#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v1g s LEU 2 N 0.00 4.35 0.86 0.99 1.02 -1.26 -5.10 118.68 119.54 2v1g s LEU 2 Ca 0.00 0.52 -0.11 0.00 0.02 0.00 0.00 54.13 54.56 2v1g s LEU 2 Cb 0.00 -2.85 0.11 0.00 0.02 0.00 0.00 46.19 43.46 2v1g s LEU 2 CO 0.00 0.20 1.09 -0.94 0.02 0.00 0.00 176.35 176.72 2v1g s SER 3 N -1.98 3.84 0.23 2.29 1.04 -1.26 -4.83 113.70 113.03 2v1g s SER 3 Ca 0.32 1.44 -0.06 0.00 0.48 0.00 0.00 55.95 58.13 2v1g s SER 3 Cb -0.13 -2.14 0.36 0.00 0.10 0.00 0.00 66.02 64.21 2v1g s SER 3 CO 0.20 -2.40 1.77 0.44 0.98 0.00 0.00 173.24 174.23 2v1g h ASP 4 N -1.39 0.45 -0.74 7.02 3.32 -1.99 -0.80 116.42 122.30 2v1g h ASP 4 Ca -0.48 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.63 2v1g h ASP 4 Cb 1.28 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.78 2v1g h ASP 4 CO 0.56 0.25 0.43 1.23 -1.72 0.00 0.00 179.24 179.99 2v1g h GLY 5 N 0.59 1.09 0.98 2.75 0.00 -2.00 -1.20 103.07 105.28 2v1g h GLY 5 Ca 0.37 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 2v1g h GLY 5 CO -0.29 0.45 0.07 0.83 0.00 0.00 0.00 176.54 177.60 2v1g h GLU 6 N 1.02 0.80 -0.96 4.80 5.08 -1.80 -1.88 114.58 121.64 2v1g h GLU 6 Ca 0.26 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2v1g h GLU 6 Cb -0.01 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.10 2v1g h GLU 6 CO -0.05 0.81 0.62 -1.49 -1.00 0.00 0.00 179.01 177.90 2v1g h TRP 7 N 0.67 1.23 -0.87 4.33 -0.00 -0.79 -0.15 115.95 120.36 2v1g h TRP 7 Ca 0.14 0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 59.03 2v1g h TRP 7 Cb 0.40 -0.41 -0.04 0.00 -0.00 0.00 0.00 29.16 29.11 2v1g h TRP 7 CO 0.03 0.79 0.48 0.37 -0.00 0.00 0.00 178.44 180.11 2v1g h GLN 8 N 1.31 1.22 -0.45 0.49 4.15 -0.92 -0.90 115.11 120.01 2v1g h GLN 8 Ca 0.35 -0.14 -0.03 0.00 0.77 0.00 0.00 58.65 59.60 2v1g h GLN 8 Cb -0.12 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 27.32 2v1g h GLN 8 CO -0.07 0.89 0.16 1.96 -1.93 0.00 0.00 178.83 179.84 2v1g h GLN 9 N 1.22 0.69 -0.29 1.69 4.20 -0.56 -0.70 115.11 121.35 2v1g h GLN 9 Ca 0.31 -0.14 0.05 0.00 0.06 0.00 0.00 58.65 58.93 2v1g h GLN 9 Cb 0.03 -0.11 -0.05 0.00 0.30 0.00 0.00 27.48 27.66 2v1g h GLN 9 CO -0.05 0.65 0.01 0.28 -0.67 0.00 0.00 178.83 179.05 2v1g h VAL 10 N 0.59 0.79 0.00 -0.54 2.07 -0.47 -0.45 116.25 118.24 2v1g h VAL 10 Ca 0.15 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.58 2v1g h VAL 10 Cb 0.23 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2v1g h VAL 10 CO -0.01 0.02 -0.26 -0.07 0.02 0.00 0.00 177.57 177.27 2v1g h LEU 11 N 0.09 0.00 -0.12 2.57 3.38 -1.05 0.05 115.31 120.24 2v1g h LEU 11 Ca 0.14 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 2v1g h LEU 11 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2v1g h LEU 11 CO -0.23 0.26 -0.07 -1.13 0.09 0.00 0.00 178.44 177.36 2v1g h ASN 12 N 0.00 0.26 -0.84 -0.43 -1.24 -0.68 -2.53 115.58 110.12 2v1g h ASN 12 Ca -0.00 -0.43 0.07 0.00 0.71 0.00 0.00 56.30 56.65 2v1g h ASN 12 Cb 0.95 -0.07 -0.06 0.00 0.73 0.00 0.00 38.32 39.87 2v1g h ASN 12 CO 0.03 0.63 0.52 0.58 -1.29 0.00 0.00 177.43 177.90 2v1g h VAL 13 N -0.11 1.02 -0.06 2.57 2.07 -0.81 -2.14 116.25 118.78 2v1g h VAL 13 Ca 0.02 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 2v1g h VAL 13 Cb 0.54 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2v1g h VAL 13 CO 0.02 0.17 -0.04 -0.25 0.02 0.00 0.00 177.57 177.49 2v1g h TRP 14 N 0.93 0.09 -0.44 1.57 2.91 -0.87 -0.20 115.95 119.94 2v1g h TRP 14 Ca 0.37 -0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.48 2v1g h TRP 14 Cb 0.20 -0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 28.80 2v1g h TRP 14 CO -0.04 0.13 0.30 0.78 -1.03 0.00 0.00 178.44 178.59 2v1g h GLY 15 N 0.31 0.30 1.07 2.65 0.00 -0.94 -0.15 103.07 106.30 2v1g h GLY 15 Ca 0.02 -0.09 -0.14 0.00 0.00 0.00 0.00 47.33 47.12 2v1g h GLY 15 CO 0.01 0.06 -0.28 0.50 0.00 0.00 0.00 176.54 176.82 2v1g h LYS 16 N 0.22 0.89 -0.51 4.80 1.57 -1.08 -2.86 116.57 119.60 2v1g h LYS 16 Ca 0.20 -0.43 -0.04 0.00 -1.87 0.00 0.00 60.65 58.51 2v1g h LYS 16 Cb 0.51 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 2v1g h LYS 16 CO -0.04 1.08 0.15 0.28 -0.57 0.00 0.00 179.45 180.35 2v1g h VAL 17 N 0.71 1.24 0.00 0.50 2.07 -1.15 -2.99 116.25 116.62 2v1g h VAL 17 Ca 0.08 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.79 2v1g h VAL 17 Cb 0.87 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2v1g h VAL 17 CO 0.08 0.30 0.00 -0.33 0.02 0.00 0.00 177.57 177.63 2v1g h GLU 18 N 0.70 0.00 0.00 1.57 5.08 -0.90 -1.37 114.58 119.67 2v1g h GLU 18 Ca 0.16 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 2v1g h GLU 18 Cb 0.30 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 2v1g h GLU 18 CO -0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 179.01 177.90 2v1g h ALA 19 N 2.01 1.01 -0.77 3.43 0.00 -1.35 -3.36 119.26 120.23 2v1g h ALA 19 Ca 0.00 -0.10 -0.31 0.00 0.00 0.00 0.00 54.91 54.50 2v1g h ALA 19 Cb 0.18 -0.02 -0.22 0.00 0.00 0.00 0.00 17.79 17.73 2v1g h ALA 19 CO 0.00 0.13 -0.67 -3.47 0.00 0.00 0.00 179.25 175.25 2v1g n ASP 20 N -3.24 -2.13 -0.19 0.00 2.03 -0.56 -5.02 116.55 107.45 2v1g n ASP 20 Ca 0.01 -3.04 -0.08 0.00 0.52 0.00 0.00 54.79 52.19 2v1g n ASP 20 Cb 0.38 1.10 0.02 0.00 -0.72 0.00 0.00 41.12 41.89 2v1g n ASP 20 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 