#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xbo h MET 3 N 0.00 0.00 0.00 3.44 -0.00 -1.89 -1.04 114.93 115.45 1xbo h MET 3 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 59.70 59.60 1xbo h MET 3 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.59 1xbo h MET 3 CO 0.00 0.25 -0.49 1.49 -0.00 0.00 0.00 176.91 178.16 1xbo h GLU 4 N 0.00 0.00 -0.04 -0.10 4.81 -1.97 -1.55 114.58 115.73 1xbo h GLU 4 Ca -0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1xbo h GLU 4 Cb 0.63 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.01 1xbo h GLU 4 CO 0.03 0.49 -0.04 -0.22 -0.73 0.00 0.00 179.01 178.55 1xbo h LYS 5 N 0.00 0.09 -0.26 1.92 3.64 -1.66 -2.31 116.57 117.99 1xbo h LYS 5 Ca -0.00 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1xbo h LYS 5 Cb 1.13 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 1xbo h LYS 5 CO 0.06 0.55 0.18 1.49 -2.27 0.00 0.00 179.45 179.47 1xbo h GLU 6 N -0.37 0.26 -0.27 1.90 4.81 -1.27 -0.05 114.58 119.59 1xbo h GLU 6 Ca 0.01 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1xbo h GLU 6 Cb 0.54 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 1xbo h GLU 6 CO 0.01 0.17 0.07 0.35 -0.73 0.00 0.00 179.01 178.88 1xbo h PHE 7 N 0.26 0.44 -0.68 0.92 3.57 -1.03 0.12 116.94 120.53 1xbo h PHE 7 Ca 0.11 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 1xbo h PHE 7 Cb 0.10 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 1xbo h PHE 7 CO -0.00 0.49 0.24 0.93 -2.23 0.00 0.00 178.31 177.73 1xbo h GLU 8 N 0.26 1.05 0.89 1.11 4.39 -0.74 -0.38 114.58 121.16 1xbo h GLU 8 Ca 0.08 -0.21 -0.04 0.00 0.34 0.00 0.00 59.36 59.53 1xbo h GLU 8 Cb 0.26 -0.16 0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1xbo h GLU 8 CO -0.00 0.89 -0.43 0.37 -1.16 0.00 0.00 179.01 178.68 1xbo h GLN 9 N 0.99 -1.16 -0.69 2.33 5.75 -0.76 0.58 115.11 122.15 1xbo h GLN 9 Ca 0.22 0.08 0.06 0.00 -0.15 0.00 0.00 58.65 58.86 1xbo h GLN 9 Cb 0.26 0.26 -0.06 0.00 1.07 0.00 0.00 27.48 29.02 1xbo h GLN 9 CO -0.01 -0.77 0.39 0.82 -2.65 0.00 0.00 178.83 176.61 1xbo h ILE 10 N -1.20 0.98 0.12 2.39 2.04 -0.77 -1.76 117.51 119.31 1xbo h ILE 10 Ca -0.12 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1xbo h ILE 10 Cb 0.92 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 1xbo h ILE 10 CO 0.20 0.13 -0.06 -0.78 0.00 0.00 0.00 178.15 177.64 1xbo h ASP 11 N 0.73 -0.14 -1.00 1.72 -0.00 -1.02 -1.70 116.42 115.01 1xbo h ASP 11 Ca 0.31 -0.15 0.24 0.00 -0.00 0.00 0.00 57.03 57.43 1xbo h ASP 11 Cb 0.18 0.04 -0.09 0.00 -0.00 0.00 0.00 39.33 39.46 1xbo h ASP 11 CO -0.18 0.07 0.64 0.50 -0.00 0.00 0.00 179.24 180.27 1xbo h LYS 12 N -0.34 0.43 -0.66 0.28 3.64 0.67 -1.38 116.57 119.21 1xbo h LYS 12 Ca -0.02 -0.03 -0.46 0.00 -1.27 0.00 0.00 60.65 58.88 1xbo h LYS 12 Cb 0.28 -0.10 -0.31 0.00 -0.41 0.00 0.00 32.23 31.69 1xbo h LYS 12 CO 0.03 0.29 -0.37 -1.13 -2.27 0.00 0.00 179.45 176.00 1xbo n SER 13 N -4.60 4.71 -3.68 4.20 3.41 -0.71 -5.00 113.62 111.96 1xbo n SER 13 Ca 0.23 -3.78 0.00 0.00 -0.26 0.00 0.00 58.87 55.06 1xbo n SER 13 Cb 0.78 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1xbo n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xbo n GLY 14 N -0.86 0.00 1.87 5.00 0.00 -0.52 -4.79 105.19 105.90 1xbo n GLY 14 Ca 0.43 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.24 1xbo n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xbo n SER 15 N 0.92 4.85 0.04 1.61 3.41 -0.73 -4.69 113.62 119.03 1xbo n SER 15 Ca 0.00 -3.77 -0.18 0.00 -0.26 0.00 0.00 58.87 54.65 1xbo n SER 15 Cb 0.00 -0.48 -0.09 0.00 -0.26 0.00 0.00 64.21 63.39 1xbo n SER 15 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1xbo h TRP 16 N 1.95 0.95 -0.61 7.33 4.06 -1.87 -1.33 115.95 126.44 1xbo h TRP 16 Ca 0.36 -0.51 -0.03 0.00 2.06 0.00 0.00 58.89 60.77 1xbo h TRP 16 Cb 1.40 -0.11 -0.03 0.00 -1.00 0.00 0.00 29.16 29.42 1xbo h TRP 16 CO 0.95 1.34 0.26 0.00 -3.56 0.00 0.00 178.44 177.43 1xbo h ALA 17 N 0.49 1.32 -0.03 1.49 0.00 -1.91 0.10 119.26 120.73 1xbo h ALA 17 Ca -0.11 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1xbo h ALA 17 Cb 1.64 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1xbo h ALA 17 CO 0.19 0.52 -0.14 0.00 0.00 0.00 0.00 179.25 179.82 1xbo h ALA 18 N 1.42 0.05 -0.35 0.00 0.00 -1.89 -1.56 119.26 116.94 1xbo h ALA 18 Ca 0.21 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1xbo h ALA 18 Cb 0.14 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 1xbo h ALA 18 CO -0.02 -0.01 0.07 0.82 0.00 0.00 0.00 179.25 180.10 1xbo h ILE 19 N -0.46 0.83 -0.55 0.00 1.08 -1.08 -0.49 117.51 116.85 1xbo h ILE 19 Ca -0.01 -0.06 -0.02 0.00 -0.39 0.00 0.00 64.86 64.38 1xbo h ILE 19 Cb 0.81 0.62 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 1xbo h ILE 19 CO 0.03 0.03 0.26 0.22 -0.69 0.00 0.00 178.15 178.00 1xbo h TYR 20 N 0.19 0.76 -0.03 1.37 3.20 -0.83 -1.80 116.97 119.83 1xbo h TYR 20 Ca 0.16 -0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.90 1xbo h TYR 20 Cb 0.19 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 1xbo h TYR 20 CO -0.19 0.57 -0.52 0.37 -1.64 0.00 0.00 178.16 176.75 1xbo h GLN 21 N 0.77 0.07 -0.75 1.82 5.75 -0.27 -2.74 115.11 119.76 1xbo h GLN 21 Ca 0.19 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.61 1xbo h GLN 21 Cb 0.09 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.61 1xbo h GLN 21 CO -0.02 0.58 0.31 -0.44 -2.65 0.00 0.00 178.83 176.60 1xbo h ASP 22 N 0.06 1.03 -0.42 -0.69 3.45 -0.25 -0.39 116.42 119.21 1xbo h ASP 22 Ca -0.00 -0.17 -0.06 0.00 0.43 0.00 0.00 57.03 57.23 1xbo h ASP 22 Cb 0.94 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 39.42 1xbo h ASP 22 CO 0.07 0.91 0.06 0.40 -1.57 0.00 0.00 179.24 179.11 1xbo h ILE 23 N 1.08 1.23 -0.37 0.35 2.04 -1.27 -1.87 117.51 118.70 1xbo h ILE 23 Ca 0.25 -0.90 -0.13 0.00 1.00 0.00 0.00 64.86 65.09 1xbo h ILE 23 Cb 0.20 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1xbo h ILE 23 CO -0.02 0.32 -0.26 0.03 0.00 0.00 0.00 178.15 178.22 1xbo h ARG 24 N 0.74 0.84 -0.17 2.37 3.08 -1.11 0.87 114.38 121.00 1xbo h ARG 24 Ca 0.15 -0.40 -0.03 0.00 0.07 0.00 0.00 59.98 59.78 1xbo h ARG 24 Cb 0.37 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 1xbo h ARG 24 CO 0.01 1.04 -0.02 1.25 -1.07 0.00 0.00 179.97 181.17 1xbo h HIS 25 N 0.64 0.25 -0.01 3.04 2.76 -0.80 -2.88 115.15 118.15 1xbo h HIS 25 Ca 0.07 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1xbo h HIS 25 Cb 0.83 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.71 1xbo h HIS 25 CO 0.06 0.29 -0.63 0.39 -1.30 0.00 0.00 177.93 176.74 1xbo n GLU 26 N -4.37 0.62 -1.55 5.26 1.02 -0.73 -5.00 120.64 115.89 1xbo n GLU 26 Ca -0.00 -0.48 -0.37 0.00 -0.02 0.00 0.00 57.16 56.29 1xbo n GLU 26 Cb 0.19 -1.49 0.07 0.00 -0.02 0.00 0.00 31.44 30.19 1xbo n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xbo n ALA 27 N -0.77 0.26 -0.98 0.62 0.00 0.28 -4.96 120.51 114.97 1xbo n ALA 27 Ca 0.07 -0.07 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1xbo n ALA 27 Cb 0.39 -2.17 0.15 0.00 0.00 0.00 0.00 19.45 17.83 1xbo n ALA 27 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1xbo s SER 28 N -1.44 3.19 -0.15 0.00 0.01 -1.26 -5.05 113.70 109.00 1xbo s SER 28 Ca 0.77 1.77 -0.04 0.00 1.31 0.00 0.00 55.95 59.75 1xbo s SER 28 Cb -0.38 -2.38 0.08 0.00 0.21 0.00 0.00 66.02 63.54 1xbo s SER 28 CO 0.46 -2.86 0.27 -0.62 0.41 0.00 0.00 173.24 170.90 1xbo s ASP 29 N -3.07 0.54 0.10 2.44 3.68 -1.26 -4.94 116.67 114.15 1xbo s ASP 29 Ca 0.65 0.41 0.04 0.00 2.13 0.00 0.00 52.55 55.77 1xbo s ASP 29 Cb -0.20 0.68 -0.04 0.00 -1.45 0.00 0.00 42.92 41.91 1xbo s ASP 29 CO 0.58 -0.26 -0.10 -0.36 0.13 0.00 0.00 175.17 175.16 1xbo s PHE 30 N 2.42 1.06 0.43 -5.34 0.08 -1.26 -5.13 117.98 110.24 1xbo s PHE 30 Ca 0.03 -0.67 -0.26 0.00 0.12 0.00 0.00 56.93 56.16 1xbo s PHE 30 Cb -0.13 -0.58 -0.08 0.00 -0.57 0.00 0.00 43.02 41.66 1xbo s PHE 30 CO -0.10 -0.00 1.37 -1.25 -0.10 0.00 0.00 175.22 175.14 1xbo s PRO 31 N -2.87 3.80 -0.36 0.24 0.04 -1.26 -4.84 135.00 129.75 1xbo s PRO 31 Ca 0.06 2.30 0.09 0.00 0.04 0.00 0.00 61.00 63.49 1xbo s PRO 31 Cb -0.02 -2.69 0.44 0.00 0.04 0.00 0.00 34.50 32.27 1xbo s PRO 31 CO -0.00 -0.68 1.12 0.00 0.04 0.00 0.00 177.00 177.47 1xbo h ARG 33 N 2.50 -0.16 -0.85 0.00 3.08 -1.92 -2.53 114.38 114.49 1xbo h ARG 33 Ca 0.24 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.38 1xbo h ARG 33 Cb 1.18 0.04 -0.07 0.00 0.08 0.00 0.00 29.97 31.20 1xbo h ARG 33 CO 0.73 -0.11 0.51 0.28 -1.07 0.00 0.00 179.97 180.31 1xbo h VAL 34 N -0.17 0.99 -0.21 2.04 2.07 -1.92 -1.70 116.25 117.35 1xbo h VAL 34 Ca 0.09 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 1xbo h VAL 34 Cb 0.30 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1xbo h VAL 34 CO -0.23 0.17 -0.02 0.00 0.02 0.00 0.00 177.57 177.50 1xbo h ALA 35 N 1.43 1.58 -0.01 1.67 0.00 -1.77 -2.78 119.26 119.37 1xbo h ALA 35 Ca 0.39 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1xbo h ALA 35 Cb 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1xbo h ALA 35 CO -0.20 0.31 -0.07 1.63 0.00 0.00 0.00 179.25 180.92 1xbo n LYS 36 N -4.34 1.27 -2.00 0.00 4.76 -0.67 -4.64 118.16 112.55 1xbo n LYS 36 Ca 0.00 -0.64 -0.41 0.00 -2.87 0.00 0.00 58.31 54.39 1xbo n LYS 36 Cb 0.21 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 31.89 1xbo n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1xbo s LEU 37 N -2.17 4.38 0.44 -0.35 1.43 -1.03 -4.88 118.68 116.50 1xbo s LEU 37 Ca 0.35 2.68 0.28 0.00 -1.03 0.00 0.00 54.13 56.41 1xbo s LEU 37 Cb 0.21 -3.62 1.35 0.00 0.03 0.00 0.00 46.19 44.16 1xbo s LEU 37 CO 0.40 -0.72 1.67 -0.65 0.23 0.00 0.00 176.35 177.28 1xbo h PRO 38 N 5.12 0.16 0.00 1.29 0.11 -1.91 0.25 132.00 137.01 1xbo h PRO 38 Ca -0.46 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 1xbo h PRO 38 Cb 1.22 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1xbo h PRO 38 CO 0.78 0.10 -0.24 1.57 -0.21 0.00 0.00 178.00 180.01 1xbo h LYS 39 N 0.16 0.00 -0.64 1.05 2.10 -1.95 -2.84 116.57 114.46 1xbo h LYS 39 Ca 0.75 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.40 1xbo h LYS 39 Cb 2.