#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bu7 s ILE 2 N 0.00 4.15 0.13 12.58 2.07 -1.26 -4.31 121.20 134.55 1bu7 s ILE 2 Ca 0.00 1.51 0.07 0.00 -1.41 0.00 0.00 60.65 60.82 1bu7 s ILE 2 Cb 0.00 -3.97 -0.04 0.00 0.13 0.00 0.00 42.46 38.58 1bu7 s ILE 2 CO 0.00 0.04 -0.07 -0.75 -1.91 0.00 0.00 174.94 172.25 1bu7 s LYS 3 N 1.83 2.19 0.34 3.50 2.36 -0.14 -5.02 119.74 124.80 1bu7 s LYS 3 Ca 0.57 -1.08 -0.28 0.00 -2.55 0.00 0.00 55.97 52.64 1bu7 s LYS 3 Cb -0.27 -2.30 -0.10 0.00 -1.05 0.00 0.00 37.83 34.11 1bu7 s LYS 3 CO 0.25 0.49 1.24 -2.00 1.55 0.00 0.00 175.35 176.88 1bu7 s GLU 4 N -2.48 4.34 0.02 4.03 2.12 -1.26 -4.65 118.70 120.82 1bu7 s GLU 4 Ca 0.23 2.07 -0.26 0.00 0.36 0.00 0.00 54.97 57.37 1bu7 s GLU 4 Cb -0.10 -3.01 -0.05 0.00 0.26 0.00 0.00 34.13 31.23 1bu7 s GLU 4 CO 0.15 -0.15 0.83 1.41 -0.54 0.00 0.00 175.26 176.96 1bu7 s MET 5 N -1.83 4.53 0.53 4.30 -2.45 -1.26 -4.99 119.30 118.12 1bu7 s MET 5 Ca 0.50 1.16 -0.21 0.00 -1.25 0.00 0.00 55.69 55.89 1bu7 s MET 5 Cb -0.37 -3.40 -0.07 0.00 1.25 0.00 0.00 34.83 32.24 1bu7 s MET 5 CO 0.48 0.16 1.03 -2.30 1.05 0.00 0.00 175.02 175.43 1bu7 n PRO 6 N 3.24 1.18 -3.69 4.11 -0.02 -1.26 -4.74 135.00 133.83 1bu7 n PRO 6 Ca 0.00 0.44 -0.13 0.00 -2.02 0.00 0.00 63.50 61.79 1bu7 n PRO 6 Cb 0.50 -2.17 -0.09 0.00 -0.02 0.00 0.00 33.50 31.72 1bu7 n PRO 6 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1bu7 s GLN 7 N -2.48 0.63 1.01 -0.52 0.74 -1.26 -0.44 119.66 117.34 1bu7 s GLN 7 Ca 0.70 0.78 -0.12 0.00 0.05 0.00 0.00 55.36 56.77 1bu7 s GLN 7 Cb -0.46 0.29 0.19 0.00 1.10 0.00 0.00 33.01 34.13 1bu7 s GLN 7 CO 0.51 -0.08 1.08 -2.14 -0.55 0.00 0.00 175.29 174.11 1bu7 s PRO 8 N 0.37 0.35 0.22 1.67 0.02 -1.26 -4.95 135.00 131.43 1bu7 s PRO 8 Ca -0.01 0.65 -0.32 0.00 0.02 0.00 0.00 61.00 61.35 1bu7 s PRO 8 Cb -0.04 -1.72 -0.13 0.00 0.02 0.00 0.00 34.50 32.63 1bu7 s PRO 8 CO -0.00 -2.82 1.55 1.17 -0.33 0.00 0.00 177.00 176.57 1bu7 n LYS 9 N -4.26 2.33 -3.79 5.54 3.00 -1.26 -4.94 118.16 114.79 1bu7 n LYS 9 Ca 0.05 0.83 -0.35 0.00 -0.00 0.00 0.00 58.31 58.85 1bu7 n LYS 9 Cb 0.56 -2.58 -0.05 0.00 0.00 0.00 0.00 35.03 32.96 1bu7 n LYS 9 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1bu7 s THR 10 N 0.43 5.34 -0.67 3.15 -4.23 -1.26 -4.44 115.64 113.96 1bu7 s THR 10 Ca 0.71 0.17 0.02 0.00 -1.18 0.00 0.00 61.69 61.42 1bu7 s THR 10 Cb -0.60 -3.54 0.16 0.00 1.34 0.00 0.00 72.50 69.86 1bu7 s THR 10 CO 0.43 0.42 0.46 -0.36 -0.54 0.00 0.00 174.62 175.03 1bu7 s PHE 11 N -1.24 3.48 0.00 3.99 0.08 0.16 -4.88 117.98 119.57 1bu7 s PHE 11 Ca 0.25 -3.15 0.00 0.00 0.12 0.00 0.00 56.93 54.15 1bu7 s PHE 11 Cb -0.13 -2.91 0.00 0.00 -0.57 0.00 0.00 43.02 39.41 1bu7 s PHE 11 CO 0.14 -0.68 0.00 0.41 -0.10 0.00 0.00 175.22 174.99 1bu7 n GLY 12 N 2.60 2.36 0.27 4.36 0.00 -1.26 -1.67 105.19 111.85 1bu7 n GLY 12 Ca 0.14 -0.35 0.18 0.00 0.00 0.00 0.00 46.02 45.98 1bu7 n GLY 12 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1bu7 h GLU 13 N 0.00 0.00 0.00 1.61 9.09 -2.04 -0.80 114.58 122.44 1bu7 h GLU 13 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 1bu7 h GLU 13 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1bu7 h GLU 13 CO 0.00 0.00 -0.00 -0.07 0.05 0.00 0.00 179.01 178.99 1bu7 h LEU 14 N 0.00 0.00 0.00 3.06 4.07 -1.74 -3.39 115.31 117.31 1bu7 h LEU 14 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1bu7 h LEU 14 Cb 0.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.03 1bu7 h LEU 14 CO 0.00 0.00 0.00 0.29 -1.08 0.00 0.00 178.44 177.65 1bu7 n LYS 15 N -3.09 0.00 0.00 1.13 4.76 -0.31 -2.16 118.16 118.48 1bu7 n LYS 15 Ca 0.00 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.57 1bu7 n LYS 15 Cb 0.30 0.00 0.19 0.00 -1.84 0.00 0.00 35.03 33.68 1bu7 n LYS 15 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1bu7 n ASN 16 N 4.78 1.75 -0.30 4.39 5.03 -0.05 0.37 115.26 131.23 1bu7 n ASN 16 Ca 0.00 -1.36 0.11 0.00 0.87 0.00 0.00 54.58 54.20 1bu7 n ASN 16 Cb 0.00 0.25 0.27 0.00 -1.02 0.00 0.00 39.78 39.29 1bu7 n ASN 16 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 1bu7 h LEU 17 N 2.28 0.34 -1.86 3.41 5.85 -1.45 -1.16 115.31 122.72 1bu7 h LEU 17 Ca 0.00 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1bu7 h LEU 17 Cb 0.67 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.81 1bu7 h LEU 17 CO 0.00 0.05 0.13 -0.65 -0.34 0.00 0.00 178.44 177.63 1bu7 h PRO 18 N 0.44 0.00 -0.01 5.25 0.11 -1.80 0.02 132.00 136.01 1bu7 h PRO 18 Ca 0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.63 1bu7 h PRO 18 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1bu7 h PRO 18 CO -0.48 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.59 1bu7 n LEU 19 N -2.56 1.27 -2.66 2.35 4.77 -0.44 -4.09 117.00 115.64 1bu7 n LEU 19 Ca -0.02 -0.42 -0.05 0.00 -0.03 0.00 0.00 56.01 55.48 1bu7 n LEU 19 Cb 0.17 -0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.30 1bu7 n LEU 19 CO 0.12 0.21 0.03 -0.11 -1.33 0.00 0.00 177.39 176.32 1bu7 n LEU 20 N -0.00 2.32 -4.23 2.23 7.94 -0.01 -4.95 117.00 120.30 1bu7 n LEU 20 Ca 0.20 -3.41 -0.43 0.00 -1.11 0.00 0.00 56.01 51.26 1bu7 n LEU 20 Cb 0.32 0.30 0.00 0.00 0.53 0.00 0.00 43.42 44.56 1bu7 n LEU 20 CO 0.17 1.27 1.87 -3.20 -1.11 0.00 0.00 177.39 176.40 1bu7 n ASN 21 N -0.62 4.92 -3.48 1.96 4.05 -1.24 -4.89 115.26 115.96 1bu7 n ASN 21 Ca 0.15 -2.98 -0.15 0.00 0.45 0.00 0.00 54.58 52.06 1bu7 n ASN 21 Cb 0.84 -1.61 -0.04 0.00 1.23 0.00 0.00 39.78 40.20 1bu7 n ASN 21 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1bu7 s THR 22 N 2.17 0.00 -1.93 -0.44 -1.32 -1.26 -5.01 115.64 107.85 1bu7 s THR 22 Ca 0.45 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 61.10 1bu7 s THR 22 Cb 0.04 -1.00 0.50 0.00 -1.51 0.00 0.00 72.50 70.54 1bu7 s THR 22 CO 0.01 0.00 1.41 0.47 -2.21 0.00 0.00 174.62 174.30 1bu7 n ASP 23 N 0.32 3.07 -3.06 8.08 8.00 -1.26 -4.30 116.55 127.41 1bu7 n ASP 23 Ca -0.18 -2.03 -0.25 0.00 0.71 0.00 0.00 54.79 53.04 1bu7 n ASP 23 Cb 0.61 -0.39 -0.04 0.00 -0.02 0.00 0.00 41.12 41.28 1bu7 n ASP 23 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1bu7 n LYS 24 N 1.11 2.53 -0.26 -1.24 5.02 -1.26 -4.25 118.16 119.80 1bu7 n LYS 24 Ca 0.19 -4.43 -0.02 0.00 -2.02 0.00 0.00 58.31 52.03 1bu7 n LYS 24 Cb 0.50 -2.07 0.16 0.00 -0.02 0.00 0.00 35.03 33.59 1bu7 n LYS 24 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1bu7 h PRO 25 N 3.14 1.10 -0.53 1.97 0.13 -1.93 -2.24 132.00 133.64 1bu7 h PRO 25 Ca 0.13 -0.12 -0.01 0.00 -0.87 0.00 0.00 66.00 65.13 1bu7 h PRO 25 Cb 0.64 -0.22 -0.03 0.00 0.13 0.00 0.00 31.00 31.53 1bu7 h PRO 25 CO 0.73 0.81 0.30 0.28 -0.23 0.00 0.00 178.00 179.88 1bu7 h VAL 26 N 1.11 1.17 -0.35 1.56 2.07 -1.97 0.23 116.25 120.08 1bu7 h VAL 26 Ca 0.28 -0.43 -0.08 0.00 0.82 0.00 0.00 66.70 67.29 1bu7 h VAL 26 Cb 0.02 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 1bu7 h VAL 26 CO -0.05 0.19 -0.11 1.56 0.02 0.00 0.00 177.57 179.18 1bu7 h GLN 27 N 0.71 0.60 -0.39 1.57 4.20 -1.88 -0.66 115.11 119.25 1bu7 h GLN 27 Ca 0.19 -0.18 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1bu7 h GLN 27 Cb 0.03 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1bu7 h GLN 27 CO -0.03 0.70 0.13 0.00 -0.67 0.00 0.00 178.83 178.96 1bu7 h ALA 28 N 1.33 0.52 -0.20 3.87 0.00 -1.09 -2.89 119.26 120.81 1bu7 h ALA 28 Ca 0.10 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1bu7 h ALA 28 Cb 0.52 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1bu7 h ALA 28 CO 0.03 0.16 -0.21 -0.07 0.00 0.00 0.00 179.25 179.16 1bu7 h LEU 29 N 0.49 0.34 -1.10 0.00 3.38 -0.06 -1.80 115.31 116.56 1bu7 h LEU 29 Ca 0.13 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1bu7 h LEU 29 Cb 0.25 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1bu7 h LEU 29 CO -0.00 0.57 0.12 0.24 0.09 0.00 0.00 178.44 179.45 1bu7 h MET 30 N 0.32 0.75 -0.12 1.13 2.86 -1.04 0.48 114.93 119.31 1bu7 h MET 30 Ca 0.05 -0.15 -0.14 0.00 -2.06 0.00 0.00 59.70 57.41 1bu7 h MET 30 Cb 0.55 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 1bu7 h MET 30 CO 0.04 0.68 -0.52 0.87 1.06 0.00 0.00 176.91 179.04 1bu7 h LYS 31 N 0.73 0.33 -0.37 1.72 1.57 -1.14 -0.27 116.57 119.14 1bu7 h LYS 31 Ca 0.16 -0.20 -0.13 0.00 -1.87 0.00 0.00 60.65 58.61 1bu7 h LYS 31 Cb 0.28 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1bu7 h LYS 31 CO -0.00 0.77 -0.29 0.82 -0.57 0.00 0.00 179.45 180.18 1bu7 h ILE 32 N 0.26 1.28 -0.43 1.86 2.04 -0.94 -2.45 117.51 119.14 1bu7 h ILE 32 Ca 0.01 -1.46 -0.00 0.00 1.00 0.00 0.00 64.86 64.41 1bu7 h ILE 32 Cb 1.00 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 1bu7 h ILE 32 CO 0.09 0.48 0.26 0.00 0.00 0.00 0.00 178.15 178.98 1bu7 h ALA 33 N 0.77 1.64 -0.42 1.87 0.00 -0.61 0.31 119.26 122.82 1bu7 h ALA 33 Ca 0.07 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1bu7 h ALA 33 Cb 0.87 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1bu7 h ALA 33 CO 0.08 0.32 0.08 -0.44 0.00 0.00 0.00 179.25 179.29 1bu7 h ASP 34 N 0.60 0.58 0.14 0.00 3.32 -0.59 0.16 116.42 120.63 1bu7 h ASP 34 Ca 0.16 -0.09 -0.20 0.00 0.02 0.00 0.00 57.03 56.92 1bu7 h ASP 34 Cb -0.02 -0.15 0.02 0.00 0.22 0.00 0.00 39.33 39.40 1bu7 h ASP 34 CO -0.03 0.59 -0.89 -0.08 -1.72 0.00 0.00 179.24 177.11 1bu7 h GLU 35 N 0.61 0.30 0.00 3.56 4.81 -1.07 -3.40 114.58 119.39 1bu7 h GLU 35 Ca 0.14 -0.51 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 1bu7 h GLU 35 Cb 0.26 0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1bu7 h GLU 35 CO -0.00 1.24 -1.40 1.28 -0.73 0.00 0.00 179.01 179.40 1bu7 n LEU 36 N -4.10 0.45 0.00 1.64 4.77 0.10 -5.09 117.00 114.78 1bu7 n LEU 36 Ca -0.15 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1bu7 n LEU 36 Cb 0.84 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.93 1bu7 n LEU 36 CO 0.48 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1bu7 