#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u4o n PRO 19 N 0.00 1.37 -1.51 0.00 -0.04 -1.26 -4.85 135.00 128.70 1u4o n PRO 19 Ca 0.00 -0.56 -0.42 0.00 -0.04 0.00 0.00 63.50 62.48 1u4o n PRO 19 Cb 0.00 -1.24 0.01 0.00 -0.04 0.00 0.00 33.50 32.22 1u4o n PRO 19 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1u4o n LYS 20 N -0.14 0.85 -1.99 0.54 5.02 -1.26 -4.94 118.16 116.25 1u4o n LYS 20 Ca 0.11 0.31 -0.37 0.00 -2.02 0.00 0.00 58.31 56.33 1u4o n LYS 20 Cb 0.17 -1.70 0.02 0.00 -0.02 0.00 0.00 35.03 33.51 1u4o n LYS 20 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1u4o s ALA 21 N -1.36 2.79 -0.20 7.82 0.00 -1.26 -4.84 121.76 124.71 1u4o s ALA 21 Ca 0.63 1.13 -0.05 0.00 0.00 0.00 0.00 51.96 53.67 1u4o s ALA 21 Cb -0.60 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.01 1u4o s ALA 21 CO 0.57 -1.10 -0.01 0.21 0.00 0.00 0.00 175.76 175.43 1u4o s LYS 22 N -2.96 3.58 -0.22 0.00 2.20 -1.26 -1.02 119.74 120.06 1u4o s LYS 22 Ca 0.71 -0.54 0.02 0.00 -0.36 0.00 0.00 55.97 55.80 1u4o s LYS 22 Cb -0.34 -3.07 0.04 0.00 -1.51 0.00 0.00 37.83 32.95 1u4o s LYS 22 CO 0.40 -0.01 -0.15 0.42 -0.36 0.00 0.00 175.35 175.65 1u4o s ILE 23 N 1.06 2.17 -0.23 5.43 1.01 0.51 -0.80 121.20 130.34 1u4o s ILE 23 Ca 0.02 -1.27 -0.08 0.00 0.00 0.00 0.00 60.65 59.32 1u4o s ILE 23 Cb -0.14 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 1u4o s ILE 23 CO 0.01 0.25 0.07 -0.69 0.00 0.00 0.00 174.94 174.59 1u4o s VAL 24 N 1.20 4.49 -0.51 2.92 1.01 0.04 -1.14 120.40 128.42 1u4o s VAL 24 Ca -0.02 -0.12 -0.18 0.00 0.00 0.00 0.00 61.98 61.67 1u4o s VAL 24 Cb -0.17 -3.08 0.08 0.00 0.00 0.00 0.00 36.38 33.21 1u4o s VAL 24 CO -0.09 0.36 0.55 -0.76 0.00 0.00 0.00 175.10 175.17 1u4o s LEU 25 N 1.29 5.35 -0.80 3.92 1.43 0.25 -1.05 118.68 129.07 1u4o s LEU 25 Ca 0.05 -1.20 -0.22 0.00 -1.03 0.00 0.00 54.13 51.73 1u4o s LEU 25 Cb -0.15 -2.32 0.08 0.00 0.03 0.00 0.00 46.19 43.84 1u4o s LEU 25 CO 0.04 -0.84 1.11 -0.69 0.23 0.00 0.00 176.35 176.20 1u4o s VAL 26 N 2.23 4.36 0.00 -1.59 1.01 0.21 -1.10 120.40 125.51 1u4o s VAL 26 Ca 0.10 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.32 1u4o s VAL 26 Cb -0.22 -4.79 0.00 0.00 0.00 0.00 0.00 36.38 31.37 1u4o s VAL 26 CO 0.09 -1.57 0.00 0.61 0.00 0.00 0.00 175.10 174.22 1u4o n GLY 27 N 5.60 2.95 2.14 4.51 0.00 0.15 -1.26 105.19 119.27 1u4o n GLY 27 Ca 0.11 -1.08 -0.20 0.00 0.00 0.00 0.00 46.02 44.85 1u4o n GLY 27 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1u4o n SER 28 N 0.00 4.44 -2.91 1.61 7.64 -1.13 -4.51 113.62 118.76 1u4o n SER 28 Ca 0.00 -3.50 0.00 0.00 1.01 0.00 0.00 58.87 56.38 1u4o n SER 28 Cb 0.00 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 1u4o n SER 28 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1u4o n GLY 29 N -0.69 0.41 0.19 0.23 0.00 -1.26 -4.66 105.19 99.41 1u4o n GLY 29 Ca 0.39 -1.55 -0.09 0.00 0.00 0.00 0.00 46.02 44.77 1u4o n GLY 29 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1u4o h MET 30 N 0.00 0.57 -0.48 1.61 2.86 -2.00 -1.98 114.93 115.51 1u4o h MET 30 Ca 0.00 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1u4o h MET 30 Cb 0.00 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 1u4o h MET 30 CO 0.00 0.55 0.21 0.97 1.06 0.00 0.00 176.91 179.70 1u4o h ILE 31 N 0.47 1.17 -0.68 -1.22 2.10 -1.93 -2.70 117.51 114.73 1u4o h ILE 31 Ca 0.13 -0.52 0.00 0.00 1.08 0.00 0.00 64.86 65.55 1u4o h ILE 31 Cb 0.19 0.58 -0.03 0.00 -1.09 0.00 0.00 36.82 36.47 1u4o h ILE 31 CO -0.01 0.21 0.43 1.23 -1.08 0.00 0.00 178.15 178.93 1u4o h GLY 32 N 0.81 0.97 1.54 8.18 0.00 -1.60 -0.79 103.07 112.17 1u4o h GLY 32 Ca 0.17 -0.38 -0.10 0.00 0.00 0.00 0.00 47.33 47.02 1u4o h GLY 32 CO -0.02 0.37 -0.24 -1.33 0.00 0.00 0.00 176.54 175.32 1u4o h GLY 33 N 0.92 0.58 1.34 4.60 0.00 -1.14 -0.53 103.07 108.85 1u4o h GLY 33 Ca 0.25 -0.47 -0.18 0.00 0.00 0.00 0.00 47.33 46.92 1u4o h GLY 33 CO -0.05 0.43 -0.62 -2.08 0.00 0.00 0.00 176.54 174.23 1u4o h VAL 35 N 0.47 1.31 -0.46 4.60 2.07 -1.19 -1.35 116.25 121.70 1u4o h VAL 35 Ca 0.07 -1.86 0.02 0.00 0.82 0.00 0.00 66.70 65.75 1u4o h VAL 35 Cb 0.67 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 32.22 1u4o h VAL 35 CO 0.05 0.58 0.27 0.24 0.02 0.00 0.00 177.57 178.74 1u4o h MET 36 N 0.50 0.53 -0.57 1.57 2.86 -0.82 -1.12 114.93 117.88 1u4o h MET 36 Ca -0.01 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1u4o h MET 36 Cb 1.20 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 32.70 1u4o h MET 36 CO 0.12 0.35 0.34 0.00 1.06 0.00 0.00 176.91 178.78 1u4o h ALA 37 N 1.20 0.73 -0.23 6.32 0.00 -0.88 -0.67 119.26 125.73 1u4o h ALA 37 Ca 0.18 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.11 1u4o h ALA 37 Cb 0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1u4o h ALA 37 CO -0.08 0.05 0.07 1.15 0.00 0.00 0.00 179.25 180.44 1u4o h THR 38 N 0.67 0.92 -0.25 0.00 2.02 -0.88 -2.23 112.91 113.16 1u4o h THR 38 Ca 0.23 -0.06 -0.11 0.00 0.77 0.00 0.00 66.41 67.24 1u4o h THR 38 Cb 0.04 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1u4o h THR 38 CO -0.11 0.03 -0.31 -0.07 0.37 0.00 0.00 175.52 175.44 1u4o h LEU 39 N 0.17 0.53 -0.60 2.58 3.38 -0.86 -1.36 115.31 119.14 1u4o h LEU 39 Ca 0.10 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1u4o h LEU 39 Cb 0.08 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1u4o h LEU 39 CO -0.12 0.81 0.28 0.40 0.09 0.00 0.00 178.44 179.90 1u4o h ILE 40 N 0.44 1.22 -0.39 1.22 2.04 -0.85 -1.54 117.51 119.65 1u4o h ILE 40 Ca 0.06 -0.63 -0.06 0.00 1.00 0.00 0.00 64.86 65.23 1u4o h ILE 40 Cb 0.76 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 1u4o h ILE 40 CO 0.06 0.25 0.01 0.58 0.00 0.00 0.00 178.15 179.05 1u4o h VAL 41 N 0.83 1.26 -1.00 1.67 2.07 -1.19 0.28 116.25 120.17 1u4o h VAL 41 Ca 0.21 -0.98 0.14 0.00 0.82 0.00 0.00 66.70 66.89 1u4o h VAL 41 Cb 0.14 1.12 -0.09 0.00 -1.52 0.00 0.00 31.29 30.94 1u4o h VAL 41 CO -0.02 0.33 0.63 1.56 0.02 0.00 0.00 177.57 180.08 1u4o h GLN 42 N 0.51 0.91 -0.06 1.57 1.08 -1.01 -1.74 115.11 116.37 1u4o h GLN 42 Ca 0.11 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1u4o h GLN 42 Cb 0.45 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.68 1u4o h GLN 42 CO 0.02 0.60 0.00 1.63 -0.95 0.00 0.00 178.83 180.13 1u4o n LYS 43 N -4.65 2.11 -3.93 1.46 5.02 -0.60 -4.97 118.16 112.59 1u4o n LYS 43 Ca 0.20 -1.62 -0.28 0.00 -2.02 0.00 0.00 58.31 54.59 1u4o n LYS 43 Cb 0.41 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 1u4o n LYS 43 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1u4o n ASN 44 N 0.95 -2.27 0.09 4.39 5.15 0.86 -4.87 115.26 119.56 1u4o n ASN 44 Ca 0.16 -0.90 -0.00 0.00 -0.60 0.00 0.00 54.58 53.24 1u4o n ASN 44 Cb 0.51 -3.46 -0.04 0.00 -0.53 0.00 0.00 39.78 36.27 1u4o n ASN 44 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1u4o h LEU 45 N -1.85 0.00 0.00 1.20 4.07 -1.49 -3.49 115.31 113.75 1u4o h LEU 45 Ca -0.61 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.35 1u4o h LEU 45 Cb 1.37 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.11 1u4o h LEU 45 CO 0.65 0.62 0.00 0.61 -1.08 0.00 0.00 178.44 179.25 1u4o n GLY 46 N 1.31 0.55 3.76 0.83 0.00 -1.26 -4.51 105.19 105.86 1u4o n GLY 46 Ca -0.02 -1.16 -0.37 0.00 0.00 0.00 0.00 46.02 44.47 1u4o n GLY 46 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1u4o s ASP 47 N 0.00 5.76 -0.04 1.61 1.01 -0.19 -4.64 116.67 120.18 1u4o s ASP 47 Ca 0.00 2.42 0.05 0.00 0.71 0.00 0.00 52.55 55.73 1u4o s ASP 47 Cb 0.00 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 1u4o s ASP 47 CO 0.00 -1.21 -0.21 -0.69 0.21 0.00 0.00 175.17 173.28 1u4o s VAL 49 N -1.51 1.71 -0.21 -1.27 1.01 0.10 -0.36 120.40 119.86 1u4o s VAL 49 Ca 0.68 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.74 1u4o s VAL 49 Cb -0.31 -1.45 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 1u4o s VAL 49 CO 0.37 0.48 -0.05 -0.69 0.00 0.00 0.00 175.10 175.21 1u4o s VAL 50 N -0.17 3.35 -0.60 2.92 1.01 -0.29 -1.33 120.40 125.29 1u4o s VAL 50 Ca -0.01 -0.51 -0.23 0.00 0.00 0.00 0.00 61.98 61.24 1u4o s VAL 50 Cb -0.11 -2.51 0.06 0.00 0.00 0.00 0.00 36.38 33.81 1u4o s VAL 50 CO 0.02 0.43 0.90 -0.76 0.00 0.00 0.00 175.10 175.70 1u4o s LEU 51 N 1.36 4.39 -0.08 3.92 1.43 0.23 -0.58 118.68 129.35 1u4o s LEU 51 Ca 0.04 -0.77 -0.09 0.00 -1.03 0.00 0.00 54.13 52.29 1u4o s LEU 51 Cb -0.14 -2.56 -0.04 0.00 0.03 0.00 0.00 46.19 43.47 1u4o s LEU 51 CO -0.03 -1.28 0.21 0.12 0.23 0.00 0.00 176.35 175.60 1u4o s PHE 52 N 3.79 3.63 -0.01 0.29 5.36 -0.26 -0.56 117.98 130.22 1u4o s PHE 52 Ca 0.24 0.64 -0.28 0.00 -0.96 0.00 0.00 56.93 56.56 1u4o s PHE 52 Cb -0.16 -2.02 0.08 0.00 -0.34 0.00 0.00 43.02 40.58 1u4o s PHE 52 CO 0.13 0.71 0.75 0.34 -1.46 0.00 0.00 175.22 175.69 1u4o s ASP 53 N -1.08 -0.54 0.44 6.13 -1.08 -0.62 -0.67 116.67 119.24 1u4o s ASP 53 Ca 0.18 0.38 0.24 0.00 -0.52 0.00 0.00 52.55 52.83 1u4o s ASP 53 Cb -0.13 0.49 0.81 0.00 -1.46 0.00 0.00 42.92 42.63 1u4o s ASP 53 CO 0.07 -0.65 1.78 0.16 0.52 0.00 0.00 175.17 177.04 1u4o h ILE 54 N 2.52 0.43 -2.88 4.11 3.07 -1.92 -3.39 117.51 119.46 1u4o h ILE 54 Ca -0.26 -1.15 -0.53 0.00 1.55 0.00 0.00 64.86 64.46 1u4o h ILE 54 Cb 1.20 1.84 0.02 0.00 -0.27 0.00 0.00 36.82 39.61 1u4o h ILE 54 CO 0.36 0.19 0.84 -0.69 -1.05 0.00 0.00 178.15 177.81 1u4o s VAL 55 N -3.51 3.31 0.37 0.16 1.01 -1.26 -4.97 120.40 115.51 1u4o s VAL 55 Ca 0.02 0.83 -0.27 0.00 0.00 0.00 0.00 61.98 62.56 1u4o s VAL 55 Cb 0.09 -3.53 -0.10 0.00 0.00 0.00 0.00 36.38 32.84 1u4o s VAL 55 CO 0.64 0.03 1.30 -0.54 0.00 0.00 0.00 175.10 176.52 1u4o s LYS 56 N 1.92 4.18 0.00 2.72 -0.14 -1.26 -4.23 119.74 122.92 1u4o s LYS 56 Ca 0.67 2.17 0.00 0.00 -1.36 0.00 0.00 55.97 57.45 1u4o s LYS 56 Cb -0.36 -2.92 0.00 0.00 -1.68 0.00 0.00 37.83 32.87 1u4o s LYS 56 CO 0.30 -0.32 0.00 0.09 -0.76 0.00 0.00 175.35 174.66 1u4o n ASN 57 N 0.48 0.00 -0.24 2.83 3.02 -1.26 -4.72 115.26 115.37 1u4o n ASN 57 Ca 0.02 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.58 1u4o n ASN 57 Cb 0.43 0.00 0.09 0.00 -0.61 0.00 0.00 39.78 39.69 1u4o n ASN 57 CO 0.00 0.00 0.00 -0.03 -2.62 0.00 0.00 177.26 174.61 1u4o h MET 58 N 0.00 0.02 -0.48 3.52 4.05 -2.00 -0.48 114.93 119.56 1u4o h MET 58 Ca 0.00 -0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1u4o h MET 58 Cb 0.00 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.77 1u4o h MET 58 CO 0.00 0.01 0.20 -1.35 0.23 0.00 0.00 176.91 176.00 1u4o h PRO 59 N 0.02 0.67 -0.77 0.39 0.11 -1.84 -1.10 132.00 129.47 1u4o h PRO 59 Ca 0.35 -0.09 -0.05 0.00 0.11 0.00 0.00 66.00 66.31 1u4o h PRO 59 Cb 0.54 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.49 1u4o