2v1g h ILE 21 N 3.19 1.24 -0.54 5.18 6.09 -1.60 -1.57 117.51 129.50 2v1g h ILE 21 Ca -0.04 -0.79 -0.04 0.00 -1.37 0.00 0.00 64.86 62.62 2v1g h ILE 21 Cb 1.00 0.72 -0.02 0.00 0.47 0.00 0.00 36.82 38.99 2v1g h ILE 21 CO 0.31 0.30 0.19 0.00 -3.07 0.00 0.00 178.15 175.88 2v1g h ALA 22 N 1.03 0.70 -0.29 0.18 0.00 -1.88 0.82 119.26 119.83 2v1g h ALA 22 Ca 0.18 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2v1g h ALA 22 Cb 0.28 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2v1g h ALA 22 CO -0.01 0.34 0.04 0.78 0.00 0.00 0.00 179.25 180.40 2v1g h GLY 23 N 0.74 0.53 1.01 0.00 0.00 -1.89 0.16 103.07 103.62 2v1g h GLY 23 Ca 0.18 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 47.09 2v1g h GLY 23 CO -0.01 0.34 0.18 0.45 0.00 0.00 0.00 176.54 177.49 2v1g h HIS 24 N 0.31 0.98 -0.37 5.60 -0.00 -1.21 -2.01 115.15 118.45 2v1g h HIS 24 Ca 0.09 -0.10 -0.05 0.00 -0.00 0.00 0.00 60.37 60.31 2v1g h HIS 24 Cb 0.36 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 27.48 2v1g h HIS 24 CO 0.03 0.82 0.05 0.78 -0.00 0.00 0.00 177.93 179.60 2v1g h GLY 25 N 0.86 0.66 0.68 2.45 0.00 -0.63 -0.21 103.07 106.89 2v1g h GLY 25 Ca 0.19 -0.45 0.03 0.00 0.00 0.00 0.00 47.33 47.10 2v1g h GLY 25 CO -0.00 0.42 -0.04 -1.61 0.00 0.00 0.00 176.54 175.30 2v1g h GLN 26 N 0.45 -0.01 -0.44 4.80 4.15 -0.94 -1.44 115.11 121.68 2v1g h GLN 26 Ca 0.11 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.46 2v1g h GLN 26 Cb 0.38 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 2v1g h GLN 26 CO 0.01 -0.01 -0.03 0.93 -1.93 0.00 0.00 178.83 177.80 2v1g h GLU 27 N -0.01 0.73 -0.20 1.69 5.08 -1.09 0.35 114.58 121.12 2v1g h GLU 27 Ca 0.07 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 2v1g h GLU 27 Cb 0.12 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2v1g h GLU 27 CO -0.16 0.76 0.08 0.28 -1.00 0.00 0.00 179.01 178.98 2v1g h VAL 28 N 0.68 1.16 -0.65 3.13 2.07 -0.79 0.05 116.25 121.90 2v1g h VAL 28 Ca 0.13 -0.48 -0.08 0.00 0.82 0.00 0.00 66.70 67.10 2v1g h VAL 28 Cb 0.46 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 2v1g h VAL 28 CO 0.02 0.15 0.11 -0.07 0.02 0.00 0.00 177.57 177.81 2v1g h LEU 29 N 0.18 1.03 -0.72 2.57 3.38 -0.92 -1.02 115.31 119.80 2v1g h LEU 29 Ca 0.07 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 2v1g h LEU 29 Cb 0.17 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2v1g h LEU 29 CO -0.01 1.03 0.02 0.40 0.09 0.00 0.00 178.44 179.97 2v1g h ILE 30 N 0.99 1.26 -0.46 1.22 2.04 -0.81 0.41 117.51 122.16 2v1g h ILE 30 Ca 0.20 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2v1g h ILE 30 Cb 0.43 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 2v1g h ILE 30 CO 0.01 0.40 0.29 -0.09 0.00 0.00 0.00 178.15 178.76 2v1g h ARG 31 N 0.92 0.61 0.03 2.37 9.65 -0.75 -0.23 114.38 126.99 2v1g h ARG 31 Ca 0.17 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.01 2v1g h ARG 31 Cb 0.51 -0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 28.95 2v1g h ARG 31 CO 0.02 0.43 -0.03 1.25 2.80 0.00 0.00 179.97 184.44 2v1g h LEU 32 N 0.62 -0.08 -0.56 3.80 5.85 -0.83 -1.54 115.31 122.57 2v1g h LEU 32 Ca 0.17 0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.75 2v1g h LEU 32 Cb -0.04 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 2v1g h LEU 32 CO -0.03 -0.05 -0.39 -0.26 -0.34 0.00 0.00 178.44 177.37 2v1g h PHE 33 N -0.07 0.87 0.07 1.25 0.04 -0.74 -0.16 116.94 118.20 2v1g h PHE 33 Ca 0.00 -0.25 -0.25 0.00 2.80 0.00 0.00 57.97 60.27 2v1g h PHE 33 Cb 0.07 -0.18 -0.00 0.00 2.20 0.00 0.00 35.95 38.03 2v1g h PHE 33 CO -0.09 1.00 -1.10 1.79 -0.60 0.00 0.00 178.31 179.31 2v1g h THR 34 N 0.60 1.50 0.00 -1.55 1.35 -1.05 -2.77 112.91 110.99 2v1g h THR 34 Ca 0.05 -2.92 -0.13 0.00 -0.55 0.00 0.00 66.41 62.86 2v1g h THR 34 Cb 0.93 2.76 -0.02 0.00 -1.73 0.00 0.00 68.15 70.09 2v1g h THR 34 CO 0.08 0.85 -0.64 1.23 -0.25 0.00 0.00 175.52 176.79 2v1g h GLY 35 N 1.70 0.00 -6.16 5.82 0.00 -1.24 -3.39 103.07 99.80 2v1g h GLY 35 Ca -0.10 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.68 2v1g h GLY 35 CO 0.18 0.00 -1.00 1.42 0.00 0.00 0.00 176.54 177.14 2v1g n HIS 36 N -3.41 -0.88 0.17 5.60 8.25 -0.08 -5.00 115.22 119.88 2v1g n HIS 36 Ca 0.00 -3.30 0.18 0.00 -0.26 0.00 0.00 57.72 54.35 2v1g n HIS 36 Cb 0.73 0.11 0.80 0.00 1.12 0.00 0.00 29.99 32.76 2v1g n HIS 36 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2v1g h PRO 37 N 4.99 0.00 -0.05 -0.41 0.11 -1.71 0.62 132.00 135.55 2v1g h PRO 37 Ca 0.18 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.31 2v1g h PRO 37 Cb 0.91 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 2v1g h PRO 37 CO 0.39 0.00 0.05 1.05 -0.21 0.00 0.00 178.00 179.28 2v1g h GLU 38 N 0.00 0.00 -0.09 1.05 9.09 -1.93 -2.03 114.58 120.67 2v1g h GLU 38 Ca 0.12 0.00 -0.12 0.00 0.05 0.00 0.00 59.36 59.41 2v1g h GLU 38 Cb 0.72 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.81 2v1g h GLU 38 CO -0.00 0.00 -0.49 1.79 0.05 0.00 0.00 179.01 180.36 2v1g h THR 39 N 0.00 1.34 -0.31 -1.06 1.35 -1.19 -2.61 112.91 110.43 2v1g h THR 39 Ca 0.02 -1.70 -0.01 0.00 -0.55 0.00 0.00 66.41 64.18 2v1g h THR 39 Cb 0.12 1.81 -0.02 0.00 -1.73 0.00 0.00 68.15 68.34 2v1g h THR 39 CO -0.00 0.51 0.17 0.25 -0.25 0.00 0.00 175.52 176.19 2v1g h LEU 40 N 0.18 0.36 -1.03 3.87 5.85 -1.51 -1.98 115.31 121.06 2v1g h