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.63 1xbo h LYS 39 CO -0.34 0.24 0.00 0.09 -2.00 0.00 0.00 179.45 177.44 1xbo n ASN 40 N -3.56 3.81 -0.03 7.07 3.02 0.86 -4.46 115.26 121.96 1xbo n ASN 40 Ca -0.01 -2.21 -0.09 0.00 -0.03 0.00 0.00 54.58 52.24 1xbo n ASN 40 Cb 0.39 -0.48 -0.03 0.00 -0.61 0.00 0.00 39.78 39.04 1xbo n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1xbo h LYS 41 N 3.60 0.11 -0.15 3.52 3.64 -1.47 -1.54 116.57 124.28 1xbo h LYS 41 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1xbo h LYS 41 Cb 1.09 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1xbo h LYS 41 CO 0.11 0.07 0.00 0.27 -2.27 0.00 0.00 179.45 177.63 1xbo n ASN 42 N -5.08 0.15 -0.61 4.20 6.94 -1.26 -2.65 115.26 116.95 1xbo n ASN 42 Ca -0.03 -1.84 0.06 0.00 -0.02 0.00 0.00 54.58 52.76 1xbo n ASN 42 Cb 0.08 -0.08 0.11 0.00 -2.36 0.00 0.00 39.78 37.53 1xbo n ASN 42 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1xbo n ARG 43 N -0.41 1.66 -4.90 -3.83 1.74 -0.58 -4.92 116.66 105.42 1xbo n ARG 43 Ca 0.00 -1.64 -0.33 0.00 -0.77 0.00 0.00 57.85 55.12 1xbo n ARG 43 Cb 0.04 -1.27 -0.16 0.00 -1.02 0.00 0.00 32.46 30.05 1xbo n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1xbo s ASN 44 N -1.04 3.56 0.07 0.55 0.01 -1.08 -4.46 114.94 112.55 1xbo s ASN 44 Ca 0.20 -0.45 -0.14 0.00 -0.71 0.00 0.00 52.86 51.76 1xbo s ASN 44 Cb 0.12 -1.52 -0.23 0.00 0.41 0.00 0.00 41.25 40.03 1xbo s ASN 44 CO 0.17 0.15 1.19 -0.09 -1.51 0.00 0.00 177.10 177.00 1xbo h ARG 45 N 6.84 0.70 -4.96 -0.60 2.43 -1.89 -3.45 114.38 113.45 1xbo h ARG 45 Ca -0.25 -0.75 -0.59 0.00 -0.81 0.00 0.00 59.98 57.58 1xbo h ARG 45 Cb 1.22 0.21 -0.33 0.00 -0.42 0.00 0.00 29.97 30.65 1xbo h ARG 45 CO 0.53 1.32 -0.84 0.71 -1.51 0.00 0.00 179.97 180.17 1xbo s TYR 46 N -3.31 1.96 0.30 2.20 2.02 -1.26 -5.03 117.35 114.22 1xbo s TYR 46 Ca -0.10 -0.75 0.01 0.00 -0.37 0.00 0.00 57.07 55.86 1xbo s TYR 46 Cb 0.07 -1.35 0.54 0.00 -0.40 0.00 0.00 41.96 40.81 1xbo s TYR 46 CO 0.92 -0.33 1.89 -0.09 -1.57 0.00 0.00 175.55 176.37 1xbo h ARG 47 N 6.79 0.99 -0.31 -0.62 2.43 -1.99 -2.36 114.38 119.31 1xbo h ARG 47 Ca -0.26 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 1xbo h ARG 47 Cb 1.21 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1xbo h ARG 47 CO 0.47 0.65 0.00 -0.25 -1.51 0.00 0.00 179.97 179.34 1xbo n ASP 48 N -4.52 2.00 -3.87 -3.80 8.00 -1.26 -4.72 116.55 108.37 1xbo n ASP 48 Ca 0.15 -1.90 -0.30 0.00 0.71 0.00 0.00 54.79 53.45 1xbo n ASP 48 Cb 0.25 -0.21 -0.15 0.00 -0.02 0.00 0.00 41.12 40.99 1xbo n ASP 48 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xbo s VAL 49 N -1.59 1.43 0.09 2.53 1.01 -0.89 -5.08 120.40 117.91 1xbo s VAL 49 Ca 0.29 -1.57 0.03 0.00 0.00 0.00 0.00 61.98 60.72 1xbo s VAL 49 Cb 0.15 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1xbo s VAL 49 CO 0.21 -0.47 -0.08 -0.44 0.00 0.00 0.00 175.10 174.32 1xbo s SER 50 N 1.37 1.25 0.17 3.32 0.01 -1.26 -4.62 113.70 113.93 1xbo s SER 50 Ca 0.05 -0.88 -0.20 0.00 1.31 0.00 0.00 55.95 56.23 1xbo s SER 50 Cb -0.18 0.05 -0.08 0.00 0.21 0.00 0.00 66.02 66.02 1xbo s SER 50 CO -0.14 -0.35 0.68 -2.16 0.41 0.00 0.00 173.24 171.68 1xbo s PRO 51 N -3.15 4.27 0.58 12.44 0.04 -1.26 -4.58 135.00 143.35 1xbo s PRO 51 Ca 0.07 0.85 -0.18 0.00 0.04 0.00 0.00 61.00 61.78 1xbo s PRO 51 Cb 0.00 -3.05 -0.04 0.00 0.04 0.00 0.00 34.50 31.45 1xbo s PRO 51 CO -0.02 0.50 1.15 -0.06 0.04 0.00 0.00 177.00 178.62 1xbo s PHE 52 N -1.34 2.54 0.18 0.56 0.08 -1.26 -4.59 117.98 114.15 1xbo s PHE 52 Ca 0.37 1.54 -0.10 0.00 0.12 0.00 0.00 56.93 58.87 1xbo s PHE 52 Cb -0.18 -3.34 0.06 0.00 -0.57 0.00 0.00 43.02 38.98 1xbo s PHE 52 CO 0.21 -1.84 1.63 -0.44 -0.10 0.00 0.00 175.22 174.69 1xbo h ASP 53 N 0.87 1.03 0.23 1.36 3.32 -1.54 -2.51 116.42 119.19 1xbo h ASP 53 Ca -0.50 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.24 1xbo h ASP 53 Cb 1.27 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 40.54 1xbo h ASP 53 CO 0.56 1.09 -0.04 1.12 -1.72 0.00 0.00 179.24 180.24 1xbo h HIS 54 N 0.95 0.00 0.00 4.55 2.07 -1.92 -3.11 115.15 117.68 1xbo h HIS 54 Ca 0.17 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.69 1xbo h HIS 54 Cb 0.56 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.54 1xbo h HIS 54 CO 0.04 0.04 -0.09 -1.13 -3.07 0.00 0.00 177.93 173.72 1xbo n SER 55 N -3.47 1.47 -4.82 3.10 3.41 -1.20 -5.07 113.62 107.04 1xbo n SER 55 Ca -0.02 -2.27 -0.32 0.00 -0.26 0.00 0.00 58.87 55.99 1xbo n SER 55 Cb 0.15 -0.20 0.01 0.00 -0.26 0.00 0.00 64.21 63.91 1xbo n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xbo s ARG 56 N -1.38 3.43 -0.11 4.33 1.70 -0.95 -0.39 118.95 125.57 1xbo s ARG 56 Ca 0.12 1.07 -0.18 0.00 -0.47 0.00 0.00 55.73 56.27 1xbo s ARG 56 Cb 0.11 -2.05 -0.04 0.00 -0.57 0.00 0.00 34.95 32.39 1xbo s ARG 56 CO 0.01 -0.71 0.46 0.42 -1.08 0.00 0.00 175.30 174.40 1xbo s ILE 57 N -2.65 5.19 -0.15 4.99 -1.09 -0.76 -4.77 121.20 121.96 1xbo s ILE 57 Ca 0.61 0.91 -0.07 0.00 -2.23 0.00 0.00 60.65 59.87 1xbo s ILE 57 Cb -0.14 -3.80 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 1xbo s ILE 57 CO 0.40 0.35 0.11 -0.54 -1.23 0.00 0.00 174.94 174.02 1xbo s LYS 58 N 0.50 3.69 0.35 2.79 1.02 -1.26 -4.37 119.74 122.46 1xbo s LYS 58 Ca 0.25 -0.22 -0.26 0.00 0.02 0.00 0.00 55.97 55.76 1xbo s LYS 58 Cb -0.15 -3.21 -0.10 0.00 -0.52 0.00 0.00 37.83 33.85 1xbo s LYS 58 CO 0.10 0.55 1.00 -0.51 -0.92 0.00 0.00 175.35 175.57 1xbo s LEU 59 N -0.38 4.28 0.00 3.17 1.43 -0.28 -4.91 118.68 121.98 1xbo s LEU 59 Ca 0.11 1.94 0.00 0.00 -1.03 0.00 0.00 54.13 55.15 1xbo s LEU 59 Cb -0.12 -4.05 0.00 0.00 0.03 0.00 0.00 46.19 42.05 1xbo s LEU 59 CO 0.01 -0.23 0.75 1.41 0.23 0.00 0.00 176.35 178.52 1xbo n HIS 60 N 0.36 0.00 -3.83 0.29 8.25 -1.26 -4.65 115.22 114.38 1xbo n HIS 60 Ca 0.03 -0.28 -0.24 0.00 -0.26 0.00 0.00 57.72 56.97 1xbo n HIS 60 Cb 0.49 -0.18 -0.02 0.00 1.12 0.00 0.00 29.99 31.40 1xbo n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1xbo s GLN 61 N -0.40 3.46 0.08 -0.41 -2.07 -1.26 -5.03 119.66 114.04 1xbo s GLN 61 Ca 0.00 -0.56 0.17 0.00 -1.82 0.00 0.00 55.36 53.15 1xbo s GLN 61 Cb 0.00 -2.87 -0.12 0.00 -1.09 0.00 0.00 33.01 28.93 1xbo s GLN 61 CO 0.00 0.42 0.87 0.93 -1.32 0.00 0.00 175.29 176.19 1xbo h GLU 62 N 1.62 0.00 0.00 9.60 5.08 -2.02 -3.40 114.58 125.46 1xbo h GLU 62 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1xbo h GLU 62 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1xbo h GLU 62 CO 0.65 0.28 0.00 -3.47 -1.00 0.00 0.00 179.01 175.47 1xbo n ASP 63 N -2.89 0.00 -3.99 1.42 -0.08 -1.26 -4.78 116.55 104.96 1xbo n ASP 63 Ca -0.08 0.24 -0.29 0.00 -1.51 0.00 0.00 54.79 53.15 1xbo n ASP 63 Cb 0.82 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 44.11 1xbo n ASP 63 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 1xbo s ASN 64 N -2.00 2.50 -0.06 1.67 3.84 -1.26 -5.03 114.94 114.60 1xbo s ASN 64 Ca 0.00 -0.43 0.14 0.00 0.21 0.00 0.00 52.86 52.78 1xbo s ASN 64 Cb 0.00 -1.07 0.50 0.00 -0.55 0.00 0.00 41.25 40.13 1xbo s ASN 64 CO 0.00 -0.06 1.38 -0.90 -2.79 0.00 0.00 177.10 174.73 1xbo n ASP 65 N 4.73 3.36 -4.81 -4.21 5.68 -1.26 -4.80 116.55 115.24 1xbo n ASP 65 Ca -0.16 -2.24 -0.36 0.00 -0.50 0.00 0.00 54.79 51.52 1xbo n ASP 65 Cb 0.50 -0.45 -0.06 0.00 -1.14 0.00 0.00 41.12 39.97 1xbo n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1xbo s TYR 66 N -1.65 3.66 -0.28 2.11 5.04 -1.26 -1.13 117.35 123.84 1xbo s TYR 66 Ca 0.36 1.39 -0.16 0.00 -2.44 0.00 0.00 57.07 56.22 1xbo s TYR 66 Cb 0.22 -2.62 0.11 0.00 0.35 0.00 0.00 41.96 40.02 1xbo s TYR 66 CO 0.19 0.34 0.83 -1.50 -1.34 0.00 0.00 175.55 174.07 1xbo s ILE 67 N -1.51 0.00 -1.10 3.14 2.07 -1.26 -4.87 121.20 117.67 1xbo s ILE 67 Ca 0.43 0.00 -0.24 0.00 -1.41 0.00 0.00 60.65 59.43 1xbo s ILE 67 Cb -0.17 -1.00 -0.10 0.00 0.13 0.00 0.00 42.46 41.32 1xbo s ILE 67 CO 0.21 0.00 1.98 0.21 -1.91 0.00 0.00 174.94 175.43 1xbo s ASN 68 N 1.48 4.77 -0.09 4.50 3.84 -1.26 -4.60 114.94 123.58 1xbo s ASN 68 Ca -0.09 -1.30 -0.21 0.00 0.21 0.00 0.00 52.86 51.47 1xbo s ASN 68 Cb -0.04 -2.58 0.05 0.00 -0.55 0.00 0.00 41.25 38.12 1xbo s ASN 68 CO -0.17 -3.29 0.49 0.00 -2.79 0.00 0.00 177.10 171.34 1xbo s ALA 69 N 11.87 -1.26 0.03 1.71 0.00 -1.26 -2.95 121.76 129.90 1xbo s ALA 69 Ca 0.72 1.02 0.06 0.00 0.00 0.00 0.00 51.96 53.75 1xbo s ALA 69 Cb -0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 1xbo s ALA 69 CO 0.11 -0.29 -0.17 -1.12 0.00 0.00 0.00 175.76 174.29 1xbo s SER 70 N -0.74 2.01 -0.51 0.00 0.01 0.11 -1.84 113.70 112.75 1xbo s SER 70 Ca -0.08 -0.43 -0.20 0.00 1.31 0.00 0.00 55.95 56.55 1xbo s SER 70 Cb -0.03 -0.17 0.06 0.00 0.21 0.00 0.00 66.02 66.08 1xbo s SER 70 CO 0.05 0.12 0.66 -0.22 0.41 0.00 0.00 173.24 174.26 1xbo s LEU 71 N -0.94 4.86 -0.54 2.44 2.96 0.47 -1.25 118.68 126.69 1xbo s LEU 71 Ca 0.05 -0.84 -0.23 0.00 -0.22 0.00 0.00 54.13 52.89 1xbo s LEU 71 Cb -0.08 -2.49 0.05 0.00 0.50 0.00 0.00 46.19 44.16 1xbo s LEU 71 CO 0.01 -0.92 0.86 -0.63 -1.32 0.00 0.00 176.35 174.35 1xbo s ILE 72 N 2.77 4.51 -0.58 6.68 1.09 0.57 -4.92 121.20 131.31 1xbo s ILE 72 Ca 0.17 0.09 -0.11 0.00 -1.10 0.00 0.00 60.65 59.70 1xbo s ILE 72 Cb -0.18 -4.48 0.15 0.00 -1.06 0.00 0.00 42.46 36.88 1xbo s ILE 72 CO 0.13 -1.04 0.48 -0.75 -0.10 0.00 0.00 174.94 173.66 1xbo s LYS 73 N 3.63 2.83 -0.91 2.79 2.20 -1.26 -1.37 119.74 127.64 1xbo s LYS 73 Ca 0.27 -2.01 -0.23 0.00 -0.36 0.00 0.00 55.97 53.63 1xbo s LYS 73 Cb -0.14 -4.08 0.06 0.00 -1.51 0.00 0.00 37.83 32.16 1xbo s LYS 73 CO 0.17 -1.24 1.31 -1.64 -0.36 0.00 0.00 175.35 173.59 1xbo s MET 74 N 0.95 3.47 0.06 4.03 -1.94 -0.54 -4.92 119.30 120.41 1xbo s MET 74 Ca 0.09 -1.04 -0.18 0.00 -1.71 0.00 0.00 55.69 52.85 1xbo s MET 74 Cb -0.23 -4.93 -0.07 0.00 2.01 0.00 0.00 34.83 31.61 1xbo s MET 74 CO -0.02 -2.08 1.29 1.49 -0.01 0.00 0.00 175.02 175.69 1xbo h GLU 75 N 9.64 -0.31 -0.81 2.03 4.81 -1.96 0.12 114.58 128.11 1xbo h GLU 75 Ca 0.05 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.32 1xbo h GLU 75 Cb 1.03 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.43 1xbo h GLU 75 CO 1.32 -0.21 0.52 1.49 -0.73 0.00 0.00 179.01 181.40 1xbo h GLU 76 N -0.32 1.02 0.00 1.92 4.81 -1.97 -2.38 114.58 117.66 1xbo h GLU 76 Ca 0.01 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1xbo h GLU 76 Cb 0.37 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 