h PRO 59 CO -0.70 0.55 0.27 0.45 -0.21 0.00 0.00 178.00 178.36 1u4o h HIS 60 N 0.67 1.22 -0.27 0.65 3.86 -1.41 -0.34 115.15 119.53 1u4o h HIS 60 Ca 0.16 -0.11 -0.04 0.00 -1.16 0.00 0.00 60.37 59.23 1u4o h HIS 60 Cb 0.13 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.23 1u4o h HIS 60 CO 0.01 0.94 0.02 0.78 0.86 0.00 0.00 177.93 180.54 1u4o h GLY 61 N 1.14 0.50 1.41 2.45 0.00 -0.60 -1.17 103.07 106.81 1u4o h GLY 61 Ca 0.25 -0.35 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 1u4o h GLY 61 CO -0.01 0.33 -0.09 0.50 0.00 0.00 0.00 176.54 177.26 1u4o h LYS 62 N 0.26 0.71 -0.63 4.80 1.57 -1.18 -2.02 116.57 120.07 1u4o h LYS 62 Ca 0.08 -0.22 -0.06 0.00 -1.87 0.00 0.00 60.65 58.58 1u4o h LYS 62 Cb 0.39 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1u4o h LYS 62 CO 0.01 0.79 0.18 0.00 -0.57 0.00 0.00 179.45 179.85 1u4o h ALA 63 N 1.25 0.83 0.27 3.86 0.00 -0.92 -1.31 119.26 123.24 1u4o h ALA 63 Ca 0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1u4o h ALA 63 Cb 0.54 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1u4o h ALA 63 CO 0.03 0.53 -0.13 1.25 0.00 0.00 0.00 179.25 180.93 1u4o h LEU 64 N 0.92 -0.31 -0.43 0.00 5.85 -0.89 -0.01 115.31 120.45 1u4o h LEU 64 Ca 0.20 -0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.92 1u4o h LEU 64 Cb 0.33 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.36 1u4o h LEU 64 CO -0.00 -0.11 -0.08 -0.78 -0.34 0.00 0.00 178.44 177.13 1u4o h ASP 65 N -0.50 -0.34 -0.16 1.25 3.58 -1.32 -2.61 116.42 116.33 1u4o h ASP 65 Ca -0.04 0.12 -0.09 0.00 0.42 0.00 0.00 57.03 57.44 1u4o h ASP 65 Cb 0.37 0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.65 1u4o h ASP 65 CO 0.06 -0.12 -0.20 0.74 -2.88 0.00 0.00 179.24 176.84 1u4o h THR 66 N 0.03 1.26 -0.28 2.25 2.02 -1.06 -2.96 112.91 114.18 1u4o h THR 66 Ca 0.21 -1.22 0.03 0.00 0.77 0.00 0.00 66.41 66.20 1u4o h THR 66 Cb 0.31 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 1u4o h THR 66 CO -0.42 0.40 0.19 0.77 0.37 0.00 0.00 175.52 176.83 1u4o h SER 67 N 0.52 0.21 0.45 4.18 4.64 -0.59 -1.74 113.55 121.21 1u4o h SER 67 Ca 0.08 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.37 1u4o h SER 67 Cb 0.63 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1u4o h SER 67 CO 0.04 0.14 -0.16 0.45 -0.87 0.00 0.00 176.83 176.44 1u4o h HIS 68 N 0.24 0.00 0.00 4.77 -0.00 -1.49 -2.50 115.15 116.16 1u4o h HIS 68 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.49 1u4o h HIS 68 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.58 1u4o h HIS 68 CO -0.00 0.16 0.00 0.25 -0.00 0.00 0.00 177.93 178.33 1u4o n THR 69 N -3.65 0.94 -0.20 2.45 -2.24 -0.65 -2.06 114.28 108.86 1u4o n THR 69 Ca -0.02 0.24 0.15 0.00 -2.27 0.00 0.00 64.05 62.15 1u4o n THR 69 Cb 0.28 -1.02 0.47 0.00 -2.10 0.00 0.00 70.33 67.96 1u4o n THR 69 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1u4o h ASN 70 N 0.00 0.46 0.12 3.42 2.35 -1.61 -0.90 115.58 119.42 1u4o h ASN 70 Ca 0.00 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1u4o h ASN 70 Cb 0.29 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1u4o h ASN 70 CO 0.00 0.23 -0.06 0.58 -1.65 0.00 0.00 177.43 176.53 1u4o h VAL 71 N 0.49 1.05 0.00 2.81 2.07 -1.65 -1.81 116.25 119.21 1u4o h VAL 71 Ca 0.40 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1u4o h VAL 71 Cb 0.86 1.53 -0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1u4o h VAL 71 CO -0.15 0.18 -0.11 0.24 0.02 0.00 0.00 177.57 177.75 1u4o h MET 72 N -0.52 0.00 -0.00 1.57 2.86 -1.62 -3.06 114.93 114.16 1u4o h MET 72 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1u4o h MET 72 Cb 0.42 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 1u4o h MET 72 CO 0.03 0.11 -0.58 0.00 1.06 0.00 0.00 176.91 177.53 1u4o n ALA 73 N -2.51 3.77 -2.92 6.32 0.00 -0.38 -4.96 120.51 119.84 1u4o n ALA 73 Ca -0.03 -0.46 -0.22 0.00 0.00 0.00 0.00 53.44 52.73 1u4o n ALA 73 Cb 0.19 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 18.67 1u4o n ALA 73 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1u4o n TYR 73 N -1.14 -1.79 -3.69 0.00 4.02 -0.75 -4.99 117.16 108.82 1u4o n TYR 73 Ca 0.07 0.42 -0.21 0.00 -0.01 0.00 0.00 57.90 58.16 1u4o n TYR 73 Cb 0.35 -4.28 -0.04 0.00 -0.02 0.00 0.00 39.34 35.35 1u4o n TYR 73 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1u4o s SER 74 N -2.58 4.95 -0.40 7.72 0.01 -0.76 -5.06 113.70 117.59 1u4o s SER 74 Ca 0.25 -0.78 0.08 0.00 1.31 0.00 0.00 55.95 56.80 1u4o s SER 74 Cb -0.11 -0.59 0.24 0.00 0.21 0.00 0.00 66.02 65.77 1u4o s SER 74 CO 0.31 -0.60 0.54 -3.20 0.41 0.00 0.00 173.24 170.70 1u4o n ASN 75 N -1.47 -0.14 -4.33 2.44 2.85 -1.26 -4.69 115.26 108.65 1u4o n ASN 75 Ca 0.02 -2.72 -0.34 0.00 -0.11 0.00 0.00 54.58 51.43 1u4o n ASN 75 Cb 0.62 -0.42 -0.14 0.00 1.24 0.00 0.00 39.78 41.08 1u4o n ASN 75 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1u4o s LYS 77 N 1.00 4.30 -0.12 0.00 1.02 -1.26 -4.88 119.74 119.79 1u4o s LYS 77 Ca -0.01 2.12 -0.00 0.00 0.02 0.00 0.00 55.97 58.10 1u4o s LYS 77 Cb -0.15 -3.00 0.03 0.00 -0.52 0.00 0.00 37.83 34.19 1u4o s LYS 77 CO -0.01 -0.20 -0.08 0.08 -0.92 0.00 0.00 175.35 174.22 1u4o s VAL 78 N -1.19 1.12 0.04 3.17 1.01 -1.26 0.01 120.40 123.30 1u4o s VAL 78 Ca 0.50 -0.38 0.04 0.00 0.00 0.00 0.00 61.98 62.14 1u4o s VAL 78 Cb -0.38 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 1u4o s VAL 78 CO 0.49 0.35 -0.12 -0.94 0.00 0.00 0.00 175.10 174.88 1u4o s SER 79 N 1.67 1.41 0.49 3.32 1.04 -0.44 -4.60 113.70 116.58 1u4o s SER 79 Ca 0.04 -0.49 -0.04 0.00 0.48 0.00 0.00 55.95 55.95 1u4o s SER 79 Cb -0.13 -0.06 -0.02 0.00 0.10 0.00 0.00 66.02 65.91 1u4o s SER 79 CO -0.09 -0.04 0.77 -0.83 0.98 0.00 0.00 173.24 174.04 1u4o s GLY 80 N -1.30 1.52 -0.19 7.32 0.00 -1.26 -0.60 107.32 112.81 1u4o s GLY 80 Ca -0.02 -0.66 -0.16 0.00 0.00 0.00 0.00 44.72 43.88 1u4o s GLY 80 CO 0.01 -0.48 0.49 -0.45 0.00 0.00 0.00 173.10 172.67 1u4o s SER 81 N -4.16 -0.53 -0.14 1.64 0.15 0.27 -4.83 113.70 106.10 1u4o s SER 81 Ca 0.48 1.00 0.17 0.00 0.70 0.00 0.00 55.95 58.30 1u4o s SER 81 Cb -0.10 0.99 0.37 0.00 -1.71 0.00 0.00 66.02 65.57 1u4o s SER 81 CO 0.43 -0.18 1.26 0.59 1.20 0.00 0.00 173.24 176.54 1u4o n ASN 83 N 3.02 2.97 -4.02 5.45 5.03 -1.26 -1.59 115.26 124.85 1u4o n ASN 83 Ca -0.15 -2.98 -0.31 0.00 0.87 0.00 0.00 54.58 52.02 1u4o n ASN 83 Cb 0.57 -0.45 -0.16 0.00 -1.02 0.00 0.00 39.78 38.71 1u4o n ASN 83 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1u4o s THR 84 N -2.72 1.67 0.49 3.41 2.01 -1.26 -4.94 115.64 114.29 1u4o s THR 84 Ca 0.34 -0.88 0.18 0.00 0.31 0.00 0.00 61.69 61.65 1u4o s THR 84 Cb 0.29 -1.66 0.34 0.00 0.01 0.00 0.00 72.50 71.48 1u4o s THR 84 CO 0.06 0.31 2.02 1.88 -0.69 0.00 0.00 174.62 178.19 1u4o h TYR 85 N 7.99 0.19 0.00 4.92 -1.99 -1.98 -1.66 116.97 124.45 1u4o h TYR 85 Ca -0.33 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.40 1u4o h TYR 85 Cb 1.11 -0.06 0.00 0.00 2.00 0.00 0.00 36.73 39.78 1u4o h TYR 85 CO 0.49 0.09 0.00 -0.44 -0.00 0.00 0.00 178.16 178.31 1u4o h ASP 86 N 0.18 0.00 0.17 3.88 3.32 -1.96 -0.59 116.42 121.42 1u4o h ASP 86 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1u4o h ASP 86 Cb 0.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1u4o h ASP 86 CO -0.03 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 177.96 1u4o n ASP 87 N -2.32 0.00 0.23 6.45 8.00 -0.62 -1.58 116.55 126.70 1u4o n ASP 87 Ca 0.01 0.14 0.16 0.00 0.71 0.00 0.00 54.79 55.80 1u4o n ASP 87 Cb 0.16 -0.28 0.77 0.00 -0.02 0.00 0.00 41.12 41.76 1u4o n ASP 87 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1u4o h LEU 88 N 0.00 0.00 -9.62 0.64 3.38 -1.31 -3.45 115.31 104.94 1u4o h LEU 88 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 1u4o h LEU 88 Cb 0.08 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.91 1u4o h LEU 88 CO 0.00 0.00 0.79 0.00 0.09 0.00 0.00 178.44 179.32 1u4o n ALA 89 N -1.91 1.78 -0.98 1.53 0.00 -0.62 -1.63 120.51 118.68 1u4o n ALA 89 Ca -0.01 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1u4o n ALA 89 Cb 0.13 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.20 1u4o n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u4o n GLY 90 N 2.80 0.54 3.74 0.00 0.00 -1.22 -4.99 105.19 106.06 1u4o n GLY 90 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1u4o n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u4o s ALA 91 N -2.32 3.63 -0.06 4.61 0.00 -0.64 -4.64 121.76 122.34 1u4o s ALA 91 Ca 0.00 1.26 0.02 0.00 0.00 0.00 0.00 51.96 53.24 1u4o s ALA 91 Cb 0.00 -3.55 -0.25 0.00 0.00 0.00 0.00 23.12 19.32 1u4o s ALA 91 CO 0.00 -0.69 0.61 -0.44 0.00 0.00 0.00 175.76 175.24 1u4o h ASP 92 N 5.61 0.25 -3.75 0.00 5.19 -1.32 -3.37 116.42 119.03 1u4o h ASP 92 Ca -0.45 -0.48 -0.40 0.00 -0.62 0.00 0.00 57.03 55.09 1u4o h ASP 92 Cb 1.21 -0.08 -0.31 0.00 0.18 0.00 0.00 39.33 40.33 1u4o h ASP 92 CO 0.81 1.42 -0.78 -0.69 -3.12 0.00 0.00 179.24 176.89 1u4o s VAL 93 N -2.59 0.63 -0.11 -1.35 1.01 -1.04 -1.40 120.40 115.54 1u4o s VAL 93 Ca -0.12 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 61.62 1u4o s VAL 93 Cb 0.07 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 35.89 1u4o s VAL 93 CO 0.81 0.21 -0.17 -0.69 0.00 0.00 0.00 175.10 175.26 1u4o s VAL 94 N 0.31 1.63 -0.24 2.92 1.01 -0.30 -0.78 120.40 124.95 1u4o s VAL 94 Ca -0.04 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 1u4o s VAL 94 Cb -0.09 -1.47 0.02 0.00 0.00 0.00 0.00 36.38 34.84 1u4o s VAL 94 CO 0.00 0.47 -0.07 -0.63 0.00 0.00 0.00 175.10 174.87 1u4o s ILE 95 N 0.89 2.94 -0.36 2.22 1.01 -0.21 -0.73 121.20 126.95 1u4o s ILE 95 Ca -0.08 -0.88 -0.11 0.00 0.00 0.00 0.00 60.65 59.58 1u4o s ILE 95 Cb -0.15 -2.43 0.02 0.00 0.01 0.00 0.00 42.46 39.90 1u4o s ILE 95 CO -0.01 0.28 0.21 -0.69 0.00 0.00 0.00 174.94 174.73 1u4o s VAL 96 N 1.36 4.68 -0.22 2.92 1.01 0.11 -0.62 120.40 129.64 1u4o s VAL 96 Ca 0.02 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.31 1u4o s VAL 96 Cb -0.16 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1u4o s VAL 96 CO -0.05 -0.17 0.25 0.35 0.00 0.00 0.00 175.10 175.48 1u4o n THR 97 N 5.02 0.00 -1.78 3.92 -2.24 -0.39 -0.55 114.28 118.25 1u4o n THR 97 Ca -0.12 -0.45 -0.38 0.00 -2.27 0.00 0.00 64.05 60.83 1u4o n THR 97 Cb 0.47 1.02 0.05 0.00 -2.10 0.00 0.00 70.33 69.77 1u4o n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1u4o s ALA 98 N -1.01 2.68 0.00 6.98 0.00 -0.79 -4.65 121.76 124.96 1u4o s ALA 98 Ca 0.02 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.27 1u4o s ALA 98 Cb 0.02 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1u4o s ALA 98 CO 0.10 -1.43 0.00 0.41 0.00 0.00 0.00 175.76 