LEU 40 Ca 0.01 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.71 2v1g h LEU 40 Cb 0.93 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.87 2v1g h LEU 40 CO 0.07 0.30 0.00 -0.33 -0.34 0.00 0.00 178.44 178.14 2v1g h GLU 41 N 0.42 0.00 0.00 1.25 4.39 -1.52 -0.55 114.58 118.57 2v1g h GLU 41 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2v1g h GLU 41 Cb 0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 2v1g h GLU 41 CO -0.02 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 179.46 2v1g n LYS 42 N -2.49 0.25 -3.63 2.33 4.76 -0.74 -4.46 118.16 114.18 2v1g n LYS 42 Ca 0.01 0.29 -0.39 0.00 -2.87 0.00 0.00 58.31 55.36 2v1g n LYS 42 Cb 0.23 -1.84 -0.09 0.00 -1.84 0.00 0.00 35.03 31.49 2v1g n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2v1g s PHE 43 N -3.18 3.49 0.45 2.13 0.40 -0.21 -4.93 117.98 116.13 2v1g s PHE 43 Ca 0.08 -2.29 0.19 0.00 -0.60 0.00 0.00 56.93 54.32 2v1g s PHE 43 Cb 0.11 -3.38 1.16 0.00 0.51 0.00 0.00 43.02 41.42 2v1g s PHE 43 CO 0.53 -0.94 1.92 -0.44 0.70 0.00 0.00 175.22 176.99 2v1g h ASP 44 N 7.80 0.29 0.05 1.36 3.32 -1.80 -0.54 116.42 126.91 2v1g h ASP 44 Ca -0.09 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2v1g h ASP 44 Cb 1.02 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.54 2v1g h ASP 44 CO 0.77 0.14 -0.01 2.29 -1.72 0.00 0.00 179.24 180.70 2v1g n LYS 45 N -4.45 1.18 0.00 3.56 2.85 -1.26 -3.31 118.16 116.72 2v1g n LYS 45 Ca 0.15 -0.36 0.00 0.00 -1.05 0.00 0.00 58.31 57.05 2v1g n LYS 45 Cb 0.61 -1.49 0.00 0.00 -0.65 0.00 0.00 35.03 33.50 2v1g n LYS 45 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2v1g n PHE 46 N -0.59 0.00 -0.03 5.58 3.72 -0.30 -4.72 117.46 121.12 2v1g n PHE 46 Ca 0.21 0.00 0.20 0.00 -0.05 0.00 0.00 57.45 57.81 2v1g n PHE 46 Cb 0.22 0.00 0.67 0.00 -0.94 0.00 0.00 39.48 39.43 2v1g n PHE 46 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2v1g h LYS 47 N 0.00 0.04 0.00 -1.08 1.57 -1.31 -0.22 116.57 115.57 2v1g h LYS 47 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2v1g h LYS 47 Cb 0.01 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2v1g h LYS 47 CO 0.00 0.03 0.00 -2.39 -0.57 0.00 0.00 179.45 176.52 2v1g n HIS 48 N -4.38 0.50 -2.35 -1.35 1.44 -1.26 -4.53 115.22 103.29 2v1g n HIS 48 Ca 0.11 0.18 -0.36 0.00 -2.01 0.00 0.00 57.72 55.63 2v1g n HIS 48 Cb 0.62 -0.79 -0.04 0.00 0.12 0.00 0.00 29.99 29.90 2v1g n HIS 48 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2v1g s LEU 49 N -3.88 3.32 0.06 2.39 1.43 -0.10 -4.76 118.68 117.14 2v1g s LEU 49 Ca 0.08 -0.86 0.25 0.00 -1.03 0.00 0.00 54.13 52.56 2v1g s LEU 49 Cb 0.11 -2.56 0.48 0.00 0.03 0.00 0.00 46.19 44.25 2v1g s LEU 49 CO 0.42 -2.03 1.40 0.29 0.23 0.00 0.00 176.35 176.66 2v1g n LYS 50 N 8.99 0.15 -4.07 1.70 4.76 -1.26 -4.88 118.16 123.54 2v1g n LYS 50 Ca 0.29 0.04 -0.07 0.00 -2.87 0.00 0.00 58.31 55.70 2v1g n LYS 50 Cb 0.50 -1.59 -0.10 0.00 -1.84 0.00 0.00 35.03 31.99 2v1g n LYS 50 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2v1g s THR 51 N -3.08 0.22 0.40 -0.18 2.01 -1.26 -5.04 115.64 108.70 2v1g s THR 51 Ca 0.09 -1.66 0.10 0.00 0.31 0.00 0.00 61.69 60.53 2v1g s THR 51 Cb 0.16 -1.31 0.17 0.00 0.01 0.00 0.00 72.50 71.52 2v1g s THR 51 CO 0.70 -0.91 1.93 -0.08 -0.69 0.00 0.00 174.62 175.57 2v1g h GLU 52 N 3.40 0.21 -0.55 4.92 4.81 -1.99 -0.84 114.58 124.54 2v1g h GLU 52 Ca -0.34 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.83 2v1g h GLU 52 Cb 1.15 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.48 2v1g h GLU 52 CO 0.62 0.35 0.30 0.00 -0.73 0.00 0.00 179.01 179.54 2v1g h ALA 53 N 1.68 0.71 -0.81 2.92 0.00 -1.99 0.17 119.26 121.95 2v1g h ALA 53 Ca 0.04 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2v1g h ALA 53 Cb 0.35 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2v1g h ALA 53 CO 0.02 0.24 0.34 0.93 0.00 0.00 0.00 179.25 180.77 2v1g h GLU 54 N 0.74 1.19 -0.42 0.00 5.08 -1.78 -0.95 114.58 118.44 2v1g h GLU 54 Ca 0.19 -0.21 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2v1g h GLU 54 Cb 0.06 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2v1g h GLU 54 CO -0.03 0.95 0.26 0.52 -1.00 0.00 0.00 179.01 179.72 2v1g h MET 55 N 1.17 0.52 -0.27 2.33 2.86 -0.45 -2.16 114.93 118.93 2v1g h MET 55 Ca 0.27 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.81 2v1g h MET 55 Cb 0.19 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 2v1g h MET 55 CO -0.03 0.34 -0.12 -0.22 1.06 0.00 0.00 176.91 177.95 2v1g h LYS 56 N 0.54 0.45 -0.00 1.72 1.63 -0.20 -2.57 116.57 118.13 2v1g h LYS 56 Ca 0.16 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2v1g h LYS 56 Cb -0.03 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.55 2v1g h LYS 56 CO -0.05 0.57 -0.05 0.00 -3.45 0.00 0.00 179.45 176.46 2v1g n ALA 57 N -2.48 2.52 -2.61 5.00 0.00 -0.41 -4.82 120.51 117.71 2v1g n ALA 57 Ca 0.00 -0.15 -0.43 0.00 0.00 0.00 0.00 53.44 52.86 2v1g n ALA 57 Cb 0.31 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.29 2v1g n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2v1g s SER 58 N -2.79 6.75 0.26 0.00 0.15 -0.84 -4.90 113.70 112.33 2v1g s SER 58 Ca 0.20 0.70 0.12 0.00 0.70 0.00 0.00 55.95 57.67 2v1g s SER 58 Cb 0.19 -2.50 0.27 0.00 -1.71 0.00 0.00 66.02 62.28 2v1g s SER 58 CO 0.51 -0.93 1.55 -0.33 1.20 0.00 0.00 173.24 175.25 2v1g h GLU 59 N 