#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oqc n ASP 14 N 0.00 0.00 -4.64 0.00 2.03 -1.26 -5.13 116.55 107.56 1oqc n ASP 14 Ca 0.00 -0.13 -0.25 0.00 0.52 0.00 0.00 54.79 54.93 1oqc n ASP 14 Cb 0.00 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.31 1oqc n ASP 14 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1oqc n PRO 16 N -0.99 1.52 -2.11 0.00 -0.02 -1.26 -4.92 135.00 127.22 1oqc n PRO 16 Ca -0.04 0.55 -0.39 0.00 -2.02 0.00 0.00 63.50 61.60 1oqc n PRO 16 Cb 0.63 -2.25 -0.01 0.00 -0.02 0.00 0.00 33.50 31.86 1oqc n PRO 16 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1oqc s GLN 17 N -2.31 4.05 0.75 -0.52 -1.52 -1.26 -5.04 119.66 113.81 1oqc s GLN 17 Ca 0.65 2.10 -0.00 0.00 -1.95 0.00 0.00 55.36 56.16 1oqc s GLN 17 Cb -0.50 -2.79 0.15 0.00 -0.22 0.00 0.00 33.01 29.65 1oqc s GLN 17 CO 0.55 -0.41 1.02 -0.40 -0.25 0.00 0.00 175.29 175.80 1oqc n ASP 18 N 0.23 1.40 -0.13 5.90 5.68 -1.26 -4.81 116.55 123.55 1oqc n ASP 18 Ca 0.03 -2.17 -0.04 0.00 -0.50 0.00 0.00 54.79 52.11 1oqc n ASP 18 Cb 0.44 -0.66 0.04 0.00 -1.14 0.00 0.00 41.12 39.80 1oqc n ASP 18 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1oqc h ARG 19 N 0.00 0.19 -0.56 0.11 2.43 -1.99 -1.46 114.38 113.09 1oqc h ARG 19 Ca -0.34 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 58.76 1oqc h ARG 19 Cb 1.25 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 1oqc h ARG 19 CO 0.36 0.13 0.13 0.93 -1.51 0.00 0.00 179.97 180.01 1oqc h GLU 20 N 0.20 0.91 -0.24 0.20 3.07 -1.99 -1.22 114.58 115.51 1oqc h GLU 20 Ca 0.21 -0.22 -0.03 0.00 -0.50 0.00 0.00 59.36 58.82 1oqc h GLU 20 Cb 0.27 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 1oqc h GLU 20 CO -0.29 0.85 0.03 0.93 -1.40 0.00 0.00 179.01 179.13 1oqc h GLU 21 N 0.81 0.41 -0.77 2.33 5.08 -1.88 -0.82 114.58 119.75 1oqc h GLU 21 Ca 0.18 -0.12 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1oqc h GLU 21 Cb 0.36 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 1oqc h GLU 21 CO 0.00 0.56 0.51 1.25 -1.00 0.00 0.00 179.01 180.33 1oqc h LEU 22 N 0.21 0.88 0.50 1.33 5.85 -1.24 -1.89 115.31 120.95 1oqc h LEU 22 Ca 0.07 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 1oqc h LEU 22 Cb 0.35 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1oqc h LEU 22 CO 0.01 0.64 -0.26 1.23 -0.34 0.00 0.00 178.44 179.71 1oqc h GLY 23 N 1.04 -0.74 0.46 3.75 0.00 -0.95 0.12 103.07 106.76 1oqc h GLY 23 Ca 0.28 0.28 0.09 0.00 0.00 0.00 0.00 47.33 47.98 1oqc h GLY 23 CO -0.06 -0.27 0.29 3.21 0.00 0.00 0.00 176.54 179.70 1oqc h ARG 24 N -0.70 0.49 -0.26 4.80 3.08 -1.02 0.22 114.38 120.99 1oqc h ARG 24 Ca -0.07 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.82 1oqc h ARG 24 Cb 0.55 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1oqc h ARG 24 CO 0.10 0.32 -0.38 -0.91 -1.07 0.00 0.00 179.97 178.03 1oqc h ASN 25 N 0.50 0.62 -0.18 7.04 -0.26 -1.21 -1.59 115.58 120.50 1oqc h ASN 25 Ca 0.32 -0.27 -0.20 0.00 -0.56 0.00 0.00 56.30 55.58 1oqc h ASN 25 Cb 0.34 -0.17 0.01 0.00 -1.06 0.00 0.00 38.32 37.44 1oqc h ASN 25 CO -0.27 0.94 -0.67 0.74 -1.06 0.00 0.00 177.43 177.10 1oqc h THR 26 N 0.49 1.29 -0.77 2.81 2.02 -0.14 -1.77 112.91 116.84 1oqc h THR 26 Ca 0.05 -1.88 -0.04 0.00 0.77 0.00 0.00 66.41 65.30 1oqc h THR 26 Cb 0.88 1.92 -0.03 0.00 -1.74 0.00 0.00 68.15 69.18 1oqc h THR 26 CO 0.08 0.60 0.32 -0.50 0.37 0.00 0.00 175.52 176.38 1oqc h TRP 27 N 0.51 1.16 -0.15 3.16 -0.00 -0.94 0.21 115.95 119.90 1oqc h TRP 27 Ca -0.03 -0.08 0.00 0.00 -0.00 0.00 0.00 58.89 58.78 1oqc h TRP 27 Cb 1.30 -0.35 -0.01 0.00 -0.00 0.00 0.00 29.16 30.10 1oqc h TRP 27 CO 0.09 0.87 0.08 0.00 -0.00 0.00 0.00 178.44 179.48 1oqc h ALA 28 N 1.23 0.18 0.09 1.49 0.00 -1.19 0.18 