq h GLU 109 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1yhq h GLU 109 CO 0.00 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.05 1yhq n GLN 110 N -4.32 3.41 -1.98 2.33 1.13 -1.09 -4.91 117.38 111.95 1yhq n GLN 110 Ca 0.10 -2.30 -0.08 0.00 -1.94 0.00 0.00 57.00 52.78 1yhq n GLN 110 Cb 0.64 -1.86 -0.01 0.00 0.11 0.00 0.00 30.24 29.12 1yhq n GLN 110 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1yhq n GLY 111 N 0.82 0.22 3.53 1.08 0.00 0.45 -4.66 105.19 106.63 1yhq n GLY 111 Ca 0.21 -0.59 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 1yhq n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yhq s LEU 112 N -2.11 2.85 0.23 0.99 1.43 0.18 -1.71 118.68 120.53 1yhq s LEU 112 Ca 0.00 -0.55 -0.30 0.00 -1.03 0.00 0.00 54.13 52.25 1yhq s LEU 112 Cb 0.00 -1.62 -0.10 0.00 0.03 0.00 0.00 46.19 44.50 1yhq s LEU 112 CO 0.00 0.15 1.45 -0.55 0.23 0.00 0.00 176.35 177.63 1yhq s SER 113 N -2.43 6.66 0.00 2.29 0.15 0.45 -3.32 113.70 117.50 1yhq s SER 113 Ca 0.21 2.63 0.03 0.00 0.70 0.00 0.00 55.95 59.53 1yhq s SER 113 Cb -0.10 -2.62 0.16 0.00 -1.71 0.00 0.00 66.02 61.76 1yhq s SER 113 CO 0.13 -0.71 0.98 -2.65 1.20 0.00 0.00 173.24 172.18 1yhq n PRO 114 N 2.66 0.04 -5.16 5.44 -0.02 -1.26 -4.66 135.00 132.04 1yhq n PRO 114 Ca 0.08 0.31 -0.32 0.00 -2.02 0.00 0.00 63.50 61.55 1yhq n PRO 114 Cb 0.40 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.23 1yhq n PRO 114 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1yhq s THR 115 N -2.69 2.38 -0.31 3.45 2.01 -1.26 -4.40 115.64 114.82 1yhq s THR 115 Ca 0.03 -0.97 -0.09 0.00 0.31 0.00 0.00 61.69 60.97 1yhq s THR 115 Cb 0.02 -1.88 0.00 0.00 0.01 0.00 0.00 72.50 70.66 1yhq s THR 115 CO 0.05 0.58 0.13 -0.76 -0.69 0.00 0.00 174.62 173.94 1yhq s LEU 116 N -0.47 4.11 -0.79 4.42 1.43 0.11 -4.68 118.68 122.82 1yhq s LEU 116 Ca 0.06 -0.67 -0.20 0.00 -1.03 0.00 0.00 54.13 52.29 1yhq s LEU 116 Cb -0.11 -1.96 0.11 0.00 0.03 0.00 0.00 46.19 44.26 1yhq s LEU 116 CO 0.01 -0.22 0.99 -0.13 0.23 0.00 0.00 176.35 177.23 1yhq s ARG 117 N 1.56 3.36 0.81 1.70 0.52 -1.26 0.44 118.95 126.08 1yhq s ARG 117 Ca 0.03 -1.44 -0.12 0.00 -0.52 0.00 0.00 55.73 53.69 1yhq s ARG 117 Cb -0.17 -4.58 0.08 0.00 0.52 0.00 0.00 34.95 30.80 1yhq s ARG 117 CO 0.05 -1.73 1.13 -0.51 0.02 0.00 0.00 175.30 174.26 1yhq s LEU 118 N 2.99 2.48 0.30 2.53 1.43 -1.04 -4.93 118.68 122.44 1yhq s LEU 118 Ca 0.25 1.04 0.01 0.00 -1.03 0.00 0.00 54.13 54.40 1yhq s LEU 118 Cb -0.12 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.49 1yhq s LEU 118 CO -0.01 -1.98 0.48 -2.28 0.23 0.00 0.00 176.35 172.80 1yhq s HIS 119 N -3.35 3.49 0.69 0.29 5.65 -0.89 -4.82 115.29 116.35 1yhq s HIS 119 Ca 0.61 0.28 -0.17 0.00 0.25 0.00 0.00 55.06 56.03 1yhq s HIS 119 Cb -0.13 -1.83 0.01 0.00 -1.18 0.00 0.00 32.58 29.46 1yhq s HIS 119 CO 0.52 0.24 1.27 -2.30 -0.65 0.00 0.00 174.74 173.81 1yhq n PRO 120 N -1.48 0.88 -1.86 2.88 -0.02 -1.26 -4.45 135.00 129.69 1yhq n PRO 120 Ca -0.06 0.36 -0.43 0.00 -2.02 0.00 0.00 63.50 61.36 1yhq n PRO 120 Cb 0.56 -2.