8.48 0.00 -0.07 5.44 4.39 -1.88 -2.89 114.58 128.05 2v1g h GLU 59 Ca -0.22 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.37 2v1g h GLU 59 Cb 1.07 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 2v1g h GLU 59 CO 1.02 0.65 -0.44 0.22 -1.16 0.00 0.00 179.01 179.30 2v1g h ASP 60 N 0.00 0.17 -0.57 1.42 3.58 -1.97 -0.69 116.42 118.36 2v1g h ASP 60 Ca -0.01 -0.07 -0.09 0.00 0.42 0.00 0.00 57.03 57.29 2v1g h ASP 60 Cb 1.22 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.20 2v1g h ASP 60 CO 0.08 0.59 0.02 0.25 -2.88 0.00 0.00 179.24 177.31 2v1g h LEU 61 N 0.13 0.97 -0.71 2.28 5.85 -1.86 -0.32 115.31 121.66 2v1g h LEU 61 Ca 0.01 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.40 2v1g h LEU 61 Cb 0.83 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 2v1g h LEU 61 CO 0.06 1.02 0.29 0.50 -0.34 0.00 0.00 178.44 179.98 2v1g h LYS 62 N 0.88 1.05 -0.38 1.25 3.64 -1.30 -0.11 116.57 121.60 2v1g h LYS 62 Ca 0.16 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2v1g h LYS 62 Cb 0.51 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 2v1g h LYS 62 CO 0.02 0.86 0.22 -0.22 -2.27 0.00 0.00 179.45 178.06 2v1g h LYS 63 N 1.00 0.43 -0.35 1.90 3.64 -0.82 -0.49 116.57 121.88 2v1g h LYS 63 Ca 0.24 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.51 2v1g h LYS 63 Cb 0.19 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2v1g h LYS 63 CO -0.02 0.28 -0.11 1.25 -2.27 0.00 0.00 179.45 178.59 2v1g h HIS 64 N 0.44 0.66 -0.99 1.91 2.76 -0.74 -1.56 115.15 117.64 2v1g h HIS 64 Ca 0.15 -0.11 0.01 0.00 -2.20 0.00 0.00 60.37 58.23 2v1g h HIS 64 Cb 0.02 -0.17 -0.05 0.00 1.55 0.00 0.00 27.41 28.75 2v1g h HIS 64 CO -0.08 0.69 0.66 0.78 -1.30 0.00 0.00 177.93 178.68 2v1g h GLY 65 N 0.95 1.39 0.97 5.26 0.00 -0.42 0.76 103.07 111.99 2v1g h GLY 65 Ca 0.10 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 2v1g h GLY 65 CO 0.03 0.50 0.24 -0.84 0.00 0.00 0.00 176.54 176.48 2v1g h THR 66 N 1.34 1.19 -0.41 4.70 2.02 -0.50 -1.02 112.91 120.23 2v1g h THR 66 Ca 0.36 -0.55 -0.00 0.00 0.77 0.00 0.00 66.41 66.99 2v1g h THR 66 Cb -0.15 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 2v1g h THR 66 CO -0.08 0.22 0.24 0.58 0.37 0.00 0.00 175.52 176.85 2v1g h VAL 67 N 0.67 1.14 0.10 3.16 2.07 -0.47 -0.47 116.25 122.45 2v1g h VAL 67 Ca 0.17 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 2v1g h VAL 67 Cb 0.12 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2v1g h VAL 67 CO -0.02 0.14 -0.05 0.58 0.02 0.00 0.00 177.57 178.24 2v1g h VAL 68 N 0.54 1.00 0.00 2.57 2.07 -0.70 -1.87 116.25 119.86 2v1g h VAL 68 Ca 0.15 -0.37 -0.11 0.00 0.82 0.00 0.00 66.70 67.19 2v1g h VAL 68 Cb 0.01 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2v1g h VAL 68 CO -0.03 0.09 -0.51 -0.07 0.02 0.00 0.00 177.57 177.08 2v1g h LEU 69 N -0.31 0.00 -0.53 2.57 3.38 -1.15 -1.44 115.31 117.84 2v1g h LEU 69 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2v1g h LEU 69 Cb 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2v1g h LEU 69 CO 0.02 0.51 0.17 0.74 0.09 0.00 0.00 178.44 179.97 2v1g h THR 70 N 0.00 1.23 -0.30 0.22 2.02 -0.99 0.66 112.91 115.74 2v1g h THR 70 Ca -0.01 -0.78 -0.03 0.00 0.77 0.00 0.00 66.41 66.37 2v1g h THR 70 Cb 0.98 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 2v1g h THR 70 CO 0.07 0.29 0.08 0.00 0.37 0.00 0.00 175.52 176.33 2v1g h ALA 71 N 1.03 0.40 -0.67 6.16 0.00 -1.02 -1.83 119.26 123.33 2v1g h ALA 71 Ca 0.17 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2v1g h ALA 71 Cb 0.27 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2v1g h ALA 71 CO -0.01 0.05 0.35 1.25 0.00 0.00 0.00 179.25 180.89 2v1g h LEU 72 N 0.33 0.86 -0.87 0.00 5.85 -1.16 -1.87 115.31 118.45 2v1g h LEU 72 Ca 0.10 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2v1g h LEU 72 Cb 0.27 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 2v1g h LEU 72 CO -0.00 0.73 0.48 1.23 -0.34 0.00 0.00 178.44 180.54 2v1g h GLY 73 N 0.93 1.30 1.01 3.75 0.00 -0.73 0.11 103.07 109.44 2v1g h GLY 73 Ca 0.23 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 2v1g h GLY 73 CO -0.03 0.56 0.51 -1.33 0.00 0.00 0.00 176.54 176.25 2v1g h GLY 74 N 1.22 1.22 0.84 4.60 0.00 -0.97 -1.16 103.07 108.81 2v1g h GLY 74 Ca 0.31 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 2v1g h GLY 74 CO -0.05 0.49 0.04 -2.22 0.00 0.00 0.00 176.54 174.80 2v1g h ILE 75 N 1.15 1.18 -0.87 2.60 2.04 -0.70 -3.14 117.51 119.76 2v1g h ILE 75 Ca 0.30 -0.54 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 2v1g h ILE 75 Cb -0.05 1.32 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 2v1g h ILE 75 CO -0.06 0.16 0.52 -0.07 0.00 0.00 0.00 178.15 178.71 2v1g h LEU 76 N -0.00 1.05 -0.68 1.44 3.38 -0.55 -1.13 115.31 118.82 2v1g h LEU 76 Ca 0.04 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2v1g h LEU 76 Cb 0.22 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2v1g h LEU 76 CO -0.00 0.80 0.00 0.29 0.09 0.00 0.00 178.44 179.62 2v1g n LYS 77 N -4.36 0.11 0.00 1.13 5.02 -0.46 -1.17 118.16 118.43 2v1g n LYS 77 Ca 0.10 0.46 0.14 0.00 -2.02 0.00 0.00 58.31 56.99 2v1g n LYS 77 Cb 0.06 -1.77 0.63 0.00 -0.02 0.00 0.00 35.03 33.93 2v1g n LYS 77 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2v1g n LYS 78 N -2.00 0.21 -3.83 1.97 4.76 -0.43 -4.95 118.16 113.90 2v1g n LYS 