174.84 1u4o n GLY 99 N 0.77 4.23 3.76 0.00 0.00 -1.26 -4.73 105.19 107.95 1u4o n GLY 99 Ca 0.12 -0.93 -0.38 0.00 0.00 0.00 0.00 46.02 44.83 1u4o n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1u4o s PHE 100 N -1.98 2.68 0.00 1.61 0.40 -1.26 -4.94 117.98 114.49 1u4o s PHE 100 Ca 0.00 1.44 0.00 0.00 -0.60 0.00 0.00 56.93 57.77 1u4o s PHE 100 Cb 0.00 -3.61 0.00 0.00 0.51 0.00 0.00 43.02 39.92 1u4o s PHE 100 CO 0.00 -2.14 0.00 0.25 0.70 0.00 0.00 175.22 174.03 1u4o n THR 101 N -0.42 0.00 -3.69 0.64 -2.24 -1.26 -4.93 114.28 102.38 1u4o n THR 101 Ca 0.07 -0.21 -0.25 0.00 -2.27 0.00 0.00 64.05 61.39 1u4o n THR 101 Cb 0.45 0.85 -0.17 0.00 -2.10 0.00 0.00 70.33 69.36 1u4o n THR 101 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1u4o s LYS 102 N -0.63 0.33 0.00 -0.78 -2.85 -1.26 -5.09 119.74 109.46 1u4o s LYS 102 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 55.97 54.93 1u4o s LYS 102 Cb 0.00 -1.46 0.00 0.00 -2.06 0.00 0.00 37.83 34.31 1u4o s LYS 102 CO 0.00 -0.51 0.00 -1.71 0.10 0.00 0.00 175.35 173.23 1u4o n ASN 108 N 5.19 0.00 0.01 0.03 2.85 -1.26 -5.08 115.26 117.00 1u4o n ASN 108 Ca -0.07 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.43 1u4o n ASN 108 Cb 0.49 0.00 0.39 0.00 1.24 0.00 0.00 39.78 41.90 1u4o n ASN 108 CO 0.00 0.00 0.00 -0.09 -2.11 0.00 0.00 177.26 175.06 1u4o h ARG 109 N 0.00 0.50 -0.41 1.20 2.43 -2.03 -2.65 114.38 113.43 1u4o h ARG 109 Ca 0.00 -0.06 0.12 0.00 -0.81 0.00 0.00 59.98 59.23 1u4o h ARG 109 Cb 0.00 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 1u4o h ARG 109 CO 0.00 0.41 0.31 -0.44 -1.51 0.00 0.00 179.97 178.74 1u4o h ASP 110 N 0.51 0.00 0.19 -3.80 3.32 -2.02 -1.82 116.42 112.79 1u4o h ASP 110 Ca 0.13 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1u4o h ASP 110 Cb 0.09 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 1u4o h ASP 110 CO -0.02 0.00 -0.07 0.44 -1.72 0.00 0.00 179.24 177.87 1u4o h ASP 111 N 0.00 0.00 1.48 6.45 3.45 -1.89 -2.11 116.42 123.80 1u4o h ASP 111 Ca 0.20 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.66 1u4o h ASP 111 Cb 0.82 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.59 1u4o h ASP 111 CO -0.00 0.07 0.00 -0.07 -1.57 0.00 0.00 179.24 177.67 1u4o h LEU 112 N 0.00 0.00 0.05 1.55 3.38 -1.50 -3.37 115.31 115.42 1u4o h LEU 112 Ca -0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1u4o h LEU 112 Cb 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1u4o h LEU 112 CO 0.01 0.00 -0.17 -0.07 0.09 0.00 0.00 178.44 178.30 1u4o h LEU 113 N 0.00 -0.49 -1.65 1.67 3.38 -1.50 -0.47 115.31 116.26 1u4o h LEU 113 Ca 0.00 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1u4o h LEU 113 Cb 0.74 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 1u4o h LEU 113 CO 0.00 -0.24 0.03 1.55 0.09 0.00 0.00 178.44 179.87 1u4o h PRO 114 N -0.31 0.24 -0.25 1.13 0.13 -1.71 -1.26 132.00 129.98 1u4o h PRO 114 Ca 0.04 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 1u4o h PRO 114 Cb 0.35 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.42 1u4o h PRO 114 CO -0.13 0.25 0.03 -0.07 -0.23 0.00 0.00 178.00 177.85 1u4o h LEU 115 N 0.25 0.41 -0.80 1.56 4.07 -1.56 -2.92 115.31 116.31 1u4o h LEU 115 Ca 0.06 -0.27 -0.09 0.00 0.08 0.00 0.00 57.88 57.66 1u4o h LEU 115 Cb 0.13 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.75 1u4o h LEU 115 CO -0.00 0.58 -0.44 0.78 -1.08 0.00 0.00 178.44 178.27 1u4o h ASN 116 N 0.23 0.00 -0.56 -0.43 2.35 -0.89 -2.50 115.58 113.78 1u4o h ASN 116 Ca 0.08 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.84 1u4o h ASN 116 Cb 0.35 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 1u4o h ASN 116 CO 0.01 0.44 0.37 -1.13 -1.65 0.00 0.00 177.43 175.47 1u4o h ASN 117 N 0.00 0.63 -0.89 5.81 -1.24 -1.17 -0.68 115.58 118.05 1u4o h ASN 117 Ca -0.00 -0.01 -0.00 0.00 0.71 0.00 0.00 56.30 56.99 1u4o h ASN 117 Cb 1.00 -0.15 -0.04 0.00 0.73 0.00 0.00 38.32 39.85 1u4o h ASN 117 CO 0.06 0.45 0.55 0.11 -1.29 0.00 0.00 177.43 177.31 1u4o h LYS 118 N 0.74 1.19 -0.33 6.67 1.79 -1.27 0.47 116.57 125.84 1u4o h LYS 118 Ca 0.21 -0.10 -0.04 0.00 -2.18 0.00 0.00 60.65 58.54 1u4o h LYS 118 Cb -0.07 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.32 1u4o h LYS 118 CO -0.06 0.82 0.04 0.82 -1.08 0.00 0.00 179.45 180.00 1u4o h ILE 119 N 1.22 1.24 -0.80 1.86 2.04 -1.03 -1.61 117.51 120.44 1u4o h ILE 119 Ca 0.32 -0.86 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 1u4o h ILE 119 Cb -0.08 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 1u4o h ILE 119 CO -0.06 0.28 0.49 0.24 0.00 0.00 0.00 178.15 179.10 1u4o h MET 120 N 0.38 1.07 -0.29 2.37 2.86 -0.66 -0.40 114.93 120.27 1u4o h MET 120 Ca 0.10 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1u4o h MET 120 Cb 0.37 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1u4o h MET 120 CO 0.01 0.74 0.11 0.82 1.06 0.00 0.00 176.91 179.65 1u4o h ILE 121 N 1.09 1.18 -0.24 -1.22 2.04 -0.59 0.14 117.51 119.91 1u4o h ILE 121 Ca 0.29 -0.56 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 1u4o h ILE 121 Cb -0.06 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1u4o h ILE 121 CO -0.06 0.19 0.12 -0.08 0.00 0.00 0.00 178.15 178.32 1u4o h GLU 122 N 0.31 0.34 -0.57 2.37 4.81 -1.00 -1.28 114.58 119.56 1u4o h GLU 122 Ca 0.10 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 1u4o h GLU 122 Cb 0.19 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1u4o h GLU 122 CO -0.01 0.34 0.02 0.82 -0.73 0.00 0.00 179.01 179.46 1u4o h ILE 123 N 0.26 1.26 -0.61 2.32 2.04 -0.98 -2.71 117.51 119.08 1u4o h ILE 123 Ca 0.08 -1.08 -0.04 0.00 1.00 0.00 0.00 64.86 64.83 1u4o h ILE 123 Cb 0.11 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 1u4o h ILE 123 CO -0.01 0.39 0.24 1.23 0.00 0.00 0.00 178.15 180.00 1u4o h GLY 124 N 1.00 0.99 0.67 5.37 0.00 -0.71 -1.01 103.07 109.39 1u4o h GLY 124 Ca 0.17 -0.55 0.07 0.00 0.00 0.00 0.00 47.33 47.02 1u4o h GLY 124 CO 0.02 0.52 0.55 -1.33 0.00 0.00 0.00 176.54 176.30 1u4o h GLY 125 N 0.86 1.37 1.63 4.60 0.00 -1.08 -0.05 103.07 110.39 1u4o h GLY 125 Ca 0.20 -0.39 -0.16 0.00 0.00 0.00 0.00 47.33 46.98 1u4o h GLY 125 CO -0.01 0.25 -0.61 0.45 0.00 0.00 0.00 176.54 176.61 1u4o h HIS 126 N 0.98 0.49 -0.49 5.60 -0.00 -1.13 -2.44 115.15 118.17 1u4o h HIS 126 Ca 0.40 -0.19 -0.08 0.00 -0.00 0.00 0.00 60.37 60.50 1u4o h HIS 126 Cb 0.23 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 27.53 1u4o h HIS 126 CO -0.03 0.89 -0.02 0.82 -0.00 0.00 0.00 177.93 179.60 1u4o h ILE 127 N 0.28 1.26 -0.87 2.45 2.04 -0.69 -0.42 117.51 121.57 1u4o h ILE 127 Ca -0.01 -1.10 -0.02 0.00 1.00 0.00 0.00 64.86 64.74 1u4o h ILE 127 Cb 1.14 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 38.19 1u4o h ILE 127 CO 0.10 0.38 0.48 0.50 0.00 0.00 0.00 178.15 179.62 1u4o h LYS 128 N 0.73 1.21 0.01 2.37 3.64 -0.90 -0.74 116.57 122.88 1u4o h LYS 128 Ca 0.14 -0.14 -0.14 0.00 -1.27 0.00 0.00 60.65 59.24 1u4o h LYS 128 Cb 0.54 -0.24 0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1u4o h LYS 128 CO 0.03 0.88 -0.54 -0.22 -2.27 0.00 0.00 179.45 177.33 1u4o h LYS 129 N 1.21 0.35 0.00 1.90 3.64 -1.35 -3.38 116.57 118.94 1u4o h LYS 129 Ca 0.31 -0.39 -0.34 0.00 -1.27 0.00 0.00 60.65 58.95 1u4o h LYS 129 Cb 0.02 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 31.89 1u4o h LYS 129 CO -0.05 1.08 -2.29 0.09 -2.27 0.00 0.00 179.45 176.01 1u4o n ASN 130 N -4.27 0.74 -2.99 4.20 3.02 -0.18 -4.78 115.26 111.01 1u4o n ASN 130 Ca -0.10 -0.02 -0.14 0.00 -0.03 0.00 0.00 54.58 54.28 1u4o n ASN 130 Cb 0.65 0.71 0.02 0.00 -0.61 0.00 0.00 39.78 40.55 1u4o n ASN 130 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u4o h PRO 132 N 2.98 0.00 -0.11 0.00 0.13 -1.62 -1.32 132.00 132.05 1u4o h PRO 132 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1u4o h PRO 132 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1u4o h PRO 132 CO 0.35 0.01 0.00 0.09 -0.23 0.00 0.00 178.00 178.22 1u4o n ASN 132 N -3.29 1.82 -4.79 1.44 5.03 -1.26 -4.78 115.26 109.42 1u4o n ASN 132 Ca -0.02 -1.67 -0.34 0.00 0.87 0.00 0.00 54.58 53.42 1u4o n ASN 132 Cb 0.12 -0.07 0.00 0.00 -1.02 0.00 0.00 39.78 38.81 1u4o n ASN 132 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1u4o s ALA 133 N -1.87 2.71 -0.18 5.41 0.00 -0.50 -4.98 121.76 122.36 1u4o s ALA 133 Ca 0.35 0.59 -0.17 0.00 0.00 0.00 0.00 51.96 52.73 1u4o s ALA 133 Cb 0.19 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 1u4o s ALA 133 CO 0.30 -0.76 0.46 0.12 0.00 0.00 0.00 175.76 175.88 1u4o s PHE 134 N -2.13 3.41 -0.16 0.00 5.36 -0.50 -4.88 117.98 119.09 1u4o s PHE 134 Ca 0.68 0.74 -0.03 0.00 -0.96 0.00 0.00 56.93 57.36 1u4o s PHE 134 Cb -0.19 -2.57 -0.02 0.00 -0.34 0.00 0.00 43.02 39.89 1u4o s PHE 134 CO 0.31 0.02 -0.06 0.42 -1.46 0.00 0.00 175.22 174.44 1u4o s ILE 135 N 1.21 3.59 -0.20 3.12 -1.09 0.07 -1.15 121.20 126.75 1u4o s ILE 135 Ca 0.22 -0.46 -0.01 0.00 -2.23 0.00 0.00 60.65 58.17 1u4o s ILE 135 Cb -0.15 -2.57 0.01 0.00 -1.58 0.00 0.00 42.46 38.17 1u4o s ILE 135 CO 0.09 0.49 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.53 1u4o s ILE 136 N 0.50 2.63 -0.05 2.92 1.01 0.10 -1.24 121.20 127.07 1u4o s ILE 136 Ca -0.05 -0.75 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 1u4o s ILE 136 Cb -0.15 -2.16 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 1u4o s ILE 136 CO 0.03 0.48 0.11 -0.69 0.00 0.00 0.00 174.94 174.88 1u4o s VAL 137 N 1.37 5.06 0.00 2.92 1.01 -0.06 -0.71 120.40 129.99 1u4o s VAL 137 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.89 1u4o s VAL 137 Cb -0.14 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.97 1u4o s VAL 137 CO -0.09 0.46 0.00 0.52 0.00 0.00 0.00 175.10 175.99 1u4o n VAL 138 N 1.49 0.00 -1.63 2.92 0.31 0.28 -1.63 118.33 120.07 1u4o n VAL 138 Ca -0.15 0.00 -0.51 0.00 -0.01 0.00 0.00 64.34 63.67 1u4o n VAL 138 Cb 0.53 -0.23 -0.06 0.00 -0.91 0.00 0.00 33.84 33.18 1u4o n VAL 138 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1u4o n THR 139 N -1.14 0.09 -2.48 2.52 -1.04 -1.19 -4.48 114.28 106.56 1u4o n THR 139 Ca 0.00 -0.02 -0.40 0.00 -2.04 0.00 0.00 64.05 61.59 1u4o n THR 139 Cb 0.17 -1.14 -0.04 0.00 -1.82 0.00 0.00 70.33 67.50 1u4o n THR 139 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1u4o s ASN 140 N 1.29 7.27 -0.15 8.00 2.47 -1.26 -2.19 114.94 130.37 1u4o s ASN 140 Ca 0.86 2.25 -0.27 0.00 0.42 0.00 0.00 52.86 56.12 1u4o s ASN 140 Cb -0.88 -2.62 -0.01 0.00 -1.45 0.00 0.00 41.25 36.28 1u4o s ASN 140 CO 0.47 -0.15 0.90 -2.16 -3.72 0.00 0.00 177.10 172.45 1u4o s PRO 141 N -1.32 4.34 0.30 0.43 0.04 -1.26 -4.95 135.00 132.58 1u4o s PRO 141 Ca 0.45 1.16 -0.01 0.00 0.04 