n GLY 37 N 1.42 -1.16 0.25 -0.72 0.00 0.57 -4.69 105.19 100.85 1bu7 n GLY 37 Ca -0.00 -1.99 0.17 0.00 0.00 0.00 0.00 46.02 44.19 1bu7 n GLY 37 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1bu7 h GLU 38 N 0.00 0.00 -2.58 1.61 4.11 -1.93 -3.43 114.58 112.36 1bu7 h GLU 38 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.33 1bu7 h GLU 38 Cb 0.00 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.01 1bu7 h GLU 38 CO 0.00 0.00 -0.17 -1.50 0.07 0.00 0.00 179.01 177.41 1bu7 s ILE 39 N -3.69 -0.00 -0.10 -1.06 2.07 -1.26 -0.40 121.20 116.76 1bu7 s ILE 39 Ca 0.00 0.01 -0.16 0.00 -1.41 0.00 0.00 60.65 59.09 1bu7 s ILE 39 Cb 0.10 -0.67 0.04 0.00 0.13 0.00 0.00 42.46 42.06 1bu7 s ILE 39 CO 0.44 0.00 0.40 0.72 -1.91 0.00 0.00 174.94 174.60 1bu7 s PHE 40 N 0.43 -0.38 0.31 3.50 -0.71 -0.89 -4.34 117.98 115.90 1bu7 s PHE 40 Ca -0.01 0.84 -0.27 0.00 -1.04 0.00 0.00 56.93 56.45 1bu7 s PHE 40 Cb -0.04 0.16 -0.10 0.00 -1.21 0.00 0.00 43.02 41.83 1bu7 s PHE 40 CO -0.02 -0.31 0.97 0.21 -1.34 0.00 0.00 175.22 174.73 1bu7 s LYS 41 N -0.40 4.61 -0.07 1.99 2.20 0.42 -0.93 119.74 127.55 1bu7 s LYS 41 Ca -0.05 1.42 0.01 0.00 -0.36 0.00 0.00 55.97 56.98 1bu7 s LYS 41 Cb -0.03 -2.91 0.02 0.00 -1.51 0.00 0.00 37.83 33.40 1bu7 s LYS 41 CO 0.03 0.29 -0.07 0.12 -0.36 0.00 0.00 175.35 175.35 1bu7 s PHE 42 N -1.49 1.16 0.05 4.03 2.19 0.72 -4.21 117.98 120.43 1bu7 s PHE 42 Ca 0.48 -0.45 0.09 0.00 0.33 0.00 0.00 56.93 57.38 1bu7 s PHE 42 Cb -0.22 -0.97 -0.03 0.00 -1.31 0.00 0.00 43.02 40.50 1bu7 s PHE 42 CO 0.27 -0.33 -0.25 -1.21 1.83 0.00 0.00 175.22 175.53 1bu7 s GLU 43 N 1.21 1.69 0.19 10.12 2.02 -1.26 -1.23 118.70 131.43 1bu7 s GLU 43 Ca -0.05 -1.11 0.03 0.00 0.02 0.00 0.00 54.97 53.86 1bu7 s GLU 43 Cb -0.14 -1.89 -0.05 0.00 0.10 0.00 0.00 34.13 32.16 1bu7 s GLU 43 CO -0.02 0.48 -0.03 0.00 0.02 0.00 0.00 175.26 175.71 1bu7 s ALA 44 N -0.83 1.56 -0.18 5.21 0.00 -0.72 -0.87 121.76 125.93 1bu7 s ALA 44 Ca 0.11 -1.63 -0.36 0.00 0.00 0.00 0.00 51.96 50.08 1bu7 s ALA 44 Cb -0.10 0.37 -0.13 0.00 0.00 0.00 0.00 23.12 23.26 1bu7 s ALA 44 CO 0.02 -0.22 1.85 -2.30 0.00 0.00 0.00 175.76 175.11 1bu7 n PRO 45 N -0.30 1.74 -2.04 0.00 -0.02 -1.26 -1.21 135.00 131.91 1bu7 n PRO 45 Ca -0.07 0.63 -0.09 0.00 -2.02 0.00 0.00 63.50 61.95 1bu7 n PRO 45 Cb 0.63 -2.44 -0.01 0.00 -0.02 0.00 0.00 33.50 31.66 1bu7 n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bu7 n GLY 46 N 4.45 0.15 3.56 -1.23 0.00 -1.26 -5.02 105.19 105.84 1bu7 n GLY 46 Ca 0.25 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 1bu7 n GLY 46 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1bu7 s ARG 47 N -4.21 0.72 -0.03 1.61 1.04 -0.35 -5.16 118.95 112.58 1bu7 s ARG 47 Ca 0.00 0.14 -0.02 0.00 -1.04 0.00 0.00 55.73 54.82 1bu7 s ARG 47 Cb 0.00 0.34 0.01 0.00 -2.04 0.00 0.00 34.95 33.27 1bu7 s ARG 47 CO 0.00 -0.23 0.06 0.08 -0.04 0.00 0.00 175.30 175.17 1bu7 s VAL 48 N -1.26 -0.02 0.26 4.99 1.01 -1.26 -1.76 120.40 122.36 1bu7 s VAL 48 Ca -0.04 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 1bu7 s VAL 48 Cb -0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 36.38 36.26 1bu7 s VAL 48 CO 0.03 0.03 0.41 0.28 0.00 0.00 0.00 175.10 175.84 1bu7 s THR 49 N 0.39 0.00 -0.17 3.92 -1.32 -0.37 -4.64 115.64 113.45 1bu7 s THR 49 Ca -0.03 -1.57 -0.01 0.00 -1.21 0.00 0.00 61.69 58.87 1bu7 s THR 49 Cb -0.04 -2.37 0.04 0.00 -1.51 0.00 0.00 72.50 68.62 1bu7 s THR 49 CO -0.01 0.00 -0.04 -0.13 -2.21 0.00 0.00 174.62 172.22 1bu7 s ARG 50 N -3.82 1.37 -0.18 7.08 0.52 -1.12 -0.20 118.95 122.60 1bu7 s ARG 50 Ca 0.28 -0.54 -0.25 0.00 -0.52 0.00 0.00 55.73 54.69 1bu7 s ARG 50 Cb 0.01 -2.05 -0.01 0.00 0.52 0.00 0.00 34.95 33.42 1bu7 s ARG 50 CO 0.12 -0.46 0.82 0.71 0.02 0.00 0.00 175.30 176.51 1bu7 s TYR 51 N 1.64 3.40 -0.14 -0.53 2.02 -0.10 -0.24 117.35 123.39 1bu7 s TYR 51 Ca 0.00 1.22 -0.06 0.00 -0.37 0.00 0.00 57.07 57.86 1bu7 s TYR 51 Cb -0.16 -3.01 -0.04 0.00 -0.40 0.00 0.00 41.96 38.35 1bu7 s TYR 51 CO -0.08 -0.27 0.08 -0.51 -1.57 0.00 0.00 175.55 173.21 1bu7 s LEU 52 N 2.27 3.99 0.00 -1.29 1.02 -0.13 -2.09 118.68 122.45 1bu7 s LEU 52 Ca 0.37 0.24 0.00 0.00 0.02 0.00 0.00 54.13 54.76 1bu7 s LEU 52 Cb -0.16 -1.98 0.00 0.00 0.02 0.00 0.00 46.19 44.07 1bu7 s LEU 52 CO 0.11 0.29 0.06 -1.20 0.02 0.00 0.00 176.35 175.64 1bu7 n SER 53 N 2.74 0.12 -4.86 2.29 7.64 0.46 -1.82 113.62 120.18 1bu7 n SER 53 Ca -0.18 -0.44 -0.30 0.00 1.01 0.00 0.00 58.87 58.96 1bu7 n SER 53 Cb 0.53 0.27 -0.05 0.00 -1.01 0.00 0.00 64.21 63.96 1bu7 n SER 53 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1bu7 s SER 54 N -0.27 6.00 0.38 6.43 1.04 -1.25 -3.07 113.70 122.97 1bu7 s SER 54 Ca 0.00 0.13 0.05 0.00 0.48 0.00 0.00 55.95 56.60 1bu7 s SER 54 Cb 0.00 -1.75 0.74 0.00 0.10 0.00 0.00 66.02 65.12 1bu7 s SER 54 CO 0.00 0.14 2.03 -0.61 0.98 0.00 0.00 173.24 175.78 1bu7 h GLN 55 N 2.95 0.70 -0.21 4.02 -0.00 -1.88 0.76 115.11 121.45 1bu7 h GLN 55 Ca -0.46 -0.04 -0.15 0.00 -0.00 0.00 0.00 58.65 58.00 1bu7 h GLN 55 Cb 1.17 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 28.48 1bu7 h GLN 55 CO 0.70 0.46 -0.47 0.07 0.00 0.00 0.00 178.83 179.59 1bu7 h ARG 56 N 0.72 0.56 0.14 1.69 0.11 -1.94 -0.77 114.38 114.90 1bu7 h ARG 56 Ca 0.20 -0.32 -0.29 0.00 0.10 0.00 0.00 59.98 59.68 1bu7 h ARG 56 Cb -0.06 0.02 0.01 0.00 1.11 0.00 0.00 29.97 31.05 1bu7 h ARG 56 CO -0.05 0.91 -1.31 -0.07 0.10 0.00 0.00 179.97 179.56 1bu7 h LEU 57 N 0.45 0.48 -0.95 0.08 3.38 -1.91 -3.29 115.31 113.54 1bu7 h LEU 57 Ca 0.02 -0.52 -0.11 0.00 0.09 0.00 0.00 57.88 57.36 1bu7 h LEU 57 Cb 1.00 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1bu7 h LEU 57 CO 0.09 1.41 -0.52 0.40 0.09 0.00 0.00 178.44 179.91 1bu7 h ILE 58 N 0.08 1.36 -0.98 1.22 2.04 -0.64 -1.78 117.51 118.81 1bu7 h ILE 58 Ca -0.16 -1.79 0.06 0.00 1.00 0.00 0.00 64.86 63.97 1bu7 h ILE 58 Cb 2.00 1.97 -0.06 0.00 -0.74 0.00 0.00 36.82 39.99 1bu7 h ILE 58 CO 0.21 0.51 0.63 0.50 0.00 0.00 0.00 178.15 180.00 1bu7 h LYS 59 N 0.00 1.11 -0.28 2.37 3.64 -1.22 -1.36 116.57 120.83 1bu7 h LYS 59 Ca -0.01 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 1bu7 h LYS 59 Cb 0.93 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1bu7 h LYS 59 CO 0.07 0.73 0.01 0.93 -2.27 0.00 0.00 179.45 178.92 1bu7 h GLU 60 N 1.14 0.48 -0.10 1.90 5.08 -1.45 -2.73 114.58 118.90 1bu7 h GLU 60 Ca 0.42 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.66 1bu7 h GLU 60 Cb 0.17 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1bu7 h GLU 60 CO -0.16 0.63 0.09 0.00 -1.00 0.00 0.00 179.01 178.57 1bu7 h ALA 61 N 0.84 1.87 -0.22 3.43 0.00 -0.84 -1.72 119.26 122.61 1bu7 h ALA 61 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1bu7 h ALA 61 Cb 0.40 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1bu7 h ALA 61 CO 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.12 1bu7 s ASP 63 N -1.32 6.11 0.37 0.00 -1.08 -0.65 -4.89 116.67 115.21 1bu7 s ASP 63 Ca 0.27 0.16 0.27 0.00 -0.52 0.00 0.00 52.55 52.73 1bu7 s ASP 63 Cb 0.14 -2.55 1.21 0.00 -1.46 0.00 0.00 42.92 40.27 1bu7 s ASP 63 CO 0.21 -1.75 1.82 -0.33 0.52 0.00 0.00 175.17 175.64 1bu7 h GLU 64 N 11.01 0.00 -0.35 4.34 5.08 -1.86 0.53 114.58 133.34 1bu7 h GLU 64 Ca -0.27 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 1bu7 h GLU 64 Cb 1.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 1bu7 h GLU 64 CO 1.20 0.00 0.11 0.77 -1.00 0.00 0.00 179.01 180.09 1bu7 h SER 65 N 0.00 0.46 0.00 1.42 0.02 -1.97 -3.33 113.55 110.14 1bu7 h SER 65 Ca 0.00 -0.05 -0.12 0.00 -0.84 0.00 0.00 61.79 60.78 1bu7 h SER 65 Cb 0.32 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 1bu7 h SER 65 CO 0.00 0.44 -1.89 0.54 -1.14 0.00 0.00 176.83 174.78 1bu7 n ARG 66 N -4.37 0.91 -3.88 3.45 1.74 0.07 -4.86 116.66 109.71 1bu7 n ARG 66 Ca 0.02 -0.09 -0.11 0.00 -0.77 0.00 0.00 57.85 56.89 1bu7 n ARG 66 Cb 0.16 -1.40 -0.12 0.00 -1.02 0.00 0.00 32.46 30.08 1bu7 n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1bu7 s PHE 67 N -2.83 0.01 0.25 -1.55 0.08 -0.52 -1.36 117.98 112.05 1bu7 s PHE 67 Ca -0.07 -0.00 0.05 0.00 0.12 0.00 0.00 56.93 57.02 1bu7 s PHE 67 Cb 0.08 -0.03 -0.05 0.00 -0.57 0.00 0.00 43.02 42.45 1bu7 s PHE 67 CO 0.67 -0.14 -0.02 0.34 -0.10 0.00 0.00 175.22 175.97 1bu7 s ASP 68 N -0.64 2.17 0.25 1.36 2.15 -0.91 -4.21 116.67 116.84 1bu7 s ASP 68 Ca -0.07 -1.22 -0.30 0.00 0.43 0.00 0.00 52.55 51.39 1bu7 s ASP 68 Cb -0.04 -0.05 -0.11 0.00 -0.30 0.00 0.00 42.92 42.42 1bu7 s ASP 68 CO 0.00 -0.46 1.52 -0.75 -0.17 0.00 0.00 175.17 175.31 1bu7 s LYS 69 N -3.82 4.21 0.01 4.34 2.20 -1.26 -1.08 119.74 124.32 1bu7 s LYS 69 Ca 0.29 2.42 -0.00 0.00 -0.36 0.00 0.00 55.97 58.31 1bu7 s LYS 69 Cb 0.05 -3.08 -0.04 0.00 -1.51 0.00 0.00 37.83 33.25 1bu7 s LYS 69 CO 0.10 -0.53 0.10 1.21 -0.36 0.00 0.00 175.35 175.87 1bu7 s ASN 70 N 0.53 5.79 -0.44 1.43 2.47 -0.31 -4.73 114.94 119.68 1bu7 s ASN 70 Ca 0.62 0.17 -0.21 0.00 0.42 0.00 0.00 52.86 53.86 1bu7 s ASN 70 Cb -0.44 -1.68 0.02 0.00 -1.45 0.00 0.00 41.25 37.70 1bu7 s ASN 70 CO 0.43 0.26 0.65 -0.76 -3.72 0.00 0.00 177.10 173.96 1bu7 s LEU 71 N -1.86 4.48 1.14 3.21 1.43 -1.26 -4.50 118.68 121.32 1bu7 s LEU 71 Ca 0.25 -0.31 -0.13 0.00 -1.03 0.00 0.00 54.13 52.91 1bu7 s LEU 71 Cb -0.12 -2.74 0.27 0.00 0.03 0.00 0.00 46.19 43.63 1bu7 s LEU 71 CO 0.16 -0.78 1.04 -0.94 0.23 0.00 0.00 176.35 176.06 1bu7 s SER 72 N 2.00 1.28 0.33 2.29 1.04 -1.26 -4.72 113.70 114.66 1bu7 s SER 72 Ca 0.23 1.40 0.05 0.00 0.48 0.00 0.00 55.95 58.12 1bu7 s SER 72 Cb -0.14 -2.17 0.69 0.00 0.10 0.00 0.00 66.02 64.50 1bu7 s SER 72 CO 0.19 -4.00 1.88 -0.61 0.98 0.00 0.00 173.24 171.68 1bu7 h GLN 73 N -2.48 0.81 0.24 4.02 5.75 -1.99 -1.36 115.11 120.10 1bu7 h GLN 73 Ca -0.61 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 57.84 1bu7 h GLN 73 Cb 1.34 