78 Ca 0.01 -0.03 -0.24 0.00 -2.87 0.00 0.00 58.31 55.18 2v1g n LYS 78 Cb 0.13 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.83 2v1g n LYS 78 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2v1g n LYS 79 N -1.37 -4.30 0.00 1.97 5.02 -0.32 -1.34 118.16 117.82 2v1g n LYS 79 Ca 0.10 0.53 0.00 0.00 -2.02 0.00 0.00 58.31 56.92 2v1g n LYS 79 Cb 0.30 -4.96 0.00 0.00 -0.02 0.00 0.00 35.03 30.35 2v1g n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2v1g n GLY 80 N -1.73 3.21 2.52 0.72 0.00 -1.26 -4.92 105.19 103.73 2v1g n GLY 80 Ca -0.26 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 2v1g n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2v1g n HIS 81 N -1.68 2.66 -0.96 1.61 8.25 -0.45 -4.59 115.22 120.06 2v1g n HIS 81 Ca 0.00 -2.87 0.08 0.00 -0.26 0.00 0.00 57.72 54.66 2v1g n HIS 81 Cb 0.00 -2.00 0.11 0.00 1.12 0.00 0.00 29.99 29.22 2v1g n HIS 81 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2v1g n HIS 82 N 2.59 0.00 -0.15 4.41 1.44 -1.26 -4.80 115.22 117.44 2v1g n HIS 82 Ca 0.61 -0.85 -0.03 0.00 -2.01 0.00 0.00 57.72 55.45 2v1g n HIS 82 Cb 0.27 -0.13 0.04 0.00 0.12 0.00 0.00 29.99 30.30 2v1g n HIS 82 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 2v1g h GLU 83 N 0.00 0.05 -0.49 -1.40 4.57 -1.99 0.23 114.58 115.56 2v1g h GLU 83 Ca 0.00 -0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.13 2v1g h GLU 83 Cb 0.95 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.50 2v1g h GLU 83 CO 0.00 0.04 0.13 0.00 -1.18 0.00 0.00 179.01 178.00 2v1g h ALA 84 N 1.46 1.32 0.16 2.92 0.00 -2.00 -0.53 119.26 122.58 2v1g h ALA 84 Ca 0.24 -0.18 -0.29 0.00 0.00 0.00 0.00 54.91 54.68 2v1g h ALA 84 Cb 0.37 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 17.97 2v1g h ALA 84 CO -0.45 0.49 -1.29 0.93 0.00 0.00 0.00 179.25 178.93 2v1g h GLU 85 N 0.71 0.42 0.22 0.00 3.07 -1.76 -3.39 114.58 113.84 2v1g h GLU 85 Ca 0.16 -0.66 -0.35 0.00 -0.50 0.00 0.00 59.36 58.02 2v1g h GLU 85 Cb 0.25 0.24 0.02 0.00 -0.84 0.00 0.00 28.75 28.41 2v1g h GLU 85 CO -0.00 1.30 -1.64 1.25 -1.40 0.00 0.00 179.01 178.51 2v1g h LEU 86 N 0.14 0.71 -0.15 1.33 6.46 -0.30 -3.34 115.31 120.16 2v1g h LEU 86 Ca -0.17 -0.92 0.05 0.00 -0.12 0.00 0.00 57.88 56.72 2v1g h LEU 86 Cb 1.99 -0.23 -0.06 0.00 -0.73 0.00 0.00 40.66 41.63 2v1g h LEU 86 CO 0.23 1.75 -0.28 0.50 -0.62 0.00 0.00 178.44 180.02 2v1g h LYS 87 N 0.12 -0.33 -0.72 1.25 3.64 -1.29 0.29 116.57 119.54 2v1g h LYS 87 Ca -0.31 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.10 2v1g h LYS 87 Cb 2.13 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 33.99 2v1g h LYS 87 CO 0.22 -0.22 0.47 -1.00 -2.27 0.00 0.00 179.45 176.65 2v1g h PRO 88 N -0.34 0.95 -0.37 1.90 0.13 -1.76 0.22 132.00 132.72 2v1g h PRO 88 Ca 0.10 -0.06 -0.10 0.00 -0.87 0.00 0.00 66.00 65.07 2v1g h PRO 88 Cb 0.50 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.41 2v1g h PRO 88 CO -0.34 0.63 -0.17 -0.07 -0.23 0.00 0.00 178.00 177.82 2v1g h LEU 89 N 0.98 0.79 -0.52 1.56 3.38 -1.52 0.56 115.31 120.54 2v1g h LEU 89 Ca 0.26 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2v1g h LEU 89 Cb -0.11 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.40 2v1g h LEU 89 CO -0.06 1.02 0.32 0.00 0.09 0.00 0.00 178.44 179.81 2v1g h ALA 90 N 0.80 0.66 -0.20 1.53 0.00 -0.51 -0.50 119.26 121.03 2v1g h ALA 90 Ca 0.08 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 2v1g h ALA 90 Cb 0.71 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2v1g h ALA 90 CO 0.05 0.15 -0.53 1.96 0.00 0.00 0.00 179.25 180.87 2v1g h GLN 91 N 0.70 0.59 -0.54 0.00 4.20 -0.77 -1.24 115.11 118.06 2v1g h GLN 91 Ca 0.19 -0.37 -0.07 0.00 0.06 0.00 0.00 58.65 58.46 2v1g h GLN 91 Cb -0.02 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 2v1g h GLN 91 CO -0.04 0.98 0.06 1.03 -0.67 0.00 0.00 178.83 180.19 2v1g h SER 92 N 0.46 0.88 0.34 1.46 0.87 -0.73 -0.02 113.55 116.81 2v1g h SER 92 Ca 0.01 -0.27 -0.13 0.00 -1.23 0.00 0.00 61.79 60.17 2v1g h SER 92 Cb 1.08 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.79 2v1g h SER 92 CO 0.10 0.93 -0.54 0.45 -0.53 0.00 0.00 176.83 177.25 2v1g h HIS 93 N 0.79 0.27 0.08 2.24 3.86 -0.84 -0.36 115.15 121.19 2v1g h HIS 93 Ca 0.16 -0.09 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 2v1g h HIS 93 Cb 0.45 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.87 2v1g h HIS 93 CO 0.03 0.71 -0.04 0.00 0.86 0.00 0.00 177.93 179.49 2v1g h ALA 94 N 1.27 -0.11 0.13 2.45 0.00 -1.16 0.16 119.26 122.01 2v1g h ALA 94 Ca 0.00 -0.20 -0.22 0.00 0.00 0.00 0.00 54.91 54.49 2v1g h ALA 94 Cb 1.01 0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.86 2v1g h ALA 94 CO 0.08 -0.13 -0.93 1.79 0.00 0.00 0.00 179.25 180.06 2v1g h THR 95 N -0.97 1.44 0.00 0.00 1.35 -1.05 -2.94 112.91 110.74 2v1g h THR 95 Ca -0.01 -2.48 -0.24 0.00 -0.55 0.00 0.00 66.41 63.13 2v1g h THR 95 Cb 0.44 3.03 -0.04 0.00 -1.73 0.00 0.00 68.15 69.85 2v1g h THR 95 CO 0.02 0.72 -1.32 1.17 -0.25 0.00 0.00 175.52 175.86 2v1g n LYS 96 N -4.04 0.57 0.07 4.72 4.81 -0.40 -4.56 118.16 119.33 2v1g n LYS 96 Ca -0.14 0.56 0.12 0.00 -0.87 0.00 0.00 58.31 57.98 2v1g n LYS 96 Cb 0.86 -1.74 0.06 0.00 0.02 0.00 0.00 35.03 34.23 2v1g n LYS 96 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2v1g n HIS 97 N -4.41 0.68 -3.41 5.64 8.25 -0.28 -4.98 115.22 116.70 2v1g