119.26 121.24 1oqc h ALA 28 Ca 0.26 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1oqc h ALA 28 Cb 0.19 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1oqc h ALA 28 CO -0.02 -0.35 -0.05 0.35 0.00 0.00 0.00 179.25 179.18 1oqc h PHE 29 N 0.18 -0.13 -0.31 0.00 3.57 -0.72 -1.83 116.94 117.70 1oqc h PHE 29 Ca 0.06 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1oqc h PHE 29 Cb -0.01 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1oqc h PHE 29 CO -0.08 -0.08 0.19 -0.07 -2.23 0.00 0.00 178.31 176.04 1oqc h LEU 30 N -0.13 0.37 -1.05 0.59 3.38 -0.33 0.12 115.31 118.25 1oqc h LEU 30 Ca -0.01 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1oqc h LEU 30 Cb 0.11 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1oqc h LEU 30 CO 0.01 0.29 -0.28 0.45 0.09 0.00 0.00 178.44 179.01 1oqc h HIS 31 N 0.41 0.37 -0.16 1.13 3.86 -0.63 -0.65 115.15 119.48 1oqc h HIS 31 Ca 0.11 -0.08 -0.22 0.00 -1.16 0.00 0.00 60.37 59.03 1oqc h HIS 31 Cb -0.01 -0.09 0.01 0.00 1.06 0.00 0.00 27.41 28.37 1oqc h HIS 31 CO -0.05 0.58 -0.75 1.15 0.86 0.00 0.00 177.93 179.72 1oqc h THR 32 N 0.29 1.28 -0.36 2.45 2.02 -1.14 0.96 112.91 118.42 1oqc h THR 32 Ca 0.04 -1.96 0.05 0.00 0.77 0.00 0.00 66.41 65.32 1oqc h THR 32 Cb 0.65 1.95 -0.05 0.00 -1.74 0.00 0.00 68.15 68.96 1oqc h THR 32 CO 0.05 0.62 0.09 0.25 0.37 0.00 0.00 175.52 176.89 1oqc h LEU 33 N 0.54 0.05 -0.61 2.58 5.85 -0.38 -2.00 115.31 121.34 1oqc h LEU 33 Ca -0.04 0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 1oqc h LEU 33 Cb 1.38 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.45 1oqc h LEU 33 CO 0.15 0.06 -0.08 0.00 -0.34 0.00 0.00 178.44 178.24 1oqc h ALA 34 N 1.26 0.81 -0.29 1.25 0.00 -1.02 -2.47 119.26 118.80 1oqc h ALA 34 Ca 0.17 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1oqc h ALA 34 Cb 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1oqc h ALA 34 CO -0.21 0.67 0.20 0.00 0.00 0.00 0.00 179.25 179.91 1oqc h ALA 35 N 0.98 2.01 -0.34 0.00 0.00 -0.11 -2.42 119.26 119.39 1oqc h ALA 35 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1oqc h ALA 35 Cb 0.64 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1oqc h ALA 35 CO 0.04 -0.07 0.00 0.66 0.00 0.00 0.00 179.25 179.88 1oqc n TYR 36 N -4.49 0.44 -1.99 0.00 4.02 -0.86 -4.97 117.16 109.32 1oqc n TYR 36 Ca 0.03 -0.31 -0.37 0.00 -0.01 0.00 0.00 57.90 57.24 1oqc n TYR 36 Cb 0.22 -0.01 0.03 0.00 -0.02 0.00 0.00 39.34 39.55 1oqc n TYR 36 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1oqc s TYR 37 N -1.17 2.46 0.47 -0.72 5.04 -0.91 -4.92 117.35 117.60 1oqc s TYR 37 Ca 0.30 1.47 -0.25 0.00 -2.44 0.00 0.00 57.07 56.15 1oqc s TYR 37 Cb 0.17 -3.57 -0.08 0.00 0.35 0.00 0.00 41.96 38.83 1oqc s TYR 37 CO 0.23 -2.30 1.43 -2.14 -1.34 0.00 0.00 175.55 171.43 1oqc s PRO 38 N -3.03 3.57 0.25 4.97 0.02 -1.26 -4.58 135.00 134.94 1oqc s PRO 38 Ca 0.72 2.43 0.06 0.00 0.02 0.00 0.00 61.00 64.23 1oqc s PRO 38 Cb -0.34 -2.58 0.30 0.00 0.02 0.00 0.00 34.50 31.90 1oqc s PRO 38 CO 0.39 -0.92 1.59 -0.44 -0.33 0.00 0.00 177.00 177.29 1oqc h ASP 39 N 2.15 0.20 -2.26 2.53 3.32 -1.93 -2.21 116.42 118.21 1oqc h ASP 39 Ca -0.51 -0.11 -0.60 0.00 0.02 0.00 0.00 57.03 55.83 1oqc h ASP 39 Cb 1.27 -0.06 -0.42 0.00 0.22 0.00 0.00 39.33 40.35 1oqc h ASP 39 CO 0.60 0.74 -0.60 0.80 -1.72 0.00 0.00 179.24 179.06 1oqc n MET 40 N -3.87 3.06 -2.14 3.56 1.56 -1.26 -3.93 117.12 114.09 1oqc n MET 40 Ca -0.02 -4.81 -0.35 0.00 -0.27 0.00 0.00 57.70 52.25 1oqc n MET 40 Cb 0.60 -2.25 0.02 0.00 2.15 0.00 0.00 33.22 33.74 1oqc n MET 40 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 1oqc s PRO 41 N -3.18 3.18 0.73 2.12 0.04 -1.24 -5.01 135.00 131.63 1oqc s PRO 41 Ca 0.46 1.71 -0.11 0.00 