1xbo h GLU 76 CO -0.22 0.67 -0.13 0.00 -0.73 0.00 0.00 179.01 178.60 1xbo h ALA 77 N 1.32 1.00 -2.68 2.92 0.00 -1.91 -3.48 119.26 116.44 1xbo h ALA 77 Ca 0.31 -0.12 -0.25 0.00 0.00 0.00 0.00 54.91 54.85 1xbo h ALA 77 Cb -0.05 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 17.74 1xbo h ALA 77 CO -0.09 0.16 -0.36 1.04 0.00 0.00 0.00 179.25 180.00 1xbo n GLN 78 N -3.25 -2.59 -4.23 0.00 1.13 0.41 -4.88 117.38 103.97 1xbo n GLN 78 Ca 0.01 0.56 -0.17 0.00 -1.94 0.00 0.00 57.00 55.46 1xbo n GLN 78 Cb 0.40 -4.70 -0.14 0.00 0.11 0.00 0.00 30.24 25.91 1xbo n GLN 78 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1xbo s ARG 79 N -5.11 0.58 0.04 -1.09 6.06 -1.11 -4.96 118.95 113.36 1xbo s ARG 79 Ca 0.15 -0.34 0.07 0.00 -2.50 0.00 0.00 55.73 53.11 1xbo s ARG 79 Cb -0.06 -0.53 -0.02 0.00 0.06 0.00 0.00 34.95 34.39 1xbo s ARG 79 CO 0.18 0.14 -0.20 -1.12 -2.50 0.00 0.00 175.30 171.80 1xbo s SER 80 N -0.40 2.39 0.07 -2.12 0.01 -1.26 -1.47 113.70 110.92 1xbo s SER 80 Ca 0.01 -0.52 0.03 0.00 1.31 0.00 0.00 55.95 56.78 1xbo s SER 80 Cb -0.04 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.97 1xbo s SER 80 CO -0.00 0.14 -0.09 -0.31 0.41 0.00 0.00 173.24 173.39 1xbo s TYR 81 N -0.81 0.88 -0.25 2.43 1.51 -0.47 -3.89 117.35 116.74 1xbo s TYR 81 Ca 0.07 -0.60 -0.02 0.00 -1.01 0.00 0.00 57.07 55.51 1xbo s TYR 81 Cb -0.09 -0.50 0.02 0.00 -0.11 0.00 0.00 41.96 41.29 1xbo s TYR 81 CO 0.02 -0.05 -0.05 0.42 -1.11 0.00 0.00 175.55 174.77 1xbo s ILE 82 N -1.98 2.95 -0.15 2.71 1.01 -0.14 -0.32 121.20 125.28 1xbo s ILE 82 Ca -0.02 -1.00 -0.11 0.00 0.00 0.00 0.00 60.65 59.53 1xbo s ILE 82 Cb -0.06 -2.50 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 1xbo s ILE 82 CO -0.00 0.19 0.20 -0.76 0.00 0.00 0.00 174.94 174.57 1xbo s LEU 83 N 1.34 4.30 0.12 2.97 1.02 -0.38 -0.08 118.68 127.98 1xbo s LEU 83 Ca 0.00 0.45 -0.07 0.00 0.02 0.00 0.00 54.13 54.53 1xbo s LEU 83 Cb -0.17 -2.21 -0.01 0.00 0.02 0.00 0.00 46.19 43.82 1xbo s LEU 83 CO -0.04 0.24 0.20 0.28 0.02 0.00 0.00 176.35 177.06 1xbo s THR 84 N -0.17 0.11 0.77 5.49 -1.32 -0.73 -0.71 115.64 119.07 1xbo s THR 84 Ca 0.14 -1.39 -0.12 0.00 -1.21 0.00 0.00 61.69 59.12 1xbo s THR 84 Cb -0.12 -1.65 0.05 0.00 -1.51 0.00 0.00 72.50 69.27 1xbo s THR 84 CO 0.03 -0.50 1.11 0.00 -2.21 0.00 0.00 174.62 173.05 1xbo s GLN 85 N -3.93 2.35 0.07 7.08 -2.07 -1.15 -3.65 119.66 118.35 1xbo s GLN 85 Ca 0.12 0.48 -0.31 0.00 -1.82 0.00 0.00 55.36 53.83 1xbo s GLN 85 Cb 0.05 -1.96 -0.07 0.00 -1.09 0.00 0.00 33.01 29.93 1xbo s GLN 85 CO -0.05 -1.40 1.46 0.20 -1.32 0.00 0.00 175.29 174.19 1xbo s GLY 86 N -4.19 1.81 0.44 2.60 0.00 -0.03 -4.88 107.32 103.07 1xbo s GLY 86 Ca 0.60 1.07 -0.23 0.00 0.00 0.00 0.00 44.72 46.16 1xbo s GLY 86 CO 0.52 2.55 0.83 -1.05 0.00 0.00 0.00 173.10 175.95 1xbo n PRO 87 N 4.82 1.01 -3.38 2.90 -0.02 -1.26 -4.68 135.00 134.39 1xbo n PRO 87 Ca 0.13 0.37 -0.22 0.00 -2.02 0.00 0.00 63.50 61.76 1xbo n PRO 87 Cb 0.42 -1.85 -0.00 0.00 -0.02 0.00 0.00 33.50 32.04 1xbo n PRO 87 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1xbo s LEU 88 N 0.17 3.94 0.46 2.45 1.43 -1.26 -0.82 118.68 125.06 1xbo s LEU 88 Ca 0.64 0.18 0.25 0.00 -1.03 0.00 0.00 54.13 54.18 1xbo s LEU 88 Cb -0.56 -3.05 1.28 0.00 0.03 0.00 0.00 46.19 43.89 1xbo s LEU 88 CO 0.56 -0.41 1.81 -0.65 0.23 0.00 0.00 176.35 177.89 1xbo h PRO 89 N 0.75 0.22 -0.01 1.29 0.11 -1.97 0.44 132.00 132.83 1xbo h PRO 89 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1xbo h PRO 89 Cb 1.24 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1xbo h PRO 89 CO 0.58 0.14 -0.26 0.27 -0.21 0.00 0.00 178.00 178.52 1xbo n ASN 90 N -4.44 1.64 -0.18 -2.05 6.94 -1.26 -4.33 115.26 111.59 1xbo n ASN 90 Ca 0.23 -1.31 0.02 0.00 -0.02 0.00 0.00 54.58 53.50 1xbo n ASN 90 Cb 0.97 0.21 0.04 0.00 -2.36 0.00 0.00 39.78 38.64 1xbo n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1xbo n THR 91 N -0.10 0.77 -0.19 5.53 -2.24 0.12 -4.64 114.28 113.52 1xbo n THR 91 Ca 0.12 -0.88 -0.03 0.00 -2.27 0.00 0.00 64.05 60.99 1xbo n THR 91 Cb 0.42 0.63 0.16 0.00 -2.10 0.00 0.00 70.33 69.44 1xbo n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xbo h GLY 93 N 1.03 0.11 0.68 0.00 0.00 -1.89 -1.79 103.07 101.22 1xbo h GLY 93 Ca 0.21 -0.05 0.08 0.00 0.00 0.00 0.00 47.33 47.58 1xbo h GLY 93 CO -0.01 0.04 0.63 0.45 0.00 0.00 0.00 176.54 177.65 1xbo h HIS 94 N 0.07 1.13 -0.22 5.60 3.86 -1.74 -0.48 115.15 123.36 1xbo h HIS 94 Ca 0.03 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1xbo h HIS 94 Cb 0.03 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.12 1xbo h HIS 94 CO -0.06 0.54 0.14 0.35 0.86 0.00 0.00 177.93 179.76 1xbo h PHE 95 N 1.06 0.27 0.00 2.45 3.04 -0.04 -1.15 116.94 122.57 1xbo h PHE 95 Ca 0.44 0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.35 1xbo h PHE 95 Cb 0.30 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 38.71 1xbo h PHE 95 CO -0.00 0.17 -0.23 -1.49 -2.02 0.00 0.00 178.31 174.74 1xbo h TRP 96 N 0.29 0.00 -0.32 0.41 4.06 -0.96 -2.17 115.95 117.26 1xbo h TRP 96 Ca 0.08 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.97 1xbo h TRP 96 Cb -0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.12 1xbo h TRP 96 CO -0.07 0.23 -0.03 1.49 -3.56 0.00 0.00 178.44 176.50 1xbo h GLU 97 N 0.00 0.59 -0.17 0.49 4.81 -0.71 -0.60 114.58 118.98 1xbo h GLU 97 Ca -0.00 -0.20 0.01 0.00 -0.13 0.00 0.00 59.36 59.03 1xbo h GLU 97 Cb 1.00 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 1xbo h GLU 97 CO 0.03 0.74 0.10 1.98 -0.73 0.00 0.00 179.01 181.13 1xbo h MET 98 N 0.38 0.21 -0.45 1.92 4.05 -1.05 0.25 114.93 120.24 1xbo h MET 98 Ca 0.09 -0.01 0.07 0.00 -0.28 0.00 0.00 59.70 59.57 1xbo h MET 98 Cb 0.49 -0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 31.18 1xbo h MET 98 CO 0.02 0.14 0.09 0.28 0.23 0.00 0.00 176.91 177.67 1xbo h VAL 99 N 0.21 0.76 0.18 -5.77 2.07 -1.20 0.25 116.25 112.75 1xbo h VAL 99 Ca 0.07 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1xbo h VAL 99 Cb -0.01 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1xbo h VAL 99 CO -0.03 0.04 -0.09 -0.25 0.02 0.00 0.00 177.57 177.27 1xbo h TRP 100 N 0.23 -0.22 -0.75 1.57 2.91 -0.65 -1.77 115.95 117.26 1xbo h TRP 100 Ca 0.22 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.24 1xbo h TRP 100 Cb 0.28 0.07 -0.04 0.00 -0.51 0.00 0.00 29.16 28.97 1xbo h TRP 100 CO -0.21 0.09 0.48 0.93 -1.03 0.00 0.00 178.44 178.69 1xbo h GLU 101 N -0.55 1.01 -0.00 2.65 5.08 -0.25 -1.77 114.58 120.75 1xbo h GLU 101 Ca -0.02 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1xbo h GLU 101 Cb 0.41 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1xbo h GLU 101 CO 0.04 0.69 -0.08 1.04 -1.00 0.00 0.00 179.01 179.70 1xbo n GLN 102 N -4.40 0.21 -2.53 2.33 1.13 0.86 -4.93 117.38 110.04 1xbo n GLN 102 Ca 0.08 -0.03 -0.14 0.00 -1.94 0.00 0.00 57.00 54.97 1xbo n GLN 102 Cb 0.05 -1.50 0.01 0.00 0.11 0.00 0.00 30.24 28.91 1xbo n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1xbo n LYS 103 N -1.37 -2.27 -2.32 -1.09 5.02 -0.67 -4.13 118.16 111.33 1xbo n LYS 103 Ca 0.10 0.62 -0.36 0.00 -2.02 0.00 0.00 58.31 56.64 1xbo n LYS 103 Cb 0.31 -4.83 -0.01 0.00 -0.02 0.00 0.00 35.03 30.47 1xbo n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1xbo s SER 104 N -2.63 6.17 -0.15 4.39 0.01 -0.83 -0.00 113.70 120.66 1xbo s SER 104 Ca 0.11 2.20 0.12 0.00 1.31 0.00 0.00 55.95 59.69 1xbo s SER 104 Cb -0.05 -2.59 -0.17 0.00 0.21 0.00 0.00 66.02 63.42 1xbo s SER 104 CO 0.14 -0.91 0.02 -1.14 0.41 0.00 0.00 173.24 171.76 1xbo n ARG 105 N -0.65 1.49 -4.37 12.44 0.63 -1.26 -4.85 116.66 120.08 1xbo n ARG 105 Ca 0.08 0.01 -0.20 0.00 -0.92 0.00 0.00 57.85 56.81 1xbo n ARG 105 Cb 0.49 -1.37 -0.10 0.00 0.45 0.00 0.00 32.46 31.93 1xbo n ARG 105 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1xbo s GLY 106 N -4.91 1.53 -0.05 5.14 0.00 -1.26 -0.90 107.32 106.87 1xbo s GLY 106 Ca -0.09 -1.68 -0.01 0.00 0.00 0.00 0.00 44.72 42.94 1xbo s GLY 106 CO 0.58 -1.77 0.00 0.14 0.00 0.00 0.00 173.10 172.05 1xbo s VAL 107 N -2.71 0.31 -0.33 1.40 1.01 -0.19 -2.24 120.40 117.64 1xbo s VAL 107 Ca 0.23 0.11 -0.05 0.00 0.00 0.00 0.00 61.98 62.27 1xbo s VAL 107 Cb -0.03 -0.44 0.04 0.00 0.00 0.00 0.00 36.38 35.96 1xbo s VAL 107 CO 0.09 0.22 0.08 -0.69 0.00 0.00 0.00 175.10 174.80 1xbo s VAL 108 N 1.62 3.56 -0.25 2.92 1.01 0.49 -0.15 120.40 129.60 1xbo s VAL 108 Ca -0.01 -1.22 -0.10 0.00 0.00 0.00 0.00 61.98 60.65 1xbo s VAL 108 Cb -0.13 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 1xbo s VAL 108 CO -0.03 -0.17 0.15 -0.32 0.00 0.00 0.00 175.10 174.73 1xbo s MET 109 N 1.36 3.99 -0.07 2.72 0.00 0.14 -1.20 119.30 126.24 1xbo s MET 109 Ca -0.02 -0.31 0.14 0.00 0.00 0.00 0.00 55.69 55.50 1xbo s MET 109 Cb -0.20 -3.54 0.45 0.00 0.00 0.00 0.00 34.83 31.55 1xbo s MET 109 CO 0.02 -0.03 1.37 1.28 0.00 0.00 0.00 175.02 177.66 1xbo n LEU 110 N 4.55 3.54 -4.42 4.11 4.77 -0.34 -0.64 117.00 128.56 1xbo n LEU 110 Ca -0.15 -2.36 -0.22 0.00 -0.03 0.00 0.00 56.01 53.25 1xbo n LEU 110 Cb 0.52 -0.39 -0.09 0.00 -2.33 0.00 0.00 43.42 41.14 1xbo n LEU 110 CO 0.34 0.74 -0.19 0.54 -1.33 0.00 0.00 177.39 177.49 1xbo s ASN 111 N -1.25 2.21 0.28 -1.43 4.22 -1.25 -4.60 114.94 113.13 1xbo s ASN 111 Ca 0.34 -1.63 0.10 0.00 -2.14 0.00 0.00 52.86 49.53 1xbo s ASN 111 Cb 0.22 0.43 -0.04 0.00 1.28 0.00 0.00 41.25 43.14 1xbo s ASN 111 CO 0.16 -0.91 -0.01 -0.13 -2.04 0.00 0.00 177.10 174.17 1xbo s ARG 112 N -3.73 2.21 0.20 3.55 0.52 -1.26 -4.79 118.95 115.64 1xbo s ARG 112 Ca 0.31 -1.50 -0.12 0.00 -0.52 0.00 0.00 55.73 53.90 1xbo s ARG 112 Cb 0.04 -2.09 0.12 0.00 0.52 0.00 0.00 34.95 33.54 1xbo s ARG 112 CO 0.17 0.31 1.86 0.28 0.02 0.00 0.00 175.30 177.94 1xbo h VAL 113 N 1.89 1.18 -3.20 3.52 2.07 -1.94 -3.40 116.25 116.37 1xbo h VAL 113 Ca -0.44 -0.34 -0.67 0.00 0.82 0.00 0.00 66.70 66.08 1xbo h VAL 113 Cb 1.25 0.20 -0.32 0.00 -1.52 0.00 0.00 31.29 30.90 1xbo h VAL 113 CO 0.61 0.17 -0.81 -0.32 0.02 0.00 0.00 177.57 177.25 1xbo s MET 114 N -6.11 3.14 -0.01 1.57 -2.45 -1.26 -0.48 119.30 113.71 1xbo s MET 114 Ca -0.13 -0.75 0.06 0.00 -1.25 0.00 0.00 55.69 53.62 1xbo s MET 114 Cb 0.14 -2.73 -0.02 0.00 1.25 0.00 0.00 34.83 33.47 1xbo s MET 114 