n HIS 97 Ca -0.33 0.20 -0.17 0.00 -0.26 0.00 0.00 57.72 57.16 2v1g n HIS 97 Cb 0.69 -0.75 0.09 0.00 1.12 0.00 0.00 29.99 31.14 2v1g n HIS 97 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2v1g n LYS 98 N -2.35 -6.20 -3.43 -0.41 4.76 -0.12 -4.97 118.16 105.44 2v1g n LYS 98 Ca 0.01 0.85 -0.44 0.00 -2.87 0.00 0.00 58.31 55.87 2v1g n LYS 98 Cb 0.49 -5.87 -0.09 0.00 -1.84 0.00 0.00 35.03 27.73 2v1g n LYS 98 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2v1g s ILE 99 N -3.36 5.15 0.70 -0.18 -1.09 0.38 -4.93 121.20 117.86 2v1g s ILE 99 Ca 0.05 -0.97 -0.16 0.00 -2.23 0.00 0.00 60.65 57.33 2v1g s ILE 99 Cb -0.01 -4.02 0.02 0.00 -1.58 0.00 0.00 42.46 36.88 2v1g s ILE 99 CO 0.73 -0.49 1.25 -2.16 -1.23 0.00 0.00 174.94 173.05 2v1g s PRO 100 N 1.63 2.28 0.53 2.79 0.04 -1.26 -4.68 135.00 136.32 2v1g s PRO 100 Ca 0.04 1.93 0.18 0.00 0.04 0.00 0.00 61.00 63.20 2v1g s PRO 100 Cb -0.23 -1.83 1.32 0.00 0.04 0.00 0.00 34.50 33.81 2v1g s PRO 100 CO 0.07 -1.77 2.12 0.97 0.04 0.00 0.00 177.00 178.43 2v1g h ILE 101 N 0.07 0.92 -0.99 0.56 6.09 -1.94 0.44 117.51 122.66 2v1g h ILE 101 Ca -0.49 0.00 0.21 0.00 -1.37 0.00 0.00 64.86 63.20 2v1g h ILE 101 Cb 1.32 0.95 -0.10 0.00 0.47 0.00 0.00 36.82 39.46 2v1g h ILE 101 CO 0.51 0.00 0.62 0.50 -3.07 0.00 0.00 178.15 176.71 2v1g h LYS 102 N 0.00 0.63 0.00 2.19 1.63 -1.92 0.09 116.57 119.19 2v1g h LYS 102 Ca 0.05 -0.04 -0.11 0.00 -0.85 0.00 0.00 60.65 59.70 2v1g h LYS 102 Cb 0.20 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.67 2v1g h LYS 102 CO -0.00 0.41 -0.51 1.88 -3.45 0.00 0.00 179.45 177.79 2v1g h TYR 103 N 0.64 0.00 -0.06 1.91 -1.99 -1.24 -0.39 116.97 115.84 2v1g h TYR 103 Ca 0.57 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 61.15 2v1g h TYR 103 Cb 1.05 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.77 2v1g h TYR 103 CO -0.00 0.51 -0.61 -0.07 -0.00 0.00 0.00 178.16 177.98 2v1g h LEU 104 N 0.00 0.24 -0.17 3.88 3.38 -1.06 -1.13 115.31 120.45 2v1g h LEU 104 Ca -0.01 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2v1g h LEU 104 Cb 1.00 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 2v1g h LEU 104 CO 0.07 0.79 0.09 -0.08 0.09 0.00 0.00 178.44 179.39 2v1g h GLU 105 N 0.15 0.24 -0.53 1.13 4.81 -0.79 -1.27 114.58 118.32 2v1g h GLU 105 Ca -0.01 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.25 2v1g h GLU 105 Cb 1.12 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.40 2v1g h GLU 105 CO 0.09 0.26 0.23 0.74 -0.73 0.00 0.00 179.01 179.61 2v1g h PHE 106 N 0.16 0.42 -0.01 0.92 0.04 -0.83 -1.11 116.94 116.51 2v1g h PHE 106 Ca 0.06 0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.72 2v1g h PHE 106 Cb 0.10 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.12 2v1g h PHE 106 CO -0.03 0.17 -0.63 0.97 -0.60 0.00 0.00 178.31 178.19 2v1g h ILE 107 N 0.44 1.44 -0.29 -0.55 2.10 -1.11 -0.63 117.51 118.92 2v1g h ILE 107 Ca 0.25 -2.13 -0.01 0.00 1.08 0.00 0.00 64.86 64.05 2v1g h ILE 107 Cb 0.22 2.14 -0.01 0.00 -1.09 0.00 0.00 36.82 38.07 2v1g h ILE 107 CO -0.21 0.61 0.15 0.28 -1.08 0.00 0.00 178.15 177.90 2v1g h SER 108 N 0.03 0.36 -0.89 2.19 0.02 -0.72 -0.97 113.55 113.58 2v1g h SER 108 Ca -0.01 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 2v1g h SER 108 Cb 1.12 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 63.52 2v1g h SER 108 CO 0.08 0.36 0.56 0.44 -1.14 0.00 0.00 176.83 177.14 2v1g h ASP 109 N 0.34 1.04 -0.89 3.07 3.32 -0.98 -2.46 116.42 119.86 2v1g h ASP 109 Ca 0.10 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2v1g h ASP 109 Cb 0.08 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.33 2v1g h ASP 109 CO -0.01 0.78 0.57 0.00 -1.72 0.00 0.00 179.24 178.85 2v1g h ALA 110 N 1.31 1.32 -0.44 3.45 0.00 -0.69 -1.18 119.26 123.02 2v1g h ALA 110 Ca 0.32 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2v1g h ALA 110 Cb -0.10 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.31 2v1g h ALA 110 CO -0.07 0.61 0.21 0.82 0.00 0.00 0.00 179.25 180.82 2v1g h ILE 111 N 1.22 1.18 -0.59 0.00 2.04 -0.74 0.20 117.51 120.82 2v1g h ILE 111 Ca 0.32 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 2v1g h ILE 111 Cb -0.10 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 2v1g h ILE 111 CO -0.07 0.20 0.34 0.40 0.00 0.00 0.00 178.15 179.03 2v1g h ILE 112 N 0.56 1.18 -0.35 -0.67 1.08 -1.07 -0.86 117.51 117.39 2v1g h ILE 112 Ca 0.15 -0.42 -0.00 0.00 -0.39 0.00 0.00 64.86 64.20 2v1g h ILE 112 Cb 0.13 0.40 -0.02 0.00 -3.07 0.00 0.00 36.82 34.25 2v1g h ILE 112 CO -0.02 0.19 0.21 -0.74 -0.69 0.00 0.00 178.15 177.10 2v1g h HIS 113 N 0.79 0.46 -0.50 1.37 2.76 -0.90 -2.40 115.15 116.73 2v1g h HIS 113 Ca 0.21 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.31 2v1g h HIS 113 Cb 0.00 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 28.79 2v1g h HIS 113 CO -0.02 0.34 0.05 0.28 -1.30 0.00 0.00 177.93 177.28 2v1g h VAL 114 N 0.45 1.24 -0.51 5.26 2.07 -0.71 0.63 116.25 124.67 2v1g h VAL 114 Ca 0.12 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.71 2v1g h VAL 114 Cb 0.02 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2v1g h VAL 114 CO -0.02 0.34 0.33 -0.07 0.02 0.00 0.00 177.57 178.17 2v1g h LEU 115 N 0.76 0.59 -0.62 2.57 3.38 -0.91 0.37 115.31 121.45 2v1g h LEU 115 Ca 0.16 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.01 