0.04 0.00 0.00 61.00 63.10 1oqc s PRO 41 Cb 0.24 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.84 1oqc s PRO 41 CO -0.10 -1.02 1.08 0.95 0.04 0.00 0.00 177.00 177.95 1oqc s THR 42 N -1.69 3.60 0.35 1.26 -4.23 -1.26 -4.81 115.64 108.85 1oqc s THR 42 Ca 0.75 0.52 0.07 0.00 -1.18 0.00 0.00 61.69 61.85 1oqc s THR 42 Cb -0.27 -3.32 0.31 0.00 1.34 0.00 0.00 72.50 70.56 1oqc s THR 42 CO 0.30 -0.68 1.90 -0.65 -0.54 0.00 0.00 174.62 174.95 1oqc h PRO 43 N -0.84 0.74 -0.47 3.99 0.11 -1.99 -0.23 132.00 133.31 1oqc h PRO 43 Ca -0.45 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 1oqc h PRO 43 Cb 1.24 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1oqc h PRO 43 CO 0.59 0.49 -0.19 1.49 -0.21 0.00 0.00 178.00 180.18 1oqc h GLU 44 N 0.77 0.94 -0.38 1.05 4.81 -1.99 -1.35 114.58 118.42 1oqc h GLU 44 Ca 0.41 -0.38 -0.09 0.00 -0.13 0.00 0.00 59.36 59.17 1oqc h GLU 44 Cb 0.52 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1oqc h GLU 44 CO -0.17 1.04 -0.12 1.96 -0.73 0.00 0.00 179.01 180.98 1oqc h GLN 45 N 0.82 0.68 -0.51 1.92 4.20 -1.58 0.06 115.11 120.70 1oqc h GLN 45 Ca 0.11 -0.22 -0.10 0.00 0.06 0.00 0.00 58.65 58.51 1oqc h GLN 45 Cb 0.74 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 1oqc h GLN 45 CO 0.06 0.78 -0.07 1.96 -0.67 0.00 0.00 178.83 180.89 1oqc h GLN 46 N 0.62 0.92 -0.20 1.46 4.20 -0.79 -1.30 115.11 120.01 1oqc h GLN 46 Ca 0.11 -0.30 -0.06 0.00 0.06 0.00 0.00 58.65 58.45 1oqc h GLN 46 Cb 0.57 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.27 1oqc h GLN 46 CO 0.04 0.95 -0.13 1.96 -0.67 0.00 0.00 178.83 180.98 1oqc h GLN 47 N 0.83 0.44 -0.62 1.46 4.20 -0.88 -2.79 115.11 117.74 1oqc h GLN 47 Ca 0.14 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1oqc h GLN 47 Cb 0.59 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1oqc h GLN 47 CO 0.04 0.75 0.41 -0.44 -0.67 0.00 0.00 178.83 178.91 1oqc h ASP 48 N 0.12 0.72 -0.44 1.46 3.32 -0.84 -1.18 116.42 119.57 1oqc h ASP 48 Ca 0.04 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.98 1oqc h ASP 48 Cb 0.63 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 1oqc h ASP 48 CO 0.03 0.53 -0.04 -0.03 -1.72 0.00 0.00 179.24 178.01 1oqc h MET 49 N 0.84 0.88 -0.44 3.56 4.05 -1.26 0.33 114.93 122.89 1oqc h MET 49 Ca 0.23 -0.27 -0.03 0.00 -0.28 0.00 0.00 59.70 59.35 1oqc h MET 49 Cb -0.09 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 30.61 1oqc h MET 49 CO -0.05 0.90 0.17 0.00 0.23 0.00 0.00 176.91 178.16 1oqc h ALA 50 N 1.14 0.57 -0.43 0.39 0.00 -1.21 -1.28 119.26 118.45 1oqc h ALA 50 Ca 0.14 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1oqc h ALA 50 Cb 0.54 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1oqc h ALA 50 CO 0.03 0.18 -0.14 0.37 0.00 0.00 0.00 179.25 179.70 1oqc h GLN 51 N 0.57 0.80 -0.22 0.00 5.75 -0.87 -1.64 115.11 119.50 1oqc h GLN 51 Ca 0.15 -0.28 0.01 0.00 -0.15 0.00 0.00 58.65 58.37 1oqc h GLN 51 Cb 0.20 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 1oqc h GLN 51 CO -0.01 0.89 0.12 0.35 -2.65 0.00 0.00 178.83 177.53 1oqc h PHE 52 N 0.72 0.22 -0.89 3.99 3.57 -0.00 -0.30 116.94 124.24 1oqc h PHE 52 Ca 0.12 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 1oqc h PHE 52 Cb 0.63 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.26 1oqc h PHE 52 CO 0.03 0.13 0.49 0.82 -2.23 0.00 0.00 178.31 177.55 1oqc h ILE 53 N 0.25 1.26 -0.16 1.41 1.08 -1.05 0.13 117.51 120.42 1oqc h ILE 53 Ca 0.09 -0.64 -0.01 0.00 -0.39 0.00 0.00 64.86 63.91 1oqc h ILE 53 Cb 0.01 0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 33.80 1oqc h ILE 53 CO -0.05 0.29 0.07 -0.74 -0.69 0.00 0.00 178.15 177.03 1oqc h HIS 54 N 1.25 0.23 -0.48 1.37 2.76 -0.78 -1.78 115.15 117.72 1oqc