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.51 1yhq n PRO 120 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1yhq s PRO 121 N -3.54 3.72 0.13 0.52 0.04 -1.26 -4.51 135.00 130.10 1yhq s PRO 121 Ca 0.80 2.02 -0.31 0.00 0.04 0.00 0.00 61.00 63.56 1yhq s PRO 121 Cb -0.36 -4.16 -0.10 0.00 0.04 0.00 0.00 34.50 29.92 1yhq s PRO 121 CO 0.43 -1.41 1.79 1.03 0.04 0.00 0.00 177.00 178.87 1yhq s ARG 122 N 5.05 4.14 0.00 4.56 0.52 -0.27 -0.07 118.95 132.88 1yhq s ARG 122 Ca 0.84 2.57 0.00 0.00 -0.52 0.00 0.00 55.73 58.61 1yhq s ARG 122 Cb -0.32 -3.49 0.00 0.00 0.52 0.00 0.00 34.95 31.66 1yhq s ARG 122 CO 0.34 -0.81 0.00 0.41 0.02 0.00 0.00 175.30 175.26 1yhq n GLY 123 N 4.15 0.79 0.55 -3.53 0.00 -1.26 -4.90 105.19 101.00 1yhq n GLY 123 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 1yhq n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yhq n GLY 124 N -2.10 -2.91 1.18 -0.02 0.00 0.89 -5.01 105.19 97.22 1yhq n GLY 124 Ca 0.00 -1.30 -0.06 0.00 0.00 0.00 0.00 46.02 44.66 1yhq n GLY 124 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1yhq n HIS 125 N -2.91 -2.95 1.56 1.61 1.44 -1.26 -4.94 115.22 107.77 1yhq n HIS 125 Ca -0.04 -0.60 0.02 0.00 -2.01 0.00 0.00 57.72 55.09 1yhq n HIS 125 Cb 0.26 -0.19 0.06 0.00 0.12 0.00 0.00 29.99 30.25 1yhq n HIS 125 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1yhq n ASP 126 N -2.86 0.73 0.00 4.39 8.00 -1.26 -5.00 116.55 120.55 1yhq n ASP 126 Ca 0.05 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.55 1yhq n ASP 126 Cb 0.18 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 1yhq n ASP 126 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yhq n GLY 127 N 0.72 2.14 2.02 0.44 0.00 -1.26 -4.15 105.19 105.09 1yhq n GLY 127 Ca 0.05 -1.58 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 1yhq n GLY 127 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1yhq n VAL 128 N 1.98 3.01 0.25 1.61 0.24 -1.26 -1.37 118.33 122.78 1yhq n VAL 128 Ca 0.00 -1.83 0.03 0.00 -2.04 0.00 0.00 64.34 60.50 1yhq n VAL 128 Cb 0.00 -0.40 0.00 0.00 -1.47 0.00 0.00 33.84 31.98 1yhq n VAL 128 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1yhq n LYS 129 N -0.61 1.83 -3.95 7.34 5.02 -1.26 -4.97 118.16 121.55 1yhq n LYS 129 Ca 0.48 -0.54 -0.10 0.00 -2.02 0.00 0.00 58.31 56.13 1yhq n LYS 129 Cb 1.47 -0.98 -0.11 0.00 -0.02 0.00 0.00 35.03 35.40 1yhq n LYS 129 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1yhq s HIS 130 N -0.87 0.21 0.91 2.13 3.76 -1.26 -5.06 115.29 115.11 1yhq s HIS 130 Ca 0.05 -0.44 -0.14 0.00 -0.15 0.00 0.00 55.06 54.38 1yhq s HIS 130 Cb 0.05 -0.16 0.15 0.00 1.11 0.00 0.00 32.58 33.73 1yhq s HIS 130 CO 0.13 -0.23 1.23 -1.25 -0.85 0.00 0.00 174.74 173.77 1yhq s PRO 131 N -1.54 1.10 0.17 8.40 0.04 -1.26 -2.12 135.00 139.80 1yhq s PRO 131 Ca -0.15 -0.10 -0.14 0.00 0.04 0.00 0.00 61.00 60.65 1yhq s PRO 131 Cb -0.09 -1.87 0.13 0.00 0.04 0.00 0.00 34.50 32.71 1yhq s PRO 131 CO -0.01 -2.15 1.75 0.28 0.04 0.00 0.00 177.00 176.91 1yhq h