0.00 0.00 61.00 62.64 1u4o s PRO 141 Cb -0.32 -3.56 0.47 0.00 0.04 0.00 0.00 34.50 31.13 1u4o s PRO 141 CO 0.40 -0.33 1.96 -0.24 0.04 0.00 0.00 177.00 178.83 1u4o h VAL 142 N 5.16 1.17 0.00 -0.36 3.04 -1.66 -0.83 116.25 122.77 1u4o h VAL 142 Ca -0.30 -0.37 -0.05 0.00 -1.01 0.00 0.00 66.70 64.96 1u4o h VAL 142 Cb 1.13 -0.01 -0.01 0.00 -2.01 0.00 0.00 31.29 30.39 1u4o h VAL 142 CO 0.85 0.20 -0.26 0.44 -1.01 0.00 0.00 177.57 177.79 1u4o h ASP 143 N 1.09 0.00 0.00 3.17 3.32 -1.88 0.24 116.42 122.36 1u4o h ASP 143 Ca 0.32 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.37 1u4o h ASP 143 Cb -0.04 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 1u4o h ASP 143 CO -0.08 0.26 -0.00 0.58 -1.72 0.00 0.00 179.24 178.27 1u4o h VAL 144 N 0.00 0.93 -0.46 -1.35 2.07 -1.67 -3.37 116.25 112.41 1u4o h VAL 144 Ca -0.00 -1.70 -0.00 0.00 0.82 0.00 0.00 66.70 65.81 1u4o h VAL 144 Cb 0.74 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 1u4o h VAL 144 CO 0.03 0.32 0.27 0.24 0.02 0.00 0.00 177.57 178.45 1u4o h MET 145 N -1.00 0.61 -0.79 1.57 2.86 -0.98 -1.77 114.93 115.44 1u4o h MET 145 Ca -0.00 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1u4o h MET 145 Cb 0.52 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1u4o h MET 145 CO -0.00 0.44 0.40 -0.24 1.06 0.00 0.00 176.91 178.57 1u4o h VAL 146 N 0.63 1.25 -0.38 -2.22 3.04 -1.15 -1.18 116.25 116.22 1u4o h VAL 146 Ca 0.16 -0.66 -0.16 0.00 -1.01 0.00 0.00 66.70 65.04 1u4o h VAL 146 Cb -0.01 0.23 -0.01 0.00 -2.01 0.00 0.00 31.29 29.49 1u4o h VAL 146 CO -0.03 0.29 -0.37 -0.61 -1.01 0.00 0.00 177.57 175.84 1u4o h GLN 147 N 1.11 0.93 -0.45 4.17 4.15 -1.50 0.32 115.11 123.84 1u4o h GLN 147 Ca 0.27 -0.48 0.01 0.00 0.77 0.00 0.00 58.65 59.22 1u4o h GLN 147 Cb 0.09 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.77 1u4o h GLN 147 CO -0.04 1.14 0.29 -0.07 -1.93 0.00 0.00 178.83 178.22 1u4o h LEU 148 N 0.74 0.50 -0.73 -2.39 3.38 -1.16 -1.44 115.31 114.20 1u4o h LEU 148 Ca 0.06 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 1u4o h LEU 148 Cb 0.96 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1u4o h LEU 148 CO 0.09 0.36 -0.21 0.25 0.09 0.00 0.00 178.44 179.02 1u4o h LEU 149 N 0.59 0.75 -0.33 1.67 5.85 -1.03 -2.29 115.31 120.51 1u4o h LEU 149 Ca 0.17 -0.26 0.07 0.00 0.84 0.00 0.00 57.88 58.70 1u4o h LEU 149 Cb -0.05 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 40.71 1u4o h LEU 149 CO -0.05 0.95 -0.11 -0.74 -0.34 0.00 0.00 178.44 178.15 1u4o h HIS 150 N 0.65 -0.24 -0.32 1.25 2.76 -0.49 0.22 115.15 118.98 1u4o h HIS 150 Ca 0.09 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.21 1u4o h HIS 150 Cb 0.71 0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.81 1u4o h HIS 150 CO 0.04 -0.17 -0.17 1.96 -1.30 0.00 0.00 177.93 178.28 1u4o h GLN 151 N -0.03 0.58 0.00 5.26 4.20 -1.00 -2.39 115.11 121.73 1u4o h GLN 151 Ca 0.16 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1u4o h GLN 151 Cb 0.28 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.02 1u4o h GLN 151 CO -0.36 0.73 -0.94 0.72 -0.67 0.00 0.00 178.83 178.31 1u4o n HIS 152 N -4.16 0.54 0.05 2.96 8.25 -0.89 -4.01 115.22 117.97 1u4o n HIS 152 Ca 0.00 0.16 0.03 0.00 -0.26 0.00 0.00 57.72 57.65 1u4o n HIS 152 Cb 0.37 -0.66 -0.06 0.00 1.12 0.00 0.00 29.99 30.77 1u4o n HIS 152 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1u4o h SER 153 N 0.00 0.00 0.00 0.41 4.64 -0.88 -3.31 113.55 114.41 1u4o h SER 153 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u4o h SER 153 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1u4o h SER 153 CO 0.00 0.44 0.00 0.61 -0.87 0.00 0.00 176.83 177.01 1u4o n GLY 154 N 1.34 0.44 3.79 -0.77 0.00 -0.91 -3.99 105.19 105.10 1u4o n GLY 154 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 1u4o n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1u4o s VAL 155 N -2.04 3.65 0.75 1.61 -7.23 -1.26 -4.99 120.40 110.89 1u4o s VAL 155 Ca 0.00 0.85 -0.15 0.00 -1.81 0.00 0.00 61.98 60.86 1u4o s VAL 155 Cb 0.00 -3.34 0.04 0.00 0.56 0.00 0.00 36.38 33.64 1u4o s VAL 155 CO 0.00 -0.40 1.19 -2.65 -0.31 0.00 0.00 175.10 172.93 1u4o n PRO 156 N -1.82 0.53 0.28 4.82 -0.02 -1.26 -4.89 135.00 132.62 1u4o n PRO 156 Ca 0.09 0.25 0.11 0.00 -2.02 0.00 0.00 63.50 61.93 1u4o n PRO 156 Cb 0.52 -2.43 0.76 0.00 -0.02 0.00 0.00 33.50 32.33 1u4o n PRO 156 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1u4o h LYS 157 N -0.35 0.00 0.00 -0.52 2.10 -1.94 -1.14 116.57 114.72 1u4o h LYS 157 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1u4o h LYS 157 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 1u4o h LYS 157 CO 0.48 0.01 0.00 0.27 -2.00 0.00 0.00 179.45 178.21 1u4o n ASN 158 N -4.19 0.00 -0.35 7.07 6.94 -1.26 -3.83 115.26 119.64 1u4o n ASN 158 Ca -0.03 -0.92 0.04 0.00 -0.02 0.00 0.00 54.58 53.66 1u4o n ASN 158 Cb 0.10 -0.02 0.10 0.00 -2.36 0.00 0.00 39.78 37.60 1u4o n ASN 158 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1u4o n LYS 159 N -1.02 2.74 -3.75 -3.83 4.76 -0.43 -0.54 118.16 116.09 1u4o n LYS 159 Ca 0.23 -1.99 -0.13 0.00 -2.87 0.00 0.00 58.31 53.55 1u4o n LYS 159 Cb 0.12 -1.26 -0.14 0.00 -1.84 0.00 0.00 35.03 31.91 1u4o n LYS 159 CO 0.00 0.00 0.00 -1.50 -1.37 0.00 0.00 177.40 174.53 1u4o s ILE 160 N -1.44 -0.04 0.15 -0.18 2.07 -1.25 -0.75 121.20 119.76 1u4o s ILE 160 Ca 0.17 0.15 0.00 0.00 -1.41 0.00 0.00 60.65 59.56 1u4o s ILE 160 Cb 0.12 -0.30 -0.04 0.00 0.13 0.00 0.00 42.46 42.37 1u4o s ILE 160 CO 0.07 0.06 0.04 0.27 -1.91 0.00 0.00 174.94 173.48 1u4o s ILE 161 N 1.11 0.31 0.08 2.00 -4.36 -0.37 -4.76 121.20 115.21 1u4o s ILE 161 Ca -0.08 -1.94 0.08 0.00 -0.26 0.00 0.00 60.65 58.45 1u4o s ILE 161 Cb -0.10 -2.11 -0.04 0.00 1.25 0.00 0.00 42.46 41.46 1u4o s ILE 161 CO -0.06 -0.43 -0.19 -0.83 0.24 0.00 0.00 174.94 173.66 1u4o s GLY 162 N -3.11 1.61 0.41 6.27 0.00 -0.33 -0.88 107.32 111.29 1u4o s GLY 162 Ca 0.25 -1.28 -0.26 0.00 0.00 0.00 0.00 44.72 43.43 1u4o s GLY 162 CO 0.03 -1.21 1.33 -2.27 0.00 0.00 0.00 173.10 170.98 1u4o s LEU 163 N -1.75 4.21 0.00 0.66 2.96 -0.65 -1.02 118.68 123.10 1u4o s LEU 163 Ca 0.16 2.71 0.00 0.00 -0.22 0.00 0.00 54.13 56.78 1u4o s LEU 163 Cb -0.10 -3.89 0.00 0.00 0.50 0.00 0.00 46.19 42.70 1u4o s LEU 163 CO 0.07 -0.88 0.00 0.61 -1.32 0.00 0.00 176.35 174.83 1u4o n GLY 164 N 0.65 -2.24 0.31 7.98 0.00 -1.26 -4.67 105.19 105.96 1u4o n GLY 164 Ca 0.04 0.71 0.01 0.00 0.00 0.00 0.00 46.02 46.78 1u4o n GLY 164 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1u4o h GLY 165 N 0.00 0.79 1.00 -0.02 0.00 -1.75 -0.46 103.07 102.63 1u4o h GLY 165 Ca 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 1u4o h GLY 165 CO 0.00 0.34 0.38 -2.08 0.00 0.00 0.00 176.54 175.18 1u4o h VAL 166 N 0.74 1.18 0.08 4.60 2.07 -1.79 0.14 116.25 123.26 1u4o h VAL 166 Ca 0.19 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1u4o h VAL 166 Cb 0.07 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1u4o h VAL 166 CO -0.03 0.18 -0.04 0.25 0.02 0.00 0.00 177.57 177.95 1u4o h LEU 167 N 0.83 -0.09 -0.56 2.57 5.85 -1.60 -1.92 115.31 120.38 1u4o h LEU 167 Ca 0.22 -0.40 -0.05 0.00 0.84 0.00 0.00 57.88 58.49 1u4o h LEU 167 Cb -0.04 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1u4o h LEU 167 CO -0.04 0.38 0.17 0.44 -0.34 0.00 0.00 178.44 179.04 1u4o h ASP 168 N -0.58 0.83 0.59 1.25 3.45 -1.08 -2.51 116.42 118.36 1u4o h ASP 168 Ca -0.01 -0.21 -0.06 0.00 0.43 0.00 0.00 57.03 57.18 1u4o h ASP 168 Cb 0.49 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.03 1u4o h ASP 168 CO 0.02 0.82 -0.27 0.71 -1.57 0.00 0.00 179.24 178.95 1u4o h THR 169 N 0.79 0.83 -0.66 0.35 1.35 -1.04 -2.64 112.91 111.88 1u4o h THR 169 Ca 0.18 -1.09 0.05 0.00 -0.55 0.00 0.00 66.41 65.00 1u4o h THR 169 Cb 0.29 1.66 -0.04 0.00 -1.73 0.00 0.00 68.15 68.33 1u4o h THR 169 CO -0.00 0.27 0.44 0.77 -0.25 0.00 0.00 175.52 176.74 1u4o h SER 170 N 0.00 0.64 0.02 5.36 4.64 -0.88 0.89 113.55 124.22 1u4o h SER 170 Ca -0.00 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1u4o h SER 170 Cb 0.64 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1u4o h SER 170 CO 0.04 0.43 -0.01 0.03 -0.87 0.00 0.00 176.83 176.45 1u4o h ARG 171 N 0.74 -0.02 -0.24 4.77 -0.00 -1.44 -0.93 114.38 117.26 1u4o h ARG 171 Ca 0.27 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.75 1u4o h ARG 171 Cb 0.15 0.01 -0.01 0.00 0.00 0.00 0.00 29.97 30.12 1u4o h ARG 171 CO -0.08 0.35 0.12 1.25 0.00 0.00 0.00 179.97 181.60 1u4o h LEU 172 N -0.39 0.31 -0.28 3.04 5.85 -1.34 -0.74 115.31 121.77 1u4o h LEU 172 Ca -0.00 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.62 1u4o h LEU 172 Cb 0.38 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 1u4o h LEU 172 CO 0.00 0.35 0.11 0.11 -0.34 0.00 0.00 178.44 178.67 1u4o h LYS 173 N 0.26 0.24 0.08 1.25 1.57 -0.89 -2.21 116.57 116.88 1u4o h LYS 173 Ca 0.08 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1u4o h LYS 173 Cb 0.12 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1u4o h LYS 173 CO -0.01 0.16 -0.04 -0.92 -0.57 0.00 0.00 179.45 178.07 1u4o h TYR 174 N 0.25 -0.10 -0.77 -1.35 3.20 -0.82 -0.59 116.97 116.78 1u4o h TYR 174 Ca 0.12 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.99 1u4o h TYR 174 Cb 0.07 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 1u4o h TYR 174 CO -0.11 0.00 0.51 1.88 -1.64 0.00 0.00 178.16 178.80 1u4o h TYR 175 N -0.18 0.97 -0.51 -3.82 0.99 -1.07 -1.67 116.97 111.68 1u4o h TYR 175 Ca -0.01 0.02 -0.11 0.00 2.00 0.00 0.00 58.73 60.63 1u4o h TYR 175 Cb 0.15 -0.33 -0.02 0.00 1.00 0.00 0.00 36.73 37.53 1u4o h TYR 175 CO -0.05 0.61 -0.12 0.82 -0.00 0.00 0.00 178.16 179.42 1u4o h ILE 176 N 1.04 1.27 -0.04 -2.88 2.04 -1.33 -2.82 117.51 114.79 1u4o h ILE 176 Ca 0.28 -1.26 -0.05 0.00 1.00 0.00 0.00 64.86 64.83 1u4o h ILE 176 Cb -0.11 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1u4o h ILE 176 CO -0.06 0.44 -0.20 0.77 0.00 0.00 0.00 178.15 179.10 1u4o h SER 177 N 0.86 0.07 0.31 1.72 4.64 -0.23 -1.42 113.55 119.50 1u4o h SER 177 Ca 0.13 -0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 61.20 1u4o h SER 177 Cb 0.67 -0.02 0.01 0.00 -0.31 0.00 0.00 62.40 62.75 1u4o h SER 177 CO 0.05 0.28 -1.00 1.56 -0.87 0.00 0.00 176.83 176.85 1u4o h GLN 178 N 0.07 0.44 -0.46 4.77 1.08 -1.21 -0.55 115.11 119.25 1u4o h GLN 178 Ca 0.01 -0.50 -0.02 0.00 -1.45 0.00 0.00 58.65 56.69 1u4o h GLN 178 Cb 0.40 0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.96 1u4o h GLN 178 CO 0.03 1.16 0.23 -0.22 -0.95 0.00 0.00 178.83 179.07 1u4o h LYS 179 N 0.24 0.66 -0.01 1.46 1.63 -1.20 -3.13 116.57 116.22 1u4o h LYS 179 Ca -0.10 