h HIS 54 Ca 0.32 -0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.39 1oqc h HIS 54 Cb 0.02 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 28.90 1oqc h HIS 54 CO 0.01 0.28 -0.04 0.82 -1.30 0.00 0.00 177.93 177.70 1oqc h ILE 55 N 0.11 1.25 -0.54 6.26 2.04 -0.77 -2.70 117.51 123.15 1oqc h ILE 55 Ca 0.05 -1.09 0.07 0.00 1.00 0.00 0.00 64.86 64.89 1oqc h ILE 55 Cb 0.14 0.93 -0.06 0.00 -0.74 0.00 0.00 36.82 37.10 1oqc h ILE 55 CO -0.01 0.38 0.23 0.15 0.00 0.00 0.00 178.15 178.91 1oqc h PHE 56 N 0.75 0.42 0.00 1.37 3.57 -0.49 -0.83 116.94 121.73 1oqc h PHE 56 Ca 0.14 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1oqc h PHE 56 Cb 0.52 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.15 1oqc h PHE 56 CO 0.03 0.16 0.00 0.66 -2.23 0.00 0.00 178.31 176.93 1oqc h SER 57 N 0.44 0.00 0.72 0.41 4.64 -1.00 -0.05 113.55 118.72 1oqc h SER 57 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1oqc h SER 57 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1oqc h SER 57 CO -0.23 0.00 -1.08 0.29 -0.87 0.00 0.00 176.83 174.94 1oqc n LYS 58 N -3.04 0.49 0.00 4.77 5.02 -0.35 -4.43 118.16 120.62 1oqc n LYS 58 Ca -0.02 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1oqc n LYS 58 Cb 0.12 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 1oqc n LYS 58 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1oqc n PHE 59 N -2.38 0.00 -1.69 2.13 3.01 -0.70 -5.02 117.46 112.82 1oqc n PHE 59 Ca 0.00 0.00 -0.53 0.00 1.01 0.00 0.00 57.45 57.94 1oqc n PHE 59 Cb 0.51 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.92 1oqc n PHE 59 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 1oqc n TYR 60 N -0.23 2.16 -0.21 1.38 9.36 -0.12 -4.84 117.16 124.67 1oqc n TYR 60 Ca 0.00 0.29 -0.05 0.00 3.32 0.00 0.00 57.90 61.45 1oqc n TYR 60 Cb 0.01 -2.55 -0.05 0.00 -0.63 0.00 0.00 39.34 36.12 1oqc n TYR 60 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1oqc n PRO 61 N 5.69 -0.22 -1.57 2.98 -0.02 -1.26 -4.35 135.00 136.25 1oqc n PRO 61 Ca 0.24 1.11 -0.44 0.00 -2.02 0.00 0.00 63.50 62.39 1oqc n PRO 61 Cb 0.21 -1.64 -0.04 0.00 -0.02 0.00 0.00 33.50 32.01 1oqc n PRO 61 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oqc h GLU 63 N 15.14 -0.41 -0.91 0.00 4.81 -1.98 -0.82 114.58 130.40 1oqc h GLU 63 Ca -0.36 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 58.92 1oqc h GLU 63 Cb 1.26 0.09 -0.05 0.00 0.63 0.00 0.00 28.75 30.68 1oqc h GLU 63 CO 1.00 -0.27 0.60 1.49 -0.73 0.00 0.00 179.01 181.09 1oqc h GLU 64 N -0.43 1.15 -0.42 1.92 4.81 -1.94 -2.17 114.58 117.51 1oqc h GLU 64 Ca 0.09 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1oqc h GLU 64 Cb 0.57 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1oqc h GLU 64 CO -0.36 0.76 0.21 0.00 -0.73 0.00 0.00 179.01 178.89 1oqc h ALA 66 N 1.06 0.50 -0.85 0.00 0.00 -0.79 0.37 119.26 119.55 1oqc h ALA 66 Ca 0.14 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.03 1oqc h ALA 66 Cb 0.10 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1oqc h ALA 66 CO -0.02 0.04 0.53 0.93 0.00 0.00 0.00 179.25 180.72 1oqc h GLU 67 N 0.50 0.92 0.12 0.00 5.08 -1.30 -0.77 114.58 119.14 1oqc h GLU 67 Ca 0.14 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1oqc h GLU 67 Cb 0.07 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.11 1oqc h GLU 67 CO -0.02 0.61 -0.06 0.22 -1.00 0.00 0.00 179.01 178.76 1oqc h ASP 68 N 0.95 -0.13 -0.54 1.42 1.82 -0.96 -3.12 116.42 115.86 1oqc h ASP 68 Ca 0.37 -0.27 -0.02 0.00 -0.39 0.00 0.00 57.03 56.73 1oqc h ASP 68 Cb 0.18 0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.20 1oqc h ASP 68 CO -0.18 0.21 0.29 -0.29 -1.61 0.00 0.00 179.24 177.65 1oqc h ILE 69 N -0.49 1.18 -0.70 2.25 6.09 -0.67 -2.40 117.51 122.77 1oqc h ILE 69 Ca -0.02 -0.49 0.01 0.00 -1.37 0.00 0.00 64.86 63.00 1oqc h ILE 69 Cb 0.39 0.44 -0.04 0.00 0.47 0.00 0.00 36.82 38.09 1oqc h ILE 69 CO 0.03 0.21 0.46 0.03 -3.07 0.00 0.00 178.15 175.81 1oqc h ARG 70 N 0.79 0.91 -0.73 2.19 3.08 -1.16 0.27 114.38 119.73 1oqc h ARG 70 Ca 0.20 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.13 1oqc h ARG 70 Cb 0.06 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.87 1oqc h ARG 70 CO -0.03 0.61 0.21 0.87 -1.07 0.00 0.00 179.97 180.56 1oqc h LYS 71 N 0.94 1.14 -0.28 0.04 1.57 -1.38 0.03 116.57 118.64 1oqc h LYS 71 Ca 0.26 -0.25 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 1oqc h LYS 71 Cb -0.10 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.05 1oqc h LYS 71 CO -0.06 0.98 -0.32 0.00 -0.57 0.00 0.00 179.45 179.48 1oqc h ARG 72 N 1.09 0.71 -0.34 3.15 3.08 -0.96 -2.63 114.38 118.49 1oqc h ARG 72 Ca 0.23 -0.39 -0.11 0.00 0.07 0.00 0.00 59.98 59.78 1oqc h ARG 72 Cb 0.33 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1oqc h ARG 72 CO -0.00 1.01 -0.26 0.82 -1.07 0.00 0.00 179.97 180.46 1oqc h ILE 73 N 0.45 1.27 -0.02 2.04 2.04 -0.33 -1.59 117.51 121.38 1oqc h ILE 73 Ca 0.04 -1.36 -0.08 0.00 1.00 0.00 0.00 64.86 64.46 1oqc h ILE 73 Cb 0.89 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 1oqc h ILE 73 CO 0.08 0.45 -0.38 0.44 0.00 0.00 0.00 178.15 178.73 1oqc h ASP 74 N 0.59 0.04 -0.13 1.72 3.32 -0.98 -2.24 116.42 118.74 1oqc h ASP 74 Ca 0.08 -0.01 -0.19 0.00 0.02 0.00 0.00 57.03 56.93 1oqc h ASP 74 Cb 0.75 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.30 1oqc h ASP 74 CO 0.06 0.41 -0.66 -0.09 -1.72 0.00 0.00 179.24 177.24 1oqc h ARG 75 N 0.03 0.68 -2.94 3.56 2.43 -1.16 -3.40 114.38 113.59 1oqc h ARG 75 Ca 0.00 -0.56 -0.60 0.00 -0.81 0.00 0.00 59.98 58.01 1oqc h ARG 75 Cb 0.69 0.12 -0.40 0.00 -0.42 0.00 0.00 29.97 29.95 1oqc h ARG 75 CO 0.05 1.17 -0.76 0.45 -1.51 0.00 0.00 179.97 179.37 1oqc s SER 76 N -6.92 3.53 0.42 -3.80 0.15 -0.62 -5.11 113.70 101.34 1oqc s SER 76 Ca -0.11 -2.44 -0.26 0.00 0.70 0.00 0.00 55.95 53.83 1oqc s SER 76 Cb 0.07 -0.88 -0.10 0.00 -1.71 0.00 0.00 66.02 63.41 1oqc s SER 76 CO 0.87 -0.29 1.39 0.00 1.20 0.00 0.00 173.24 176.41 1oqc n GLN 77 N 3.77 2.23 -1.78 5.44 1.13 -0.86 -4.57 117.38 122.72 1oqc n GLN 77 Ca 0.08 0.79 -0.41 0.00 -1.94 0.00 0.00 57.00 55.52 1oqc n GLN 77 Cb 0.36 -2.54 -0.01 0.00 0.11 0.00 0.00 30.24 28.15 1oqc n GLN 77 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1oqc s PRO 78 N -2.27 4.12 -0.57 -1.09 0.04 -1.26 -4.94 135.00 129.02 1oqc s PRO 78 Ca 0.59 2.58 -0.18 0.00 0.04 0.00 0.00 61.00 64.03 1oqc s PRO 78 Cb -0.48 -3.02 0.11 0.00 0.04 0.00 0.00 34.50 31.15 1oqc s PRO 78 CO 0.59 -0.63 0.65 0.34 0.04 0.00 0.00 177.00 177.99 1oqc s ASP 79 N 0.47 6.18 -0.17 6.66 -1.08 -1.26 -4.89 116.67 122.59 1oqc s ASP 79 Ca 0.63 -1.50 0.13 0.00 -0.52 0.00 0.00 52.55 51.29 1oqc s ASP 79 Cb -0.48 -2.28 0.68 0.00 -1.46 0.00 0.00 42.92 39.39 1oqc s ASP 79 CO 0.48 -1.04 1.55 0.35 0.52 0.00 0.00 175.17 177.04 1oqc n THR 80 N 5.47 2.13 -0.31 1.71 -2.24 -1.26 -2.12 114.28 117.66 1oqc n THR 80 Ca -0.11 -1.14 0.02 0.00 -2.27 0.00 0.00 64.05 60.56 1oqc n THR 80 Cb 0.42 -0.21 0.21 0.00 -2.10 0.00 0.00 70.33 68.65 1oqc n THR 80 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1oqc h SER 81 N 3.44 0.96 -5.34 3.42 4.64 -1.91 -3.43 113.55 115.33 1oqc h SER 81 Ca 0.00 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 1oqc h SER 81 Cb 1.63 -0.22 -0.11 0.00 -0.31 0.00 0.00 62.40 63.39 1oqc h SER 81 CO 0.36 0.65 -0.28 0.42 -0.87 0.00 0.00 176.83 177.11 1oqc s THR 82 N -5.95 0.01 0.17 2.95 -4.23 -1.26 -4.45 115.64 102.88 1oqc s THR 82 Ca -0.12 -1.57 -0.14 0.00 -1.18 0.00 0.00 61.69 58.69 1oqc s THR 82 Cb 0.19 -2.24 0.06 0.00 1.34 0.00 0.00 72.50 71.85 1oqc s THR 82 CO 0.80 -0.03 1.82 -0.09 -0.54 0.00 0.00 174.62 176.57 1oqc h ARG 83 N 2.39 0.60 -0.17 3.99 2.43 -1.52 -0.63 114.38 121.47 1oqc h ARG 83 Ca -0.29 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.82 1oqc h ARG 83 Cb 1.25 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 1oqc h ARG 83 CO 0.42 0.40 0.02 0.28 -1.51 0.00 0.00 179.97 179.57 1oqc h VAL 84 N 0.62 1.23 -0.82 0.20 2.07 -1.89 0.72 116.25 118.37 1oqc h VAL 84 Ca 0.20 -0.77 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 1oqc h VAL 84 Cb 0.01 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1oqc h VAL 84 CO -0.08 0.23 0.39 0.77 0.02 0.00 0.00 177.57 178.90 1oqc h SER 85 N 0.07 1.08 -0.11 0.57 4.64 -1.79 -0.96 113.55 117.05 1oqc h SER 85 Ca 0.05 -0.14 -0.08 0.00 -0.47 0.00 0.00 61.79 61.15 1oqc h SER 85 Cb 0.33 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1oqc h SER 85 CO 0.01 0.92 -0.26 0.15 -0.87 0.00 0.00 176.83 176.77 1oqc h PHE 86 N 1.17 0.47 -0.46 4.77 3.57 -0.57 -0.79 116.94 125.10 1oqc h PHE 86 Ca 0.28 -0.18 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 1oqc h PHE 86 Cb 0.13 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1oqc h PHE 86 CO 0.01 0.88 0.07 0.66 -2.23 0.00 0.00 178.31 177.70 1oqc h SER 87 N -0.07 0.67 -0.30 0.41 4.64 -0.78 -0.33 113.55 117.80 1oqc h SER 87 Ca -0.00 -0.13 -0.12 0.00 -0.47 0.00 0.00 61.79 61.08 1oqc h SER 87 Cb 0.87 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1oqc h SER 87 CO 0.06 0.70 -0.27 1.56 -0.87 0.00 0.00 176.83 178.00 1oqc h GLN 88 N 0.69 0.71 -0.48 4.77 1.08 -1.16 -1.03 115.11 119.68 1oqc h GLN 88 Ca 0.15 -0.37 0.02 0.00 -1.45 0.00 0.00 58.65 57.01 1oqc h GLN 88 Cb 0.32 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.73 1oqc h GLN 88 CO 0.00 0.98 0.29 2.35 -0.95 0.00 0.00 178.83 181.50 1oqc h TRP 89 N 0.46 0.54 -0.69 2.96 7.01 -0.75 -0.02 115.95 125.46 1oqc h TRP 89 Ca 0.05 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 60.99 1oqc h TRP 89 Cb 0.84 -0.17 -0.03 0.00 -2.10 0.00 0.00 29.16 27.70 1oqc h TRP 89 CO 0.07 0.31 0.12 1.25 -2.79 0.00 0.00 178.44 177.40 1oqc h LEU 90 N 0.57 1.08 -0.67 0.65 5.85 -1.00 -1.15 115.31 120.64 1oqc h LEU 90 Ca 0.19 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 1oqc h LEU 90 Cb 0.02 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 1oqc h LEU 90 CO -0.09 1.06 0.32 0.00 -0.34 0.00 0.00 178.44 179.39 1oqc h ARG 92 N 0.93 1.09 -0.06 0.00 3.08 -0.68 -0.87 114.38 117.88 1oqc h ARG 92 Ca 0.23 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1oqc h ARG 92 Cb 0.12 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 1oqc h ARG 92 CO -0.03 0.92 0.02 1.25 -1.07 0.00 0.00 179.97 181.06 1oqc h LEU 93 N 1.06 0.09 -1.03 3.04 5.85 -0.78 -2.12 115.31 121.41 1oqc h LEU 93 Ca 0.24 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.84 1oqc h LEU 93 Cb 0.27 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.21 1oqc h LEU 93 CO -0.01 0.23 0.64 -0.74 -0.34 0.00 0.00 178.44 178.22 1oqc h HIS 94 N -0.06 1.20 -0.11 1.25 2.76 -0.96 -0.99 115.15 118.23 1oqc h HIS 94 Ca 0.02 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.19 1oqc h HIS 94 Cb 0.17 -0.40 -0.01 0.00 1.55 0.00 0.00 27.41 28.72 1oqc h HIS 94 CO -0.02 0.66 -0.09 -0.91 -1.30 0.00 0.00 177.93 176.27 1oqc h ASN 95 N 1.20 0.15 -0.48 3.26 2.35 -0.83 0.96 115.58 122.20 1oqc h ASN 95 Ca 0.41 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 56.10 1oqc h ASN 95 Cb 0.09 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1oqc h ASN 95 CO -0.15 0.26 0.15 -0.33 -1.65 0.00 0.00 177.43 175.72 1oqc h GLU 96 N 0.16 0.74 -0.31 0.81 