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 29.70 1bu7 h GLN 73 CO 0.52 0.54 -0.15 0.00 -2.65 0.00 0.00 178.83 177.09 1bu7 h ALA 74 N 1.57 -0.36 -0.29 3.38 0.00 -1.93 -1.33 119.26 120.30 1bu7 h ALA 74 Ca 0.43 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.22 1bu7 h ALA 74 Cb 0.51 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1bu7 h ALA 74 CO -0.19 -0.71 -0.05 -0.07 0.00 0.00 0.00 179.25 178.22 1bu7 h LEU 75 N -0.38 0.43 -1.19 0.00 3.38 -1.73 -1.01 115.31 114.81 1bu7 h LEU 75 Ca -0.02 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 1bu7 h LEU 75 Cb 0.32 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1bu7 h LEU 75 CO 0.02 0.54 -0.06 0.11 0.09 0.00 0.00 178.44 179.14 1bu7 h LYS 76 N 0.44 0.48 -0.11 1.13 1.57 -0.95 0.17 116.57 119.30 1bu7 h LYS 76 Ca 0.09 -0.12 -0.22 0.00 -1.87 0.00 0.00 60.65 58.54 1bu7 h LYS 76 Cb 0.37 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.63 1bu7 h LYS 76 CO 0.02 0.56 -0.78 0.74 -0.57 0.00 0.00 179.45 179.42 1bu7 h PHE 77 N 0.45 1.00 -0.16 -1.35 0.04 -0.49 -3.13 116.94 113.30 1bu7 h PHE 77 Ca 0.09 -0.46 -0.03 0.00 2.80 0.00 0.00 57.97 60.37 1bu7 h PHE 77 Cb 0.40 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1bu7 h PHE 77 CO 0.01 1.29 -0.03 0.28 -0.60 0.00 0.00 178.31 179.26 1bu7 h VAL 78 N 0.42 1.13 0.00 -0.55 2.07 -0.90 -1.70 116.25 116.72 1bu7 h VAL 78 Ca -0.07 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 1bu7 h VAL 78 Cb 1.42 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 32.23 1bu7 h VAL 78 CO 0.16 0.17 -0.00 -0.09 0.02 0.00 0.00 177.57 177.82 1bu7 h ARG 79 N 0.23 0.00 0.00 1.57 2.43 -0.60 -0.00 114.38 118.01 1bu7 h ARG 79 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1bu7 h ARG 79 Cb 0.22 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1bu7 h ARG 79 CO 0.01 0.00 0.00 -0.44 -1.51 0.00 0.00 179.97 178.03 1bu7 h ASP 80 N 0.00 0.00 0.00 -3.80 3.32 -1.38 -0.62 116.42 113.94 1bu7 h ASP 80 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1bu7 h ASP 80 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1bu7 h ASP 80 CO 0.00 0.00 -0.70 2.22 -1.72 0.00 0.00 179.24 179.04 1bu7 n PHE 81 N -2.41 0.00 1.25 4.55 -1.74 -0.52 -4.72 117.46 113.88 1bu7 n PHE 81 Ca -0.00 0.00 0.13 0.00 -0.56 0.00 0.00 57.45 57.01 1bu7 n PHE 81 Cb 0.12 0.00 0.34 0.00 1.52 0.00 0.00 39.48 41.46 1bu7 n PHE 81 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1bu7 n ALA 82 N -1.08 3.02 -0.68 1.98 0.00 -0.13 -4.96 120.51 118.66 1bu7 n ALA 82 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1bu7 n ALA 82 Cb 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1bu7 n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bu7 n GLY 83 N 1.32 2.28 2.46 0.00 0.00 -0.24 -2.18 105.19 108.83 1bu7 n GLY 83 Ca 0.13 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 1bu7 n GLY 83 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bu7 n ASP 84 N -0.33 7.40 -3.91 1.61 5.75 -1.26 -4.59 116.55 121.22 1bu7 n ASP 84 Ca 0.00 -3.80 -0.30 0.00 -0.01 0.00 0.00 54.79 50.68 1bu7 n ASP 84 Cb 0.00 -0.94 0.25 0.00 -1.03 0.00 0.00 41.12 39.39 1bu7 n ASP 84 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1bu7 s GLY 85 N -1.81 1.52 0.28 6.12 0.00 -0.93 -4.68 107.32 107.83 1bu7 s GLY 85 Ca 0.60 -0.73 -0.02 0.00 0.00 0.00 0.00 44.72 44.57 1bu7 s GLY 85 CO -0.11 0.14 1.93 1.41 0.00 0.00 0.00 173.10 176.47 1bu7 h LEU 86 N -2.76 1.00 -0.43 0.66 3.38 -1.90 -2.94 115.31 112.32 1bu7 h LEU 86 Ca -0.48 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.34 1bu7 h LEU 86 Cb 1.32 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1bu7 h LEU 86 CO 0.38 0.69 -0.66 0.15 0.09 0.00 0.00 178.44 179.09 1bu7 h PHE 87 N 1.16 0.00 -0.16 1.13 3.57 -1.94 -3.29 116.94 117.42 1bu7 h PHE 87 Ca 0.36 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.83 1bu7 h PHE 87 Cb -0.01 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 1bu7 h PHE 87 CO -0.00 0.66 -0.05 0.25 -2.23 0.00 0.00 178.31 176.94 1bu7 n THR 88 N -3.50 2.17 -4.07 4.41 -2.24 -1.14 -5.00 114.28 104.91 1bu7 n THR 88 Ca -0.00 -2.25 -0.32 0.00 -2.27 0.00 0.00 64.05 59.21 1bu7 n THR 88 Cb 0.71 -0.26 -0.07 0.00 -2.10 0.00 0.00 70.33 68.62 1bu7 n THR 88 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1bu7 s SER 89 N -2.47 5.72 0.54 3.42 0.01 -1.12 -4.80 113.70 115.00 1bu7 s SER 89 Ca 0.38 0.13 -0.18 0.00 1.31 0.00 0.00 55.95 57.59 1bu7 s SER 89 Cb 0.33 -1.64 -0.06 0.00 0.21 0.00 0.00 66.02 64.86 1bu7 s SER 89 CO 0.04 0.25 1.06 0.26 0.41 0.00 0.00 173.24 175.26 1bu7 s TRP 90 N -1.26 2.92 0.52 2.43 0.52 -1.26 -4.94 118.94 117.87 1bu7 s TRP 90 Ca 0.25 1.55 0.20 0.00 0.02 0.00 0.00 56.10 58.11 1bu7 s TRP 90 Cb -0.12 -3.09 1.36 0.00 -1.15 0.00 0.00 33.47 30.47 1bu7 s TRP 90 CO 0.17 -1.09 2.14 1.15 0.02 0.00 0.00 176.95 179.33 1bu7 h THR 91 N 1.02 0.89 0.00 2.01 2.02 -1.98 -1.45 112.91 115.43 1bu7 h THR 91 Ca -0.48 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 66.54 1bu7 h THR 91 Cb 1.23 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.72 1bu7 h THR 91 CO 0.58 0.04 -0.06 0.00 0.37 0.00 0.00 175.52 176.45 1bu7 n HIS 92 N -4.28 0.40 -2.41 3.16 1.44 -1.26 -4.60 115.22 107.67 1bu7 n HIS 92 Ca -0.03 0.12 -0.40 0.00 -2.01 0.00 0.00 57.72 55.40 1bu7 n HIS 92 Cb 0.13 -0.67 -0.04 0.00 0.12 0.00 0.00 29.99 29.52 1bu7 n HIS 92 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1bu7 s GLU 93 N -3.05 4.59 0.28 -1.40 2.02 -0.55 -4.92 118.70 115.67 1bu7 s GLU 93 Ca 0.12 1.87 -0.01 0.00 0.02 0.00 0.00 54.97 56.97 1bu7 s GLU 93 Cb 0.16 -3.18 0.45 0.00 0.10 0.00 0.00 34.13 31.66 1bu7 s GLU 93 CO 0.57 0.13 1.90 -0.22 0.02 0.00 0.00 175.26 177.67 1bu7 h LYS 94 N 3.85 1.10 0.00 1.61 3.64 -1.89 -0.06 116.57 124.82 1bu7 h LYS 94 Ca -0.47 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 58.83 1bu7 h LYS 94 Cb 1.21 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1bu7 h LYS 94 CO 0.67 0.73 -0.09 -0.91 -2.27 0.00 0.00 179.45 177.58 1bu7 h ASN 95 N 1.13 0.00 0.59 4.20 -0.26 -1.91 -2.27 115.58 117.06 1bu7 h ASN 95 Ca 0.40 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 56.11 1bu7 h ASN 95 Cb 0.13 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.40 1bu7 h ASN 95 CO -0.15 0.09 -0.28 -0.25 -1.06 0.00 0.00 177.43 175.78 1bu7 h TRP 96 N 0.00 -0.73 -0.91 1.19 7.01 -1.27 -2.34 115.95 118.91 1bu7 h TRP 96 Ca -0.00 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.01 1bu7 h TRP 96 Cb 0.53 0.24 -0.05 0.00 -2.10 0.00 0.00 29.16 27.78 1bu7 h TRP 96 CO 0.00 -0.40 0.60 -0.22 -2.79 0.00 0.00 178.44 175.63 1bu7 h LYS 97 N -1.07 1.12 0.16 2.65 3.11 -1.42 0.67 116.57 121.79 1bu7 h LYS 97 Ca -0.08 -0.07 -0.01 0.00 -2.81 0.00 0.00 60.65 57.68 1bu7 h LYS 97 Cb 0.66 -0.25 0.00 0.00 -1.00 0.00 0.00 32.23 31.64 1bu7 h LYS 97 CO 0.13 0.74 -0.07 -0.22 -2.81 0.00 0.00 179.45 177.22 1bu7 h LYS 98 N 1.16 -0.20 -0.52 1.90 3.64 -1.48 -0.52 116.57 120.55 1bu7 h LYS 98 Ca 0.36 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.69 1bu7 h LYS 98 Cb -0.01 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1bu7 h LYS 98 CO -0.10 -0.03 0.09 0.00 -2.27 0.00 0.00 179.45 177.14 1bu7 h ALA 99 N 0.49 0.69 -0.09 5.00 0.00 -1.19 -0.23 119.26 123.92 1bu7 h ALA 99 Ca -0.02 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.69 1bu7 h ALA 99 Cb 0.27 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1bu7 h ALA 99 CO 0.04 0.42 -0.13 1.25 0.00 0.00 0.00 179.25 180.82 1bu7 h HIS 100 N 0.74 -0.32 -0.26 0.00 -0.00 -0.80 0.24 115.15 114.74 1bu7 h HIS 100 Ca 0.16 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.48 1bu7 h HIS 100 Cb 0.39 0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 27.94 1bu7 h HIS 100 CO 0.03 -0.19 -0.11 -0.91 -0.00 0.00 0.00 177.93 176.75 1bu7 h ASN 101 N -0.17 0.40 0.02 3.26 2.35 -0.75 -1.76 115.58 118.93 1bu7 h ASN 101 Ca 0.08 -0.09 -0.23 0.00 -0.55 0.00 0.00 56.30 55.50 1bu7 h ASN 101 Cb 0.28 -0.11 0.01 0.00 0.05 0.00 0.00 38.32 38.55 1bu7 h ASN 101 CO -0.19 0.55 -0.87 0.40 -1.65 0.00 0.00 177.43 175.67 1bu7 h ILE 102 N 0.40 1.31 0.00 2.81 2.04 -0.59 -3.35 117.51 120.12 1bu7 h ILE 102 Ca 0.08 -2.14 -0.12 0.00 1.00 0.00 0.00 64.86 63.68 1bu7 h ILE 102 Cb 0.44 2.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.66 1bu7 h ILE 102 CO 0.02 0.66 -1.35 0.18 0.00 0.00 0.00 178.15 177.67 1bu7 n LEU 103 N -3.87 0.82 -0.25 1.44 4.77 0.79 -4.41 117.00 116.29 1bu7 n LEU 103 Ca -0.08 0.35 0.05 0.00 -0.03 0.00 0.00 56.01 56.30 1bu7 n LEU 103 Cb 0.79 0.05 0.16 0.00 -2.33 0.00 0.00 43.42 42.08 1bu7 n LEU 103 CO 0.53 0.06 0.85 -0.07 -1.33 0.00 0.00 177.39 177.43 1bu7 h LEU 104 N 0.00 -0.27 -2.07 2.23 3.38 -1.46 0.31 115.31 117.43 1bu7 h LEU 104 Ca -0.13 0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1bu7 h LEU 104 Cb 1.43 0.31 -0.00 0.00 0.09 0.00 0.00 40.66 42.49 1bu7 h LEU 104 CO 0.03 -0.15 -0.06 -0.65 0.09 0.00 0.00 178.44 177.70 1bu7 h PRO 105 N 0.13 0.00 -0.00 1.13 0.11 -1.81 -1.70 132.00 129.86 1bu7 h PRO 105 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 1bu7 h PRO 105 Cb 0.71 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1bu7 h PRO 105 CO -0.62 0.06 -0.11 0.43 -0.21 0.00 0.00 178.00 177.55 1bu7 n SER 106 N -3.37 0.25 -0.15 -2.05 7.64 0.11 -3.26 113.62 112.79 1bu7 n SER 106 Ca -0.02 -0.16 0.03 0.00 1.01 0.00 0.00 58.87 59.74 1bu7 n SER 106 Cb 0.21 -0.18 0.06 0.00 -1.01 0.00 0.00 64.21 63.29 1bu7 n SER 106 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1bu7 n PHE 107 N -1.24 0.11 -1.40 1.43 3.72 -0.65 -4.87 117.46 114.56 1bu7 n PHE 107 Ca 0.11 -0.60 -0.29 0.00 -0.05 0.00 0.00 57.45 56.62 1bu7 n PHE 107 Cb 0.29 -0.08 0.15 0.00 -0.94 0.00 0.00 39.48 38.91 1bu7 n PHE 107 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1bu7 s SER 108 N -1.36 3.26 0.22 4.37 1.04 -1.16 -4.55 113.70 115.52 1bu7 s SER 108 Ca 0.11 1.08 -0.07 0.00 0.48 