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.61 1u4o h LYS 179 Cb 1.65 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 33.16 1u4o h LYS 179 CO 0.18 0.55 -0.23 1.28 -3.45 0.00 0.00 179.45 177.78 1u4o n LEU 180 N -4.65 1.00 -3.63 5.20 4.77 -0.58 -4.97 117.00 114.15 1u4o n LEU 180 Ca 0.01 -0.25 -0.21 0.00 -0.03 0.00 0.00 56.01 55.53 1u4o n LEU 180 Cb 0.11 -0.12 0.05 0.00 -2.33 0.00 0.00 43.42 41.12 1u4o n LEU 180 CO 0.37 0.19 -0.03 -3.20 -1.33 0.00 0.00 177.39 173.38 1u4o n ASN 181 N -0.63 -1.79 -4.41 -1.43 5.15 -0.28 -5.03 115.26 106.84 1u4o n ASN 181 Ca 0.13 -0.79 -0.21 0.00 -0.60 0.00 0.00 54.58 53.11 1u4o n ASN 181 Cb 0.34 -4.27 -0.10 0.00 -0.53 0.00 0.00 39.78 35.22 1u4o n ASN 181 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1u4o s VAL 182 N -3.59 1.55 0.15 3.44 -7.23 -0.80 -5.06 120.40 108.86 1u4o s VAL 182 Ca 0.05 -2.11 -0.34 0.00 -1.81 0.00 0.00 61.98 57.77 1u4o s VAL 182 Cb -0.01 -2.43 -0.13 0.00 0.56 0.00 0.00 36.38 34.36 1u4o s VAL 182 CO 0.80 -0.30 1.63 0.00 -0.31 0.00 0.00 175.10 176.91 1u4o h PRO 184 N 6.40 0.65 0.00 0.00 0.11 -1.90 -0.81 132.00 136.44 1u4o h PRO 184 Ca -0.45 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1u4o h PRO 184 Cb 1.25 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1u4o h PRO 184 CO 0.90 0.43 -0.03 -0.09 -0.21 0.00 0.00 178.00 179.00 1u4o h ARG 185 N 0.67 0.00 0.00 1.05 9.65 -1.92 -2.07 114.38 121.76 1u4o h ARG 185 Ca 0.50 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.38 1u4o h ARG 185 Cb 0.74 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.32 1u4o h ARG 185 CO -0.37 0.03 0.00 -0.25 2.80 0.00 0.00 179.97 182.18 1u4o n ASP 186 N -3.24 0.27 -4.70 -3.80 8.00 -0.31 -4.57 116.55 108.20 1u4o n ASP 186 Ca -0.01 0.55 -0.38 0.00 0.71 0.00 0.00 54.79 55.66 1u4o n ASP 186 Cb 0.19 -0.61 -0.06 0.00 -0.02 0.00 0.00 41.12 40.62 1u4o n ASP 186 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1u4o s VAL 187 N -3.09 5.19 0.11 2.53 1.01 -0.78 -4.20 120.40 121.18 1u4o s VAL 187 Ca 0.09 0.86 0.11 0.00 0.00 0.00 0.00 61.98 63.03 1u4o s VAL 187 Cb 0.12 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1u4o s VAL 187 CO 0.40 0.30 -0.27 0.21 0.00 0.00 0.00 175.10 175.74 1u4o s ASN 188 N 0.76 3.30 0.07 3.32 3.04 -0.33 -4.85 114.94 120.26 1u4o s ASN 188 Ca 0.23 -0.71 -0.26 0.00 0.04 0.00 0.00 52.86 52.16 1u4o s ASN 188 Cb -0.15 -0.24 0.09 0.00 -1.54 0.00 0.00 41.25 39.41 1u4o s ASN 188 CO 0.09 0.20 0.74 0.00 -3.04 0.00 0.00 177.10 175.08 1u4o s ALA 189 N -1.01 -1.71 -0.10 1.71 0.00 -1.26 -1.42 121.76 117.97 1u4o s ALA 189 Ca 0.14 0.77 0.01 0.00 0.00 0.00 0.00 51.96 52.87 1u4o s ALA 189 Cb -0.10 0.62 0.02 0.00 0.00 0.00 0.00 23.12 23.66 1u4o s ALA 189 CO 0.05 -0.71 -0.11 -1.01 0.00 0.00 0.00 175.76 173.98 1u4o s HIS 190 N -3.35 1.63 -0.11 0.00 3.76 -1.25 -4.94 115.29 111.02 1u4o s HIS 190 Ca 0.02 -0.75 0.02 0.00 -0.15 0.00 0.00 55.06 54.20 1u4o s HIS 190 Cb -0.01 -1.25 0.01 0.00 1.11 0.00 0.00 32.58 32.45 1u4o s HIS 190 CO -0.10 -0.44 -0.16 0.42 -0.85 0.00 0.00 174.74 173.61 1u4o s ILE 191 N 1.21 1.53 0.41 0.60 1.01 -1.26 -1.94 121.20 122.76 1u4o s ILE 191 Ca -0.04 -0.67 0.05 0.00 0.00 0.00 0.00 60.65 59.99 1u4o s ILE 191 Cb -0.14 -1.39 -0.02 0.00 0.01 0.00 0.00 42.46 40.92 1u4o s ILE 191 CO -0.03 0.45 0.16 0.68 0.00 0.00 0.00 174.94 176.20 1u4o s VAL 192 N 0.94 0.44 0.00 2.92 -7.23 -0.42 -4.62 120.40 112.44 1u4o s VAL 192 Ca -0.07 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.10 1u4o s VAL 192 Cb -0.15 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.46 1u4o s VAL 192 CO -0.01 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1u4o n GLY 193 N -0.89 2.01 3.36 2.32 0.00 -0.41 -1.26 105.19 110.32 1u4o n GLY 193 Ca -0.04 -0.38 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 1u4o n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u4o s ALA 194 N -0.13 -1.18 0.66 4.61 0.00 -1.26 -1.64 121.76 122.81 1u4o s ALA 194 Ca 0.00 0.29 -0.11 0.00 0.00 0.00 0.00 51.96 52.14 1u4o s ALA 194 Cb 0.00 0.58 -0.02 0.00 0.00 0.00 0.00 23.12 23.69 1u4o s ALA 194 CO 0.00 -0.60 1.04 -1.58 0.00 0.00 0.00 175.76 174.63 1u4o s HIS 195 N -3.19 3.35 0.00 0.00 2.46 -1.26 -3.74 115.29 112.91 1u4o s HIS 195 Ca -0.01 1.36 0.00 0.00 0.47 0.00 0.00 55.06 56.88 1u4o s HIS 195 Cb 0.00 -2.81 0.00 0.00 -0.13 0.00 0.00 32.58 29.64 1u4o s HIS 195 CO -0.08 -0.97 0.00 0.41 -2.47 0.00 0.00 174.74 171.64 1u4o n GLY 196 N -2.31 -3.34 0.23 1.59 0.00 -1.26 -4.54 105.19 95.56 1u4o n GLY 196 Ca 0.07 -2.03 0.16 0.00 0.00 0.00 0.00 46.02 44.22 1u4o n GLY 196 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1u4o h ASN 197 N 0.00 0.00 -0.54 1.61 2.35 -1.91 -0.95 115.58 116.14 1u4o h ASN 197 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1u4o h ASN 197 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1u4o h ASN 197 CO 0.00 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.07 1u4o n LYS 198 N -2.67 2.67 -1.61 0.81 4.76 -1.26 -4.98 118.16 115.88 1u4o n LYS 198 Ca -0.00 -2.13 -0.42 0.00 -2.87 0.00 0.00 58.31 52.89 1u4o n LYS 198 Cb 0.17 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 1u4o n LYS 198 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1u4o n MET 199 N 1.03 1.40 -3.60 1.97 0.00 -0.36 -4.48 117.12 113.06 1u4o n MET 199 Ca 0.20 0.50 -0.40 0.00 0.00 0.00 0.00 57.70 57.99 1u4o n MET 199 Cb 0.59 -2.01 -0.11 0.00 0.00 0.00 0.00 33.22 31.69 1u4o n MET 199 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1u4o s VAL 200 N -1.23 4.40 -0.22 3.17 1.01 -0.39 -4.94 120.40 122.21 1u4o s VAL 200 Ca 0.62 -1.12 -0.21 0.00 0.00 0.00 0.00 61.98 61.27 1u4o s VAL 200 Cb -0.59 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 1u4o s VAL 200 CO 0.58 -0.37 0.63 -0.76 0.00 0.00 0.00 175.10 175.19 1u4o s LEU 201 N 1.49 4.11 -0.69 3.92 1.02 -1.26 -1.30 118.68 125.98 1u4o s LEU 201 Ca 0.02 0.79 -0.11 0.00 0.02 0.00 0.00 54.13 54.85 1u4o s LEU 201 Cb -0.21 -2.88 0.18 0.00 0.02 0.00 0.00 46.19 43.30 1u4o s LEU 201 CO 0.04 -0.31 0.60 -0.76 0.02 0.00 0.00 176.35 175.94 1u4o s LEU 202 N 2.14 6.22 0.31 1.79 1.43 -0.82 -4.93 118.68 124.82 1u4o s LEU 202 Ca 0.28 -2.46 0.07 0.00 -1.03 0.00 0.00 54.13 50.99 1u4o s LEU 202 Cb -0.16 -2.11 0.79 0.00 0.03 0.00 0.00 46.19 44.74 1u4o s LEU 202 CO 0.10 -0.60 1.76 0.50 0.23 0.00 0.00 176.35 178.33 1u4o h LYS 203 N 7.92 0.67 0.00 1.70 3.64 -1.95 -1.26 116.57 127.28 1u4o h LYS 203 Ca -0.03 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1u4o h LYS 203 Cb 1.04 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1u4o h LYS 203 CO 0.81 0.44 -0.04 -0.09 -2.27 0.00 0.00 179.45 178.31 1u4o h ARG 204 N 0.69 0.00 -0.45 1.90 2.43 -1.97 -2.92 114.38 114.06 1u4o h ARG 204 Ca 0.60 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.67 1u4o h ARG 204 Cb 1.03 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.51 1u4o h ARG 204 CO -0.42 0.04 0.07 0.66 -1.51 0.00 0.00 179.97 178.81 1u4o n TYR 205 N -3.40 1.53 -3.49 2.20 4.02 -0.48 -4.95 117.16 112.60 1u4o n TYR 205 Ca -0.02 -1.12 -0.38 0.00 -0.01 0.00 0.00 57.90 56.37 1u4o n TYR 205 Cb 0.16 -0.48 -0.06 0.00 -0.02 0.00 0.00 39.34 38.93 1u4o n TYR 205 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1u4o s ILE 206 N -2.97 5.16 0.07 -0.72 1.01 -1.10 -3.92 121.20 118.73 1u4o s ILE 206 Ca 0.48 0.76 0.01 0.00 0.00 0.00 0.00 60.65 61.90 1u4o s ILE 206 Cb 0.39 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1u4o s ILE 206 CO 0.09 0.48 -0.06 0.42 0.00 0.00 0.00 174.94 175.87 1u4o s THR 207 N -0.32 0.55 -0.24 2.92 -4.23 -0.51 -1.50 115.64 112.31 1u4o s THR 207 Ca 0.22 -1.68 0.17 0.00 -1.18 0.00 0.00 61.69 59.22 1u4o s THR 207 Cb -0.15 -1.35 0.48 0.00 1.34 0.00 0.00 72.50 72.82 1u4o s THR 207 CO 0.10 -0.77 1.15 0.52 -0.54 0.00 0.00 174.62 175.08 1u4o n VAL 208 N 0.39 1.63 0.00 2.29 0.31 -1.26 -1.18 118.33 120.51 1u4o n VAL 208 Ca -0.15 -3.18 0.00 0.00 -0.01 0.00 0.00 64.34 61.00 1u4o n VAL 208 Cb 0.59 0.34 0.00 0.00 -0.91 0.00 0.00 33.84 33.86 1u4o n VAL 208 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u4o n GLY 209 N -0.56 0.00 3.86 2.92 0.00 -1.26 -4.78 105.19 105.37 1u4o n GLY 209 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 1u4o n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u4o s ILE 209 N -0.03 5.39 0.21 -0.61 1.01 -1.26 -5.05 121.20 120.86 1u4o s ILE 209 Ca 0.00 0.37 -0.32 0.00 0.00 0.00 0.00 60.65 60.70 1u4o s ILE 209 Cb 0.00 -3.48 -0.13 0.00 0.01 0.00 0.00 42.46 38.85 1u4o s ILE 209 CO 0.00 0.60 1.51 -2.65 0.00 0.00 0.00 174.94 174.40 1u4o n PRO 209 N 2.03 2.18 -0.14 2.79 -0.02 -1.26 -4.27 135.00 136.31 1u4o n PRO 209 Ca -0.18 0.78 0.21 0.00 -2.02 0.00 0.00 63.50 62.29 1u4o n PRO 209 Cb 0.54 -2.50 0.62 0.00 -0.02 0.00 0.00 33.50 32.13 1u4o n PRO 209 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1u4o h LEU 210 N 5.03 0.18 -1.92 2.45 5.85 -1.60 -2.01 115.31 123.31 1u4o h LEU 210 Ca -0.45 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.36 1u4o h LEU 210 Cb 1.26 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 1u4o h LEU 210 CO 0.82 0.08 0.23 -0.61 -0.34 0.00 0.00 178.44 178.62 1u4o h GLN 210 N 0.19 0.10 -0.70 1.25 5.75 -1.89 0.64 115.11 120.44 1u4o h GLN 210 Ca 0.38 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.85 1u4o h GLN 210 Cb 1.20 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.69 1u4o h GLN 210 CO -0.07 0.07 0.36 0.93 -2.65 0.00 0.00 178.83 177.46 1u4o h GLU 211 N 0.10 0.99 0.00 1.69 5.08 -1.73 0.48 114.58 121.20 1u4o h GLU 211 Ca 0.15 -0.12 -0.13 0.00 -1.00 0.00 0.00 59.36 58.26 1u4o h GLU 211 Cb 0.48 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1u4o h GLU 211 CO -0.02 0.75 -0.61 0.74 -1.00 0.00 0.00 179.01 178.88 1u4o h PHE 212 N 0.99 0.00 -0.02 4.33 -1.00 -1.04 -2.05 116.94 118.14 1u4o h PHE 212 Ca 0.25 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.01 1u4o h PHE 212 Cb 0.07 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.63 1u4o h PHE 212 CO 0.01 0.61 -0.05 0.82 -1.61 0.00 0.00 178.31 178.08 1u4o h ILE 213 N 0.00 1.46 -0.93 -0.55 2.04 -0.94 -0.08 117.51 118.52 1u4o h ILE 213 Ca -0.01 -1.43 0.23 0.00 1.00 0.00 0.00 64.86 64.65 1u4o h ILE 213 Cb 1.09 2.36 -0.12 0.00 -0.74 0.00 0.00 36.82 39.41 1u4o h ILE 213 CO 0.08 0.38 0.45 0.78 0.00 0.00 0.00 178.15 179.84 1u4o h ASN 214 N -0.49 0.44 -0.01 1.72 2.35 -0.86 -1.14 115.58 117.58 1u4o h ASN 214 Ca -0.00 0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1u4o h ASN 214 Cb 0.65 0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.12 1u4o h ASN 214 CO 0.01 0.03 0.00 0.59 -1.65 0.00 0.00 177.43 176.41 1u4o n ASN 215 N -4.99 0.26 -1.79 5.81 3.02 -0.78 -4.92 115.26 111.86 1u4o n ASN 215 Ca 0.23 -1.26 -0.20 0.00 -0.03 0.00 0.00 54.58 53.33 1u4o n ASN 215 Cb 0.68 -0.01 -0.06 0.00 -0.61 0.00 0.00 39.78 39.78 1u4o n ASN 215 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1u4o n LYS 216 N -0.71 -1.45 0.21 3.52 4.76 -0.43 -4.85 118.16 119.21 1u4o n LYS 216 Ca 0.19 1.11 0.10 0.00 -2.87 0.00 0.00 58.31 56.84 1u4o n LYS 216 Cb 0.13 -5.54 0.26 0.00 -1.84 0.00 0.00 35.03 28.04 1u4o n LYS 216 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1u4o h LEU 218 N 0.00 0.00 -7.28 -0.35 3.38 -1.24 -3.44 115.31 106.37 1u4o h LEU 218 Ca -0.43 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.44 1u4o h LEU 218 Cb 1.31 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.84 1u4o h LEU 218 CO 0.58 0.15 -0.14 -0.51 0.09 0.00 0.00 178.44 178.61 1u4o s ILE 219 N -3.29 0.01 0.21 1.22 2.07 -1.10 -4.86 121.20 115.47 1u4o s ILE 219 Ca 0.04 -0.11 0.05 0.00 -1.41 0.00 0.00 60.65 59.22 1u4o s ILE 219 Cb 0.07 -0.70 -0.03 0.00 0.13 0.00 0.00 42.46 41.93 1u4o s ILE 219 CO 0.66 -0.06 0.24 -0.94 -1.91 0.00 0.00 174.94 172.93 1u4o s SER 220 N -0.31 5.88 0.26 4.50 1.04 -1.26 -3.84 113.70 119.97 1u4o s SER 220 Ca -0.05 -0.06 -0.02 0.00 0.48 0.00 0.00 55.95 56.30 1u4o s SER 220 Cb -0.03 -1.63 0.44 0.00 0.10 0.00 0.00 66.02 64.90 1u4o s SER 220 CO 0.03 -0.00 1.83 0.44 0.98 0.00 0.00 173.24 176.51 1u4o h ASP 221 N 1.78 0.80 -0.72 7.02 3.32 -1.99 0.05 116.42 126.68 1u4o h ASP 221 Ca -0.49 0.04 -0.07 0.00 0.02 0.00 0.00 57.03 56.53 1u4o h ASP 221 Cb 1.22 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 1u4o h ASP 221 CO 0.63 0.45 0.18 0.00 -1.72 0.00 0.00 179.24 178.78 1u4o h ALA 222 N 1.48 0.94 -0.85 3.45 0.00 -1.99 -0.54 119.26 121.74 1u4o h ALA 222 Ca 0.43 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1u4o h ALA 222 Cb 0.37 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1u4o h ALA 222 CO -0.24 0.66 0.56 0.93 0.00 0.00 0.00 179.25 181.16 1u4o h GLU 223 N 1.08 1.13 -0.25 0.00 5.08 -1.87 -2.48 114.58 117.26 1u4o h GLU 223 Ca 0.23 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 1u4o h GLU 223 Cb 0.37 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1u4o h GLU 223 CO 0.00 0.75 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.52 1u4o h LEU 225 N 1.16 0.44 -0.77 1.33 3.38 -0.01 0.12 115.31 120.96 1u4o h LEU 225 Ca 0.31 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 1u4o h LEU 225 Cb -0.12 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 1u4o h LEU 225 CO -0.07 0.63 0.38 -0.08 0.09 0.00 0.00 178.44 179.40 1u4o h GLU 226 N 0.41 1.09 -0.62 1.13 4.81 -0.97 0.15 114.58 120.58 1u4o h GLU 226 Ca 0.07 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 1u4o h GLU 226 Cb 0.55 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 1u4o h GLU 226 CO 0.04 0.84 0.03 0.00 -0.73 0.00 0.00 179.01 179.19 1u4o h ALA 227 N 1.20 0.88 -0.55 2.92 0.00 -1.06 -1.74 119.26 120.90 1u4o h ALA 227 Ca 0.26 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1u4o h ALA 227 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1u4o h ALA 227 CO -0.04 0.67 0.04 0.82 0.00 0.00 0.00 179.25 180.74 1u4o h ILE 228 N 0.98 1.25 -0.33 0.00 2.04 -0.36 -0.66 117.51 120.42 1u4o h ILE 228 Ca 0.18 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 1u4o h ILE 228 Cb 0.52 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 1u4o h ILE 228 CO 0.02 0.37 0.18 -0.26 0.00 0.00 0.00 178.15 178.46 1u4o h PHE 229 N 0.85 0.46 -0.47 1.37 0.04 -0.34 0.18 116.94 119.03 1u4o h PHE 229 Ca 0.17 -0.01 -0.08 0.00 2.80 0.00 0.00 57.97 60.84 1u4o h PHE 229 Cb 0.44 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 1u4o h PHE 229 CO 0.03 0.37 -0.05 0.22 -0.60 0.00 0.00 178.31 178.28 1u4o h ASP 230 N 0.41 0.80 -0.63 2.17 3.58 -1.15 -2.03 116.42 119.56 1u4o h ASP 230 Ca 0.12 -0.22 -0.07 0.00 0.42 0.00 0.00 57.03 57.28 1u4o h ASP 230 Cb 0.07 -0.21 -0.03 0.00 1.72 0.00 0.00 39.33 40.88 1u4o h ASP 230 CO -0.02 0.89 0.14 -0.09 -2.88 0.00 0.00 179.24 177.28 1u4o h ARG 231 N 0.75 1.04 0.05 0.28 2.43 -0.78 -2.04 114.38 116.11 1u4o h ARG 231 Ca 0.14 -0.25 -0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1u4o h ARG 231 Cb 0.52 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1u4o h ARG 231 CO 0.03 0.94 -0.02 1.15 -1.51 0.00 0.00 179.97 180.55 1u4o h THR 232 N 0.99 1.00 -0.99 0.20 2.02 -0.50 -1.07 112.91 114.55 1u4o h THR 232 Ca 0.20 -0.15 0.05 0.00 0.77 0.00 0.00 66.41 67.28 1u4o h THR 232 Cb 0.38 1.10 -0.06 0.00 -1.74 0.00 0.00 68.15 67.83 1u4o h THR 232 CO 0.01 0.04 0.65 0.58 0.37 0.00 0.00 175.52 177.16 1u4o h VAL 233 N -0.13 1.15 -0.58 3.16 2.07 -1.24 -2.91 116.25 117.77 1u4o h VAL 233 Ca -0.01 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1u4o h VAL 233 Cb 0.11 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 29.69 1u4o h VAL 233 CO 0.01 0.22 0.00 0.59 0.02 0.00 0.00 177.57 178.41 1u4o n ASN 234 N -4.46 3.13 -0.17 0.57 5.03 -0.78 -4.62 115.26 113.97 1u4o n ASN 234 Ca 0.14 -2.00 -0.08 0.00 0.87 0.00 0.00 54.58 53.52 1u4o n ASN 234 Cb 0.12 -0.39 0.01 0.00 -1.02 0.00 0.00 39.78 38.51 1u4o n ASN 234 CO 0.00 0.00 0.00 0.74 -1.83 0.00 0.00 177.26 176.17 1u4o h THR 235 N 3.43 1.18 -0.57 3.41 2.02 -0.99 0.67 112.91 122.06 1u4o h THR 235 Ca 0.00 -0.49 0.02 0.00 0.77 0.00 0.00 66.41 66.71 1u4o h THR 235 Cb 0.78 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 1u4o h THR 235 CO 0.00 0.20 0.36 0.00 0.37 0.00 0.00 175.52 176.45 1u4o h ALA 236 N 1.10 0.73 -0.81 6.16 0.00 -1.84 -1.50 119.26 123.11 1u4o h ALA 236 Ca 0.17 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1u4o h ALA 236 Cb 0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1u4o h ALA 236 CO -0.02 0.10 0.36 1.25 0.00 0.00 0.00 179.25 180.94 1u4o h LEU 237 N 0.72 1.07 -0.75 0.00 5.85 -1.74 -1.47 115.31 118.99 1u4o h LEU 237 Ca 0.22 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.81 1u4o h LEU 237 Cb -0.01 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.70 1u4o h LEU 237 CO -0.08 0.92 0.50 -0.08 -0.34 0.00 0.00 178.44 179.36 1u4o h GLU 238 N 1.16 0.99 -0.27 1.25 4.81 -0.16 -0.11 114.58 122.25 1u4o h GLU 238 Ca 0.27 -0.06 -0.18 0.00 -0.13 0.00 0.00 59.36 59.26 1u4o h GLU 238 Cb 0.15 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.31 1u4o h GLU 238 CO -0.03 0.66 -0.55 0.82 -0.73 0.00 0.00 179.01 179.18 1u4o h ILE 239 N 1.02 1.28 -0.89 2.32 2.04 -1.05 -1.90 117.51 120.34 1u4o h ILE 239 Ca 0.28 -1.74 0.01 0.00 1.00 0.00 0.00 64.86 64.40 1u4o h ILE 239 Cb -0.11 1.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 1u4o h ILE 239 CO -0.06 0.57 0.59 0.58 0.00 0.00 0.00 178.15 179.82 1u4o h VAL 240 N 0.62 1.23 0.00 1.67 2.07 -1.06 -1.84 116.25 118.94 1u4o h VAL 240 Ca 0.01 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 1u4o h VAL 240 Cb 1.17 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1u4o h VAL 240 CO 0.12 0.22 -0.04 0.78 0.02 0.00 0.00 177.57 178.67 1u4o h ASN 241 N 1.20 0.00 -0.23 0.57 2.35 -0.80 -1.07 115.58 117.61 1u4o h ASN 241 Ca 0.32 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.07 1u4o h ASN 241 Cb -0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.23 1u4o h ASN 241 CO -0.07 0.04 0.00 0.18 -1.65 0.00 0.00 177.43 175.93 1u4o n LEU 242 N -3.17 1.33 -2.19 1.61 4.77 -0.73 -4.93 117.00 113.69 1u4o n LEU 242 Ca -0.00 -0.64 -0.15 0.00 -0.03 0.00 0.00 56.01 55.19 1u4o n LEU 242 Cb 0.29 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.26 1u4o n LEU 242 CO 0.27 0.32 0.05 1.41 -1.33 0.00 0.00 177.39 178.12 1u4o n HIS 243 N 0.20 -1.47 -4.46 -1.77 8.25 -0.40 -5.04 115.22 110.52 1u4o n HIS 243 Ca 0.10 0.45 -0.22 0.00 -0.26 0.00 0.00 57.72 57.79 1u4o n HIS 243 Cb 0.22 -3.39 -0.10 0.00 1.12 0.00 0.00 29.99 27.84 1u4o n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1u4o s ALA 244 N -3.04 2.42 -0.17 -1.41 0.00 -0.88 -5.04 121.76 113.65 1u4o s ALA 244 Ca 0.26 -2.01 0.00 0.00 0.00 0.00 0.00 51.96 50.21 1u4o s ALA 244 Cb -0.11 0.65 0.01 0.00 0.00 0.00 0.00 23.12 23.67 1u4o s ALA 244 CO 0.32 -0.31 -0.17 0.45 0.00 0.00 0.00 175.76 176.05 1u4o s SER 245 N -3.50 3.41 -1.36 0.00 0.15 -1.26 -3.41 113.70 107.73 1u4o s SER 245 Ca 0.36 -0.56 -0.11 0.00 0.70 0.00 0.00 55.95 56.34 1u4o s SER 245 Cb 0.08 -1.53 0.11 0.00 -1.71 0.00 0.00 66.02 62.98 1u4o s SER 245 CO 0.15 0.04 2.07 -0.81 1.20 0.00 0.00 173.24 175.89 1u4o n PRO 246 N 4.39 3.39 -0.00 5.44 -0.04 -1.26 -4.58 135.00 142.33 1u4o n PRO 246 Ca -0.20 -3.14 0.08 0.00 -0.04 0.00 0.00 63.50 60.20 1u4o n PRO 246 Cb 0.51 -3.04 -0.10 0.00 -0.04 0.00 0.00 33.50 30.83 1u4o n PRO 246 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1u4o n TYR 247 N 4.57 0.00 -0.01 0.54 4.11 -1.26 -4.51 117.16 120.60 1u4o n TYR 247 Ca 0.46 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 58.24 1u4o n TYR 247 Cb 0.36 -0.05 -0.10 0.00 -0.00 0.00 0.00 39.34 39.55 1u4o n TYR 247 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 1u4o h VAL 248 N 0.00 1.37 -0.57 -3.48 2.07 -1.95 -2.57 116.25 111.13 1u4o h VAL 248 Ca 0.00 -1.32 -0.03 0.00 0.82 0.00 0.00 66.70 66.16 1u4o h VAL 248 Cb 0.44 2.25 -0.03 0.00 -1.52 0.00 0.00 31.29 32.44 1u4o h VAL 248 CO 0.00 0.33 0.23 0.00 0.02 0.00 0.00 177.57 178.16 1u4o h ALA 249 N 0.31 0.74 -0.73 1.67 0.00 -1.97 -1.72 119.26 117.57 1u4o h ALA 249 Ca -0.00 -0.16 0.15 0.00 0.00 0.00 0.00 54.91 54.89 1u4o h ALA 249 Cb 0.58 -0.22 -0.10 0.00 0.00 0.00 0.00 17.79 18.04 1u4o h ALA 249 CO 0.01 0.35 0.23 -1.35 0.00 0.00 0.00 179.25 178.49 1u4o h PRO 250 N 0.78 0.34 -0.40 0.00 0.11 -1.79 -0.71 132.00 130.33 1u4o h PRO 250 Ca 0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1u4o h PRO 250 Cb 0.19 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 1u4o h PRO 250 CO -0.02 0.23 0.26 0.00 -0.21 0.00 0.00 178.00 178.26 1u4o h ALA 251 N 1.56 0.51 -0.59 -0.75 0.00 -0.96 -1.86 119.26 117.17 1u4o h ALA 251 Ca 0.40 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.18 1u4o h ALA 251 Cb 0.64 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1u4o h ALA 251 CO -0.44 -0.03 -0.03 0.00 0.00 0.00 0.00 179.25 178.75 1u4o h ALA 252 N 1.14 0.83 -0.48 0.00 0.00 -0.77 -1.64 119.26 118.34 1u4o h ALA 252 Ca 0.15 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1u4o h ALA 252 Cb -0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1u4o h ALA 252 CO -0.03 0.67 0.30 0.00 0.00 0.00 0.00 179.25 180.19 1u4o h ALA 253 N 0.99 0.61 -0.63 0.00 0.00 -0.96 -1.19 119.26 118.09 1u4o h ALA 253 Ca 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1u4o h ALA 253 Cb 0.59 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1u4o h ALA 253 CO 0.04 0.08 0.34 