VAL 132 N -1.46 0.86 0.00 -0.36 2.07 -1.52 0.46 116.25 116.30 1yhq h VAL 132 Ca -0.46 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1yhq h VAL 132 Cb 1.29 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1yhq h VAL 132 CO 0.52 0.06 0.00 0.11 0.02 0.00 0.00 177.57 178.28 1yhq h LYS 133 N 0.33 0.00 -0.38 1.57 1.57 -1.88 -0.09 116.57 117.68 1yhq h LYS 133 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1yhq h LYS 133 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1yhq h LYS 133 CO -0.21 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.06 1yhq n GLU 134 N -2.93 2.38 -0.04 3.15 1.02 -0.68 -4.95 120.64 118.59 1yhq n GLU 134 Ca -0.03 -2.11 0.00 0.00 -0.02 0.00 0.00 57.16 55.00 1yhq n GLU 134 Cb 0.06 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1yhq n GLU 134 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yhq n GLY 135 N 1.06 0.43 0.00 0.62 0.00 -0.04 -4.88 105.19 102.37 1yhq n GLY 135 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1yhq n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yhq n GLY 136 N -2.00 -0.09 0.01 -0.02 0.00 0.15 -4.75 105.19 98.49 1yhq n GLY 136 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1yhq n GLY 136 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1yhq n GLN 137 N -0.35 -0.80 -2.57 1.61 -0.06 -0.47 -3.84 117.38 110.90 1yhq n GLN 137 Ca 0.00 -0.56 -0.31 0.00 -2.00 0.00 0.00 57.00 54.14 1yhq n GLN 137 Cb 0.00 -1.00 -0.02 0.00 -4.06 0.00 0.00 30.24 25.15 1yhq n GLN 137 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1yhq s LEU 138 N -0.06 3.67 0.00 1.69 1.43 -1.10 -4.51 118.68 119.80 1yhq s LEU 138 Ca 0.00 1.29 0.00 0.00 -1.03 0.00 0.00 54.13 54.39 1yhq s LEU 138 Cb 0.00 -4.22 0.00 0.00 0.03 0.00 0.00 46.19 42.00 1yhq s LEU 138 CO 0.00 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 176.66 1yhq n GLY 139 N -1.65 -2.19 3.75 -3.19 0.00 0.02 -2.07 105.19 99.87 1yhq n GLY 139 Ca 0.04 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 1yhq n GLY 139 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yhq s LYS 140 N -0.28 4.11 0.36 1.61 2.20 -1.26 -2.52 119.74 123.96 1yhq s LYS 140 Ca 0.00 2.59 0.08 0.00 -0.36 0.00 0.00 55.97 58.29 1yhq s LYS 140 Cb 0.00 -3.02 -0.06 0.00 -1.51 0.00 0.00 37.83 33.25 1yhq s LYS 140 CO 0.00 -0.64 0.04 -1.01 -0.36 0.00 0.00 175.35 173.38 1yhq s HIS 141 N -0.05 2.56 0.57 4.03 3.76 0.32 -4.78 115.29 121.71 1yhq s HIS 141 Ca 0.63 -0.48 -0.15 0.00 -0.15 0.00 0.00 55.06 54.91 1yhq s HIS 141 Cb -0.48 -1.60 -0.05 0.00 1.11 0.00 0.00 32.58 31.56 1yhq s HIS 141 CO 0.49 0.42 1.03 0.34 -0.85 0.00 0.00 174.74 176.16 1yhq s ASP 142 N -3.75 6.14 0.41 1.40 -1.08 -1.26 -4.58 116.67 113.94 1yhq s ASP 142 Ca 0.36 1.66 0.08 0.00 -0.52 0.00 0.00 52.55 54.13 1yhq s ASP 142 Cb 0.02 -2.51 0.88 0.00 -1.46 0.00 0.00 42.92 39.84 1yhq s ASP 142 CO 0.20 -0.92 2.03 0.74 0.52 0.00 0.00 175.17 177.73 1yhq h THR 143 N 0.45 1.04 -0.01 1.71 2.02 -1.98 0.39 112.91 116.53 1yhq h THR 143 Ca -0.46 -0.19 -0.17 0.00 0.77 0.00 0.00 66.41 