0.00 0.00 55.95 57.55 1bu7 s SER 108 Cb 0.08 -1.71 0.17 0.00 0.10 0.00 0.00 66.02 64.66 1bu7 s SER 108 CO 0.03 -2.72 1.77 -0.61 0.98 0.00 0.00 173.24 172.69 1bu7 h GLN 109 N -1.61 1.16 -0.47 4.02 5.75 -1.94 -2.10 115.11 119.92 1bu7 h GLN 109 Ca -0.52 -0.23 -0.02 0.00 -0.15 0.00 0.00 58.65 57.74 1bu7 h GLN 109 Cb 1.33 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 29.67 1bu7 h GLN 109 CO 0.60 0.96 0.22 0.37 -2.65 0.00 0.00 178.83 178.34 1bu7 h GLN 110 N 1.12 0.65 0.00 1.69 5.75 -1.93 -2.05 115.11 120.34 1bu7 h GLN 110 Ca 0.25 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.66 1bu7 h GLN 110 Cb 0.26 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.68 1bu7 h GLN 110 CO -0.01 0.51 -0.08 0.00 -2.65 0.00 0.00 178.83 176.59 1bu7 h ALA 111 N 1.59 1.25 0.00 3.38 0.00 -1.64 -2.26 119.26 121.58 1bu7 h ALA 111 Ca 0.17 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1bu7 h ALA 111 Cb 0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1bu7 h ALA 111 CO -0.02 0.10 -0.08 0.52 0.00 0.00 0.00 179.25 179.77 1bu7 h MET 112 N 0.00 0.00 -0.53 0.00 2.86 -1.20 -1.71 114.93 114.34 1bu7 h MET 112 Ca -0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1bu7 h MET 112 Cb 0.27 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1bu7 h MET 112 CO 0.01 0.08 0.32 0.87 1.06 0.00 0.00 176.91 179.25 1bu7 h LYS 113 N 0.00 0.72 0.00 1.72 1.57 -1.54 -0.74 116.57 118.30 1bu7 h LYS 113 Ca -0.00 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 1bu7 h LYS 113 Cb 0.37 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1bu7 h LYS 113 CO 0.01 0.50 -0.53 0.78 -0.57 0.00 0.00 179.45 179.65 1bu7 h GLY 114 N 0.77 0.00 1.04 3.86 0.00 -1.48 -3.27 103.07 103.99 1bu7 h GLY 114 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1bu7 h GLY 114 CO -0.04 0.00 -0.73 -0.97 0.00 0.00 0.00 176.54 174.80 1bu7 h TYR 115 N 0.00 0.00 -0.28 5.60 0.05 -1.34 -3.42 116.97 117.58 1bu7 h TYR 115 Ca -0.02 0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.83 1bu7 h TYR 115 Cb 1.34 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 39.01 1bu7 h TYR 115 CO 0.00 0.00 -0.33 1.25 -1.05 0.00 0.00 178.16 178.03 1bu7 h HIS 116 N 0.00 -0.91 -0.88 4.88 2.76 -1.21 -1.97 115.15 117.82 1bu7 h HIS 116 Ca 0.00 0.05 0.08 0.00 -2.20 0.00 0.00 60.37 58.30 1bu7 h HIS 116 Cb 0.76 0.44 -0.06 0.00 1.55 0.00 0.00 27.41 30.11 1bu7 h HIS 116 CO 0.00 -0.39 0.57 0.00 -1.30 0.00 0.00 177.93 176.81 1bu7 h ALA 117 N 0.60 1.57 0.00 5.26 0.00 -1.81 -0.84 119.26 124.04 1bu7 h ALA 117 Ca 0.14 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 1bu7 h ALA 117 Cb 0.54 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1bu7 h ALA 117 CO -0.46 0.28 -0.60 0.52 0.00 0.00 0.00 179.25 178.99 1bu7 h MET 118 N 0.95 0.00 -0.53 0.00 2.07 -1.68 -1.66 114.93 114.07 1bu7 h MET 118 Ca 0.39 0.00 -0.04 0.00 -2.07 0.00 0.00 59.70 57.98 1bu7 h MET 118 Cb 0.28 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 29.98 1bu7 h MET 118 CO -0.15 0.60 0.18 0.52 1.07 0.00 0.00 176.91 179.13 1bu7 h MET 119 N 0.00 0.82 -0.98 1.72 2.86 -0.64 -2.71 114.93 116.00 1bu7 h MET 119 Ca -0.01 -0.17 0.01 0.00 -2.06 0.00 0.00 59.70 57.48 1bu7 h MET 119 Cb 1.34 -0.12 -0.05 0.00 0.06 0.00 0.00 31.60 32.83 1bu7 h MET 119 CO 0.08 0.74 0.65 0.28 1.06 0.00 0.00 176.91 179.72 1bu7 h VAL 120 N 0.73 1.24 -0.37 -2.22 2.07 -0.94 -1.37 116.25 115.40 1bu7 h VAL 120 Ca 0.17 -0.45 0.08 0.00 0.82 0.00 0.00 66.70 67.32 1bu7 h VAL 120 Cb 0.26 -0.19 -0.08 0.00 -1.52 0.00 0.00 31.29 29.76 1bu7 h VAL 120 CO -0.01 0.24 -0.15 -0.78 0.02 0.00 0.00 177.57 176.89 1bu7 h ASP 121 N 1.32 -0.51 0.19 0.57 1.82 -0.99 0.12 116.42 118.94 1bu7 h ASP 121 Ca 0.36 0.13 -0.18 0.00 -0.39 0.00 0.00 57.03 56.95 1bu7 h ASP 121 Cb -0.14 0.30 -0.00 0.00 0.68 0.00 0.00 39.33 40.16 1bu7 h ASP 121 CO -0.08 -0.18 -0.69 0.40 -1.61 0.00 0.00 179.24 177.07 1bu7 h ILE 122 N -0.08 1.36 -0.80 2.25 1.08 -1.37 -2.86 117.51 117.10 1bu7 h ILE 122 Ca 0.18 -2.05 -0.04 0.00 -0.39 0.00 0.00 64.86 62.56 1bu7 h ILE 122 Cb 0.36 2.03 -0.04 0.00 -3.07 0.00 0.00 36.82 36.10 1bu7 h ILE 122 CO -0.42 0.62 0.33 0.00 -0.69 0.00 0.00 178.15 177.99 1bu7 h ALA 123 N 0.93 1.08 -0.78 1.87 0.00 -0.68 -1.75 119.26 119.93 1bu7 h ALA 123 Ca -0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1bu7 h ALA 123 Cb 1.26 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 1bu7 h ALA 123 CO 0.12 0.66 0.37 0.28 0.00 0.00 0.00 179.25 180.68 1bu7 h VAL 124 N 1.15 1.25 -0.85 0.00 2.07 -0.71 -1.18 116.25 117.99 1bu7 h VAL 124 Ca 0.27 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 67.13 1bu7 h VAL 124 Cb 0.19 0.27 -0.06 0.00 -1.52 0.00 0.00 31.29 30.18 1bu7 h VAL 124 CO -0.02 0.30 0.53 1.56 0.02 0.00 0.00 177.57 179.96 1bu7 h GLN 125 N 1.11 0.96 -0.13 1.57 4.20 -1.22 0.15 115.11 121.74 1bu7 h GLN 125 Ca 0.27 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.90 1bu7 h GLN 125 Cb 0.13 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 27.69 1bu7 h GLN 125 CO -0.03 0.63 -0.01 1.25 -0.67 0.00 0.00 178.83 180.01 1bu7 h LEU 126 N 0.99 0.23 -0.67 1.46 5.85 -0.67 -1.24 115.31 121.25 1bu7 h LEU 126 Ca 0.36 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.79 1bu7 h LEU 126 Cb 0.12 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1bu7 h LEU 126 CO -0.15 0.50 0.42 0.58 -0.34 0.00 0.00 178.44 179.44 1bu7 h VAL 127 N -0.04 1.08 -0.19 1.05 2.07 -0.99 -2.03 116.25 117.20 1bu7 h VAL 127 Ca 0.04 -0.28 -0.11 0.00 0.82 0.00 0.00 66.70 67.16 1bu7 h VAL 127 Cb 0.38 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1bu7 h VAL 127 CO 0.01 0.15 -0.38 1.56 0.02 0.00 0.00 177.57 178.93 1bu7 h GLN 128 N 0.81 0.41 -0.36 1.57 4.20 -0.57 0.12 115.11 121.29 1bu7 h GLN 128 Ca 0.27 -0.19 0.06 0.00 0.06 0.00 0.00 58.65 58.85 1bu7 h GLN 128 Cb 0.03 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.75 1bu7 h GLN 128 CO -0.11 0.73 0.05 -0.22 -0.67 0.00 0.00 178.83 178.61 1bu7 h LYS 129 N 0.35 0.16 -0.27 1.46 3.64 -0.65 -2.21 116.57 119.04 1bu7 h LYS 129 Ca 0.04 -0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 59.25 1bu7 h LYS 129 Cb 0.82 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1bu7 h LYS 129 CO 0.07 0.10 -0.47 -1.49 -2.27 0.00 0.00 179.45 175.39 1bu7 h TRP 130 N 0.16 0.89 -0.08 1.91 4.06 -1.00 -2.16 115.95 119.73 1bu7 h TRP 130 Ca 0.18 -0.29 0.02 0.00 2.06 0.00 0.00 58.89 60.86 1bu7 h TRP 130 Cb 0.22 -0.18 -0.00 0.00 -1.00 0.00 0.00 29.16 28.20 1bu7 h TRP 130 CO -0.21 1.06 0.08 0.93 -3.56 0.00 0.00 178.44 176.74 1bu7 h GLU 131 N 0.58 0.00 -0.25 0.49 4.39 -0.76 -2.65 114.58 116.37 1bu7 h GLU 131 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1bu7 h GLU 131 Cb 1.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1bu7 h GLU 131 CO 0.10 0.00 0.00 0.54 -1.16 0.00 0.00 179.01 178.49 1bu7 n ARG 132 N -3.96 2.25 -2.44 2.33 1.74 -0.82 -4.94 116.66 110.83 1bu7 n ARG 132 Ca -0.01 -1.88 -0.35 0.00 -0.77 0.00 0.00 57.85 54.85 1bu7 n ARG 132 Cb 0.18 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.12 1bu7 n ARG 132 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1bu7 s LEU 133 N -1.62 3.85 0.53 0.55 1.43 -1.00 -5.01 118.68 117.41 1bu7 s LEU 133 Ca 0.35 2.04 -0.15 0.00 -1.03 0.00 0.00 54.13 55.34 1bu7 s LEU 133 Cb 0.21 -4.52 -0.07 0.00 0.03 0.00 0.00 46.19 41.84 1bu7 s LEU 133 CO 0.30 -0.90 0.99 0.20 0.23 0.00 0.00 176.35 177.17 1bu7 s ASN 134 N -1.84 6.54 0.57 2.29 0.01 -1.26 -4.96 114.94 116.29 1bu7 s ASN 134 Ca 0.68 1.53 0.26 0.00 -0.71 0.00 0.00 52.86 54.62 1bu7 s ASN 134 Cb -0.20 -2.50 1.58 0.00 0.41 0.00 0.00 41.25 40.54 1bu7 s ASN 134 CO 0.24 -0.64 2.12 0.00 -1.51 0.00 0.00 177.10 177.30 1bu7 h ALA 135 N 0.67 1.89 -0.14 0.60 0.00 -1.98 -1.22 119.26 119.09 1bu7 h ALA 135 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1bu7 h ALA 135 Cb 1.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1bu7 h ALA 135 CO 0.62 -0.25 0.00 -0.40 0.00 0.00 0.00 179.25 179.21 1bu7 n ASP 136 N -4.01 1.32 -4.83 0.00 5.75 -1.26 -4.91 116.55 108.60 1bu7 n ASP 136 Ca 0.01 -1.68 -0.22 0.00 -0.01 0.00 0.00 54.79 52.90 1bu7 n ASP 136 Cb 0.29 -0.09 0.09 0.00 -1.03 0.00 0.00 41.12 40.38 1bu7 n ASP 136 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1bu7 s GLU 137 N -1.82 1.94 0.27 0.11 2.02 -0.46 -5.13 118.70 115.62 1bu7 s GLU 137 Ca 0.30 -1.38 -0.04 0.00 0.02 0.00 0.00 54.97 53.87 1bu7 s GLU 137 Cb 0.16 -2.48 -0.02 0.00 0.10 0.00 0.00 34.13 31.89 1bu7 s GLU 137 CO 0.24 -1.20 0.34 -3.38 0.02 0.00 0.00 175.26 171.28 1bu7 s HIS 138 N -2.93 0.98 -0.17 1.61 -3.43 -1.26 -4.88 115.29 105.21 1bu7 s HIS 138 Ca 0.65 -1.20 -0.08 0.00 -0.80 0.00 0.00 55.06 53.62 1bu7 s HIS 138 Cb -0.05 -0.24 -0.05 0.00 -1.43 0.00 0.00 32.58 30.82 1bu7 s HIS 138 CO 0.42 -0.90 0.12 0.42 -2.00 0.00 0.00 174.74 172.80 1bu7 s ILE 139 N -3.73 5.35 -0.57 -5.38 1.01 0.66 -4.98 121.20 113.57 1bu7 s ILE 139 Ca 0.32 0.16 -0.20 0.00 0.00 0.00 0.00 60.65 60.93 1bu7 s ILE 139 Cb 0.02 -3.39 0.07 0.00 0.01 0.00 0.00 42.46 39.17 1bu7 s ILE 139 CO 0.15 0.51 0.76 -1.61 0.00 0.00 0.00 174.94 174.76 1bu7 s GLU 140 N -0.18 3.12 -0.06 2.79 2.02 -1.26 -2.32 118.70 122.81 1bu7 s GLU 140 Ca 0.10 -0.93 -0.20 0.00 0.02 0.00 0.00 54.97 53.96 1bu7 s GLU 140 Cb -0.11 -4.17 -0.16 0.00 0.10 0.00 0.00 34.13 29.79 1bu7 s GLU 140 CO 0.00 -1.48 0.81 0.28 0.02 0.00 0.00 175.26 174.89 1bu7 h VAL 141 N 5.93 0.87 -0.19 2.63 2.07 -1.67 -1.80 116.25 124.10 1bu7 h VAL 141 Ca -0.28 -1.22 -0.04 0.00 0.82 0.00 0.00 66.70 65.97 1bu7 h VAL 141 Cb 1.08 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 1bu7 h VAL 141 CO 1.07 0.24 -0.08 1.55 0.02 0.00 0.00 177.57 180.37 1bu7 h PRO 142 N -0.88 0.29 -0.03 1.57 0.13 -1.86 -0.68 132.00 130.53 1bu7 h PRO 142 Ca -0.02 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1bu7 h PRO 142 Cb 0.53 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.62 