5.08 -0.52 -0.29 114.58 120.25 1oqc h GLU 96 Ca 0.04 -0.16 -0.12 0.00 -1.00 0.00 0.00 59.36 58.12 1oqc h GLU 96 Cb 0.26 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1oqc h GLU 96 CO 0.01 0.70 -0.29 0.28 -1.00 0.00 0.00 179.01 178.72 1oqc h VAL 97 N 0.64 1.28 -0.15 3.13 2.07 -1.07 -1.85 116.25 120.29 1oqc h VAL 97 Ca 0.15 -1.40 0.02 0.00 0.82 0.00 0.00 66.70 66.30 1oqc h VAL 97 Cb 0.27 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 1oqc h VAL 97 CO -0.00 0.45 0.00 0.78 0.02 0.00 0.00 177.57 178.82 1oqc h ASN 98 N 0.56 -0.06 -0.09 0.57 -0.26 -0.34 -1.63 115.58 114.33 1oqc h ASN 98 Ca 0.07 0.03 -0.04 0.00 -0.56 0.00 0.00 56.30 55.80 1oqc h ASN 98 Cb 0.78 0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 38.08 1oqc h ASN 98 CO 0.06 -0.01 -0.05 0.03 -1.06 0.00 0.00 177.43 176.41 1oqc h ARG 99 N 0.05 0.34 -0.16 0.81 3.08 -0.89 0.33 114.38 117.94 1oqc h ARG 99 Ca 0.07 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.97 1oqc h ARG 99 Cb 0.08 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1oqc h ARG 99 CO -0.12 0.40 -0.29 -0.22 -1.07 0.00 0.00 179.97 178.67 1oqc h LYS 100 N 0.32 0.31 -0.67 0.04 3.64 -0.71 -2.90 116.57 116.61 1oqc h LYS 100 Ca 0.07 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1oqc h LYS 100 Cb 0.30 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1oqc h LYS 100 CO 0.01 0.58 0.00 1.28 -2.27 0.00 0.00 179.45 179.05 1oqc n LEU 101 N -4.12 3.94 -1.14 5.20 4.77 -0.67 -4.93 117.00 120.05 1oqc n LEU 101 Ca -0.01 -1.98 -0.13 0.00 -0.03 0.00 0.00 56.01 53.86 1oqc n LEU 101 Cb 0.40 -0.49 -0.04 0.00 -2.33 0.00 0.00 43.42 40.96 1oqc n LEU 101 CO 0.41 0.85 -0.14 0.61 -1.33 0.00 0.00 177.39 177.79 1oqc n GLY 102 N 1.39 0.91 3.93 -0.72 0.00 -0.68 -5.01 105.19 105.00 1oqc n GLY 102 Ca 0.23 -0.40 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 1oqc n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oqc s LYS 103 N -3.57 3.52 0.69 1.61 1.02 0.11 -4.99 119.74 118.12 1oqc s LYS 103 Ca 0.00 -0.24 -0.15 0.00 0.02 0.00 0.00 55.97 55.60 1oqc s LYS 103 Cb 0.00 -2.65 0.02 0.00 -0.52 0.00 0.00 37.83 34.67 1oqc s LYS 103 CO 0.00 0.15 1.16 -2.14 -0.92 0.00 0.00 175.35 173.60 1oqc s PRO 104 N -4.14 2.51 0.13 -1.68 0.02 -1.26 -4.07 135.00 126.51 1oqc s PRO 104 Ca 0.41 1.59 -0.30 0.00 0.02 0.00 0.00 61.00 62.72 1oqc s PRO 104 Cb -0.10 -1.90 -0.06 0.00 0.02 0.00 0.00 34.50 32.46 1oqc s PRO 104 CO 0.35 -1.52 0.99 -0.51 -0.33 0.00 0.00 177.00 175.98 1oqc s ASP 105 N -2.25 7.47 0.09 2.53 1.01 -1.26 -4.81 116.67 119.44 1oqc s ASP 105 Ca 0.71 1.86 -0.20 0.00 0.71 0.00 0.00 52.55 55.62 1oqc s ASP 105 Cb -0.25 -2.59 -0.07 0.00 1.01 0.00 0.00 42.92 41.02 1oqc s ASP 105 CO 0.42 -0.08 0.60 0.12 0.21 0.00 0.00 175.17 176.45 1oqc s PHE 106 N -0.11 3.82 -0.71 4.23 5.36 -1.26 -4.99 117.98 124.33 1oqc s PHE 106 Ca 0.47 1.33 -0.26 0.00 -0.96 0.00 0.00 56.93 57.51 1oqc s PHE 106 Cb -0.25 -2.55 -0.00 0.00 -0.34 0.00 0.00 43.02 39.89 1oqc s PHE 106 CO 0.31 0.57 1.64 0.34 -1.46 0.00 0.00 175.22 176.62 1oqc s ASP 107 N -1.09 5.65 0.59 6.13 -1.08 -1.26 -4.84 116.67 120.77 1oqc s ASP 107 Ca 0.30 -0.14 0.36 0.00 -0.52 0.00 0.00 52.55 52.55 1oqc s ASP 107 Cb -0.20 -2.55 1.95 0.00 -1.46 0.00 0.00 42.92 40.66 1oqc s ASP 107 CO 0.20 -2.17 2.09 0.00 0.52 0.00 0.00 175.17 175.81 1oqc n SER 109 N -2.84 0.26 -0.78 0.00 3.41 -1.26 -2.68 113.62 109.73 1oqc n SER 109 Ca -0.02 0.56 0.08 0.00 -0.26 0.00 0.00 58.87 59.23 1oqc n SER 109 Cb 0.16 -0.62 0.23 0.00 -0.26 0.00 0.00 64.21 63.71 1oqc n SER 109 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1oqc n ARG 110 N -1.79 2.83 -0.07 4.33 1.74 0.00 -4.69 116.66 119.02 1oqc n ARG 110 Ca 0.03 -2.63 0.07 0.00 -0.77 0.00 0.00 57.85 54.55 