2v1g h LEU 115 Cb 0.39 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2v1g h LEU 115 CO 0.01 0.44 0.02 0.45 0.09 0.00 0.00 178.44 179.45 2v1g h HIS 116 N 0.69 1.18 -0.48 1.13 3.86 -0.98 -1.35 115.15 119.20 2v1g h HIS 116 Ca 0.19 -0.20 -0.10 0.00 -1.16 0.00 0.00 60.37 59.10 2v1g h HIS 116 Cb -0.07 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.07 2v1g h HIS 116 CO -0.04 1.03 -0.11 1.03 0.86 0.00 0.00 177.93 180.70 2v1g h SER 117 N 0.99 0.88 1.07 2.45 0.87 -0.39 -1.90 113.55 117.51 2v1g h SER 117 Ca 0.18 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2v1g h SER 117 Cb 0.55 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2v1g h SER 117 CO 0.03 1.00 -0.70 0.11 -0.53 0.00 0.00 176.83 176.74 2v1g h LYS 118 N 0.79 0.00 -1.39 2.24 1.57 -0.93 -3.38 116.57 115.47 2v1g h LYS 118 Ca 0.13 0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 58.47 2v1g h LYS 118 Cb 0.62 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.53 2v1g h LYS 118 CO 0.04 0.00 -1.10 0.72 -0.57 0.00 0.00 179.45 178.54 2v1g n HIS 119 N -2.47 1.42 -2.01 -1.35 8.25 -0.51 -5.09 115.22 113.47 2v1g n HIS 119 Ca 0.02 -3.16 -0.42 0.00 -0.26 0.00 0.00 57.72 53.91 2v1g n HIS 119 Cb 0.50 -0.35 -0.03 0.00 1.12 0.00 0.00 29.99 31.22 2v1g n HIS 119 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2v1g s PRO 120 N -3.04 4.25 0.00 -0.41 0.04 -0.73 -0.77 135.00 134.35 2v1g s PRO 120 Ca 0.34 2.28 0.00 0.00 0.04 0.00 0.00 61.00 63.67 2v1g s PRO 120 Cb 0.41 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.79 2v1g s PRO 120 CO -0.03 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 176.89 2v1g n GLY 121 N 3.38 1.89 0.08 0.56 0.00 -1.26 -4.83 105.19 105.01 2v1g n GLY 121 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.24 2v1g n GLY 121 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2v1g n ASP 122 N 0.00 2.37 -3.63 1.61 2.03 0.05 -4.81 116.55 114.17 2v1g n ASP 122 Ca 0.00 -3.09 -0.29 0.00 0.52 0.00 0.00 54.79 51.93 2v1g n ASP 122 Cb 0.00 -0.43 -0.12 0.00 -0.72 0.00 0.00 41.12 39.85 2v1g n ASP 122 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2v1g s PHE 123 N -2.88 1.84 0.99 -0.67 5.36 -1.18 -5.01 117.98 116.42 2v1g s PHE 123 Ca 0.32 -2.44 -0.14 0.00 -0.96 0.00 0.00 56.93 53.71 2v1g s PHE 123 Cb 0.28 -1.64 0.18 0.00 -0.34 0.00 0.00 43.02 41.51 2v1g s PHE 123 CO 0.03 -0.76 1.15 0.20 -1.46 0.00 0.00 175.22 174.38 2v1g s GLY 124 N 0.08 1.60 0.24 13.12 0.00 -1.26 -4.65 107.32 116.44 2v1g s GLY 124 Ca 0.23 -0.69 -0.07 0.00 0.00 0.00 0.00 44.72 44.18 2v1g s GLY 124 CO -0.08 -0.03 1.89 0.00 0.00 0.00 0.00 173.10 174.88 2v1g h ALA 125 N -1.79 1.18 -0.49 3.20 0.00 -2.00 0.67 119.26 120.03 2v1g h ALA 125 Ca -0.49 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.30 2v1g h ALA 125 Cb 1.31 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2v1g h ALA 125 CO 0.52 0.62 0.21 0.38 0.00 0.00 0.00 179.25 180.98 2v1g h ASP 126 N 1.27 0.66 -0.52 0.00 3.04 -1.99 -1.27 116.42 117.60 2v1g h ASP 126 Ca 0.33 -0.16 -0.03 0.00 -3.24 0.00 0.00 57.03 53.94 2v1g h ASP 126 Cb -0.07 -0.17 -0.02 0.00 -1.04 0.00 0.00 39.33 38.02 2v1g h ASP 126 CO -0.06 0.64 0.22 0.00 -2.04 0.00 0.00 179.24 177.99 2v1g h ALA 127 N 1.05 0.68 -0.66 4.15 0.00 -1.71 -0.63 119.26 122.13 2v1g h ALA 127 Ca 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2v1g h ALA 127 Cb 0.17 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2v1g h ALA 127 CO -0.02 0.28 0.37 0.37 0.00 0.00 0.00 179.25 180.25 2v1g h GLN 128 N 0.71 0.92 -0.37 0.00 4.15 -0.78 0.05 115.11 119.79 2v1g h GLN 128 Ca 0.18 -0.10 0.01 0.00 0.77 0.00 0.00 58.65 59.51 2v1g h GLN 128 Cb 0.18 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 2v1g h GLN 128 CO -0.02 0.69 0.22 0.78 -1.93 0.00 0.00 178.83 178.57 2v1g h GLY 129 N 0.91 0.52 0.74 2.39 0.00 -0.73 0.01 103.07 106.90 2v1g h GLY 129 Ca 0.23 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.36 2v1g h GLY 129 CO -0.04 0.15 -0.04 0.00 0.00 0.00 0.00 176.54 176.61 2v1g h ALA 130 N 1.16 0.19 -0.82 3.60 0.00 -0.82 -1.72 119.26 120.85 2v1g h ALA 130 Ca 0.15 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2v1g h ALA 130 Cb -0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2v1g h ALA 130 CO -0.06 -0.05 0.44 1.98 0.00 0.00 0.00 179.25 181.56 2v1g h MET 131 N -0.05 1.14 -0.48 0.00 1.85 -0.91 -1.19 114.93 115.29 2v1g h MET 131 Ca 0.03 -0.13 0.01 0.00 -0.61 0.00 0.00 59.70 59.00 2v1g h MET 131 Cb 0.48 -0.22 -0.03 0.00 0.43 0.00 0.00 31.60 32.26 2v1g h MET 131 CO 0.02 0.84 0.31 1.15 -0.40 0.00 0.00 176.91 178.83 2v1g h THR 132 N 1.15 1.11 -0.84 -0.77 2.02 -0.86 -0.67 112.91 114.03 2v1g h THR 132 Ca 0.29 -0.22 0.01 0.00 0.77 0.00 0.00 66.41 67.26 2v1g h THR 132 Cb 0.03 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 66.82 2v1g h THR 132 CO -0.05 0.12 0.56 0.11 0.37 0.00 0.00 175.52 176.63 2v1g h LYS 133 N 0.64 1.10 -0.62 6.66 1.57 -0.76 0.32 116.57 125.47 2v1g h LYS 133 Ca 0.18 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.81 2v1g h LYS 133 Cb -0.06 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 31.98 2v1g h LYS 133 CO -0.05 0.73 0.05 0.00 -0.57 0.00 0.00 179.45 179.61 2v1g h ALA 134 N 1.31 0.84 -0.12 3.86 0.00 -0.74 -0.66 119.26 123.75 2v1g h ALA 134 Ca 0.31 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 2v1g h ALA 134 Cb -0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2v1g h ALA 134 CO -0.07 0.64 -0.57 -0.07 0.00 0.00 0.00 179.25 179.18 2v1g h LEU 135 N 0.98 0.41 -0.53 0.00 3.38 -0.78 -1.59 115.31 117.17 2v1g h LEU 135 Ca 0.18 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 2v1g h LEU 135 Cb 0.51 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2v1g h LEU 135 CO 0.02 0.89 0.05 -0.33 0.09 0.00 0.00 178.44 179.16 2v1g h GLU 136 N 0.28 0.91 -0.36 1.13 5.08 -0.76 -0.54 114.58 120.31 2v1g h GLU 136 Ca 0.00 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2v1g h GLU 136 Cb 1.08 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 2v1g h GLU 136 CO 0.10 0.90 0.21 1.25 -1.00 0.00 0.00 179.01 180.46 2v1g h LEU 137 N 0.79 0.44 -0.08 1.33 5.85 -0.96 0.22 115.31 122.90 2v1g h LEU 137 Ca 0.16 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.84 2v1g h LEU 137 Cb 0.46 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 2v1g h LEU 137 CO 0.02 0.39 -0.15 0.15 -0.34 0.00 0.00 178.44 178.51 2v1g h PHE 138 N 0.46 -0.38 -0.65 1.25 3.57 -1.19 -0.48 116.94 119.52 2v1g h PHE 138 Ca 0.13 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 2v1g h PHE 138 Cb 0.03 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.93 2v1g h PHE 138 CO -0.03 -0.22 0.21 -0.09 -2.23 0.00 0.00 178.31 175.94 2v1g h ARG 139 N -0.21 1.00 -0.28 1.11 2.43 -0.85 -1.61 114.38 115.98 2v1g h ARG 139 Ca 0.08 -0.21 -0.14 0.00 -0.81 0.00 0.00 59.98 58.89 2v1g h ARG 139 Cb 0.32 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 2v1g h ARG 139 CO -0.21 0.88 -0.42 -0.97 -1.51 0.00 0.00 179.97 177.74 2v1g h ASN 140 N 0.93 0.72 -0.05 -3.80 -0.73 -0.36 0.13 115.58 112.43 2v1g h ASN 140 Ca 0.21 -0.33 -0.12 0.00 1.87 0.00 0.00 56.30 57.92 2v1g h ASN 140 Cb 0.29 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.67 2v1g h ASN 140 CO -0.01 1.05 -0.36 0.44 -0.37 0.00 0.00 177.43 178.18 2v1g h ASP 141 N 0.55 0.57 -0.45 1.15 3.32 -0.92 -1.50 116.42 119.13 2v1g h ASP 141 Ca 0.04 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 56.83 2v1g h ASP 141 Cb 0.95 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.33 2v1g h ASP 141 CO 0.09 0.88 0.17 0.40 -1.72 0.00 0.00 179.24 179.05 2v1g h ILE 142 N 0.46 1.21 -0.99 0.35 2.04 -0.97 -2.87 117.51 116.73 2v1g h ILE 142 Ca 0.05 -0.66 0.11 0.00 1.00 0.00 0.00 64.86 65.37 2v1g h ILE 142 Cb 0.84 0.80 -0.08 0.00 -0.74 0.00 0.00 36.82 37.64 2v1g h ILE 142 CO 0.07 0.24 0.62 0.00 0.00 0.00 0.00 178.15 179.08 2v1g h ALA 143 N 1.02 1.48 -0.72 1.87 0.00 -0.37 0.63 119.26 123.16 2v1g h ALA 143 Ca 0.15 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2v1g h ALA 143 Cb 0.21 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2v1g h ALA 143 CO -0.01 0.23 0.25 0.00 0.00 0.00 0.00 179.25 179.72 2v1g h ALA 144 N 1.53 1.07 -0.48 0.00 0.00 -1.09 0.03 119.26 120.33 2v1g h ALA 144 Ca 0.49 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 2v1g h ALA 144 Cb 0.46 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2v1g h ALA 144 CO -0.26 0.64 -0.20 0.87 0.00 0.00 0.00 179.25 180.30 2v1g h LYS 145 N 1.06 0.96 -0.79 0.00 1.79 -1.00 -2.01 116.57 116.58 2v1g h LYS 145 Ca 0.24 -0.40 0.01 0.00 -2.18 0.00 0.00 60.65 58.32 2v1g h LYS 145 Cb 0.26 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.83 2v1g h LYS 145 CO -0.01 1.06 0.52 1.88 -1.08 0.00 0.00 179.45 181.82 2v1g h TYR 146 N 0.83 0.99 -0.64 -1.35 -1.99 -0.54 -2.21 116.97 112.07 2v1g h TYR 146 Ca 0.11 0.02 -0.06 0.00 2.00 0.00 0.00 58.73 60.81 2v1g h TYR 146 Cb 0.77 -0.33 -0.03 0.00 2.00 0.00 0.00 36.73 39.14 2v1g h TYR 146 CO 0.05 0.61 0.18 -0.22 -0.00 0.00 0.00 178.16 178.78 2v1g h LYS 147 N 1.05 1.00 -0.63 4.88 3.64 -0.76 -0.24 116.57 125.51 2v1g h LYS 147 Ca 0.30 -0.23 0.13 0.00 -1.27 0.00 0.00 60.65 59.58 2v1g h LYS 147 Cb -0.09 -0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 31.49 2v1g h LYS 147 CO -0.08 0.89 0.03 1.49 -2.27 0.00 0.00 179.45 179.51 2v1g h GLU 148 N 0.92 0.14 0.00 1.90 4.81 -1.00 -0.54 114.58 120.81 2v1g h GLU 148 Ca 0.20 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2v1g h GLU 148 Cb 0.32 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2v1g h GLU 148 CO -0.00 0.09 0.00 1.28 -0.73 0.00 0.00 179.01 179.65 2v1g n LEU 149 N -5.26 0.00 -1.46 1.64 4.77 -0.86 -4.90 117.00 110.93 2v1g n LEU 149 Ca 0.10 0.45 -0.15 0.00 -0.03 0.00 0.00 56.01 56.38 2v1g n LEU 149 Cb 0.36 -0.45 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 2v1g n LEU 149 CO 0.11 -0.03 -0.17 0.61 -1.33 0.00 0.00 177.39 176.58 2v1g n GLY 150 N 1.23 0.42 3.75 -0.72 0.00 -0.21 -4.98 105.19 104.68 2v1g n GLY 150 Ca 0.08 -0.30 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 2v1g n GLY 150 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2v1g s PHE 151 N -2.66 3.66 0.00 1.61 5.36 -0.25 -4.92 117.98 120.77 2v1g s PHE 151 Ca 0.00 1.23 0.00 0.00 -0.96 0.00 0.00 56.93 57.20 2v1g s PHE 151 Cb 0.00 -2.68 0.00 0.00 -0.34 0.00 0.00 43.02 40.00 2v1g s PHE 151 CO 0.00 0.27 0.00 1.04 -1.46 0.00 0.00 175.22 175.07 2v1g n GLN 152 N 3.03 0.00 0.00 10.12 1.13 -1.26 -4.63 117.38 125.77 2v1g n GLN 152 Ca -0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.01 2v1g n GLN 152 Cb 0.51 -0.82 0.00 0.00 0.11 0.00 0.00 30.24 30.04 2v1g n GLN 152 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03