0.82 0.00 0.00 0.00 179.25 180.52 1u4o h ILE 254 N 0.65 1.20 -0.09 0.00 2.04 -1.11 -2.07 117.51 118.12 1u4o h ILE 254 Ca 0.17 -0.53 -0.09 0.00 1.00 0.00 0.00 64.86 65.42 1u4o h ILE 254 Cb -0.04 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1u4o h ILE 254 CO -0.03 0.22 -0.35 0.40 0.00 0.00 0.00 178.15 178.39 1u4o h ILE 255 N 0.86 1.28 -0.69 -0.67 1.08 -1.15 0.33 117.51 118.55 1u4o h ILE 255 Ca 0.22 -1.33 -0.05 0.00 -0.39 0.00 0.00 64.86 63.31 1u4o h ILE 255 Cb 0.06 1.59 -0.03 0.00 -3.07 0.00 0.00 36.82 35.37 1u4o h ILE 255 CO -0.03 0.40 0.23 -0.08 -0.69 0.00 0.00 178.15 177.97 1u4o h GLU 256 N 0.16 1.06 0.07 2.37 4.81 -0.78 0.75 114.58 123.03 1u4o h GLU 256 Ca 0.02 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 59.03 1u4o h GLU 256 Cb 0.70 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1u4o h GLU 256 CO 0.05 0.91 -0.03 0.52 -0.73 0.00 0.00 179.01 179.73 1u4o h MET 257 N 1.00 -0.09 -0.88 1.92 2.86 -0.81 -2.40 114.93 116.52 1u4o h MET 257 Ca 0.22 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 1u4o h MET 257 Cb 0.28 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.91 1u4o h MET 257 CO -0.01 0.14 0.53 0.00 1.06 0.00 0.00 176.91 178.62 1u4o h ALA 258 N 0.59 1.13 -0.61 6.32 0.00 -0.81 -2.40 119.26 123.49 1u4o h ALA 258 Ca -0.01 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1u4o h ALA 258 Cb 0.27 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1u4o h ALA 258 CO 0.02 0.60 0.07 1.49 0.00 0.00 0.00 179.25 181.42 1u4o h GLU 259 N 1.22 1.01 -0.77 0.00 4.81 -0.82 -1.07 114.58 118.96 1u4o h GLU 259 Ca 0.32 -0.27 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1u4o h GLU 259 Cb -0.04 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 1u4o h GLU 259 CO -0.06 0.94 0.33 1.03 -0.73 0.00 0.00 179.01 180.53 1u4o h SER 260 N 0.94 1.03 0.37 1.04 0.87 -0.94 -0.56 113.55 116.30 1u4o h SER 260 Ca 0.18 -0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.59 1u4o h SER 260 Cb 0.45 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1u4o h SER 260 CO 0.02 0.89 -0.18 0.22 -0.53 0.00 0.00 176.83 177.25 1u4o h TYR 261 N 1.10 -0.46 -0.46 2.24 3.20 -1.21 -0.93 116.97 120.46 1u4o h TYR 261 Ca 0.26 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 1u4o h TYR 261 Cb 0.17 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1u4o h TYR 261 CO 0.02 -0.17 0.11 -0.07 -1.64 0.00 0.00 178.16 176.41 1u4o h LEU 262 N -0.70 0.63 -2.16 2.82 3.38 -0.94 -2.81 115.31 115.53 1u4o h LEU 262 Ca -0.05 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1u4o h LEU 262 Cb 0.49 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1u4o h LEU 262 CO 0.08 0.63 0.00 0.29 0.09 0.00 0.00 178.44 179.53 1u4o n LYS 263 N -4.31 2.18 -3.77 1.13 5.02 -0.24 -4.98 118.16 113.20 1u4o n LYS 263 Ca 0.03 -2.01 -0.23 0.00 -2.02 0.00 0.00 58.31 54.08 1u4o n LYS 263 Cb 0.20 -1.43 0.02 0.00 -0.02 0.00 0.00 35.03 33.81 1u4o n LYS 263 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1u4o n ASP 264 N 1.22 -1.09 0.14 4.39 2.03 -0.79 -4.89 116.55 117.55 1u4o n ASP 264 Ca 0.15 -0.86 0.00 0.00 0.52 0.00 0.00 54.79 54.61 1u4o n ASP 264 Cb 0.53 -3.81 0.13 0.00 -0.72 0.00 0.00 41.12 37.25 1u4o n ASP 264 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1u4o h LEU 265 N -1.87 0.00 0.29 -2.67 3.38 -1.38 -3.45 115.31 109.61 1u4o h LEU 265 Ca -0.61 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 56.95 1u4o h LEU 265 Cb 1.36 0.00 0.09 0.00 0.09 0.00 0.00 40.66 42.20 1u4o h LEU 265 CO 0.58 0.60 -0.64 0.29 0.09 0.00 0.00 178.44 179.36 1u4o n LYS 266 N -3.49 -6.12 -2.07 1.13 5.02 -0.42 -4.98 118.16 107.23 1u4o n LYS 266 Ca 0.00 0.88 -0.38 0.00 -2.02 0.00 0.00 58.31 56.79 1u4o n LYS 266 Cb 0.68 -5.83 0.01 0.00 -0.02 0.00 0.00 35.03 29.87 1u4o n LYS 266 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1u4o s LYS 267 N -5.95 3.66 -0.36 1.97 1.02 -1.21 -4.64 119.74 114.24 1u4o s LYS 267 Ca 0.42 2.01 -0.26 0.00 0.02 0.00 0.00 55.97 58.16 1u4o s LYS 267 Cb -0.18 -2.48 0.01 0.00 -0.52 0.00 0.00 37.83 34.66 1u4o s LYS 267 CO 0.51 -0.70 0.91 0.08 -0.92 0.00 0.00 175.35 175.24 1u4o s VAL 268 N -1.39 4.60 -0.01 3.17 1.01 -1.26 -1.65 120.40 124.88 1u4o s VAL 268 Ca 0.64 1.19 0.01 0.00 0.00 0.00 0.00 61.98 63.81 1u4o s VAL 268 Cb -0.35 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.72 1u4o s VAL 268 CO 0.42 -0.51 -0.02 -0.76 0.00 0.00 0.00 175.10 174.24 1u4o s LEU 269 N 3.42 1.82 -0.23 3.92 1.43 -0.18 -4.94 118.68 123.92 1u4o s LEU 269 Ca 0.37 -0.03 -0.21 0.00 -1.03 0.00 0.00 54.13 53.23 1u4o s LEU 269 Cb -0.12 -0.13 -0.02 0.00 0.03 0.00 0.00 46.19 45.95 1u4o s LEU 269 CO 0.18 -0.00 0.67 -0.63 0.23 0.00 0.00 176.35 176.80 1u4o s ILE 270 N 0.18 4.97 0.09 -0.59 1.01 -1.26 -1.32 121.20 124.28 1u4o s ILE 270 Ca -0.01 1.24 -0.03 0.00 0.00 0.00 0.00 60.65 61.84 1u4o s ILE 270 Cb -0.04 -3.98 -0.03 0.00 0.01 0.00 0.00 42.46 38.43 1u4o s ILE 270 CO -0.01 0.04 0.07 0.00 0.00 0.00 0.00 174.94 175.05 1u4o s SER 272 N -2.94 7.21 0.06 0.00 0.15 -0.19 -1.62 113.70 116.37 1u4o s SER 272 Ca 0.12 1.67 -0.08 0.00 0.70 0.00 0.00 55.95 58.36 1u4o s SER 272 Cb 0.07 -2.56 -0.00 0.00 -1.71 0.00 0.00 66.02 61.81 1u4o s SER 272 CO -0.06 -0.44 0.17 0.28 1.20 0.00 0.00 173.24 174.39 1u4o s THR 273 N 1.76 0.13 0.02 6.45 -1.32 -0.76 -1.19 115.64 120.74 1u4o s THR 273 Ca 0.52 -1.07 -0.30 0.00 -1.21 0.00 0.00 61.69 59.63 1u4o s THR 273 Cb -0.21 -1.11 -0.08 0.00 -1.51 0.00 0.00 72.50 69.58 1u4o s THR 273 CO 0.22 -0.59 1.84 -0.22 -2.21 0.00 0.00 174.62 173.66 1u4o s LEU 274 N -2.45 4.39 -0.03 9.08 2.96 -1.26 -1.95 118.68 129.43 1u4o s LEU 274 Ca -0.00 2.53 -0.22 0.00 -0.22 0.00 0.00 54.13 56.22 1u4o s LEU 274 Cb 0.02 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.13 1u4o s LEU 274 CO -0.07 -1.00 0.66 -0.76 -1.32 0.00 0.00 176.35 173.86 1u4o s LEU 275 N 4.08 4.37 -0.29 -0.68 1.43 -0.17 -4.97 118.68 122.44 1u4o s LEU 275 Ca 0.82 1.20 0.09 0.00 -1.03 0.00 0.00 54.13 55.22 1u4o s LEU 275 Cb -0.40 -3.03 0.47 0.00 0.03 0.00 0.00 46.19 43.26 1u4o s LEU 275 CO 0.37 -0.01 1.17 -0.62 0.23 0.00 0.00 176.35 177.49 1u4o n GLU 276 N 3.21 3.30 0.00 1.70 1.02 -1.24 -2.56 120.64 126.07 1u4o n GLU 276 Ca -0.04 -4.08 0.00 0.00 -0.02 0.00 0.00 57.16 53.02 1u4o n GLU 276 Cb 0.51 -2.17 0.00 0.00 -0.02 0.00 0.00 31.44 29.76 1u4o n GLU 276 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1u4o n GLY 277 N -0.68 1.54 3.76 0.62 0.00 0.19 -4.91 105.19 105.72 1u4o n GLY 277 Ca 0.38 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.99 1u4o n GLY 277 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1u4o s GLN 278 N 0.00 4.26 -1.88 1.61 1.11 -1.20 -1.46 119.66 122.10 1u4o s GLN 278 Ca 0.00 2.34 0.00 0.00 0.01 0.00 0.00 55.36 57.71 1u4o s GLN 278 Cb 0.00 -3.05 0.00 0.00 -1.01 0.00 0.00 33.01 28.95 1u4o s GLN 278 CO 0.00 -0.35 0.00 0.66 0.01 0.00 0.00 175.29 175.61 1u4o n TYR 279 N 1.18 0.00 -1.03 0.91 4.01 -1.26 -1.39 117.16 119.57 1u4o n TYR 279 Ca 0.02 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.75 1u4o n TYR 279 Cb 0.41 -3.08 -0.00 0.00 -0.31 0.00 0.00 39.34 36.35 1u4o n TYR 279 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1u4o n GLY 280 N -0.66 0.47 3.35 2.72 0.00 -0.53 -5.00 105.19 105.54 1u4o n GLY 280 Ca -0.18 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 1u4o n GLY 280 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1u4o s HIS 281 N -1.89 2.49 0.17 1.61 3.76 -0.49 -4.91 115.29 116.03 1u4o s HIS 281 Ca 0.00 -0.44 0.02 0.00 -0.15 0.00 0.00 55.06 54.49 1u4o s HIS 281 Cb 0.00 -1.58 -0.05 0.00 1.11 0.00 0.00 32.58 32.06 1u4o s HIS 281 CO 0.00 -0.03 -0.01 -1.12 -0.85 0.00 0.00 174.74 172.73 1u4o s SER 282 N -0.49 1.29 -1.34 1.40 0.01 -1.26 0.56 113.70 113.87 1u4o s SER 282 Ca 0.06 -1.15 -0.04 0.00 1.31 0.00 0.00 55.95 56.13 1u4o s SER 282 Cb -0.11 0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.22 1u4o s SER 282 CO 0.01 -0.54 0.56 0.47 0.41 0.00 0.00 173.24 174.15 1u4o n ASP 283 N -0.23 -5.56 -3.53 2.44 9.92 -1.06 -4.96 116.55 113.58 1u4o n ASP 283 Ca -0.07 -0.26 -0.16 0.00 -0.53 0.00 0.00 54.79 53.77 1u4o n ASP 283 Cb 0.63 -4.38 -0.05 0.00 -0.64 0.00 0.00 41.12 36.67 1u4o n ASP 283 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1u4o s ILE 285 N -3.11 0.01 -0.06 0.53 1.10 -1.26 -5.05 121.20 113.36 1u4o s ILE 285 Ca 0.28 -0.08 -0.11 0.00 -0.51 0.00 0.00 60.65 60.23 1u4o s ILE 285 Cb -0.12 -0.98 -0.05 0.00 0.15 0.00 0.00 42.46 41.46 1u4o s ILE 285 CO 0.34 -0.04 0.28 -0.36 -2.11 0.00 0.00 174.94 173.05 1u4o s PHE 286 N -1.96 3.67 0.11 3.50 0.40 -1.26 -1.00 117.98 121.43 1u4o s PHE 286 Ca -0.08 0.77 -0.10 0.00 -0.60 0.00 0.00 56.93 56.92 1u4o s PHE 286 Cb -0.01 -2.12 0.00 0.00 0.51 0.00 0.00 43.02 41.41 1u4o s PHE 286 CO 0.03 0.69 0.25 0.20 0.70 0.00 0.00 175.22 177.09 1u4o s GLY 287 N -1.05 0.09 -0.03 4.36 0.00 -0.82 -4.87 107.32 105.00 1u4o s GLY 287 Ca 0.19 -0.55 -0.30 0.00 0.00 0.00 0.00 44.72 44.06 1u4o s GLY 287 CO 0.09 -0.70 1.28 -0.32 0.00 0.00 0.00 173.10 173.45 1u4o s GLY 288 N -2.87 2.00 0.01 0.20 0.00 -0.65 -1.83 107.32 104.17 1u4o s GLY 288 Ca 0.07 0.73 -0.27 0.00 0.00 0.00 0.00 44.72 45.24 1u4o s GLY 288 CO -0.09 2.34 0.63 -1.08 0.00 0.00 0.00 173.10 174.89 1u4o s THR 289 N 2.30 0.01 0.21 0.90 -1.32 -0.64 -1.29 115.64 115.81 1u4o s THR 289 Ca 0.59 -0.06 -0.32 0.00 -1.21 0.00 0.00 61.69 60.69 1u4o s THR 289 Cb -0.27 -0.98 -0.13 0.00 -1.51 0.00 0.00 72.50 69.61 1u4o s THR 289 CO 0.24 -0.03 1.60 -0.81 -2.21 0.00 0.00 174.62 173.41 1u4o n PRO 290 N 0.58 2.43 -4.33 7.08 -0.04 -1.26 -1.88 135.00 137.58 1u4o n PRO 290 Ca -0.19 0.87 -0.17 0.00 -0.04 0.00 0.00 63.50 63.97 1u4o n PRO 290 Cb 0.59 -2.65 -0.10 0.00 -0.04 0.00 0.00 33.50 31.30 1u4o n PRO 290 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1u4o s VAL 291 N 0.69 1.09 -0.22 0.52 -7.23 -0.44 -0.93 120.40 113.89 1u4o s VAL 291 Ca 0.74 -2.04 -0.06 0.00 -1.81 0.00 0.00 61.98 58.80 1u4o s VAL 291 Cb -0.59 -2.32 -0.02 0.00 0.56 0.00 0.00 36.38 34.01 1u4o s VAL 291 CO 0.40 -0.35 0.03 -0.69 -0.31 0.00 0.00 175.10 174.17 1u4o s VAL 292 N -3.38 4.06 -0.23 1.32 1.01 -0.52 -1.01 120.40 121.65 1u4o s VAL 292 Ca 0.28 -0.27 -0.07 0.00 0.00 0.00 0.00 61.98 61.92 1u4o s VAL 292 Cb 0.05 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 1u4o s VAL 292 CO 0.08 0.39 0.06 -0.76 0.00 0.00 0.00 175.10 174.88 1u4o s LEU 293 N 1.27 3.48 0.00 3.92 1.43 -0.66 -0.77 118.68 127.36 1u4o s LEU 293 Ca 0.04 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 1u4o s LEU 293 Cb -0.15 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.15 1u4o s LEU 293 CO 0.02 0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.22 