CO 0.77 -0.19 -0.19 -1.21 1.05 0.00 0.00 175.02 175.25 1xbo s GLU 115 N 1.33 1.51 -1.55 4.11 2.02 -0.51 -4.75 118.70 120.86 1xbo s GLU 115 Ca 0.05 -0.69 -0.04 0.00 0.02 0.00 0.00 54.97 54.31 1xbo s GLU 115 Cb -0.14 -1.47 0.04 0.00 0.10 0.00 0.00 34.13 32.66 1xbo s GLU 115 CO -0.09 0.40 0.29 1.63 0.02 0.00 0.00 175.26 177.51 1xbo n LYS 116 N 2.57 -1.96 -2.13 1.61 5.02 -1.26 0.28 118.16 122.28 1xbo n LYS 116 Ca -0.15 0.23 -0.19 0.00 -2.02 0.00 0.00 58.31 56.18 1xbo n LYS 116 Cb 0.53 -4.18 -0.03 0.00 -0.02 0.00 0.00 35.03 31.33 1xbo n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xbo n GLY 117 N -2.11 0.26 2.96 0.72 0.00 -1.26 -4.98 105.19 100.78 1xbo n GLY 117 Ca -0.24 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.63 1xbo n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xbo s SER 118 N -2.24 0.58 -0.56 1.61 0.15 0.14 -5.10 113.70 108.30 1xbo s SER 118 Ca 0.00 -0.14 -0.27 0.00 0.70 0.00 0.00 55.95 56.24 1xbo s SER 118 Cb 0.00 -0.05 -0.01 0.00 -1.71 0.00 0.00 66.02 64.25 1xbo s SER 118 CO 0.00 0.03 1.71 -0.76 1.20 0.00 0.00 173.24 175.42 1xbo s LEU 119 N -0.27 3.35 0.00 3.45 2.01 -1.26 -1.42 118.68 124.54 1xbo s LEU 119 Ca 0.00 0.45 0.25 0.00 0.01 0.00 0.00 54.13 54.85 1xbo s LEU 119 Cb -0.03 -2.84 0.55 0.00 0.01 0.00 0.00 46.19 43.88 1xbo s LEU 119 CO -0.00 -2.06 1.43 0.29 1.01 0.00 0.00 176.35 177.02 1xbo n LYS 120 N 8.93 0.53 -3.60 1.70 4.76 0.37 -4.96 118.16 125.89 1xbo n LYS 120 Ca 0.18 -0.34 -0.10 0.00 -2.87 0.00 0.00 58.31 55.18 1xbo n LYS 120 Cb 0.50 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 32.14 1xbo n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xbo s ALA 122 N -0.55 2.65 -1.11 0.00 0.00 0.00 -4.76 121.76 117.99 1xbo s ALA 122 Ca 0.00 0.37 -0.19 0.00 0.00 0.00 0.00 51.96 52.14 1xbo s ALA 122 Cb -0.02 -3.24 0.10 0.00 0.00 0.00 0.00 23.12 19.96 1xbo s ALA 122 CO -0.02 -1.03 1.43 -1.14 0.00 0.00 0.00 175.76 175.01 1xbo s GLN 123 N -4.29 3.81 0.00 0.00 2.00 -1.26 -4.81 119.66 115.11 1xbo s GLN 123 Ca 0.63 -1.84 0.29 0.00 -2.00 0.00 0.00 55.36 52.44 1xbo s GLN 123 Cb -0.17 -5.22 1.27 0.00 0.80 0.00 0.00 33.01 29.70 1xbo s GLN 123 CO 0.42 -2.01 1.88 2.48 -0.50 0.00 0.00 175.29 177.56 1xbo n TYR 124 N 7.42 0.00 -4.21 1.67 0.18 -1.26 -4.86 117.16 116.10 1xbo n TYR 124 Ca 0.35 0.00 -0.19 0.00 1.88 0.00 0.00 57.90 59.94 1xbo n TYR 124 Cb 0.47 -0.08 -0.12 0.00 -0.38 0.00 0.00 39.34 39.24 1xbo n TYR 124 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 1xbo s TRP 125 N -2.22 1.37 0.31 -3.48 -2.14 -1.26 -5.07 118.94 106.45 1xbo s TRP 125 Ca 0.35 -0.49 -0.29 0.00 2.66 0.00 0.00 56.10 58.34 1xbo s TRP 125 Cb 0.21 -0.75 -0.10 0.00 -3.10 0.00 0.00 33.47 29.73 1xbo s TRP 125 CO 0.41 0.11 1.25 -1.25 -2.66 0.00 0.00 176.95 174.81 1xbo s PRO 126 N -2.09 4.44 0.03 3.25 0.04 -1.26 -4.96 135.00 134.44 1xbo s PRO 126 Ca 0.03 2.10 0.22 0.00 0.04 0.00 0.00 61.00 63.39 1xbo s PRO 126 Cb -0.08 -3.11 -0.18 0.00 0.04 0.00 0.00 34.50 31.17 1xbo s PRO 126 CO 0.03 -0.07 0.76 1.04 0.04 0.00 0.00 177.00 178.80 1xbo n GLN 127 N 0.94 0.45 -4.26 4.56 6.02 -1.26 -4.69 117.38 119.14 1xbo n GLN 127 Ca -0.00 -0.08 -0.21 0.00 -0.01 0.00 0.00 57.00 56.70 1xbo n GLN 127 Cb 0.43 -1.58 -0.16 0.00 1.02 0.00 0.00 30.24 29.95 1xbo n GLN 127 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1xbo s LYS 128 N -3.33 1.06 0.33 -1.09 1.02 -1.26 -5.05 119.74 111.41 1xbo s LYS 128 Ca -0.01 -0.18 0.11 0.00 0.02 0.00 0.00 55.97 55.90 1xbo s LYS 128 Cb 0.14 -1.00 0.96 0.00 -0.52 0.00 0.00 37.83 37.41 1xbo s LYS 128 CO 0.86 -0.06 1.69 0.93 -0.92 0.00 0.00 175.35 177.86 1xbo h GLU 129 N 7.16 0.43 0.00 1.68 3.07 -1.91 0.01 114.58 125.01 1xbo h GLU 129 Ca -0.36 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.48 1xbo h GLU 129 Cb 1.16 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.97 1xbo h GLU 129 CO 0.47 0.29 0.00 -0.85 -1.40 0.00 0.00 179.01 177.51 1xbo n GLU 130 N -4.98 0.10 -3.78 2.33 0.00 -1.26 -4.20 120.64 108.84 1xbo n GLU 130 Ca 0.29 0.18 -0.31 0.00 0.00 0.00 0.00 57.16 57.31 1xbo n GLU 130 Cb 0.85 -1.64 -0.10 0.00 0.00 0.00 0.00 31.44 30.55 1xbo n GLU 130 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1xbo n LYS 131 N -1.82 2.20 -1.45 3.44 5.02 -0.01 -5.08 118.16 120.46 1xbo n LYS 131 Ca 0.05 -4.49 -0.30 0.00 -2.02 0.00 0.00 58.31 51.54 1xbo n LYS 131 Cb 0.31 -2.34 0.09 0.00 -0.02 0.00 0.00 35.03 33.06 1xbo n LYS 131 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1xbo s GLU 132 N -1.46 2.22 -0.09 1.97 1.03 -1.26 -4.61 118.70 116.50 1xbo s GLU 132 Ca 0.26 0.86 0.01 0.00 0.03 0.00 0.00 54.97 56.13 1xbo s GLU 132 Cb -0.05 -1.92 -0.02 0.00 -0.80 0.00 0.00 34.13 31.34 1xbo s GLU 132 CO -0.15 -1.58 -0.11 -1.64 -1.33 0.00 0.00 175.26 170.45 1xbo s MET 133 N -5.04 2.97 -0.14 -4.83 -1.94 0.54 -4.97 119.30 105.88 1xbo s MET 133 Ca 0.60 -0.64 0.01 0.00 -1.71 0.00 0.00 55.69 53.96 1xbo s MET 133 Cb -0.15 -2.57 0.00 0.00 2.01 0.00 0.00 34.83 34.12 1xbo s MET 133 CO 0.55 0.46 -0.18 0.42 -0.01 0.00 0.00 175.02 176.26 1xbo s ILE 134 N -0.29 2.44 -0.66 2.53 1.01 -1.26 -0.18 121.20 124.80 1xbo s ILE 134 Ca 0.03 -0.85 -0.16 0.00 0.00 0.00 0.00 60.65 59.67 1xbo s ILE 134 Cb -0.13 -2.00 0.16 0.00 0.01 0.00 0.00 42.46 40.49 1xbo s ILE 134 CO 0.03 0.53 0.64 -0.36 0.00 0.00 0.00 174.94 175.77 1xbo s PHE 135 N 0.73 3.38 0.20 3.97 0.08 0.59 -4.94 117.98 121.99 1xbo s PHE 135 Ca -0.08 -1.48 -0.10 0.00 0.12 0.00 0.00 56.93 55.38 1xbo s PHE 135 Cb -0.16 -3.85 0.19 0.00 -0.57 0.00 0.00 43.02 38.63 1xbo s PHE 135 CO 0.01 -1.06 1.82 0.93 -0.10 0.00 0.00 175.22 176.82 1xbo h GLU 136 N 8.56 0.70 -0.49 0.44 5.08 -1.97 0.17 114.58 127.08 1xbo h GLU 136 Ca -0.15 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1xbo h GLU 136 Cb 1.08 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 1xbo h GLU 136 CO 0.96 0.47 0.32 0.38 -1.00 0.00 0.00 179.01 180.13 1xbo h ASP 137 N 0.72 0.56 -0.18 1.42 2.03 -1.97 -2.87 116.42 116.13 1xbo h ASP 137 Ca 0.27 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.55 1xbo h ASP 137 Cb 0.09 -0.14 0.00 0.00 -0.83 0.00 0.00 39.33 38.45 1xbo h ASP 137 CO -0.14 0.41 0.00 0.35 -1.03 0.00 0.00 179.24 178.83 1xbo n THR 138 N -4.74 0.22 -3.56 1.15 -2.24 -1.17 -4.99 114.28 98.94 1xbo n THR 138 Ca 0.02 -0.55 -0.26 0.00 -2.27 0.00 0.00 64.05 61.00 1xbo n THR 138 Cb 0.02 1.06 0.05 0.00 -2.10 0.00 0.00 70.33 69.36 1xbo n THR 138 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1xbo n ASN 139 N 1.16 -5.16 -4.13 3.42 5.15 0.55 -4.95 115.26 111.30 1xbo n ASN 139 Ca 0.17 -0.91 -0.16 0.00 -0.60 0.00 0.00 54.58 53.08 1xbo n ASN 139 Cb 0.55 -3.98 -0.12 0.00 -0.53 0.00 0.00 39.78 35.69 1xbo n ASN 139 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1xbo s LEU 140 N -6.19 2.29 -0.03 1.20 1.43 -0.96 -2.57 118.68 113.84 1xbo s LEU 140 Ca 0.41 -0.62 0.05 0.00 -1.03 0.00 0.00 54.13 52.94 1xbo s LEU 140 Cb -0.12 -0.36 -0.01 0.00 0.03 0.00 0.00 46.19 45.73 1xbo s LEU 140 CO 0.82 -0.15 -0.19 -0.75 0.23 0.00 0.00 176.35 176.32 1xbo s LYS 141 N -1.84 1.78 -0.09 1.70 2.20 -0.44 -0.30 119.74 122.76 1xbo s LYS 141 Ca -0.04 -0.67 0.02 0.00 -0.36 0.00 0.00 55.97 54.93 1xbo s LYS 141 Cb -0.09 -1.60 0.01 0.00 -1.51 0.00 0.00 37.83 34.64 1xbo s LYS 141 CO 0.01 0.32 -0.14 -1.17 -0.36 0.00 0.00 175.35 174.01 1xbo s LEU 142 N -0.16 1.70 -0.07 5.43 2.96 0.75 -0.41 118.68 128.89 1xbo s LEU 142 Ca 0.00 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.57 1xbo s LEU 142 Cb -0.10 -0.98 0.01 0.00 0.50 0.00 0.00 46.19 45.61 1xbo s LEU 142 CO 0.01 0.04 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.04 1xbo s THR 143 N 0.78 1.34 0.06 3.68 2.01 -0.44 -0.34 115.64 122.73 1xbo s THR 143 Ca -0.12 -0.61 -0.31 0.00 0.31 0.00 0.00 61.69 60.96 1xbo s THR 143 Cb -0.16 -1.20 -0.06 0.00 0.01 0.00 0.00 72.50 71.10 1xbo s THR 143 CO 0.02 0.40 1.18 -0.22 -0.69 0.00 0.00 174.62 175.31 1xbo s LEU 144 N 0.50 4.37 -0.16 4.42 2.96 -1.26 -1.50 118.68 128.01 1xbo s LEU 144 Ca -0.14 1.99 0.13 0.00 -0.22 0.00 0.00 54.13 55.90 1xbo s LEU 144 Cb -0.15 -3.58 -0.19 0.00 0.50 0.00 0.00 46.19 42.77 1xbo s LEU 144 CO 0.04 -0.44 0.03 -0.38 -1.32 0.00 0.00 176.35 174.28 1xbo n ILE 145 N 3.85 1.06 0.00 6.68 2.08 0.43 -4.44 119.36 129.02 1xbo n ILE 145 Ca 0.08 -0.64 0.00 0.00 0.56 0.00 0.00 62.75 62.76 1xbo n ILE 145 Cb 0.47 -0.64 0.00 0.00 -0.75 0.00 0.00 39.64 38.72 1xbo n ILE 145 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 1xbo n SER 146 N -2.61 0.00 -3.76 4.38 3.41 -1.12 -4.99 113.62 108.94 1xbo n SER 146 Ca -0.26 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.23 1xbo n SER 146 Cb 0.99 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.82 1xbo n SER 146 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1xbo s GLU 147 N -2.00 0.30 -0.44 4.33 -1.05 -1.26 -0.40 118.70 118.18 1xbo s GLU 147 Ca 0.00 0.46 -0.08 0.00 -0.15 0.00 0.00 54.97 55.20 1xbo s GLU 147 Cb 0.00 0.07 0.11 0.00 -0.44 0.00 0.00 34.13 33.87 1xbo s GLU 147 CO 0.00 -0.08 0.29 0.34 0.95 0.00 0.00 175.26 176.76 1xbo s ASP 148 N 0.54 5.57 -0.17 0.83 2.15 0.94 -4.97 116.67 121.57 1xbo s ASP 148 Ca -0.03 -1.83 -0.23 0.00 0.43 0.00 0.00 52.55 50.89 1xbo s ASP 148 Cb -0.05 -1.96 -0.02 0.00 -0.30 0.00 0.00 42.92 40.59 1xbo s ASP 148 CO -0.03 -0.62 0.73 -0.63 -0.17 0.00 0.00 175.17 174.45 1xbo s ILE 149 N 1.33 4.96 0.52 4.11 1.01 -1.26 -1.47 121.20 130.39 1xbo s ILE 149 Ca 0.05 1.41 0.04 0.00 0.00 0.00 0.00 60.65 62.16 1xbo s ILE 149 Cb -0.25 -4.04 0.01 0.00 0.01 0.00 0.00 42.46 38.19 1xbo s ILE 149 CO -0.01 0.08 0.22 -0.54 0.00 0.00 0.00 174.94 174.70 1xbo s LYS 150 N 1.92 2.23 0.11 2.79 -0.14 -0.17 -4.85 119.74 121.64 1xbo s LYS 150 Ca 0.34 -2.16 -0.26 0.00 -1.36 0.00 0.00 55.97 52.54 1xbo s LYS 150 Cb -0.16 -1.86 -0.09 0.00 -1.68 0.00 0.00 37.83 34.04 1xbo s LYS 150 CO 0.12 -0.47 1.66 0.66 -0.76 0.00 0.00 175.35 176.56 1xbo h SER 151 N 1.05 -0.55 -0.09 2.83 4.64 0.56 -3.31 113.55 118.68 1xbo h SER 151 Ca -0.40 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1xbo h SER 151 Cb 1.30 0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.61 1xbo h SER 151 CO 0.65 -0.27 0.00 0.00 -0.87 0.00 0.00 176.83 176.34 1xbo n TYR 152 N -5.32 0.11 -3.65 4.77 4.11 -1.26 -5.00 117.16 110.92 1xbo n