1bu7 h PRO 142 CO 0.03 0.38 0.02 0.93 -0.23 0.00 0.00 178.00 179.13 1bu7 h GLU 143 N 0.28 0.04 -0.05 0.86 3.07 -1.91 0.15 114.58 117.01 1bu7 h GLU 143 Ca 0.06 -0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.77 1bu7 h GLU 143 Cb 0.32 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 1bu7 h GLU 143 CO 0.02 0.08 -0.61 -0.44 -1.40 0.00 0.00 179.01 176.66 1bu7 h ASP 144 N -0.01 0.21 0.33 1.42 3.32 -0.98 -1.55 116.42 119.16 1bu7 h ASP 144 Ca 0.01 -0.12 -0.12 0.00 0.02 0.00 0.00 57.03 56.82 1bu7 h ASP 144 Cb 0.05 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1bu7 h ASP 144 CO -0.00 0.77 -0.49 0.24 -1.72 0.00 0.00 179.24 178.04 1bu7 h MET 145 N 0.14 0.19 -0.12 3.56 2.86 -0.91 -1.81 114.93 118.83 1bu7 h MET 145 Ca -0.01 -0.10 -0.22 0.00 -2.06 0.00 0.00 59.70 57.31 1bu7 h MET 145 Cb 1.10 0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.78 1bu7 h MET 145 CO 0.09 0.64 -0.81 1.15 1.06 0.00 0.00 176.91 179.04 1bu7 h THR 146 N 0.15 1.29 -0.64 2.22 2.02 -0.80 -0.39 112.91 116.76 1bu7 h THR 146 Ca 0.01 -2.04 0.08 0.00 0.77 0.00 0.00 66.41 65.23 1bu7 h THR 146 Cb 0.92 2.05 -0.07 0.00 -1.74 0.00 0.00 68.15 69.31 1bu7 h THR 146 CO 0.07 0.64 0.30 0.03 0.37 0.00 0.00 175.52 176.93 1bu7 h ARG 147 N 0.48 0.52 0.06 6.66 3.08 -1.09 -1.76 114.38 122.33 1bu7 h ARG 147 Ca -0.06 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1bu7 h ARG 147 Cb 1.43 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.36 1bu7 h ARG 147 CO 0.16 0.34 -0.03 1.25 -1.07 0.00 0.00 179.97 180.63 1bu7 h LEU 148 N 0.53 -0.06 -0.38 3.04 5.85 -1.19 -1.81 115.31 121.29 1bu7 h LEU 148 Ca 0.31 -0.12 -0.15 0.00 0.84 0.00 0.00 57.88 58.75 1bu7 h LEU 148 Cb 0.31 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1bu7 h LEU 148 CO -0.25 0.08 -0.37 0.71 -0.34 0.00 0.00 178.44 178.27 1bu7 h THR 149 N -0.21 1.27 -0.04 1.05 1.35 -0.90 -0.49 112.91 114.93 1bu7 h THR 149 Ca -0.01 -1.54 0.02 0.00 -0.55 0.00 0.00 66.41 64.33 1bu7 h THR 149 Cb 0.18 1.38 -0.02 0.00 -1.73 0.00 0.00 68.15 67.96 1bu7 h THR 149 CO 0.01 0.51 -0.08 -0.07 -0.25 0.00 0.00 175.52 175.65 1bu7 h LEU 150 N 0.74 -0.24 -1.25 3.87 3.38 -1.37 -0.56 115.31 119.88 1bu7 h LEU 150 Ca 0.06 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1bu7 h LEU 150 Cb 0.96 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 1bu7 h LEU 150 CO 0.09 -0.12 -0.01 0.44 0.09 0.00 0.00 178.44 178.93 1bu7 h ASP 151 N -0.12 0.46 -0.30 -0.43 5.19 -1.19 -0.30 116.42 119.73 1bu7 h ASP 151 Ca 0.05 -0.09 -0.09 0.00 -0.62 0.00 0.00 57.03 56.29 1bu7 h ASP 151 Cb 0.19 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.57 1bu7 h ASP 151 CO -0.12 0.54 -0.15 0.74 -3.12 0.00 0.00 179.24 177.13 1bu7 h THR 152 N 0.47 1.29 -0.46 0.35 2.02 -0.73 -1.53 112.91 114.33 1bu7 h THR 152 Ca 0.10 -1.25 -0.10 0.00 0.77 0.00 0.00 66.41 65.94 1bu7 h THR 152 Cb 0.33 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 1bu7 h THR 152 CO 0.01 0.40 -0.10 0.40 0.37 0.00 0.00 175.52 176.60 1bu7 h ILE 153 N 0.38 1.26 -0.43 3.11 2.04 -0.86 0.16 117.51 123.16 1bu7 h ILE 153 Ca 0.07 -1.18 -0.00 0.00 1.00 0.00 0.00 64.86 64.75 1bu7 h ILE 153 Cb 0.67 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 1bu7 h ILE 153 CO 0.04 0.41 0.26 1.23 0.00 0.00 0.00 178.15 180.09 1bu7 h GLY 154 N 0.97 0.63 0.32 5.37 0.00 -0.92 0.46 103.07 109.90 1bu7 h GLY 154 Ca 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1bu7 h GLY 154 CO 0.04 0.26 -0.05 -2.00 0.00 0.00 0.00 176.54 174.78 1bu7 h LEU 155 N 0.57 -0.12 -1.55 3.11 5.85 -1.00 -1.69 115.31 120.49 1bu7 h LEU 155 Ca 0.16 -0.45 -0.05 0.00 0.84 0.00 0.00 57.88 58.37 1bu7 h LEU 155 Cb 0.00 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1bu7 h LEU 155 CO -0.03 0.49 -0.24 0.00 -0.34 0.00 0.00 178.44 178.32 1bu7 h GLY 157 N 0.96 0.00 -2.50 0.00 0.00 -0.98 -3.30 103.07 97.25 1bu7 h GLY 157 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 1bu7 h GLY 157 CO 0.03 0.00 -0.91 1.97 0.00 0.00 0.00 176.54 177.63 1bu7 n PHE 158 N -4.37 0.00 -4.00 5.60 -1.74 -0.69 -1.88 117.46 110.38 1bu7 n PHE 158 Ca -0.00 -0.38 -0.31 0.00 -0.56 0.00 0.00 57.45 56.20 1bu7 n PHE 158 Cb 0.00 -0.13 0.01 0.00 1.52 0.00 0.00 39.48 40.88 1bu7 n PHE 158 CO 0.00 0.00 0.00 -1.71 -0.56 0.00 0.00 176.76 174.49 1bu7 n ASN 159 N 0.38 -3.93 -4.38 5.98 5.15 -0.73 -4.95 115.26 112.78 1bu7 n ASN 159 Ca 0.05 -0.87 -0.32 0.00 -0.60 0.00 0.00 54.58 52.84 1bu7 n ASN 159 Cb 1.04 -3.50 -0.15 0.00 -0.53 0.00 0.00 39.78 36.64 1bu7 n ASN 159 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1bu7 s TYR 160 N -3.35 2.59 -0.29 1.20 5.04 -0.85 -4.92 117.35 116.76 1bu7 s TYR 160 Ca 0.62 -0.43 -0.07 0.00 -2.44 0.00 0.00 57.07 54.74 1bu7 s TYR 160 Cb -0.32 -1.64 0.00 0.00 0.35 0.00 0.00 41.96 40.35 1bu7 s TYR 160 CO 0.86 -0.02 0.09 1.03 -1.34 0.00 0.00 175.55 176.17 1bu7 s ARG 161 N -0.38 3.20 0.43 4.97 0.52 -1.26 -2.55 118.95 123.87 1bu7 s ARG 161 Ca 0.03 -0.79 0.26 0.00 -0.52 0.00 0.00 55.73 54.71 1bu7 s ARG 161 Cb -0.12 -3.41 0.64 0.00 0.52 0.00 0.00 34.95 32.58 1bu7 s ARG 161 CO 0.02 -0.41 1.71 0.74 0.02 0.00 0.00 175.30 177.38 1bu7 h PHE 162 N 8.26 0.00 -6.32 -0.53 0.04 -1.92 -3.47 116.94 112.99 1bu7 h PHE 162 Ca -0.32 0.00 -0.47 0.00 2.80 0.00 0.00 57.97 59.98 1bu7 h PHE 162 Cb 1.14 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.27 1bu7 h PHE 162 CO 0.62 0.00 -0.85 0.09 -0.60 0.00 0.00 178.31 177.57 1bu7 n ASN 163 N -2.98 -1.17 0.24 2.17 3.02 -1.26 -4.64 115.26 110.64 1bu7 n ASN 163 Ca 0.03 -0.91 0.16 0.00 -0.03 0.00 0.00 54.58 53.84 1bu7 n ASN 163 Cb 0.46 -3.53 0.70 0.00 -0.61 0.00 0.00 39.78 36.80 1bu7 n ASN 163 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1bu7 h SER 164 N -1.86 0.00 -0.38 6.41 0.02 -1.92 -1.31 113.55 114.51 1bu7 h SER 164 Ca -0.62 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 1bu7 h SER 164 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 1bu7 h SER 164 CO 0.61 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.79 1bu7 n PHE 165 N -2.80 0.61 -0.27 3.45 3.72 -1.26 -3.57 117.46 117.34 1bu7 n PHE 165 Ca 0.00 -0.28 0.07 0.00 -0.05 0.00 0.00 57.45 57.19 1bu7 n PHE 165 Cb 0.23 -0.04 0.20 0.00 -0.94 0.00 0.00 39.48 38.93 1bu7 n PHE 165 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1bu7 n TYR 166 N 0.61 0.62 -3.58 1.38 4.02 -0.49 -5.03 117.16 114.70 1bu7 n TYR 166 Ca 0.13 -0.52 -0.15 0.00 -0.01 0.00 0.00 57.90 57.35 1bu7 n TYR 166 Cb 0.39 -0.04 -0.06 0.00 -0.02 0.00 0.00 39.34 39.61 1bu7 n TYR 166 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 1bu7 s ARG 167 N -1.12 1.00 -0.18 -0.72 1.70 -1.23 -5.04 118.95 113.36 1bu7 s ARG 167 Ca 0.30 -0.07 -0.21 0.00 -0.47 0.00 0.00 55.73 55.27 1bu7 s ARG 167 Cb 0.16 0.46 -0.18 0.00 -0.57 0.00 0.00 34.95 34.82 1bu7 s ARG 167 CO 0.19 -0.34 0.32 0.38 -1.08 0.00 0.00 175.30 174.77 1bu7 h ASP 168 N 2.97 0.00 -3.01 -2.89 3.04 -1.96 -3.45 116.42 111.12 1bu7 h ASP 168 Ca -0.29 -0.57 -0.57 0.00 -3.24 0.00 0.00 57.03 52.36 1bu7 h ASP 168 Cb 1.19 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.44 1bu7 h ASP 168 CO 0.40 1.22 0.82 -1.58 -2.04 0.00 0.00 179.24 178.06 1bu7 s GLN 169 N -2.26 4.28 1.06 4.15 2.00 -1.26 -5.03 119.66 122.60 1bu7 s GLN 169 Ca -0.23 1.57 -0.12 0.00 -2.00 0.00 0.00 55.36 54.58 1bu7 s GLN 169 Cb 0.03 -3.68 0.23 0.00 0.80 0.00 0.00 33.01 30.38 1bu7 s GLN 169 CO 0.55 -0.61 1.07 -2.14 -0.50 0.00 0.00 175.29 173.66 1bu7 s PRO 170 N 3.08 -0.13 0.48 1.67 0.02 -1.26 -4.92 135.00 133.93 1bu7 s PRO 170 Ca 0.52 1.07 -0.23 0.00 0.02 0.00 0.00 61.00 62.37 1bu7 s PRO 170 Cb -0.20 -1.63 -0.08 0.00 0.02 0.00 0.00 34.50 32.61 1bu7 s PRO 170 CO 0.14 -3.26 1.21 1.58 -0.33 0.00 0.00 177.00 176.34 1bu7 n HIS 171 N -4.62 1.85 -0.31 6.54 -0.00 -1.26 -4.70 115.22 112.72 1bu7 n HIS 171 Ca 0.06 0.48 0.12 0.00 -0.00 0.00 0.00 57.72 58.39 1bu7 n HIS 171 Cb 0.54 -2.32 0.30 0.00 -0.00 0.00 0.00 29.99 28.51 1bu7 n HIS 171 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1bu7 h PRO 172 N 1.62 0.45 -0.51 1.57 0.11 -1.97 0.21 132.00 133.49 1bu7 h PRO 172 Ca -0.48 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.69 1bu7 h PRO 172 Cb 1.31 -0.10 -0.07 0.00 0.11 0.00 0.00 31.00 32.25 1bu7 h PRO 172 CO 0.57 0.30 0.11 0.35 -0.21 0.00 0.00 178.00 179.12 1bu7 h PHE 173 N 0.46 0.17 -0.41 0.65 3.57 -1.92 -1.32 116.94 118.15 1bu7 h PHE 173 Ca 0.55 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.97 1bu7 h PHE 173 Cb 1.00 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 1bu7 h PHE 173 CO -0.12 -0.00 -0.17 0.82 -2.23 0.00 0.00 178.31 176.61 1bu7 h ILE 174 N 0.25 1.28 -0.67 1.41 2.04 -1.33 0.62 117.51 121.10 1bu7 h ILE 174 Ca 0.25 -1.31 0.10 0.00 1.00 0.00 0.00 64.86 64.91 1bu7 h ILE 174 Cb 0.34 1.25 -0.08 0.00 -0.74 0.00 0.00 36.82 37.59 1bu7 h ILE 174 CO -0.33 0.44 0.28 0.74 0.00 0.00 0.00 178.15 179.28 1bu7 h THR 175 N 0.66 0.77 -0.26 -0.27 2.02 -1.11 0.02 112.91 114.74 1bu7 h THR 175 Ca 0.09 -0.16 -0.19 0.00 0.77 0.00 0.00 66.41 66.92 1bu7 h THR 175 Cb 0.73 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1bu7 h THR 175 CO 0.06 0.09 -0.60 0.28 0.37 0.00 0.00 175.52 175.71 1bu7 h SER 176 N 0.48 0.96 -0.09 4.18 0.02 -0.83 -1.47 113.55 116.80 1bu7 h SER 176 Ca 0.34 -0.54 -0.02 0.00 -0.84 0.00 0.00 61.79 60.73 1bu7 h SER 176 Cb 0.43 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 1bu7 h SER 176 CO -0.32 1.34 -0.02 -0.03 -1.14 0.00 0.00 176.83 176.67 1bu7 h MET 177 N 0.64 0.18 -0.76 3.45 -1.53 -0.50 -0.50 114.93 115.91 1bu7 h MET 177 Ca -0.00 -0.06 -0.02 0.00 -3.44 0.00 0.00 59.70 56.18 1bu7 h MET 177 Cb 1.21 -0.01 -0.04 0.00 -0.55 0.00 0.00 31.60 32.21 1bu7 h MET 177 CO 0.13 0.48 0.40 0.28 0.14 0.00 0.00 176.91 178.34 1bu7 h VAL 178 N -0.14 1.23 -0.03 -5.77 2.07 -1.04 -0.77 116.25 111.79 1bu7 h VAL 178 Ca 0.02 -0.58 -0.16 0.00 0.82 0.00 0.00 66.70 66.80 