1oqc n ARG 110 Cb 0.20 -1.69 0.44 0.00 -1.02 0.00 0.00 32.46 30.39 1oqc n ARG 110 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 1oqc h VAL 111 N 1.72 1.01 -0.23 1.55 -1.51 -1.64 -1.66 116.25 115.50 1oqc h VAL 111 Ca 0.00 -0.19 -0.14 0.00 -1.23 0.00 0.00 66.70 65.14 1oqc h VAL 111 Cb 1.25 0.42 -0.01 0.00 -2.13 0.00 0.00 31.29 30.82 1oqc h VAL 111 CO 0.16 0.10 -0.44 0.44 -1.23 0.00 0.00 177.57 176.59 1oqc h ASP 112 N 0.55 0.61 -0.39 4.19 3.32 -1.86 0.27 116.42 123.11 1oqc h ASP 112 Ca 0.23 -0.29 -0.06 0.00 0.02 0.00 0.00 57.03 56.93 1oqc h ASP 112 Cb 0.21 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1oqc h ASP 112 CO -0.06 0.97 0.02 -0.33 -1.72 0.00 0.00 179.24 178.12 1oqc h GLU 113 N 0.46 0.67 -0.31 3.56 5.08 -1.57 0.37 114.58 122.84 1oqc h GLU 113 Ca 0.03 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.09 1oqc h GLU 113 Cb 0.96 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1oqc h GLU 113 CO 0.09 0.76 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.58 1oqc h ARG 114 N 0.50 0.66 -0.01 2.33 9.65 -1.22 0.31 114.38 126.62 1oqc h ARG 114 Ca 0.11 -0.31 0.00 0.00 -1.10 0.00 0.00 59.98 58.69 1oqc h ARG 114 Cb 0.44 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.01 1oqc h ARG 114 CO 0.02 0.90 -0.22 0.91 2.80 0.00 0.00 179.97 184.37 1oqc n TRP 115 N -4.35 0.00 0.06 2.20 7.02 0.07 -4.78 117.44 117.66 1oqc n TRP 115 Ca -0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.45 1oqc n TRP 115 Cb 0.40 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.29 1oqc n TRP 115 CO 0.00 0.00 0.00 -2.13 -2.02 0.00 0.00 177.69 173.54 1oqc n ARG 116 N -0.30 0.00 0.01 -0.99 0.63 0.11 -4.78 116.66 111.34 1oqc n ARG 116 Ca 0.04 0.00 0.09 0.00 -0.92 0.00 0.00 57.85 57.06 1oqc n ARG 116 Cb 0.21 -0.22 -0.13 0.00 0.45 0.00 0.00 32.46 32.77 1oqc n ARG 116 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1oqc n ASP 117 N -3.14 0.23 0.00 6.15 8.00 0.11 -5.02 116.55 122.87 1oqc n ASP 117 Ca 0.00 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.59 1oqc n ASP 117 Cb 0.10 1.52 0.00 0.00 -0.02 0.00 0.00 41.12 42.72 1oqc n ASP 117 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oqc n GLY 118 N 1.28 0.50 3.75 0.44 0.00 0.11 -4.95 105.19 106.31 1oqc n GLY 118 Ca -0.05 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.90 1oqc n GLY 118 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1oqc n TRP 119 N 0.70 2.77 0.31 1.61 7.02 -1.18 -4.53 117.44 124.14 1oqc n TRP 119 Ca 0.00 0.48 0.18 0.00 -1.02 0.00 0.00 57.50 57.14 1oqc n TRP 119 Cb 0.00 -2.49 1.03 0.00 -2.42 0.00 0.00 31.31 27.43 1oqc n TRP 119 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 1oqc h LYS 120 N 2.78 0.00 0.00 -0.99 1.57 -1.92 0.27 116.57 118.28 1oqc h LYS 120 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1oqc h LYS 120 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1oqc h LYS 120 CO 0.63 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.11 1oqc n ASP 121 N -3.53 0.00 -0.11 0.86 5.75 -1.26 -4.87 116.55 113.39 1oqc n ASP 121 Ca -0.03 -0.21 -0.01 0.00 -0.01 0.00 0.00 54.79 54.52 1oqc n ASP 121 Cb 0.10 -0.21 -0.01 0.00 -1.03 0.00 0.00 41.12 39.97 1oqc n ASP 121 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1oqc n GLY 122 N 0.52 0.51 0.00 6.12 0.00 0.09 -4.91 105.19 107.51 1oqc n GLY 122 Ca 0.12 -0.32 0.03 0.00 0.00 0.00 0.00 46.02 45.85 1oqc n GLY 122 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1oqc n SER 123 N 0.37 0.00 -0.78 1.61 3.41 -1.26 -5.00 113.62 111.96 1oqc n SER 123 Ca -0.01 0.44 0.10 0.00 -0.26 0.00 0.00 58.87 59.13 1oqc n SER 123 Cb 0.11 -0.46 0.08 0.00 -0.26 0.00 0.00 64.21 63.68 1oqc n SER 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88