TYR 152 Ca -0.06 -0.15 -0.12 0.00 -0.00 0.00 0.00 57.90 57.57 1xbo n TYR 152 Cb 0.24 -0.01 -0.06 0.00 -0.00 0.00 0.00 39.34 39.51 1xbo n TYR 152 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.86 178.38 1xbo s TYR 153 N -0.81 -0.27 -0.03 -3.48 -0.85 -1.25 -0.27 117.35 110.39 1xbo s TYR 153 Ca 0.13 0.16 0.03 0.00 -0.52 0.00 0.00 57.07 56.87 1xbo s TYR 153 Cb 0.08 0.24 -0.00 0.00 0.38 0.00 0.00 41.96 42.66 1xbo s TYR 153 CO 0.11 -0.61 -0.12 0.99 -1.52 0.00 0.00 175.55 174.40 1xbo s THR 154 N -2.83 1.05 -0.25 -3.49 2.01 -0.32 -0.99 115.64 110.82 1xbo s THR 154 Ca -0.03 -0.51 -0.04 0.00 0.31 0.00 0.00 61.69 61.42 1xbo s THR 154 Cb -0.00 -0.92 0.01 0.00 0.01 0.00 0.00 72.50 71.60 1xbo s THR 154 CO -0.05 0.31 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.48 1xbo s VAL 155 N 0.09 3.29 0.10 3.82 1.01 -0.54 -1.18 120.40 126.98 1xbo s VAL 155 Ca -0.03 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.25 1xbo s VAL 155 Cb -0.09 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 1xbo s VAL 155 CO 0.01 0.26 0.02 -0.13 0.00 0.00 0.00 175.10 175.26 1xbo s ARG 156 N 1.42 2.61 -0.21 2.72 0.52 0.26 -0.04 118.95 126.23 1xbo s ARG 156 Ca 0.03 -0.83 -0.03 0.00 -0.52 0.00 0.00 55.73 54.38 1xbo s ARG 156 Cb -0.16 -2.56 -0.00 0.00 0.52 0.00 0.00 34.95 32.75 1xbo s ARG 156 CO -0.03 0.54 -0.08 -1.14 0.02 0.00 0.00 175.30 174.61 1xbo s GLN 157 N -2.39 3.30 0.28 3.54 0.74 0.46 -0.52 119.66 125.07 1xbo s GLN 157 Ca 0.27 -0.67 0.11 0.00 0.05 0.00 0.00 55.36 55.11 1xbo s GLN 157 Cb -0.12 -2.89 -0.05 0.00 1.10 0.00 0.00 33.01 31.06 1xbo s GLN 157 CO 0.19 -0.17 -0.12 -0.51 -0.55 0.00 0.00 175.29 174.14 1xbo s LEU 158 N 1.35 2.81 -0.12 3.68 1.43 -0.06 -0.43 118.68 127.36 1xbo s LEU 158 Ca 0.04 -0.92 0.02 0.00 -1.03 0.00 0.00 54.13 52.24 1xbo s LEU 158 Cb -0.14 -1.30 0.01 0.00 0.03 0.00 0.00 46.19 44.79 1xbo s LEU 158 CO -0.05 -0.01 -0.16 -0.70 0.23 0.00 0.00 176.35 175.66 1xbo s GLU 159 N -3.58 2.31 -0.16 1.70 2.12 -0.57 -1.12 118.70 119.40 1xbo s GLU 159 Ca 0.31 -0.59 -0.03 0.00 0.36 0.00 0.00 54.97 55.02 1xbo s GLU 159 Cb -0.05 -1.96 -0.02 0.00 0.26 0.00 0.00 34.13 32.36 1xbo s GLU 159 CO 0.17 -0.07 -0.06 -1.17 -0.54 0.00 0.00 175.26 173.58 1xbo s LEU 160 N 1.01 3.07 -0.11 2.70 2.96 -0.12 -1.33 118.68 126.86 1xbo s LEU 160 Ca -0.06 -0.21 0.03 0.00 -0.22 0.00 0.00 54.13 53.67 1xbo s LEU 160 Cb -0.15 -1.73 0.01 0.00 0.50 0.00 0.00 46.19 44.82 1xbo s LEU 160 CO -0.02 0.15 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.26 1xbo s GLU 161 N 0.49 2.62 -0.88 1.98 2.12 0.45 -0.31 118.70 125.18 1xbo s GLU 161 Ca -0.05 -0.72 -0.25 0.00 0.36 0.00 0.00 54.97 54.31 1xbo s GLU 161 Cb -0.15 -2.09 0.04 0.00 0.26 0.00 0.00 34.13 32.19 1xbo s GLU 161 CO 0.03 0.05 1.37 1.21 -0.54 0.00 0.00 175.26 177.38 1xbo s ASN 162 N 0.67 6.32 0.65 -1.70 3.84 -0.01 -1.33 114.94 123.38 1xbo s ASN 162 Ca -0.12 -0.94 0.30 0.00 0.21 0.00 0.00 52.86 52.31 1xbo s ASN 162 Cb -0.16 -2.56 1.65 0.00 -0.55 0.00 0.00 41.25 39.62 1xbo s ASN 162 CO 0.03 -1.69 1.92 -0.07 -2.79 0.00 0.00 177.10 174.51 1xbo h LEU 163 N 12.97 0.00 0.05 3.21 3.38 -1.80 1.19 115.31 134.32 1xbo h LEU 163 Ca -0.04 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.69 1xbo h LEU 163 Cb 1.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1xbo h LEU 163 CO 1.35 0.00 -1.12 0.74 0.09 0.00 0.00 178.44 179.50 1xbo h THR 164 N 0.00 1.60 -0.00 0.22 2.02 -1.89 -3.36 112.91 111.50 1xbo h THR 164 Ca 0.00 -3.26 0.00 0.00 0.77 0.00 0.00 66.41 63.92 1xbo h THR 164 Cb 0.62 2.87 0.00 0.00 -1.74 0.00 0.00 68.15 69.91 1xbo h THR 164 CO 0.00 0.93 -0.17 0.35 0.37 0.00 0.00 175.52 177.00 1xbo n THR 165 N -3.41 0.00 -1.79 3.16 -2.24 -0.06 -4.99 114.28 104.96 1xbo n THR 165 Ca -0.04 -0.42 -0.19 0.00 -2.27 0.00 0.00 64.05 61.14 1xbo n THR 165 Cb 0.98 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 70.18 1xbo n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xbo n GLN 166 N -0.73 -1.35 -3.19 -0.78 6.02 0.39 -4.97 117.38 112.77 1xbo n GLN 166 Ca 0.02 1.08 -0.39 0.00 -0.01 0.00 0.00 57.00 57.70 1xbo n GLN 166 Cb 0.09 -5.45 -0.06 0.00 1.02 0.00 0.00 30.24 25.85 1xbo n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1xbo s GLU 167 N -3.98 4.31 0.11 -1.09 2.12 -1.22 -4.87 118.70 114.08 1xbo s GLU 167 Ca 0.00 0.85 0.10 0.00 0.36 0.00 0.00 54.97 56.27 1xbo s GLU 167 Cb 0.00 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 31.10 1xbo s GLU 167 CO 0.00 0.60 -0.24 0.95 -0.54 0.00 0.00 175.26 176.03 1xbo s THR 168 N -1.04 1.98 0.02 -1.70 -4.23 -1.26 -0.83 115.64 108.59 1xbo s THR 168 Ca 0.31 -1.62 0.02 0.00 -1.18 0.00 0.00 61.69 59.22 1xbo s THR 168 Cb -0.20 -1.77 -0.01 0.00 1.34 0.00 0.00 72.50 71.85 1xbo s THR 168 CO 0.21 0.04 -0.07 -0.13 -0.54 0.00 0.00 174.62 174.13 1xbo s ARG 169 N -1.91 0.48 -0.16 3.99 0.52 0.58 -4.97 118.95 117.47 1xbo s ARG 169 Ca 0.10 -0.48 -0.20 0.00 -0.52 0.00 0.00 55.73 54.63 1xbo s ARG 169 Cb -0.10 -0.36 -0.03 0.00 0.52 0.00 0.00 34.95 34.98 1xbo s ARG 169 CO 0.05 0.08 0.60 -2.00 0.02 0.00 0.00 175.30 174.05 1xbo s GLU 170 N -0.86 4.27 -0.15 3.54 2.12 -1.26 -0.94 118.70 125.41 1xbo s GLU 170 Ca -0.04 0.61 -0.00 0.00 0.36 0.00 0.00 54.97 55.90 1xbo s GLU 170 Cb -0.06 -3.53 -0.01 0.00 0.26 0.00 0.00 34.13 30.79 1xbo s GLU 170 CO 0.00 -0.11 -0.14 0.42 -0.54 0.00 0.00 175.26 174.89 1xbo s ILE 171 N 1.49 2.86 -0.12 -3.70 -1.09 -0.28 -4.84 121.20 115.52 1xbo s ILE 171 Ca 0.29 -0.71 -0.16 0.00 -2.23 0.00 0.00 60.65 57.84 1xbo s ILE 171 Cb -0.16 -2.21 -0.05 0.00 -1.58 0.00 0.00 42.46 38.46 1xbo s ILE 171 CO 0.11 0.51 0.40 -0.76 -1.23 0.00 0.00 174.94 173.98 1xbo s LEU 172 N 0.67 4.29 -0.28 2.97 1.43 -0.08 -0.88 118.68 126.80 1xbo s LEU 172 Ca -0.07 0.72 -0.03 0.00 -1.03 0.00 0.00 54.13 53.72 1xbo s LEU 172 Cb -0.16 -2.56 0.03 0.00 0.03 0.00 0.00 46.19 43.54 1xbo s LEU 172 CO 0.02 0.08 -0.00 -2.28 0.23 0.00 0.00 176.35 174.40 1xbo s HIS 173 N 0.33 3.17 -0.33 0.29 2.46 0.32 -1.02 115.29 120.51 1xbo s HIS 173 Ca 0.22 -1.57 -0.12 0.00 0.47 0.00 0.00 55.06 54.06 1xbo s HIS 173 Cb -0.15 -2.12 -0.02 0.00 -0.13 0.00 0.00 32.58 30.16 1xbo s HIS 173 CO 0.08 -0.73 0.21 -0.06 -2.47 0.00 0.00 174.74 171.77 1xbo s PHE 174 N 1.33 3.21 -0.30 3.88 0.08 0.79 -0.57 117.98 126.40 1xbo s PHE 174 Ca -0.02 -0.30 0.01 0.00 0.12 0.00 0.00 56.93 56.74 1xbo s PHE 174 Cb -0.18 -2.44 0.07 0.00 -0.57 0.00 0.00 43.02 39.90 1xbo s PHE 174 CO -0.02 -0.38 -0.02 -1.58 -0.10 0.00 0.00 175.22 173.13 1xbo s HIS 175 N 1.69 3.38 -0.36 0.36 2.46 -0.33 0.27 115.29 122.77 1xbo s HIS 175 Ca 0.06 -2.30 -0.25 0.00 0.47 0.00 0.00 55.06 53.04 1xbo s HIS 175 Cb -0.17 -2.28 0.01 0.00 -0.13 0.00 0.00 32.58 30.01 1xbo s HIS 175 CO 0.09 -0.87 0.89 -0.47 -2.47 0.00 0.00 174.74 171.91 1xbo s TYR 176 N 1.12 3.10 -2.72 3.88 6.14 0.19 -1.17 117.35 127.89 1xbo s TYR 176 Ca -0.03 0.74 0.24 0.00 0.64 0.00 0.00 57.07 58.66 1xbo s TYR 176 Cb -0.20 -3.57 0.31 0.00 0.42 0.00 0.00 41.96 38.92 1xbo s TYR 176 CO -0.04 -0.79 1.33 0.25 0.64 0.00 0.00 175.55 176.94 1xbo n THR 177 N 5.90 0.26 -1.72 4.34 -2.24 0.62 -3.84 114.28 117.60 1xbo n THR 177 Ca 0.06 -0.63 0.05 0.00 -2.27 0.00 0.00 64.05 61.26 1xbo n THR 177 Cb 0.48 1.24 0.18 0.00 -2.10 0.00 0.00 70.33 70.13 1xbo n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1xbo n THR 178 N 1.42 1.96 -3.62 4.28 -2.24 -1.21 -4.89 114.28 109.98 1xbo n THR 178 Ca 0.17 -3.01 -0.40 0.00 -2.27 0.00 0.00 64.05 58.54 1xbo n THR 178 Cb 0.60 -0.12 -0.10 0.00 -2.10 0.00 0.00 70.33 68.62 1xbo n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1xbo s TRP 179 N -2.88 3.37 0.49 4.78 -0.11 -1.26 -4.62 118.94 118.71 1xbo s TRP 179 Ca 0.38 -1.66 -0.23 0.00 1.22 0.00 0.00 56.10 55.81 1xbo s TRP 179 Cb 0.37 -3.01 -0.08 0.00 -1.50 0.00 0.00 33.47 29.26 1xbo s TRP 179 CO -0.08 -0.87 1.16 -2.30 -4.62 0.00 0.00 176.95 170.24 1xbo n PRO 180 N 4.88 1.50 -1.81 5.86 -0.02 -1.26 -4.81 135.00 139.34 1xbo n PRO 180 Ca -0.09 0.55 -0.42 0.00 -2.02 0.00 0.00 63.50 61.52 1xbo n PRO 180 Cb 0.43 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.58 1xbo n PRO 180 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1xbo s ASP 181 N -0.84 6.44 -2.02 2.55 -1.08 -1.26 -0.44 116.67 120.02 1xbo s ASP 181 Ca 0.67 2.84 0.00 0.00 -0.52 0.00 0.00 52.55 55.54 1xbo s ASP 181 Cb -0.47 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.37 1xbo s ASP 181 CO 0.53 -0.90 0.00 0.49 0.52 0.00 0.00 175.17 175.81 1xbo n PHE 182 N 3.18 -0.30 -3.02 -5.34 3.01 -1.26 -4.95 117.46 108.78 1xbo n PHE 182 Ca 0.12 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.58 1xbo n PHE 182 Cb 0.37 -3.51 0.00 0.00 -0.01 0.00 0.00 39.48 36.33 1xbo n PHE 182 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xbo n GLY 183 N -0.53 5.70 3.11 1.37 0.00 0.41 -4.95 105.19 110.30 1xbo n GLY 183 Ca -0.21 -2.07 -0.12 0.00 0.00 0.00 0.00 46.02 43.61 1xbo n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xbo s VAL 184 N 0.78 0.63 0.85 1.61 -7.23 -1.26 -4.78 120.40 111.00 1xbo s VAL 184 Ca 0.00 -1.47 -0.13 0.00 -1.81 0.00 0.00 61.98 58.57 1xbo s VAL 184 Cb 0.00 -1.10 0.05 0.00 0.56 0.00 0.00 36.38 35.89 1xbo s VAL 184 CO 0.00 -0.59 0.83 -2.65 -0.31 0.00 0.00 175.10 172.38 1xbo n PRO 185 N 0.79 -0.02 -0.21 4.82 -0.02 -1.26 -4.60 135.00 134.48 1xbo n PRO 185 Ca -0.18 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1xbo n PRO 185 Cb 0.57 -2.14 0.12 0.00 -0.02 0.00 0.00 33.50 32.03 1xbo n PRO 185 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1xbo h GLU 186 N -1.13 0.46 -3.62 -0.52 5.08 -2.00 -3.44 114.58 109.40 1xbo h GLU 186 Ca -0.45 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 57.82 1xbo h GLU 186 Cb 1.30 -0.10 -0.12 0.00 0.50 0.00 0.00 28.75 30.33 1xbo h GLU 186 CO 0.41 0.30 -0.18 -1.54 -1.00 0.00 0.00 179.01 177.00 1xbo s SER 187 N -5.43 -0.08 0.43 1.42 1.04 -1.26 -5.01 113.70 104.81 1xbo s SER 187 Ca -0.13 -0.64 0.30 0.00 0.48 0.00 0.00 55.95 55.96 1xbo s SER 187 Cb 0.17 0.48 1.20 0.00 0.10 0.00 0.00 66.02 67.96 1xbo s SER 187 CO 0.75 -0.92 1.87 1.55 0.98 0.00 0.00 173.24 177.47 1xbo h PRO 188 N 2.43 0.00 0.38 4.02 0.13 -1.95 -2.79 132.00 134.21 1xbo h PRO 188 Ca -0.31 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.80 1xbo h PRO 188 