1u4o n GLY 294 N 4.64 4.52 0.28 -3.19 0.00 -0.40 -1.30 105.19 109.74 1u4o n GLY 294 Ca -0.16 -1.06 0.13 0.00 0.00 0.00 0.00 46.02 44.93 1u4o n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u4o h ALA 295 N 1.36 1.48 -0.49 4.61 0.00 -1.81 0.20 119.26 124.62 1u4o h ALA 295 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1u4o h ALA 295 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1u4o h ALA 295 CO 0.00 0.07 0.00 0.09 0.00 0.00 0.00 179.25 179.41 1u4o n ASN 296 N -3.85 4.88 0.00 0.00 3.02 -1.26 -5.03 115.26 113.02 1u4o n ASN 296 Ca -0.03 -2.74 0.00 0.00 -0.03 0.00 0.00 54.58 51.79 1u4o n ASN 296 Cb 0.15 -0.64 0.00 0.00 -0.61 0.00 0.00 39.78 38.67 1u4o n ASN 296 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1u4o n GLY 297 N 0.57 0.34 3.55 7.41 0.00 0.06 -4.49 105.19 112.64 1u4o n GLY 297 Ca 0.23 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 45.12 1u4o n GLY 297 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u4o s VAL 298 N 0.00 3.61 -0.02 1.61 1.01 0.30 -1.27 120.40 125.64 1u4o s VAL 298 Ca 0.00 -0.07 0.11 0.00 0.00 0.00 0.00 61.98 62.02 1u4o s VAL 298 Cb 0.00 -4.51 -0.08 0.00 0.00 0.00 0.00 36.38 31.79 1u4o s VAL 298 CO 0.00 -1.44 1.34 -0.33 0.00 0.00 0.00 175.10 174.67 1u4o h GLU 299 N 11.54 0.00 -2.88 2.72 5.08 -1.18 -3.45 114.58 126.42 1u4o h GLU 299 Ca -0.09 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.13 1u4o h GLU 299 Cb 1.06 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.06 1u4o h GLU 299 CO 1.28 0.74 -0.32 -0.65 -1.00 0.00 0.00 179.01 179.06 1u4o s GLN 301 N -2.83 0.39 -0.26 2.33 -0.21 -1.24 -4.99 119.66 112.85 1u4o s GLN 301 Ca 0.02 0.52 -0.08 0.00 0.02 0.00 0.00 55.36 55.83 1u4o s GLN 301 Cb 0.09 0.15 -0.03 0.00 1.00 0.00 0.00 33.01 34.21 1u4o s GLN 301 CO 0.78 -0.07 0.10 0.08 -2.12 0.00 0.00 175.29 174.07 1u4o s VAL 302 N 0.39 4.59 -0.22 1.09 1.01 -1.26 -1.44 120.40 124.55 1u4o s VAL 302 Ca -0.02 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.75 1u4o s VAL 302 Cb -0.04 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 1u4o s VAL 302 CO -0.02 0.31 0.29 -0.63 0.00 0.00 0.00 175.10 175.06 1u4o s ILE 303 N 1.65 5.27 -0.38 2.22 1.01 -0.10 -5.01 121.20 125.87 1u4o s ILE 303 Ca 0.07 0.48 -0.14 0.00 0.00 0.00 0.00 60.65 61.05 1u4o s ILE 303 Cb -0.15 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.69 1u4o s ILE 303 CO 0.06 0.30 0.27 -0.70 0.00 0.00 0.00 174.94 174.86 1u4o s GLU 304 N 1.17 3.23 0.32 2.79 2.12 -1.26 -4.14 118.70 122.93 1u4o s GLU 304 Ca 0.14 -0.84 -0.29 0.00 0.36 0.00 0.00 54.97 54.35 1u4o s GLU 304 Cb -0.14 -3.89 -0.10 0.00 0.26 0.00 0.00 34.13 30.25 1u4o s GLU 304 CO 0.06 -0.60 1.29 -0.51 -0.54 0.00 0.00 175.26 174.96 1u4o s LEU 305 N 1.70 4.44 -1.39 2.70 1.43 -1.26 -4.90 118.68 121.40 1u4o s LEU 305 Ca 0.06 2.64 -0.13 0.00 -1.03 0.00 0.00 54.13 55.66 1u4o s LEU 305 Cb -0.18 -3.65 0.08 0.00 0.03 0.00 0.00 46.19 42.48 1u4o s LEU 305 CO 0.10 -0.49 2.08 0.00 0.23 0.00 0.00 176.35 178.27 1u4o n GLN 306 N 0.91 3.12 -2.00 1.70 6.02 -1.26 -4.93 117.38 120.95 1u4o n GLN 306 Ca 0.00 -2.95 -0.38 0.00 -0.01 0.00 0.00 57.00 53.66 1u4o n GLN 306 Cb 0.42 -3.17 0.02 0.00 1.02 0.00 0.00 30.24 28.52 1u4o n GLN 306 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1u4o s LEU 307 N 1.50 3.94 0.91 1.08 1.43 -1.26 -5.06 118.68 121.23 1u4o s LEU 307 Ca 0.45 2.57 -0.13 0.00 -1.03 0.00 0.00 54.13 55.99 1u4o s LEU 307 Cb 0.12 -4.23 0.18 0.00 0.03 0.00 0.00 46.19 42.29 1u4o s LEU 307 CO -0.05 -1.25 1.26 0.54 0.23 0.00 0.00 176.35 177.07 1u4o s ASN 308 N -1.10 3.41 0.34 2.29 2.20 -1.26 -4.84 114.94 115.98 1u4o s ASN 308 Ca 0.67 0.18 0.09 0.00 -0.94 0.00 0.00 52.86 52.86 1u4o s ASN 308 Cb -0.35 -0.31 0.60 0.00 -2.00 0.00 0.00 41.25 39.19 1u4o s ASN 308 CO 0.42 -2.53 1.78 0.77 -2.94 0.00 0.00 177.10 174.61 1u4o h SER 309 N -1.41 0.17 -0.07 3.54 4.64 -1.98 -0.75 113.55 117.69 1u4o h SER 309 Ca -0.43 -0.06 -0.19 0.00 -0.47 0.00 0.00 61.79 60.64 1u4o h SER 309 Cb 1.24 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1u4o h SER 309 CO 0.40 0.51 -0.65 -0.33 -0.87 0.00 0.00 176.83 175.88 1u4o h GLU 310 N 0.15 0.69 -0.30 4.77 3.07 -2.00 -1.01 114.58 119.95 1u4o h GLU 310 Ca 0.02 -0.50 -0.12 0.00 -0.50 0.00 0.00 59.36 58.26 1u4o h GLU 310 Cb 0.68 0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.66 1u4o h GLU 310 CO 0.05 1.12 -0.28 0.93 -1.40 0.00 0.00 179.01 179.43 1u4o h GLU 311 N 0.51 0.72 -0.95 2.33 5.08 -1.87 -3.03 114.58 117.38 1u4o h GLU 311 Ca -0.02 -0.37 0.02 0.00 -1.00 0.00 0.00 59.36 57.99 1u4o h GLU 311 Cb 1.25 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.45 1u4o h GLU 311 CO 0.13 0.99 0.63 -0.22 -1.00 0.00 0.00 179.01 179.54 1u4o h LYS 312 N 0.48 1.20 -0.99 2.33 3.64 -0.99 -1.45 116.57 120.79 1u4o h LYS 312 Ca 0.05 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1u4o h LYS 312 Cb 0.85 -0.27 -0.06 0.00 -0.41 0.00 0.00 32.23 32.34 1u4o h LYS 312 CO 0.07 0.80 0.65 0.00 -2.27 0.00 0.00 179.45 178.69 1u4o h ALA 313 N 1.43 1.35 -0.23 5.00 0.00 -1.07 0.17 119.26 125.92 1u4o h ALA 313 Ca 0.36 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 55.07 1u4o h ALA 313 Cb -0.06 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 1u4o h ALA 313 CO -0.10 0.56 -0.51 0.87 0.00 0.00 0.00 179.25 180.07 1u4o h LYS 314 N 1.26 0.64 -0.71 0.00 1.79 -1.28 -2.50 116.57 115.76 1u4o h LYS 314 Ca 0.39 -0.38 0.02 0.00 -2.18 0.00 0.00 60.65 58.50 1u4o h LYS 314 Cb -0.01 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.64 1u4o h LYS 314 CO -0.12 0.99 0.46 0.35 -1.08 0.00 0.00 179.45 180.06 1u4o h PHE 315 N 0.50 0.87 -0.99 -1.35 3.57 -0.50 -2.28 116.94 116.76 1u4o h PHE 315 Ca 0.02 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.56 1u4o h PHE 315 Cb 1.06 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 39.46 1u4o h PHE 315 CO 0.05 0.52 0.66 -0.44 -2.23 0.00 0.00 178.31 176.87 1u4o h ASP 316 N 0.92 1.13 -0.71 0.41 3.32 -0.47 -1.20 116.42 119.81 1u4o h ASP 316 Ca 0.27 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 1u4o h ASP 316 Cb -0.05 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.19 1u4o h ASP 316 CO -0.08 0.81 0.25 -0.33 -1.72 0.00 0.00 179.24 178.17 1u4o h GLU 317 N 1.32 1.10 -0.34 3.56 5.08 -1.03 -0.10 114.58 124.17 1u4o h GLU 317 Ca 0.37 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1u4o h GLU 317 Cb -0.12 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 28.94 1u4o h GLU 317 CO -0.09 0.92 0.05 0.00 -1.00 0.00 0.00 179.01 178.89 1u4o h ALA 318 N 1.21 0.45 -0.70 3.43 0.00 -0.81 -2.36 119.26 120.48 1u4o h ALA 318 Ca 0.24 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1u4o h ALA 318 Cb 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1u4o h ALA 318 CO -0.01 0.15 0.33 0.82 0.00 0.00 0.00 179.25 180.54 1u4o h ILE 319 N 0.40 1.23 -0.58 0.00 1.08 -1.05 -2.39 117.51 116.20 1u4o h ILE 319 Ca 0.10 -0.66 0.00 0.00 -0.39 0.00 0.00 64.86 63.92 1u4o h ILE 319 Cb 0.36 0.37 -0.03 0.00 -3.07 0.00 0.00 36.82 34.45 1u4o h ILE 319 CO 0.01 0.27 0.36 0.00 -0.69 0.00 0.00 178.15 178.10 1u4o h ALA 320 N 1.16 1.55 -0.18 1.87 0.00 -0.78 -0.89 119.26 121.99 1u4o h ALA 320 Ca 0.24 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.90 1u4o h ALA 320 Cb 0.12 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1u4o h ALA 320 CO -0.03 0.40 -0.65 1.49 0.00 0.00 0.00 179.25 180.46 1u4o h GLU 321 N 0.79 0.77 -0.46 0.00 4.57 -1.18 -0.35 114.58 118.72 1u4o h GLU 321 Ca 0.21 -0.58 0.05 0.00 -1.18 0.00 0.00 59.36 57.86 1u4o h GLU 321 Cb -0.06 0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.60 1u4o h GLU 321 CO -0.04 1.20 0.20 1.15 -1.18 0.00 0.00 179.01 180.33 1u4o h THR 322 N 0.50 0.92 -0.80 0.32 2.02 -0.94 -1.95 112.91 112.97 1u4o h THR 322 Ca -0.03 -0.14 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 1u4o h THR 322 Cb 1.28 0.48 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 1u4o h THR 322 CO 0.14 0.07 0.32 0.11 0.37 0.00 0.00 175.52 176.53 1u4o h LYS 323 N 0.40 1.19 -0.30 6.66 1.57 -1.03 0.31 116.57 125.38 1u4o h LYS 323 Ca 0.21 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1u4o h LYS 323 Cb 0.15 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1u4o h LYS 323 CO -0.17 0.96 0.19 -0.09 -0.57 0.00 0.00 179.45 179.77 1u4o h ARG 324 N 1.16 0.37 -0.18 3.15 2.43 -0.73 -1.83 114.38 118.75 1u4o h ARG 324 Ca 0.27 -0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 59.28 1u4o h ARG 324 Cb 0.21 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1u4o h ARG 324 CO -0.02 0.25 -0.44 0.52 -1.51 0.00 0.00 179.97 178.76 1u4o h MET 325 N 0.39 0.45 -0.92 0.20 2.86 -1.13 -2.94 114.93 113.83 1u4o h MET 325 Ca 0.11 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1u4o h MET 325 Cb -0.03 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 1u4o h MET 325 CO -0.04 0.81 0.53 -0.22 1.06 0.00 0.00 176.91 179.05 1u4o h LYS 326 N 0.36 1.26 -0.44 1.72 3.64 -0.69 -2.16 116.57 120.27 1u4o h LYS 326 Ca 0.03 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.21 1u4o h LYS 326 Cb 0.93 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 1u4o h LYS 326 CO 0.08 0.90 -0.01 0.00 -2.27 0.00 0.00 179.45 178.15 1u4o h ALA 327 N 1.31 1.16 0.00 5.00 0.00 -1.21 -2.36 119.26 123.15 1u4o h ALA 327 Ca 0.33 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1u4o h ALA 327 Cb -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1u4o h ALA 327 CO -0.06 0.55 0.00 -0.07 0.00 0.00 0.00 179.25 179.67 1u4o h LEU 328 N 0.68 0.00 -0.57 0.00 3.38 -1.24 -3.33 115.31 114.24 1u4o h LEU 328 Ca 0.14 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 1u4o h LEU 328 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1u4o h LEU 328 CO 0.02 0.00 -0.34 0.00 0.09 0.00 0.00 178.44 178.21 1u4o h ALA 329 N 2.00 0.88 -0.12 1.53 0.00 -0.85 -3.36 119.26 119.34 1u4o h ALA 329 Ca 0.00 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 1u4o h ALA 329 Cb 0.62 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1u4o h ALA 329 CO 0.00 0.42 -0.32 0.45 0.00 0.00 0.00 179.25 179.80 1u4o h HIS 330 N 0.00 0.56 -3.72 0.00 3.86 -1.67 -3.29 115.15 110.88 1u4o h HIS 330 Ca -0.00 -0.22 -0.53 0.00 -1.16 0.00 0.00 60.37 58.46 1u4o h HIS 330 Cb 1.04 -0.10 -0.20 0.00 1.06 0.00 0.00 27.41 29.21 1u4o h HIS 330 CO 0.00 0.94 -0.81 -3.38 0.86 0.00 0.00 177.93 175.54 1u4o s HIS 331 N -3.89 1.74 -2.21 2.45 -3.43 -1.26 -4.98 115.29 103.71 1u4o s HIS 331 Ca -0.14 -0.44 0.30 0.00 -0.80 0.00 0.00 55.06 53.98 1u4o s HIS 331 Cb 0.05 -0.93 1.55 0.00 -1.43 0.00 0.00 32.58 31.82 1u4o s HIS 331 CO 0.79 0.23 2.03 0.72 -2.00 0.00 0.00 174.74 176.51