66.36 1yhq h THR 143 Cb 1.20 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1yhq h THR 143 CO 0.59 0.10 -0.77 -0.08 0.37 0.00 0.00 175.52 175.74 1yhq h GLU 144 N 0.55 0.14 -0.09 6.66 4.81 -1.92 -2.37 114.58 122.37 1yhq h GLU 144 Ca 0.21 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1yhq h GLU 144 Cb 0.13 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 1yhq h GLU 144 CO -0.05 0.84 -0.02 0.78 -0.73 0.00 0.00 179.01 179.82 1yhq h GLY 145 N 1.88 0.18 1.01 1.92 0.00 -0.98 -1.75 103.07 105.34 1yhq h GLY 145 Ca -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 1yhq h GLY 145 CO 0.11 0.14 0.35 -2.22 0.00 0.00 0.00 176.54 174.92 1yhq h ILE 146 N -0.16 1.23 -0.82 2.60 1.08 -0.44 -2.53 117.51 118.47 1yhq h ILE 146 Ca 0.02 -0.63 0.03 0.00 -0.39 0.00 0.00 64.86 63.89 1yhq h ILE 146 Cb 0.43 0.34 -0.05 0.00 -3.07 0.00 0.00 36.82 34.47 1yhq h ILE 146 CO 0.01 0.27 0.53 0.44 -0.69 0.00 0.00 178.15 178.70 1yhq h ASP 147 N 0.99 0.87 -0.41 1.72 5.19 -1.36 0.86 116.42 124.27 1yhq h ASP 147 Ca 0.24 -0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.64 1yhq h ASP 147 Cb 0.10 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.40 1yhq h ASP 147 CO -0.03 0.60 0.22 0.44 -3.12 0.00 0.00 179.24 177.34 1yhq h ASP 148 N 1.02 0.52 0.37 6.45 3.32 -0.92 -0.51 116.42 126.67 1yhq h ASP 148 Ca 0.33 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 1yhq h ASP 148 Cb 0.01 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.43 1yhq h ASP 148 CO -0.11 0.47 -0.18 0.25 -1.72 0.00 0.00 179.24 177.95 1yhq h LEU 149 N 0.53 -0.42 -0.90 1.55 5.85 -1.03 -1.49 115.31 119.40 1yhq h LEU 149 Ca 0.14 -0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.82 1yhq h LEU 149 Cb 0.07 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 1yhq h LEU 149 CO -0.02 -0.10 0.55 -0.07 -0.34 0.00 0.00 178.44 178.47 1yhq h LEU 150 N -0.77 0.84 -0.90 2.25 3.38 -0.83 0.32 115.31 119.60 1yhq h LEU 150 Ca -0.05 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 1yhq h LEU 150 Cb 0.52 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1yhq h LEU 150 CO 0.08 0.50 -0.22 -0.33 0.09 0.00 0.00 178.44 178.57 1yhq h GLU 151 N 0.96 0.56 0.00 1.13 5.08 -1.06 -1.86 114.58 119.39 1yhq h GLU 151 Ca 0.42 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.48 1yhq h GLU 151 Cb 0.29 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1yhq h GLU 151 CO -0.21 0.74 -0.42 0.00 -1.00 0.00 0.00 179.01 178.12 1yhq h ALA 152 N 1.27 1.10 -0.49 3.43 0.00 -0.08 -2.11 119.26 122.38 1yhq h ALA 152 Ca 0.08 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1yhq h ALA 152 Cb 0.65 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1yhq h ALA 152 CO 0.05 0.53 0.00 -1.33 0.00 0.00 0.00 179.25 178.49 1yhq n MET 153 N -3.74 3.90 0.00 0.00 2.81 -0.03 -1.12 117.12 118.94 1yhq n MET 153 Ca -0.01 -2.49 0.00 0.00 -1.81 0.00 0.00 57.70 53.39 1yhq n MET 153 Cb 0.49 -2.02 0.00 0.00 -0.71 0.00 0.00 33.22 30.98 1yhq n MET 153 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35