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1xbo h PRO 188 CO 0.45 0.00 -0.18 0.00 -0.23 0.00 0.00 178.00 178.04 1xbo h ALA 189 N 2.11 -0.50 -0.84 -0.56 0.00 -1.95 -0.24 119.26 117.28 1xbo h ALA 189 Ca 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1xbo h ALA 189 Cb 0.47 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1xbo h ALA 189 CO 0.00 -0.71 0.40 0.66 0.00 0.00 0.00 179.25 179.61 1xbo h SER 190 N -0.65 1.10 0.74 0.00 4.64 -1.80 -1.07 113.55 116.52 1xbo h SER 190 Ca -0.05 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.10 1xbo h SER 190 Cb 0.47 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1xbo h SER 190 CO 0.08 0.93 -0.39 0.15 -0.87 0.00 0.00 176.83 176.74 1xbo h PHE 191 N 1.20 -1.02 -0.80 4.77 3.57 -1.34 -1.80 116.94 121.52 1xbo h PHE 191 Ca 0.29 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.84 1xbo h PHE 191 Cb 0.12 0.35 -0.06 0.00 2.79 0.00 0.00 35.95 39.15 1xbo h PHE 191 CO 0.02 -0.61 0.48 -0.07 -2.23 0.00 0.00 178.31 175.89 1xbo h LEU 192 N -1.04 0.73 -0.43 0.59 3.38 -0.98 0.22 115.31 117.78 1xbo h LEU 192 Ca -0.10 0.03 0.08 0.00 0.09 0.00 0.00 57.88 57.98 1xbo h LEU 192 Cb 0.81 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 41.36 1xbo h LEU 192 CO 0.14 0.46 -0.05 -1.13 0.09 0.00 0.00 178.44 177.96 1xbo h ASN 193 N 0.87 -0.28 0.02 -0.43 -1.24 -1.01 0.17 115.58 113.67 1xbo h ASN 193 Ca 0.36 0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.48 1xbo h ASN 193 Cb 0.21 0.22 -0.00 0.00 0.73 0.00 0.00 38.32 39.47 1xbo h ASN 193 CO -0.19 -0.10 -0.02 0.15 -1.29 0.00 0.00 177.43 175.98 1xbo h PHE 194 N 0.06 -0.06 0.05 0.67 3.57 -0.26 -1.53 116.94 119.44 1xbo h PHE 194 Ca 0.21 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.74 1xbo h PHE 194 Cb 0.32 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 1xbo h PHE 194 CO -0.32 -0.04 -0.24 1.25 -2.23 0.00 0.00 178.31 176.73 1xbo h LEU 195 N -0.05 -0.68 -2.13 0.59 5.85 -0.19 -1.35 115.31 117.35 1xbo h LEU 195 Ca 0.00 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.82 1xbo h LEU 195 Cb 0.05 0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 1xbo h LEU 195 CO -0.01 -0.31 0.01 -0.26 -0.34 0.00 0.00 178.44 177.53 1xbo h PHE 196 N -0.40 0.00 -0.59 1.25 -1.00 -0.61 0.81 116.94 116.41 1xbo h PHE 196 Ca 0.05 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.77 1xbo h PHE 196 Cb 0.46 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.99 1xbo h PHE 196 CO -0.25 0.00 0.13 -0.22 -1.61 0.00 0.00 178.31 176.36 1xbo h LYS 197 N 0.00 0.95 -0.56 1.51 1.63 -0.20 0.22 116.57 120.12 1xbo h LYS 197 Ca 0.01 -0.24 -0.05 0.00 -0.85 0.00 0.00 60.65 59.52 1xbo h LYS 197 Cb 0.04 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.52 1xbo h LYS 197 CO -0.00 0.89 0.16 0.28 -3.45 0.00 0.00 179.45 177.33 1xbo h VAL 198 N 0.86 1.24 -0.51 2.00 2.07 -0.22 -2.69 116.25 119.00 1xbo h VAL 198 Ca 0.18 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1xbo h VAL 198 Cb 0.37 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1xbo h VAL 198 CO 0.01 0.31 0.33 0.03 0.02 0.00 0.00 177.57 178.26 1xbo h ARG 199 N 0.79 0.69 -0.91 1.57 3.08 -0.65 -2.61 114.38 116.34 1xbo h ARG 199 Ca 0.18 -0.05 0.09 0.00 0.07 0.00 0.00 59.98 60.27 1xbo h ARG 199 Cb 0.30 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.14 1xbo h ARG 199 CO -0.00 0.48 0.59 0.93 -1.07 0.00 0.00 179.97 180.89 1xbo h GLU 200 N 0.69 0.93 0.00 0.04 4.39 -0.33 -2.35 114.58 117.95 1xbo h GLU 200 Ca 0.19 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.83 1xbo h GLU 200 Cb -0.05 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.39 1xbo h GLU 200 CO -0.04 0.61 0.00 -1.13 -1.16 0.00 0.00 179.01 177.30 1xbo n SER 201 N -4.52 0.54 0.00 1.42 3.41 -0.98 -4.86 113.62 108.62 1xbo n SER 201 Ca 0.15 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.43 1xbo n SER 201 Cb 0.27 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.45 1xbo n SER 201 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xbo n GLY 202 N -0.52 2.19 0.54 5.00 0.00 -0.89 -4.90 105.19 106.62 1xbo n GLY 202 Ca 0.01 0.00 0.36 0.00 0.00 0.00 0.00 46.02 46.39 1xbo n GLY 202 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xbo h SER 203 N 0.00 0.00 0.19 1.61 0.02 -1.81 0.15 113.55 113.72 1xbo h SER 203 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1xbo h SER 203 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1xbo h SER 203 CO 0.00 0.00 -0.35 0.18 -1.14 0.00 0.00 176.83 175.52 1xbo n LEU 204 N -4.15 1.21 -4.57 5.07 4.77 -1.26 -4.42 117.00 113.65 1xbo n LEU 204 Ca 0.26 -0.36 -0.34 0.00 -0.03 0.00 0.00 56.01 55.54 1xbo n LEU 204 Cb 1.28 -0.10 0.12 0.00 -2.33 0.00 0.00 43.42 42.39 1xbo n LEU 204 CO 0.40 0.23 0.37 -0.24 -1.33 0.00 0.00 177.39 176.83 1xbo n SER 205 N -0.60 -0.38 0.19 -1.43 2.88 0.53 -4.90 113.62 109.91 1xbo n SER 205 Ca 0.11 0.50 0.13 0.00 -1.33 0.00 0.00 58.87 58.28 1xbo n SER 205 Cb 0.37 -1.36 0.32 0.00 -0.75 0.00 0.00 64.21 62.80 1xbo n SER 205 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1xbo h PRO 206 N -1.09 0.00 0.00 -1.46 0.13 -1.93 -3.07 132.00 124.59 1xbo h PRO 206 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1xbo h PRO 206 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1xbo h PRO 206 CO 0.41 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.33 1xbo n GLU 207 N -2.79 0.04 -4.36 0.86 0.28 -1.26 -4.71 120.64 108.70 1xbo n GLU 207 Ca 0.04 0.35 -0.24 0.00 -0.16 0.00 0.00 57.16 57.15 1xbo n GLU 207 Cb 0.45 -1.59 -0.09 0.00 1.43 0.00 0.00 31.44 31.64 1xbo n GLU 207 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 1xbo s HIS 208 N -3.09 2.53 1.22 -1.84 3.76 -1.16 -5.13 115.29 111.58 1xbo s HIS 208 Ca 0.05 -0.40 -0.16 0.00 -0.15 0.00 0.00 55.06 54.40 1xbo s HIS 208 Cb 0.07 -1.38 0.30 0.00 1.11 0.00 0.00 32.58 32.68 1xbo s HIS 208 CO 0.23 0.53 1.02 0.20 -0.85 0.00 0.00 174.74 175.87 1xbo s GLY 209 N -3.68 1.51 0.39 -2.22 0.00 1.00 -4.90 107.32 99.42 1xbo s GLY 209 Ca 0.34 -0.46 -0.27 0.00 0.00 0.00 0.00 44.72 44.32 1xbo s GLY 209 CO 0.19 0.35 1.40 -4.14 0.00 0.00 0.00 173.10 170.90 1xbo s PRO 210 N -4.80 4.05 0.39 2.90 0.02 -1.26 -4.49 135.00 131.82 1xbo s PRO 210 Ca 0.68 2.39 -0.26 0.00 0.02 0.00 0.00 61.00 63.84 1xbo s PRO 210 Cb -0.19 -2.89 -0.09 0.00 0.02 0.00 0.00 34.50 31.35 1xbo s PRO 210 CO 0.61 -0.51 1.23 0.54 -0.33 0.00 0.00 177.00 178.54 1xbo s VAL 211 N -1.17 2.92 -0.27 3.83 0.11 -1.25 -4.42 120.40 120.17 1xbo s VAL 211 Ca 0.54 0.82 -0.15 0.00 -2.93 0.00 0.00 61.98 60.26 1xbo s VAL 211 Cb -0.43 -3.48 -0.04 0.00 -1.53 0.00 0.00 36.38 30.90 1xbo s VAL 211 CO 0.57 0.11 0.37 -0.69 -3.33 0.00 0.00 175.10 172.13 1xbo s VAL 212 N -1.31 5.18 -0.09 2.04 1.01 -0.95 -0.97 120.40 125.31 1xbo s VAL 212 Ca 0.55 0.57 0.02 0.00 0.00 0.00 0.00 61.98 63.12 1xbo s VAL 212 Cb -0.34 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.32 1xbo s VAL 212 CO 0.44 0.16 -0.16 -0.69 0.00 0.00 0.00 175.10 174.86 1xbo s VAL 213 N 2.03 2.88 -0.03 2.92 1.01 0.89 -0.38 120.40 129.73 1xbo s VAL 213 Ca 0.15 -0.75 -0.25 0.00 0.00 0.00 0.00 61.98 61.13 1xbo s VAL 213 Cb -0.16 -2.16 0.05 0.00 0.00 0.00 0.00 36.38 34.12 1xbo s VAL 213 CO 0.10 0.56 0.54 -1.38 0.00 0.00 0.00 175.10 174.91 1xbo s HIS 214 N -0.13 -0.47 0.00 5.22 -3.43 -0.34 -1.78 115.29 114.35 1xbo s HIS 214 Ca -0.02 0.76 0.00 0.00 -0.80 0.00 0.00 55.06 55.00 1xbo s HIS 214 Cb -0.14 0.30 0.00 0.00 -1.43 0.00 0.00 32.58 31.31 1xbo s HIS 214 CO 0.04 -0.54 0.00 0.00 -2.00 0.00 0.00 174.74 172.23 1xbo h SER 216 N 0.00 0.64 0.00 0.00 0.87 -1.90 -2.75 113.55 110.41 1xbo h SER 216 Ca 0.00 -0.88 -0.04 0.00 -1.23 0.00 0.00 61.79 59.65 1xbo h SER 216 Cb 0.00 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1xbo h SER 216 CO 0.00 1.45 -1.81 0.00 -0.53 0.00 0.00 176.83 175.94 1xbo n ALA 217 N -2.66 2.50 -1.81 6.23 0.00 -1.26 -0.85 120.51 122.66 1xbo n ALA 217 Ca -0.13 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1xbo n ALA 217 Cb 0.87 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 19.80 1xbo n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xbo n GLY 218 N 1.60 0.73 0.28 0.00 0.00 -1.24 -3.62 105.19 102.93 1xbo n GLY 218 Ca -0.06 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1xbo n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1xbo n ILE 219 N -3.11 0.00 0.00 -0.61 -5.35 -1.26 -4.50 119.36 104.53 1xbo n ILE 219 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1xbo n ILE 219 Cb 0.42 -0.06 0.00 0.00 -1.74 0.00 0.00 39.64 38.26 1xbo n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xbo n GLY 220 N 1.29 -0.81 0.20 3.28 0.00 -1.26 -0.93 105.19 106.96 1xbo n GLY 220 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1xbo n GLY 220 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1xbo h ARG 221 N 0.00 0.26 -0.48 1.61 3.08 -1.95 -2.68 114.38 114.23 1xbo h ARG 221 Ca 0.00 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 1xbo h ARG 221 Cb 0.00 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1xbo h ARG 221 CO 0.00 0.61 0.17 0.77 -1.07 0.00 0.00 179.97 180.45 1xbo h SER 222 N 0.22 0.68 -0.09 7.04 0.02 -1.88 -1.99 113.55 117.54 1xbo h SER 222 Ca 0.02 -0.19 0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1xbo h SER 222 Cb 0.78 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 1xbo h SER 222 CO 0.06 0.68 0.02 1.23 -1.14 0.00 0.00 176.83 177.68 1xbo h GLY 223 N 0.63 0.10 0.29 -3.77 0.00 -1.24 -1.50 103.07 97.59 1xbo h GLY 223 Ca 0.16 -0.01 0.11 0.00 0.00 0.00 0.00 47.33 47.59 1xbo h GLY 223 CO -0.01 0.00 0.23 -0.84 0.00 0.00 0.00 176.54 175.93 1xbo h THR 224 N 0.06 0.72 0.52 4.70 2.02 -1.28 0.96 112.91 120.62 1xbo h THR 224 Ca 0.04 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 1xbo h THR 224 Cb 0.03 0.28 0.01 0.00 -1.74 0.00 0.00 68.15 66.73 1xbo h THR 224 CO -0.05 0.07 -0.25 0.15 0.37 0.00 0.00 175.52 175.81 1xbo h PHE 225 N 0.40 -0.65 -0.65 3.16 3.57 -1.00 -2.62 116.94 119.15 1xbo h PHE 225 Ca 0.34 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.79 1xbo h PHE 225 Cb 0.46 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.38 1xbo h PHE 225 CO -0.18 -0.38 0.29 0.00 -2.23 0.00 0.00 178.31 175.81 1xbo h LEU 227 N 0.93 -0.03 -1.24 0.00 5.85 -0.81 -1.05 115.31 118.96 1xbo h LEU 