1bu7 h VAL 178 Cb 0.41 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1bu7 h VAL 178 CO 0.01 0.26 -0.69 -0.09 0.02 0.00 0.00 177.57 177.07 1bu7 h ARG 179 N 1.06 0.18 -0.02 1.57 2.43 -1.11 -1.44 114.38 117.04 1bu7 h ARG 179 Ca 0.27 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1bu7 h ARG 179 Cb 0.04 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1bu7 h ARG 179 CO -0.04 0.80 0.01 0.00 -1.51 0.00 0.00 179.97 179.22 1bu7 h ALA 180 N 1.16 0.02 -0.81 2.80 0.00 -0.79 -1.02 119.26 120.63 1bu7 h ALA 180 Ca -0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1bu7 h ALA 180 Cb 1.23 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 1bu7 h ALA 180 CO 0.10 -0.37 0.50 -0.07 0.00 0.00 0.00 179.25 179.41 1bu7 h LEU 181 N -0.18 0.97 -0.89 0.00 3.38 -1.11 -1.41 115.31 116.06 1bu7 h LEU 181 Ca 0.01 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1bu7 h LEU 181 Cb 0.22 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1bu7 h LEU 181 CO -0.00 0.74 0.37 -0.78 0.09 0.00 0.00 178.44 178.86 1bu7 h ASP 182 N 1.11 1.07 -0.38 -0.43 3.58 -1.11 -1.99 116.42 118.27 1bu7 h ASP 182 Ca 0.29 -0.14 -0.10 0.00 0.42 0.00 0.00 57.03 57.51 1bu7 h ASP 182 Cb -0.06 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.70 1bu7 h ASP 182 CO -0.06 0.91 -0.10 -0.08 -2.88 0.00 0.00 179.24 177.04 1bu7 h GLU 183 N 1.16 0.82 -0.56 0.28 4.57 -0.60 0.10 114.58 120.34 1bu7 h GLU 183 Ca 0.28 -0.27 -0.04 0.00 -1.18 0.00 0.00 59.36 58.14 1bu7 h GLU 183 Cb 0.14 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 1bu7 h GLU 183 CO -0.03 0.89 0.19 0.00 -1.18 0.00 0.00 179.01 178.88 1bu7 h ALA 184 N 1.14 0.73 -0.17 2.92 0.00 -0.82 0.24 119.26 123.31 1bu7 h ALA 184 Ca 0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1bu7 h ALA 184 Cb 0.59 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1bu7 h ALA 184 CO 0.04 0.38 0.01 0.52 0.00 0.00 0.00 179.25 180.19 1bu7 h MET 185 N 0.78 0.29 -1.01 0.00 2.86 -1.18 -3.11 114.93 113.55 1bu7 h MET 185 Ca 0.18 -0.09 0.03 0.00 -2.06 0.00 0.00 59.70 57.77 1bu7 h MET 185 Cb 0.25 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.83 1bu7 h MET 185 CO -0.01 0.50 0.66 -0.91 1.06 0.00 0.00 176.91 178.21 1bu7 h ASN 186 N 0.04 1.11 -0.20 1.22 -0.26 -0.69 -2.29 115.58 114.52 1bu7 h ASN 186 Ca 0.05 -0.01 0.06 0.00 -0.56 0.00 0.00 56.30 55.83 1bu7 h ASN 186 Cb 0.37 -0.26 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 1bu7 h ASN 186 CO 0.01 0.77 0.26 0.11 -1.06 0.00 0.00 177.43 177.51 1bu7 h LYS 187 N 1.29 0.00 0.00 0.81 1.57 -0.46 -0.77 116.57 119.02 1bu7 h LYS 187 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1bu7 h LYS 187 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1bu7 h LYS 187 CO -0.12 0.00 0.00 -0.07 -0.57 0.00 0.00 179.45 178.69 1bu7 h LEU 188 N 0.00 0.00 -1.22 2.94 3.38 -1.44 -2.88 115.31 116.10 1bu7 h LEU 188 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1bu7 h LEU 188 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1bu7 h LEU 188 CO -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.50 1bu7 n GLN 189 N -2.79 0.44 -3.05 1.13 6.02 -0.30 -4.96 117.38 113.87 1bu7 n GLN 189 Ca 0.00 -0.91 -0.41 0.00 -0.01 0.00 0.00 57.00 55.67 1bu7 n GLN 189 Cb 0.21 -1.13 -0.06 0.00 1.02 0.00 0.00 30.24 30.28 1bu7 n GLN 189 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1bu7 s ARG 190 N -0.74 3.93 0.21 -1.09 0.52 -1.09 -4.89 118.95 115.79 1bu7 s ARG 190 Ca 0.09 0.41 -0.09 0.00 -0.52 0.00 0.00 55.73 55.62 1bu7 s ARG 190 Cb 0.07 -3.73 0.14 0.00 0.52 0.00 0.00 34.95 31.96 1bu7 s ARG 190 CO 0.11 -0.60 1.78 0.00 0.02 0.00 0.00 175.30 176.61 1bu7 h ALA 191 N 8.15 0.99 -2.65 2.13 0.00 -1.93 -3.35 119.26 122.61 1bu7 h ALA 191 Ca -0.26 -0.18 -0.60 0.00 0.00 0.00 0.00 54.91 53.87 1bu7 h ALA 191 Cb 1.11 -0.30 -0.40 0.00 0.00 0.00 0.00 17.79 18.20 1bu7 h ALA 191 CO 0.83 0.61 -0.76 0.27 0.00 0.00 0.00 179.25 180.20 1bu7 n ASN 192 N -4.32 1.68 0.10 0.00 6.94 -1.26 -4.94 115.26 113.45 1bu7 n ASN 192 Ca 0.07 -2.91 0.11 0.00 -0.02 0.00 0.00 54.58 51.83 1bu7 n ASN 192 Cb 0.17 -0.67 0.45 0.00 -2.36 0.00 0.00 39.78 37.38 1bu7 n ASN 192 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 1bu7 n PRO 193 N 2.09 0.16 0.07 -0.53 -0.02 -1.26 -2.22 135.00 133.30 1bu7 n PRO 193 Ca 0.25 0.38 0.13 0.00 -2.02 0.00 0.00 63.50 62.23 1bu7 n PRO 193 Cb 0.42 -1.79 0.40 0.00 -0.02 0.00 0.00 33.50 32.50 1bu7 n PRO 193 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1bu7 n ASP 194 N -2.09 0.61 -4.75 2.55 8.00 -1.26 -4.77 116.55 114.84 1bu7 n ASP 194 Ca 0.03 0.43 -0.41 0.00 0.71 0.00 0.00 54.79 55.54 1bu7 n ASP 194 Cb 0.23 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 40.81 1bu7 n ASP 194 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1bu7 s ASP 195 N -4.08 6.59 0.65 -2.24 2.15 -0.94 -4.89 116.67 113.92 1bu7 s ASP 195 Ca 0.11 2.76 0.34 0.00 0.43 0.00 0.00 52.55 56.18 1bu7 s ASP 195 Cb 0.14 -2.63 1.87 0.00 -0.30 0.00 0.00 42.92 42.00 1bu7 s ASP 195 CO 0.61 -0.73 2.05 1.55 -0.17 0.00 0.00 175.17 178.48 1bu7 h PRO 196 N 4.57 0.00 0.00 4.34 0.13 -1.90 0.65 132.00 139.79 1bu7 h PRO 196 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1bu7 h PRO 196 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1bu7 h PRO 196 CO 0.75 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.52 1bu7 n ALA 197 N -1.94 1.37 0.08 -0.56 0.00 -1.26 -1.41 120.51 116.79 1bu7 n ALA 197 Ca -0.02 0.13 0.11 0.00 0.00 0.00 0.00 53.44 53.66 1bu7 n ALA 197 Cb 0.27 -1.34 0.24 0.00 0.00 0.00 0.00 19.45 18.62 1bu7 n ALA 197 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1bu7 n TYR 198 N -2.21 0.63 -0.04 0.00 4.01 0.22 -4.38 117.16 115.40 1bu7 n TYR 198 Ca 0.00 -0.33 -0.04 0.00 -0.16 0.00 0.00 57.90 57.38 1bu7 n TYR 198 Cb 0.13 -0.00 0.19 0.00 -0.31 0.00 0.00 39.34 39.36 1bu7 n TYR 198 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1bu7 h ASP 199 N 4.28 0.60 -0.45 7.72 3.32 -1.38 0.47 116.42 130.98 1bu7 h ASP 199 Ca 0.00 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 56.84 1bu7 h ASP 199 Cb 0.97 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 1bu7 h ASP 199 CO 0.00 0.76 0.13 -0.08 -1.72 0.00 0.00 179.24 178.33 1bu7 h GLU 200 N 0.56 0.70 -0.66 3.56 4.57 -1.78 -0.13 114.58 121.41 1bu7 h GLU 200 Ca 0.10 -0.15 0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1bu7 h GLU 200 Cb 0.55 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.00 1bu7 h GLU 200 CO 0.03 0.68 0.43 -0.91 -1.18 0.00 0.00 179.01 178.07 1bu7 h ASN 201 N 0.59 0.65 -0.08 1.04 4.21 -1.63 0.23 115.58 120.58 1bu7 h ASN 201 Ca 0.14 -0.01 -0.23 0.00 1.21 0.00 0.00 56.30 57.42 1bu7 h ASN 201 Cb 0.28 -0.15 0.01 0.00 -1.12 0.00 0.00 38.32 37.34 1bu7 h ASN 201 CO -0.00 0.44 -0.82 0.11 -1.29 0.00 0.00 177.43 175.86 1bu7 h LYS 202 N 0.75 0.75 -0.83 0.81 1.57 -0.51 -2.11 116.57 117.00 1bu7 h LYS 202 Ca 0.27 -0.64 -0.01 0.00 -1.87 0.00 0.00 60.65 58.39 1bu7 h LYS 202 Cb 0.13 0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 1bu7 h LYS 202 CO -0.08 1.24 0.47 -0.09 -0.57 0.00 0.00 179.45 180.42 1bu7 h ARG 203 N 0.49 1.15 -0.56 3.15 2.43 -0.34 -1.99 114.38 118.71 1bu7 h ARG 203 Ca -0.06 -0.13 -0.10 0.00 -0.81 0.00 0.00 59.98 58.88 1bu7 h ARG 203 Cb 1.45 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 1bu7 h ARG 203 CO 0.17 0.84 -0.03 0.37 -1.51 0.00 0.00 179.97 179.80 1bu7 h GLN 204 N 1.15 1.00 -0.01 0.20 5.75 -0.92 -1.78 115.11 120.51 1bu7 h GLN 204 Ca 0.29 -0.32 -0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1bu7 h GLN 204 Cb 0.01 -0.09 -0.00 0.00 1.07 0.00 0.00 27.48 28.47 1bu7 h GLN 204 CO -0.05 1.00 0.00 0.35 -2.65 0.00 0.00 178.83 177.48 1bu7 h PHE 205 N 0.91 0.01 -0.91 3.99 3.57 -1.08 0.16 116.94 123.60 1bu7 h PHE 205 Ca 0.16 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.72 1bu7 h PHE 205 Cb 0.57 -0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.24 1bu7 h PHE 205 CO 0.04 0.11 0.58 1.96 -2.23 0.00 0.00 178.31 178.77 1bu7 h GLN 206 N -0.09 1.03 -0.38 1.11 1.08 -1.28 0.74 115.11 117.31 1bu7 h GLN 206 Ca 0.00 -0.06 -0.09 0.00 -1.45 0.00 0.00 58.65 57.05 1bu7 h GLN 206 Cb 0.10 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 1bu7 h GLN 206 CO -0.00 0.68 -0.13 1.49 -0.95 0.00 0.00 178.83 179.92 1bu7 h GLU 207 N 1.06 0.68 -0.29 1.46 4.81 -0.72 -1.98 114.58 119.61 1bu7 h GLU 207 Ca 0.39 -0.23 -0.11 0.00 -0.13 0.00 0.00 59.36 59.29 1bu7 h GLU 207 Cb 0.14 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1bu7 h GLU 207 CO -0.17 0.79 -0.27 -0.44 -0.73 0.00 0.00 179.01 178.20 1bu7 h ASP 208 N 0.62 0.58 -0.84 1.04 3.32 0.29 -1.37 116.42 120.07 1bu7 h ASP 208 Ca 0.10 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1bu7 h ASP 208 Cb 0.59 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.94 1bu7 h ASP 208 CO 0.04 0.83 0.47 0.40 -1.72 0.00 0.00 179.24 179.26 1bu7 h ILE 209 N 0.50 1.24 -0.46 0.35 2.04 -0.65 -1.98 117.51 118.56 1bu7 h ILE 209 Ca 0.07 -0.60 -0.13 0.00 1.00 0.00 0.00 64.86 65.20 1bu7 h ILE 209 Cb 0.72 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1bu7 h ILE 209 CO 0.06 0.27 -0.21 0.50 0.00 0.00 0.00 178.15 178.77 1bu7 h LYS 210 N 1.17 0.95 -0.30 2.37 3.64 -0.80 0.94 116.57 124.54 1bu7 h LYS 210 Ca 0.30 -0.41 0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1bu7 h LYS 210 Cb 0.02 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.77 1bu7 h LYS 210 CO -0.05 1.07 0.05 0.28 -2.27 0.00 0.00 179.45 178.53 1bu7 h VAL 211 N 0.79 0.85 -0.08 2.00 2.07 -1.08 0.23 116.25 121.03 1bu7 h VAL 211 Ca 0.10 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1bu7 h VAL 211 Cb 0.78 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1bu7 h VAL 211 CO 0.06 0.03 0.03 0.24 0.02 0.00 0.00 177.57 177.95 1bu7 h MET 212 N 0.16 0.11 -0.82 1.57 2.86 -1.12 -2.04 114.93 115.65 1bu7 h MET 212 Ca 0.14 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.73 1bu7 h MET 212 Cb 0.15 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 1bu7 h MET 212 CO -0.19 0.23 0.38 -0.91 1.06 0.00 0.00 176.91 177.48 1bu7 h ASN 213 N -0.02 1.09 -0.25 1.22 -0.26 -0.69 -2.13 115.58 114.54 1bu7 h ASN 213 Ca 0.03 -0.14 -0.04 0.00 -0.56 0.00 0.00 56.30 55.58 1bu7 h ASN 213 Cb 0.16 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.13 1bu7 h ASN 213 CO -0.00 0.93 -0.00 0.44 -1.06 0.00 0.00 177.43 177.73 1bu7 h ASP 214 N 1.18 0.43 -0.34 5.81 3.32 -0.38 0.44 116.42 126.87 1bu7 h ASP 214 Ca 0.28 -0.31 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1bu7 h ASP 214 Cb 0.14 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1bu7 h ASP 214 CO -0.03 0.64 0.13 0.25 -1.72 0.00 0.00 179.24 178.51 1bu7 h LEU 215 N 0.22 0.48 -0.42 1.55 5.85 -1.33 -2.10 115.31 119.55 1bu7 h LEU 215 Ca 0.07 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.55 1bu7 h LEU 215 Cb 0.42 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1bu7 h LEU 215 CO 0.01 0.52 -0.00 0.58 -0.34 0.00 0.00 178.44 179.22 1bu7 h VAL 216 N 0.40 1.26 -0.84 1.05 2.07 -1.23 -1.87 116.25 117.08 1bu7 h VAL 216 Ca 0.11 -1.02 0.01 0.00 0.82 0.00 0.00 66.70 66.62 1bu7 h VAL 216 Cb 0.20 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1bu7 h VAL 216 CO -0.01 0.35 0.55 0.44 0.02 0.00 0.00 177.57 178.92 1bu7 h ASP 217 N 0.57 0.98 -0.60 0.57 3.32 -0.86 -1.64 116.42 118.76 1bu7 h ASP 217 Ca 0.12 -0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.16 1bu7 h ASP 217 Cb 0.48 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.75 1bu7 h ASP 217 CO 0.02 0.72 0.38 0.50 -1.72 0.00 0.00 179.24 179.13 1bu7 h LYS 218 N 1.15 0.73 -0.87 3.56 3.64 -1.15 -0.25 116.57 123.38 1bu7 h LYS 218 Ca 0.31 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.65 1bu7 h LYS 218 Cb -0.12 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.49 1bu7 h LYS 218 CO -0.07 0.48 0.57 0.82 -2.27 0.00 0.00 179.45 178.99 1bu7 h ILE 219 N 0.75 1.23 -0.17 2.00 2.04 -0.86 0.21 117.51 122.70 1bu7 h ILE 219 Ca 0.23 -0.42 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 1bu7 h ILE 219 Cb -0.02 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.01 1bu7 h ILE 219 CO -0.08 0.22 -0.12 0.40 0.00 0.00 0.00 178.15 178.57 1bu7 h ILE 220 N 1.18 1.32 -0.63 -0.67 2.04 -0.60 -1.65 117.51 118.50 1bu7 h ILE 220 Ca 0.32 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 1bu7 h ILE 220 Cb -0.12 1.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 1bu7 h ILE 220 CO -0.07 0.36 0.36 0.00 0.00 0.00 0.00 178.15 178.80 1bu7 h ALA 221 N 0.66 0.81 -0.75 1.87 0.00 -0.66 -1.88 119.26 119.31 1bu7 h ALA 221 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1bu7 h ALA 221 Cb 0.62 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1bu7 h ALA 221 CO 0.03 0.32 0.48 -0.44 0.00 0.00 0.00 179.25 179.64 1bu7 h ASP 222 N 0.86 0.88 -0.57 0.00 3.32 -0.56 -1.69 116.42 118.67 1bu7 h ASP 222 Ca 0.22 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 1bu7 h ASP 222 Cb 0.02 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1bu7 h ASP 222 CO -0.04 0.65 0.21 -0.09 -1.72 0.00 0.00 179.24 178.25 1bu7 h ARG 223 N 1.02 0.90 -0.29 3.56 9.65 -0.69 -1.52 114.38 127.01 1bu7 h ARG 223 Ca 0.27 -0.16 -0.13 0.00 -1.10 0.00 0.00 59.98 58.87 1bu7 h ARG 223 Cb -0.09 -0.15 -0.00 0.00 -1.39 0.00 0.00 29.97 28.34 1bu7 h ARG 223 CO -0.06 0.76 -0.31 0.87 2.80 0.00 0.00 179.97 184.03 1bu7 h LYS 224 N 0.88 0.72 -0.02 0.20 1.57 -0.95 -2.65 116.57 116.32 1bu7 h LYS 224 Ca 0.20 -0.39 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 1bu7 h LYS 224 Cb 0.22 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1bu7 h LYS 224 CO -0.01 1.01 -0.29 0.00 -0.57 0.00 0.00 179.45 179.59 1bu7 h ALA 225 N 0.70 1.49 0.00 3.86 0.00 -1.05 -2.69 119.26 121.58 1bu7 h ALA 225 Ca 0.04 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1bu7 h ALA 225 Cb 0.89 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1bu7 h ALA 225 CO 0.08 0.38 -0.53 0.66 0.00 0.00 0.00 179.25 179.83 1bu7 h SER 226 N 0.03 0.00 -0.31 0.00 4.64 -1.21 -3.47 113.55 113.22 1bu7 h SER 226 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.19 1bu7 h SER 226 Cb 0.52 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.56 1bu7 h SER 226 CO 0.04 0.26 -0.12 0.61 -0.87 0.00 0.00 176.83 176.74 1bu7 n GLY 227 N 1.20 0.72 3.76 -0.77 0.00 -1.01 -4.95 105.19 104.14 1bu7 n GLY 227 Ca 0.01 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1bu7 n GLY 227 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bu7 s GLU 228 N -2.31 4.51 -0.42 1.61 2.12 -1.25 -5.01 118.70 117.94 1bu7 s GLU 228 Ca 0.00 1.97 -0.07 0.00 0.36 0.00 0.00 54.97 57.23 1bu7 s GLU 228 Cb 0.00 -3.16 0.09 0.00 0.26 0.00 0.00 34.13 31.32 1bu7 s GLU 228 CO 0.00 -0.00 0.25 -1.14 -0.54 0.00 0.00 175.26 173.83 1bu7 s GLN 229 N -1.25 2.43 0.56 4.30 2.00 -1.26 -4.99 119.66 121.44 1bu7 s GLN 229 Ca 0.48 -1.60 0.08 0.00 -2.00 0.00 0.00 55.36 52.33 1bu7 s GLN 229 Cb -0.35 -3.73 0.07 0.00 0.80 0.00 0.00 33.01 29.79 1bu7 s GLN 229 CO 0.44 -1.02 0.65 -1.12 -0.50 0.00 0.00 175.29 173.74 1bu7 s SER 230 N 2.13 4.96 -0.28 6.67 0.01 -1.26 -5.01 113.70 120.92 1bu7 s SER 230 Ca 0.04 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.34 1bu7 s SER 230 Cb -0.24 0.29 0.27 0.00 0.21 0.00 0.00 66.02 66.55 1bu7 s SER 230 CO -0.00 -1.23 1.78 0.47 0.41 0.00 0.00 173.24 174.67 1bu7 n ASP 231 N -2.05 5.17 -4.62 2.44 9.92 -1.26 -4.81 116.55 121.34 1bu7 n ASP 231 Ca 0.09 -2.96 -0.29 0.00 -0.53 0.00 0.00 54.79 51.10 1bu7 n ASP 231 Cb 0.62 -0.89 -0.10 0.00 -0.64 0.00 0.00 41.12 40.12 1bu7 n ASP 231 CO 0.00 0.00 0.00 1.51 0.13 0.00 0.00 177.20 178.84 1bu7 s ASP 232 N 0.00 3.72 0.34 -2.24 1.47 -1.26 -4.76 116.67 113.94 1bu7 s ASP 232 Ca 0.30 -1.50 0.04 0.00 1.18 0.00 0.00 52.55 52.58 1bu7 s ASP 232 Cb 0.25 0.04 0.60 0.00 -0.34 0.00 0.00 42.92 43.47 1bu7 s ASP 232 CO 0.02 -0.65 1.89 -0.07 0.68 0.00 0.00 175.17 177.04 1bu7 h LEU 233 N 1.66 0.53 -0.87 2.11 3.38 -1.45 -2.84 115.31 117.83 1bu7 h LEU 233 Ca -0.43 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.45 1bu7 h LEU 233 Cb 1.27 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 1bu7 h LEU 233 CO 0.75 0.56 0.53 0.25 0.09 0.00 0.00 178.44 180.63 1bu7 h LEU 234 N 0.56 1.04 -0.30 1.67 5.85 -1.71 0.72 115.31 123.14 1bu7 h LEU 234 Ca 0.13 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1bu7 h LEU 234 Cb 0.27 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1bu7 h LEU 234 CO 0.00 0.79 0.19 0.74 -0.34 0.00 0.00 178.44 179.83 1bu7 h THR 235 N 1.19 1.07 -0.71 1.05 2.02 -1.80 0.14 112.91 115.86 1bu7 h THR 235 Ca 0.31 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.33 1bu7 h THR 235 Cb -0.06 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 1bu7 h THR 235 CO -0.06 0.07 0.36 0.45 0.37 0.00 0.00 175.52 176.71 1bu7 h HIS 236 N 0.39 1.01 0.00 3.16 3.86 -1.25 -0.05 115.15 122.27 1bu7 h HIS 236 Ca 0.11 -0.04 -0.09 0.00 -1.16 0.00 0.00 60.37 59.19 1bu7 h HIS 236 Cb -0.04 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.10 1bu7 h HIS 236 CO -0.06 0.74 -0.44 0.52 0.86 0.00 0.00 177.93 179.55 1bu7 h MET 237 N 0.99 0.00 0.11 2.45 2.07 -0.42 0.26 114.93 120.40 1bu7 h MET 237 Ca 0.25 0.00 -0.28 0.00 -2.07 0.00 0.00 59.70 57.59 1bu7 h MET 237 Cb 0.09 0.00 0.02 0.00 -1.87 0.00 0.00 31.60 29.84 1bu7 h MET 237 CO -0.03 0.44 -1.21 -0.07 1.07 0.00 0.00 176.91 177.11 1bu7 h LEU 238 N 0.00 0.70 0.00 1.22 3.38 -0.46 -3.34 115.31 116.82 1bu7 h LEU 238 Ca -0.00 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.30 1bu7 h LEU 238 Cb 0.91 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1bu7 h LEU 238 CO 0.06 1.49 -0.58 0.59 0.09 0.00 0.00 178.44 180.08 1bu7 n ASN 239 N -3.71 0.60 -4.89 -0.43 5.03 -0.08 -4.98 115.26 106.80 1bu7 n ASN 239 Ca -0.11 -0.01 -0.30 0.00 0.87 0.00 0.00 54.58 55.02 1bu7 n ASN 239 Cb 0.98 0.20 -0.04 0.00 -1.02 0.00 0.00 39.78 39.90 1bu7 n ASN 239 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1bu7 s GLY 240 N -3.41 2.05 0.01 7.41 0.00 0.92 -5.06 107.32 109.24 1bu7 s GLY 240 Ca 0.08 -0.39 0.03 0.00 0.00 0.00 0.00 44.72 44.44 1bu7 s GLY 240 CO 0.71 -0.26 -0.11 0.54 0.00 0.00 0.00 173.10 173.98 1bu7 s LYS 241 N -3.26 0.82 0.01 2.90 1.02 -1.26 -4.33 119.74 115.64 1bu7 s LYS 241 Ca 0.46 -0.47 -0.30 0.00 0.02 0.00 0.00 55.97 55.68 1bu7 s LYS 241 Cb -0.11 -0.79 -0.08 0.00 -0.52 0.00 0.00 37.83 36.33 1bu7 s LYS 241 CO 0.26 0.21 1.80 0.34 -0.92 0.00 0.00 175.35 177.04 1bu7 s ASP 242 N -0.51 6.55 0.18 2.83 2.15 -0.17 -4.86 116.67 122.83 1bu7 s ASP 242 Ca 0.03 2.49 0.19 0.00 0.43 0.00 0.00 52.55 55.68 1bu7 s ASP 242 Cb -0.05 -2.54 0.84 0.00 -0.30 0.00 0.00 42.92 40.87 1bu7 s ASP 242 CO 0.00 -0.98 1.59 -2.65 -0.17 0.00 0.00 175.17 172.96 1bu7 n PRO 243 N 7.00 0.12 -0.02 4.34 -0.02 -1.26 -0.16 135.00 144.99 1bu7 n PRO 243 Ca 0.18 0.40 -0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1bu7 n PRO 243 Cb 0.41 -1.75 -0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1bu7 n PRO 243 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1bu7 h GLU 244 N 0.00 0.00 0.00 -0.52 4.81 -1.96 -3.40 114.58 113.51 1bu7 h GLU 244 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1bu7 h GLU 244 Cb 0.