227 Ca 0.22 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1xbo h LEU 227 Cb 0.13 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1xbo h LEU 227 CO -0.03 0.20 0.50 0.00 -0.34 0.00 0.00 178.44 178.77 1xbo h ALA 228 N 0.70 1.45 0.14 1.25 0.00 -1.35 -0.79 119.26 120.66 1xbo h ALA 228 Ca -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xbo h ALA 228 Cb 0.25 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1xbo h ALA 228 CO 0.01 0.51 -0.07 0.22 0.00 0.00 0.00 179.25 179.92 1xbo h ASP 229 N 1.04 -0.16 -0.42 0.00 3.58 -1.24 -1.78 116.42 117.44 1xbo h ASP 229 Ca 0.28 -0.23 0.03 0.00 0.42 0.00 0.00 57.03 57.53 1xbo h ASP 229 Cb -0.11 0.04 -0.04 0.00 1.72 0.00 0.00 39.33 40.94 1xbo h ASP 229 CO -0.06 0.16 0.20 0.74 -2.88 0.00 0.00 179.24 177.40 1xbo h THR 230 N -0.48 0.96 -0.92 2.25 2.02 -0.95 -0.53 112.91 115.27 1xbo h THR 230 Ca -0.02 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 67.03 1xbo h THR 230 Cb 0.38 0.51 -0.05 0.00 -1.74 0.00 0.00 68.15 67.26 1xbo h THR 230 CO 0.03 0.08 0.61 0.00 0.37 0.00 0.00 175.52 176.60 1xbo h LEU 232 N 1.25 0.00 0.00 0.00 3.38 -0.84 -1.89 115.31 117.21 1xbo h LEU 232 Ca 0.34 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.05 1xbo h LEU 232 Cb -0.14 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.63 1xbo h LEU 232 CO -0.07 0.39 -1.00 0.25 0.09 0.00 0.00 178.44 178.09 1xbo h LEU 233 N 0.00 0.88 -0.19 1.67 5.85 -0.16 -2.36 115.31 120.99 1xbo h LEU 233 Ca -0.00 -0.74 -0.01 0.00 0.84 0.00 0.00 57.88 57.96 1xbo h LEU 233 Cb 0.78 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1xbo h LEU 233 CO 0.05 1.51 0.06 -0.07 -0.34 0.00 0.00 178.44 179.65 1xbo h LEU 234 N 0.35 0.28 -1.68 2.25 3.38 -0.94 -0.66 115.31 118.29 1xbo h LEU 234 Ca -0.13 -0.19 0.11 0.00 0.09 0.00 0.00 57.88 57.76 1xbo h LEU 234 Cb 1.66 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 42.31 1xbo h LEU 234 CO 0.20 0.40 0.40 -0.03 0.09 0.00 0.00 178.44 179.50 1xbo h MET 235 N 0.14 0.34 0.00 1.13 4.05 -1.40 -2.03 114.93 117.17 1xbo h MET 235 Ca 0.06 -0.02 -0.24 0.00 -0.28 0.00 0.00 59.70 59.22 1xbo h MET 235 Cb 0.22 -0.08 0.01 0.00 -0.80 0.00 0.00 31.60 30.95 1xbo h MET 235 CO -0.00 0.23 -0.99 0.22 0.23 0.00 0.00 176.91 176.60 1xbo h ASP 236 N 0.36 0.69 -0.73 1.39 3.58 -0.77 0.49 116.42 121.42 1xbo h ASP 236 Ca 0.28 -0.55 0.09 0.00 0.42 0.00 0.00 57.03 57.27 1xbo h ASP 236 Cb 0.62 -0.21 -0.05 0.00 1.72 0.00 0.00 39.33 41.41 1xbo h ASP 236 CO -0.07 1.35 0.48 0.11 -2.88 0.00 0.00 179.24 178.23 1xbo h LYS 237 N 0.30 0.62 0.00 0.28 1.57 -0.38 -3.14 116.57 115.81 1xbo h LYS 237 Ca -0.10 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1xbo h LYS 237 Cb 1.63 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.80 1xbo h LYS 237 CO 0.18 0.41 0.00 2.89 -0.57 0.00 0.00 179.45 182.36 1xbo n ARG 238 N -4.49 -0.06 -3.80 3.15 0.00 -1.21 -5.00 116.66 105.24 1xbo n ARG 238 Ca 0.12 -0.61 -0.29 0.00 -0.00 0.00 0.00 57.85 57.07 1xbo n ARG 238 Cb 0.33 -0.90 0.04 0.00 -0.00 0.00 0.00 32.46 31.92 1xbo n ARG 238 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1xbo n LYS 239 N -0.09 -6.02 -3.64 2.89 4.76 0.14 -4.95 118.16 111.24 1xbo n LYS 239 Ca 0.00 0.66 -0.28 0.00 -2.87 0.00 0.00 58.31 55.82 1xbo n LYS 239 Cb 0.11 -5.58 -0.12 0.00 -1.84 0.00 0.00 35.03 27.60 1xbo n LYS 239 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1xbo s ASP 240 N -3.27 3.15 0.50 4.39 2.15 -1.06 -4.96 116.67 117.57 1xbo s ASP 240 Ca 0.64 -3.16 0.31 0.00 0.43 0.00 0.00 52.55 50.77 1xbo s ASP 240 Cb -0.31 -0.97 1.42 0.00 -0.30 0.00 0.00 42.92 42.76 1xbo s ASP 240 CO 0.78 -0.18 1.81 -0.65 -0.17 0.00 0.00 175.17 176.77 1xbo h PRO 241 N 5.92 0.10 0.00 4.34 0.11 -1.93 -0.26 132.00 140.28 1xbo h PRO 241 Ca 0.15 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.22 1xbo h PRO 241 Cb 0.87 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 1xbo h PRO 241 CO 0.50 0.07 -0.15 0.77 -0.21 0.00 0.00 178.00 178.99 1xbo h SER 242 N 0.11 0.00 -0.29 -2.05 0.02 -1.98 -2.78 113.55 106.58 1xbo h SER 242 Ca 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 1xbo h SER 242 Cb 1.95 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.49 1xbo h SER 242 CO -0.09 0.15 0.00 -1.54 -1.14 0.00 0.00 176.83 174.21 1xbo n SER 243 N -4.35 1.60 -4.37 3.07 3.41 -0.11 -4.79 113.62 108.08 1xbo n SER 243 Ca -0.03 -2.01 -0.42 0.00 -0.26 0.00 0.00 58.87 56.16 1xbo n SER 243 Cb 0.22 -0.21 -0.10 0.00 -0.26 0.00 0.00 64.21 63.86 1xbo n SER 243 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1xbo s VAL 244 N -1.61 4.79 -0.82 -3.33 1.01 -1.05 -5.02 120.40 114.37 1xbo s VAL 244 Ca 0.20 -0.99 -0.15 0.00 0.00 0.00 0.00 61.98 61.04 1xbo s VAL 244 Cb 0.10 -3.77 0.21 0.00 0.00 0.00 0.00 36.38 32.92 1xbo s VAL 244 CO 0.13 -0.39 0.79 -0.62 0.00 0.00 0.00 175.10 175.00 1xbo s ASP 245 N 1.95 6.72 0.22 3.32 -1.08 -1.26 -4.85 116.67 121.68 1xbo s ASP 245 Ca 0.03 -2.58 -0.08 0.00 -0.52 0.00 0.00 52.55 49.40 1xbo s ASP 245 Cb -0.21 -2.23 0.35 0.00 -1.46 0.00 0.00 42.92 39.37 1xbo s ASP 245 CO 0.06 -0.64 1.70 -0.29 0.52 0.00 0.00 175.17 176.53 1xbo h ILE 246 N 4.94 0.60 -0.74 4.11 2.10 -1.98 0.85 117.51 127.39 1xbo h ILE 246 Ca 0.09 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.93 1xbo h ILE 246 Cb 1.04 0.31 -0.04 0.00 -1.09 0.00 0.00 36.82 37.04 1xbo h ILE 246 CO 0.80 0.05 0.46 0.11 -1.08 0.00 0.00 178.15 178.49 1xbo h LYS 247 N 0.27 0.99 -0.01 2.19 1.57 -1.99 0.22 116.57 119.80 1xbo h LYS 247 Ca 0.35 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 58.93 1xbo h LYS 247 Cb 0.54 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1xbo h LYS 247 CO -0.44 0.68 -0.58 -0.22 -0.57 0.00 0.00 179.45 178.32 1xbo h LYS 248 N 1.01 0.04 -0.17 3.15 3.64 -1.48 -2.28 116.57 120.48 1xbo h LYS 248 Ca 0.27 -0.03 -0.17 0.00 -1.27 0.00 0.00 60.65 59.45 1xbo h LYS 248 Cb -0.07 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1xbo h LYS 248 CO -0.05 0.61 -0.54 0.28 -2.27 0.00 0.00 179.45 177.47 1xbo h VAL 249 N 0.03 1.32 -0.59 2.00 2.07 0.17 -1.91 116.25 119.35 1xbo h VAL 249 Ca -0.01 -1.79 -0.03 0.00 0.82 0.00 0.00 66.70 65.70 1xbo h VAL 249 Cb 1.03 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 32.74 1xbo h VAL 249 CO 0.08 0.56 0.23 0.25 0.02 0.00 0.00 177.57 178.71 1xbo h LEU 250 N 0.35 0.77 -0.87 2.57 5.85 -0.93 -1.01 115.31 122.04 1xbo h LEU 250 Ca -0.02 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.49 1xbo h LEU 250 Cb 1.17 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 1xbo h LEU 250 CO 0.12 0.70 -0.37 -0.07 -0.34 0.00 0.00 178.44 178.47 1xbo h LEU 251 N 0.84 0.39 -1.01 2.25 3.38 -1.31 -0.23 115.31 119.62 1xbo h LEU 251 Ca 0.20 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1xbo h LEU 251 Cb 0.17 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1xbo h LEU 251 CO -0.02 0.74 -0.30 -0.08 0.09 0.00 0.00 178.44 178.87 1xbo h GLU 252 N 0.32 0.35 -0.07 1.13 4.57 -0.49 -2.80 114.58 117.59 1xbo h GLU 252 Ca 0.03 -0.13 -0.24 0.00 -1.18 0.00 0.00 59.36 57.84 1xbo h GLU 252 Cb 0.80 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 29.39 1xbo h GLU 252 CO 0.06 0.62 -0.89 0.52 -1.18 0.00 0.00 179.01 178.14 1xbo h MET 253 N 0.31 0.67 0.00 1.92 2.86 -0.68 -3.14 114.93 116.87 1xbo h MET 253 Ca 0.04 -0.63 0.00 0.00 -2.06 0.00 0.00 59.70 57.05 1xbo h MET 253 Cb 0.68 0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1xbo h MET 253 CO 0.05 1.23 0.00 0.54 1.06 0.00 0.00 176.91 179.80 1xbo n ARG 254 N -3.87 0.14 0.16 1.72 1.74 -0.14 -0.75 116.66 115.66 1xbo n ARG 254 Ca -0.08 0.17 0.05 0.00 -0.77 0.00 0.00 57.85 57.22 1xbo n ARG 254 Cb 0.80 -1.50 0.09 0.00 -1.02 0.00 0.00 32.46 30.83 1xbo n ARG 254 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1xbo h LYS 255 N 0.00 0.00 0.00 5.56 1.57 -1.48 -3.33 116.57 118.89 1xbo h LYS 255 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xbo h LYS 255 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1xbo h LYS 255 CO 0.00 0.36 -1.78 1.19 -0.57 0.00 0.00 179.45 178.65 1xbo n PHE 256 N -3.20 0.18 -3.63 -1.35 3.72 0.07 -4.96 117.46 108.28 1xbo n PHE 256 Ca 0.02 0.05 -0.12 0.00 -0.05 0.00 0.00 57.45 57.36 1xbo n PHE 256 Cb 0.67 -0.57 -0.07 0.00 -0.94 0.00 0.00 39.48 38.56 1xbo n PHE 256 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1xbo s ARG 257 N -3.48 0.80 0.49 -1.08 3.52 -1.14 -4.61 118.95 113.45 1xbo s ARG 257 Ca -0.06 1.04 -0.22 0.00 -0.13 0.00 0.00 55.73 56.36 1xbo s ARG 257 Cb 0.13 0.34 -0.07 0.00 -1.56 0.00 0.00 34.95 33.79 1xbo s ARG 257 CO 0.89 -0.11 1.15 0.00 -0.81 0.00 0.00 175.30 176.42 1xbo s MET 258 N 0.68 3.60 -1.41 5.12 0.23 -1.26 -4.22 119.30 122.05 1xbo s MET 258 Ca -0.02 1.72 -0.02 0.00 -1.03 0.00 0.00 55.69 56.34 1xbo s MET 258 Cb -0.05 -2.25 0.01 0.00 -1.53 0.00 0.00 34.83 31.01 1xbo s MET 258 CO -0.04 -0.67 0.16 0.41 -2.03 0.00 0.00 175.02 172.84 1xbo n GLY 259 N 0.34 -0.50 3.72 3.16 0.00 -1.26 -4.90 105.19 105.75 1xbo n GLY 259 Ca 0.09 0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1xbo n GLY 259 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xbo s LEU 260 N -6.04 4.37 -0.00 0.99 1.43 -1.26 -4.06 118.68 114.11 1xbo s LEU 260 Ca 0.10 2.70 -0.00 0.00 -1.03 0.00 0.00 54.13 55.90 1xbo s LEU 260 Cb -0.05 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.57 1xbo s LEU 260 CO 0.12 -0.86 0.01 -0.38 0.23 0.00 0.00 176.35 175.47 1xbo n ILE 261 N 3.77 -4.62 0.06 -0.59 2.08 -0.10 -4.96 119.36 114.99 1xbo n ILE 261 Ca 0.14 0.70 0.10 0.00 0.56 0.00 0.00 62.75 64.25 1xbo n ILE 261 Cb 0.38 -3.74 -0.06 0.00 -0.75 0.00 0.00 39.64 35.47 1xbo n ILE 261 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1xbo n GLN 262 N 0.41 0.62 -4.17 0.38 1.13 -1.26 -4.91 117.38 109.58 1xbo n GLN 262 Ca -0.01 0.03 -0.13 0.00 -1.94 0.00 0.00 57.00 54.95 1xbo n GLN 262 Cb 0.01 -1.73 -0.11 0.00 0.11 0.00 0.00 30.24 28.53 1xbo n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1xbo s THR 263 N -3.37 0.86 0.49 5.09 -4.23 -1.26 -5.02 115.64 108.19 1xbo s THR 263 Ca -0.03 -1.72 0.36 0.00 -1.18 0.00 0.00 61.69 59.13 1xbo s THR 263 Cb 0.11 -1.43 0.39 0.00 1.34 0.00 0.00 72.50 72.90 1xbo s THR 263 CO 0.83 -0.65 2.21 0.00 -0.54 0.00 0.00 174.62 176.47 1xbo h ALA 264 N 3.40 1.14 0.06 3.99 0.00 -1.94 -1.88 119.26 124.03 1xbo h ALA 264 Ca -0.36 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.28 1xbo h ALA 264 Cb 1.18 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1xbo h ALA 264 CO 0.56 0.04 -1.08 0.22 0.00 0.00 0.00 179.25 178.99 1xbo h ASP 265 N 0.00 0.34 -0.60 0.00 3.58 -1.95 -1.74 116.42 116.05 1xbo h ASP 265 Ca -0.00 -0.33 -0.09 0.00 0.42 0.00 0.00 57.03 57.03 1xbo h ASP 265 Cb 0.18 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 1xbo h ASP 265 CO 0.00 1.21 0.05 1.56 -2.88 0.00 0.00 179.24 179.18 1xbo h GLN 266 N 0.09 1.05 -0.03 0.28 4.20 -1.66 0.11 115.11 119.15 1xbo h GLN 266 Ca -0.09 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.32 1xbo h GLN 266 Cb 1.78 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 29.44 1xbo h GLN 266 CO 0.17 1.00 0.02 1.25 -0.67 0.00 0.00 178.83 180.60 1xbo h LEU 267 N 0.97 0.04 -1.07 1.46 5.85 -1.39 0.11 115.31 121.27 1xbo h LEU 267 Ca 0.18 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.95 1xbo h LEU 267 Cb 0.49 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.45 1xbo h LEU 267 CO 0.02 0.04 0.62 -0.09 -0.34 0.00 0.00 178.44 178.69 1xbo h ARG 268 N 0.03 1.10 -0.48 1.25 2.43 -0.94 -1.46 114.38 116.31 1xbo h ARG 268 Ca 0.01 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 1xbo h ARG 268 Cb 0.01 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.29 1xbo h ARG 268 CO -0.00 0.73 -0.01 0.35 -1.51 0.00 0.00 179.97 179.52 1xbo h PHE 269 N 1.13 0.94 -0.70 2.20 3.57 -0.13 -1.87 116.94 122.07 1xbo h PHE 269 Ca 0.41 -0.17 0.12 0.00 3.53 0.00 0.00 57.97 61.86 1xbo h PHE 269 Cb 0.14 -0.24 -0.08 0.00 2.79 0.00 0.00 35.95 38.56 1xbo h PHE 269 CO -0.00 0.89 0.28 0.77 -2.23 0.00 0.00 178.31 178.02 1xbo h SER 270 N 0.71 0.29 0.26 0.41 0.02 0.22 0.32 113.55 115.78 1xbo h SER 270 Ca 0.13 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 1xbo h SER 270 Cb 0.52 0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 1xbo h SER 270 CO 0.03 0.14 -0.15 1.88 -1.14 0.00 0.00 176.83 177.58 1xbo h TYR 271 N 0.46 -0.40 -0.18 3.45 -1.99 -1.11 -0.89 116.97 116.30 1xbo h TYR 271 Ca 0.37 -0.01 0.05 0.00 2.00 0.00 0.00 58.73 61.15 1xbo h TYR 271 Cb 0.50 0.14 -0.06 0.00 2.00 0.00 0.00 36.73 39.31 1xbo h TYR 271 CO -0.16 -0.24 -0.24 -0.07 -0.00 0.00 0.00 178.16 177.44 1xbo h LEU 272 N -0.40 -0.77 -0.18 3.88 3.38 -0.22 0.62 115.31 121.63 1xbo h LEU 272 Ca -0.03 0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1xbo h LEU 272 Cb 0.32 0.35 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 1xbo h LEU 272 CO 0.03 -0.29 -0.16 0.00 0.09 0.00 0.00 178.44 178.11 1xbo h ALA 273 N 0.71 -0.05 0.47 1.53 0.00 -0.32 0.52 119.26 122.12 1xbo h ALA 273 Ca 0.12 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1xbo h ALA 273 Cb 0.46 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1xbo h ALA 273 CO -0.35 -0.60 -0.31 0.28 0.00 0.00 0.00 179.25 178.28 1xbo h VAL 274 N -0.18 0.37 -0.73 0.00 2.07 -0.80 0.37 116.25 117.34 1xbo h VAL 274 Ca 0.11 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.78 1xbo h VAL 274 Cb 0.35 0.37 -0.10 0.00 -1.52 0.00 0.00 31.29 30.38 1xbo h VAL 274 CO -0.29 0.00 0.24 0.40 0.02 0.00 0.00 177.57 177.94 1xbo h ILE 275 N -0.75 0.59 -0.25 4.57 2.04 -0.58 0.36 117.51 123.49 1xbo h ILE 275 Ca -0.05 -0.12 -0.08 0.00 1.00 0.00 0.00 64.86 65.61 1xbo h ILE 275 Cb 0.62 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1xbo h ILE 275 CO 0.04 0.06 -0.17 -0.08 0.00 0.00 0.00 178.15 178.01 1xbo h GLU 276 N 0.35 0.55 -0.32 2.37 4.57 -0.64 -2.94 114.58 118.52 1xbo h GLU 276 Ca 0.41 -0.26 0.05 0.00 -1.18 0.00 0.00 59.36 58.37 1xbo h GLU 276 Cb 0.66 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.23 1xbo h GLU 276 CO -0.45 0.83 0.22 0.78 -1.18 0.00 0.00 179.01 179.22 1xbo h GLY 277 N 0.27 0.29 0.34 1.92 0.00 0.12 -1.54 103.07 104.48 1xbo h GLY 277 Ca 0.05 -0.10 0.17 0.00 0.00 0.00 0.00 47.33 47.45 1xbo h GLY 277 CO 0.05 0.08 0.60 0.00 0.00 0.00 0.00 176.54 177.27 1xbo h ALA 278 N 1.82 1.81 -0.79 3.60 0.00 -0.17 -1.41 119.26 124.11 1xbo h ALA 278 Ca 0.14 0.04 0.18 0.00 0.00 0.00 0.00 54.91 55.27 1xbo h ALA 278 Cb 0.25 -0.11 -0.11 0.00 0.00 0.00 0.00 17.79 17.82 1xbo h ALA 278 CO -0.03 -0.10 0.25 0.87 0.00 0.00 0.00 179.25 180.24 1xbo h LYS 279 N 0.71 0.31 -0.10 0.00 1.57 -1.38 0.93 116.57 118.61 1xbo h LYS 279 Ca 0.50 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 59.19 1xbo h LYS 279 Cb 0.83 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.07 1xbo h LYS 279 CO -0.26 0.21 -0.24 0.35 -0.57 0.00 0.00 179.45 178.93 1xbo h PHE 280 N 0.32 0.44 -0.56 -1.35 3.04 -1.38 -2.58 116.94 114.88 1xbo h PHE 280 Ca 0.46 -0.17 0.09 0.00 3.98 0.00 0.00 57.97 62.34 1xbo h PHE 280 Cb 0.82 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 39.22 1xbo h PHE 280 CO -0.22 0.85 0.38 0.82 -2.02 0.00 0.00 178.31 178.12 1xbo h ILE 281 N -0.10 0.91 -0.24 1.41 1.08 -0.97 -2.60 117.51 117.00 1xbo h ILE 281 Ca -0.00 -0.13 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1xbo h ILE 281 Cb 0.84 0.48 0.00 0.00 -3.07 0.00 0.00 36.82 35.07 1xbo h ILE 281 CO 0.05 0.07 0.00 0.23 -0.69 0.00 0.00 178.15 177.81 1xbo n MET 282 N -4.47 1.70 0.00 2.37 2.81 0.21 -4.88 117.12 114.87 1xbo n MET 282 Ca 0.09 -0.92 0.00 0.00 -1.81 0.00 0.00 57.70 55.05 1xbo n MET 282 Cb 0.34 -1.29 0.00 0.00 -0.71 0.00 0.00 33.22 31.56 1xbo n MET 282 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xbo n GLY 283 N 0.78 1.51 3.42 3.03 0.00 -0.98 -5.05 105.19 107.91 1xbo n GLY 283 Ca 0.08 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.66 1xbo n GLY 283 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xbo s ASP 284 N -1.97 6.80 0.28 1.61 -1.08 -0.97 -4.83 116.67 116.51 1xbo s ASP 284 Ca 0.00 -2.48 0.26 0.00 -0.52 0.00 0.00 52.55 49.81 1xbo s ASP 284 Cb 0.00 -2.35 0.88 0.00 -1.46 0.00 0.00 42.92 39.99 1xbo s ASP 284 CO 0.00 -0.85 1.76 0.28 0.52 0.00 0.00 175.17 176.88 1xbo h SER 285 N 8.13 0.00 0.82 -0.34 0.02 -1.84 -3.17 113.55 117.17 1xbo h SER 285 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1xbo h SER 285 Cb 0.98 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.52 1xbo h SER 285 CO 1.06 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 175.21 1xbo n SER 286 N -2.40 0.00 0.17 3.07 3.41 -1.26 -3.21 113.62 113.40 1xbo n SER 286 Ca 0.04 0.46 0.03 0.00 -0.26 0.00 0.00 58.87 59.14 1xbo n SER 286 Cb 0.35 -0.49 0.27 0.00 -0.26 0.00 0.00 64.21 64.09 1xbo n SER 286 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 1xbo h VAL 287 N 0.00 1.10 -0.31 -3.33 -1.51 -1.93 -3.07 116.25 107.20 1xbo h VAL 287 Ca 0.00 -1.75 -0.03 0.00 -1.23 0.00 0.00 66.70 63.69 1xbo h VAL 287 Cb 0.41 2.01 -0.02 0.00 -2.13 0.00 0.00 31.29 31.57 1xbo h VAL 287 CO 0.00 0.46 0.06 -0.61 -1.23 0.00 0.00 177.57 176.25 1xbo h GLN 288 N 0.00 0.45 -0.13 5.19 4.15 -1.79 -0.78 115.11 122.20 1xbo h GLN 288 Ca -0.00 -0.07 -0.22 0.00 0.77 0.00 0.00 58.65 59.13 1xbo h GLN 288 Cb 0.97 -0.08 0.01 0.00 0.21 0.00 0.00 27.48 28.59 1xbo h GLN 288 CO 0.06 0.43 -0.79 -0.44 -1.93 0.00 0.00 178.83 176.17 1xbo h ASP 289 N 0.45 0.86 -0.86 -0.69 3.32 -1.74 -2.61 116.42 115.14 1xbo h ASP 289 Ca 0.11 -0.57 -0.00 0.00 0.02 0.00 0.00 57.03 56.58 1xbo h ASP 289 Cb 0.20 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 1xbo h ASP 289 CO -0.00 1.36 0.52 1.56 -1.72 0.00 0.00 179.24 180.96 1xbo h GLN 290 N 0.48 1.17 -0.03 3.56 4.20 -1.32 -0.98 115.11 122.19 1xbo h GLN 290 Ca -0.05 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 1xbo h GLN 290 Cb 1.41 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 28.94 1xbo h GLN 290 CO 0.16 0.82 0.01 -1.49 -0.67 0.00 0.00 178.83 177.66 1xbo h TRP 291 N 1.19 0.05 -0.73 2.96 6.55 -1.10 0.50 115.95 125.37 1xbo h TRP 291 Ca 0.31 -0.00 0.14 0.00 0.95 0.00 0.00 58.89 60.29 1xbo h TRP 291 Cb -0.05 -0.01 -0.10 0.00 -0.86 0.00 0.00 29.16 28.13 1xbo h TRP 291 CO 0.00 0.17 0.24 -0.22 -1.05 0.00 0.00 178.44 177.59 1xbo h LYS 292 N -0.09 0.36 0.45 0.49 3.64 -0.99 0.64 116.57 121.06 1xbo h LYS 292 Ca 0.01 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1xbo h LYS 292 Cb 0.14 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1xbo h LYS 292 CO -0.00 0.24 -0.21 0.93 -2.27 0.00 0.00 179.45 178.13 1xbo h GLU 293 N 0.37 -0.58 -0.46 1.90 4.39 -0.81 -3.04 114.58 116.35 1xbo h GLU 293 Ca 0.40 0.04 0.13 0.00 0.34 0.00 0.00 59.36 60.28 1xbo h GLU 293 Cb 0.64 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.40 1xbo h GLU 293 CO -0.44 -0.30 0.34 -0.07 -1.16 0.00 0.00 179.01 177.39 1xbo h LEU 294 N -0.80 0.00 -0.65 1.33 3.38 -0.33 -1.85 115.31 116.40 1xbo h LEU 294 Ca -0.06 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 1xbo h LEU 294 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1xbo h LEU 294 CO 0.10 0.00 -0.51 0.77 0.09 0.00 0.00 178.44 178.89 1xbo h SER 295 N 0.00 0.48 -4.21 -0.43 4.64 -0.78 -3.46 113.55 109.79 1xbo h SER 295 Ca 0.22 -0.24 -0.26 0.00 -0.47 0.00 0.00 61.79 61.04 1xbo h SER 295 Cb 0.90 -0.14 0.09 0.00 -0.31 0.00 0.00 62.40 62.95 1xbo h SER 295 CO -0.00 0.90 -0.45 1.41 -0.87 0.00 0.00 176.83 177.82 1xbo n HIS 296 N -3.96 -1.85 0.19 4.77 8.25 -0.70 -4.90 115.22 117.01 1xbo n HIS 296 Ca -0.02 0.66 0.08 0.00 -0.26 0.00 0.00 57.72 58.18 1xbo n HIS 296 Cb 0.57 -3.70 0.42 0.00 1.12 0.00 0.00 29.99 28.40 1xbo n HIS 296 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1xbo n GLU 297 N -3.42 0.11 -2.52 -0.41 0.28 -1.26 -4.51 120.64 108.90 1xbo n GLU 297 Ca -0.01 0.54 -0.42 0.00 -0.16 0.00 0.00 57.16 57.11 1xbo n GLU 297 Cb 0.55 -1.81 -0.03 0.00 1.43 0.00 0.00 31.44 31.59 1xbo n GLU 297 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1xbo s ASP 298 N -3.75 7.10 0.01 -1.84 1.01 -1.26 0.11 116.67 118.04 1xbo s ASP 298 Ca -0.00 1.72 -0.25 0.00 0.71 0.00 0.00 52.55 54.73 1xbo s ASP 298 Cb 0.05 -2.56 -0.15 0.00 1.01 0.00 0.00 42.92 41.28 1xbo s ASP 298 CO 0.19 -0.56 1.12 -0.07 0.21 0.00 0.00 175.17 176.05 1xbo h LEU 299 N 8.27 -0.60 0.00 1.23 3.38 -1.89 -3.43 115.31 122.27 1xbo h LEU 299 Ca -0.32 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1xbo h LEU 299 Cb 1.15 0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1xbo h LEU 299 CO 0.88 -0.22 0.00 1.21 0.09 0.00 0.00 178.44 180.40