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1bu7 h GLU 244 CO 0.00 0.00 -0.28 1.79 -0.73 0.00 0.00 179.01 179.79 1bu7 h THR 245 N -0.46 0.00 0.00 0.32 1.35 -1.98 -3.47 112.91 108.68 1bu7 h THR 245 Ca 0.00 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 1bu7 h THR 245 Cb 0.04 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 1bu7 h THR 245 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1bu7 n GLY 246 N 1.24 0.65 3.90 5.82 0.00 0.77 -5.00 105.19 112.57 1bu7 n GLY 246 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1bu7 n GLY 246 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bu7 s GLU 247 N -0.33 3.62 0.48 1.61 2.02 -1.25 -4.61 118.70 120.25 1bu7 s GLU 247 Ca 0.00 -0.08 -0.00 0.00 0.02 0.00 0.00 54.97 54.91 1bu7 s GLU 247 Cb 0.00 -2.81 0.00 0.00 0.10 0.00 0.00 34.13 31.43 1bu7 s GLU 247 CO 0.00 0.42 0.71 -1.25 0.02 0.00 0.00 175.26 175.16 1bu7 s PRO 248 N -2.86 2.95 0.47 0.39 0.04 -1.26 -1.00 135.00 133.73 1bu7 s PRO 248 Ca 0.42 -0.50 -0.23 0.00 0.04 0.00 0.00 61.00 60.73 1bu7 s PRO 248 Cb -0.12 -2.52 -0.07 0.00 0.04 0.00 0.00 34.50 31.83 1bu7 s PRO 248 CO 0.25 -0.40 1.18 -0.51 0.04 0.00 0.00 177.00 177.57 1bu7 s LEU 249 N -4.63 3.99 0.73 -3.56 1.43 -1.26 -4.99 118.68 110.39 1bu7 s LEU 249 Ca 0.51 2.33 -0.10 0.00 -1.03 0.00 0.00 54.13 55.83 1bu7 s LEU 249 Cb -0.10 -4.26 0.04 0.00 0.03 0.00 0.00 46.19 41.91 1bu7 s LEU 249 CO 0.39 -0.97 1.09 1.51 0.23 0.00 0.00 176.35 178.60 1bu7 s ASP 250 N -1.35 5.05 0.39 2.29 1.47 -1.26 -4.85 116.67 118.41 1bu7 s ASP 250 Ca 0.64 0.88 0.09 0.00 1.18 0.00 0.00 52.55 55.34 1bu7 s ASP 250 Cb -0.29 -1.57 0.80 0.00 -0.34 0.00 0.00 42.92 41.52 1bu7 s ASP 250 CO 0.35 -1.54 1.94 0.44 0.68 0.00 0.00 175.17 177.04 1bu7 h ASP 251 N -0.74 0.28 -0.05 2.11 3.32 -1.99 -1.03 116.42 118.32 1bu7 h ASP 251 Ca -0.45 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 56.54 1bu7 h ASP 251 Cb 1.29 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.77 1bu7 h ASP 251 CO 0.64 0.37 -0.00 -0.08 -1.72 0.00 0.00 179.24 178.45 1bu7 h GLU 252 N 0.29 0.08 -0.52 3.56 4.81 -2.00 -1.77 114.58 119.03 1bu7 h GLU 252 Ca 0.06 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1bu7 h GLU 252 Cb 0.29 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1bu7 h GLU 252 CO 0.01 0.37 0.18 -0.97 -0.73 0.00 0.00 179.01 177.87 1bu7 h ASN 253 N -0.22 0.70 -0.83 1.04 -0.73 -1.84 -1.38 115.58 112.32 1bu7 h ASN 253 Ca 0.01 -0.10 0.02 0.00 1.87 0.00 0.00 56.30 58.10 1bu7 h ASN 253 Cb 0.33 -0.18 -0.04 0.00 0.27 0.00 0.00 38.32 38.70 1bu7 h ASN 253 CO 0.00 0.65 0.54 0.40 -0.37 0.00 0.00 177.43 178.65 1bu7 h ILE 254 N 0.75 1.18 -0.51 2.57 2.04 -1.07 0.53 117.51 123.00 1bu7 h ILE 254 Ca 0.18 -0.37 0.01 0.00 1.00 0.00 0.00 64.86 65.67 1bu7 h ILE 254 Cb 0.19 -0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.25 1bu7 h ILE 254 CO -0.01 0.20 0.34 -0.09 0.00 0.00 0.00 178.15 178.58 1bu7 h ARG 255 N 1.09 0.66 -0.52 2.37 2.43 -0.50 -1.42 114.38 118.49 1bu7 h ARG 255 Ca 0.31 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.41 1bu7 h ARG 255 Cb -0.08 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.29 1bu7 h ARG 255 CO -0.08 0.44 0.17 1.88 -1.51 0.00 0.00 179.97 180.87 1bu7 h TYR 256 N 0.68 0.78 -0.63 2.20 0.05 -0.45 -1.49 116.97 118.12 1bu7 h TYR 256 Ca 0.19 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.88 1bu7 h TYR 256 Cb -0.07 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 37.41 1bu7 h TYR 256 CO -0.04 0.63 0.26 1.96 -1.05 0.00 0.00 178.16 179.92 1bu7 h GLN 257 N 0.76 0.94 -0.27 4.88 1.08 -0.45 0.59 115.11 122.63 1bu7 h GLN 257 Ca 0.18 -0.17 -0.02 0.00 -1.45 0.00 0.00 58.65 57.19 1bu7 h GLN 257 Cb 0.21 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.47 1bu7 h GLN 257 CO -0.01 0.79 0.09 0.82 -0.95 0.00 0.00 178.83 179.57 1bu7 h ILE 258 N 0.88 1.19 -0.75 2.54 2.04 -0.78 -0.22 117.51 122.42 1bu7 h ILE 258 Ca 0.21 -0.61 0.07 0.00 1.00 0.00 0.00 64.86 65.53 1bu7 h ILE 258 Cb 0.19 1.09 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 1bu7 h ILE 258 CO -0.02 0.20 0.42 0.40 0.00 0.00 0.00 178.15 179.16 1bu7 h ILE 259 N 0.28 0.95 -0.52 -0.67 2.04 -1.10 -2.50 117.51 115.99 1bu7 h ILE 259 Ca 0.09 -0.26 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 1bu7 h ILE 259 Cb 0.23 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1bu7 h ILE 259 CO -0.00 0.14 0.08 0.74 0.00 0.00 0.00 178.15 179.11 1bu7 h THR 260 N 0.75 1.25 -0.87 -0.27 2.02 -0.42 -0.61 112.91 114.77 1bu7 h THR 260 Ca 0.35 -0.95 0.06 0.00 0.77 0.00 0.00 66.41 66.64 1bu7 h THR 260 Cb 0.26 0.86 -0.06 0.00 -1.74 0.00 0.00 68.15 67.47 1bu7 h THR 260 CO -0.21 0.34 0.54 -0.26 0.37 0.00 0.00 175.52 176.30 1bu7 h PHE 261 N 0.74 1.01 -0.23 3.16 0.04 -0.62 0.12 116.94 121.15 1bu7 h PHE 261 Ca 0.16 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.89 1bu7 h PHE 261 Cb 0.40 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 1bu7 h PHE 261 CO 0.03 0.52 -0.09 -0.07 -0.60 0.00 0.00 178.31 178.09 1bu7 h LEU 262 N 1.00 0.48 -0.33 1.54 3.38 -1.07 -1.62 115.31 118.69 1bu7 h LEU 262 Ca 0.38 -0.40 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1bu7 h LEU 262 Cb 0.15 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1bu7 h LEU 262 CO -0.17 0.77 0.02 0.40 0.09 0.00 0.00 178.44 179.55 1bu7 h ILE 263 N 0.19 1.25 0.00 1.22 2.04 -0.69 -1.93 117.51 119.59 1bu7 h ILE 263 Ca 0.05 -0.92 -0.14 0.00 1.00 0.00 0.00 64.86 64.86 1bu7 h ILE 263 Cb 0.58 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1bu7 h ILE 263 CO 0.03 0.30 -0.66 0.00 0.00 0.00 0.00 178.15 177.82 1bu7 h ALA 264 N 0.87 0.80 0.00 1.87 0.00 -0.79 -3.35 119.26 118.66 1bu7 h ALA 264 Ca 0.10 -0.60 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 1bu7 h ALA 264 Cb 0.42 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1bu7 h ALA 264 CO 0.01 0.83 -2.02 0.41 0.00 0.00 0.00 179.25 178.47 1bu7 n GLY 265 N 0.59 -0.90 0.06 0.00 0.00 -0.61 -4.48 105.19 99.85 1bu7 n GLY 265 Ca -0.00 -0.41 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 1bu7 n GLY 265 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1bu7 h HIS 266 N 0.00 0.03 0.05 1.61 2.07 -1.48 -2.89 115.15 114.55 1bu7 h HIS 266 Ca -0.17 -0.01 -0.31 0.00 -2.85 0.00 0.00 60.37 57.03 1bu7 h HIS 266 Cb 1.33 -0.01 -0.03 0.00 2.57 0.00 0.00 27.41 31.27 1bu7 h HIS 266 CO 0.00 0.51 -1.71 0.93 -3.07 0.00 0.00 177.93 174.59 1bu7 h GLU 267 N -0.46 0.11 -0.21 5.12 4.39 -1.84 -2.59 114.58 119.10 1bu7 h GLU 267 Ca 0.00 -0.18 0.02 0.00 0.34 0.00 0.00 59.36 59.53 1bu7 h GLU 267 Cb 0.51 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.21 1bu7 h GLU 267 CO 0.00 0.81 0.10 1.79 -1.16 0.00 0.00 179.01 180.54 1bu7 h THR 268 N 0.03 0.98 -0.17 1.13 1.35 -1.79 0.22 112.91 114.66 1bu7 h THR 268 Ca -0.30 -0.07 -0.19 0.00 -0.55 0.00 0.00 66.41 65.30 1bu7 h THR 268 Cb 2.01 0.75 -0.00 0.00 -1.73 0.00 0.00 68.15 69.18 1bu7 h THR 268 CO 0.10 0.04 -0.65 0.74 -0.25 0.00 0.00 175.52 175.50 1bu7 h THR 269 N 0.21 1.31 -0.49 6.82 2.02 -1.63 -2.03 112.91 119.13 1bu7 h THR 269 Ca 0.09 -1.90 -0.10 0.00 0.77 0.00 0.00 66.41 65.26 1bu7 h THR 269 Cb 0.03 1.87 -0.02 0.00 -1.74 0.00 0.00 68.15 68.30 1bu7 h THR 269 CO -0.07 0.60 -0.10 0.77 0.37 0.00 0.00 175.52 177.09 1bu7 h SER 270 N 0.47 0.93 -0.69 4.18 4.64 -1.37 -1.98 113.55 119.72 1bu7 h SER 270 Ca -0.01 -0.35 -0.01 0.00 -0.47 0.00 0.00 61.79 60.94 1bu7 h SER 270 Cb 1.23 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 63.03 1bu7 h SER 270 CO 0.13 1.06 0.38 1.23 -0.87 0.00 0.00 176.83 178.76 1bu7 h GLY 271 N 0.78 1.03 0.50 -0.77 0.00 -0.48 -1.41 103.07 102.73 1bu7 h GLY 271 Ca 0.13 -0.47 0.04 0.00 0.00 0.00 0.00 47.33 47.02 1bu7 h GLY 271 CO 0.04 0.45 -0.16 -2.00 0.00 0.00 0.00 176.54 174.88 1bu7 h LEU 272 N 0.95 -0.48 -1.32 3.11 5.85 -1.18 0.12 115.31 122.36 1bu7 h LEU 272 Ca 0.24 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 59.03 1bu7 h LEU 272 Cb 0.04 0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1bu7 h LEU 272 CO -0.04 -0.21 0.29 -0.07 -0.34 0.00 0.00 178.44 178.08 1bu7 h LEU 273 N -0.21 0.67 -0.05 2.25 3.38 -1.16 -0.78 115.31 119.41 1bu7 h LEU 273 Ca 0.08 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1bu7 h LEU 273 Cb 0.33 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1bu7 h LEU 273 CO -0.22 0.55 -0.04 0.28 0.09 0.00 0.00 178.44 179.10 1bu7 h SER 274 N 0.76 0.13 -0.38 -0.43 0.02 -0.75 -2.08 113.55 110.82 1bu7 h SER 274 Ca 0.20 -0.46 -0.04 0.00 -0.84 0.00 0.00 61.79 60.65 1bu7 h SER 274 Cb 0.03 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1bu7 h SER 274 CO -0.03 0.56 0.12 -0.26 -1.14 0.00 0.00 176.83 176.08 1bu7 h PHE 275 N -0.30 0.68 -0.48 3.45 0.04 -0.60 -0.91 116.94 118.81 1bu7 h PHE 275 Ca 0.01 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 1bu7 h PHE 275 Cb 0.52 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 1bu7 h PHE 275 CO 0.08 0.58 0.22 0.00 -0.60 0.00 0.00 178.31 178.59 1bu7 h ALA 276 N 1.48 0.62 -0.46 2.45 0.00 -1.03 0.15 119.26 122.47 1bu7 h ALA 276 Ca 0.15 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 1bu7 h ALA 276 Cb 0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1bu7 h ALA 276 CO -0.00 0.19 -0.20 1.25 0.00 0.00 0.00 179.25 180.48 1bu7 h LEU 277 N 0.63 0.92 0.02 0.00 5.85 -1.14 -0.61 115.31 120.98 1bu7 h LEU 277 Ca 0.16 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.57 1bu7 h LEU 277 Cb 0.13 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 1bu7 h LEU 277 CO -0.02 1.09 -0.48 0.22 -0.34 0.00 0.00 178.44 178.91 1bu7 h TYR 278 N 0.79 -1.39 -0.63 1.25 3.20 -0.85 -0.73 116.97 118.62 1bu7 h TYR 278 Ca 0.11 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 1bu7 h TYR 278 Cb 0.74 0.60 -0.03 0.00 1.54 0.00 0.00 36.73 39.59 1bu7 h TYR 278 CO 0.04 -0.54 0.28 0.74 -1.64 0.00 0.00 178.16 177.04 1bu7 h PHE 279 N -0.64 0.91 -0.57 -3.82 0.04 -0.75 -1.89 116.94 110.22 1bu7 h PHE 279 Ca 0.03 -0.04 -0.04 0.00 2.80 0.00 0.00 57.97 60.71 1bu7 h PHE 279 Cb 0.70 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.54 1bu7 h PHE 279 CO -0.46 0.69 0.19 -0.07 -0.60 0.00 0.00 178.31 178.05 1bu7 h LEU 280 N 0.90 0.83 -0.74 1.54 3.38 -0.71 -1.48 115.31 119.03 1bu7 h LEU 280 Ca 0.22 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1bu7 h LEU 280 Cb 0.14 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1bu7 h LEU 280 CO -0.02 0.81 -0.16 -0.37 0.09 0.00 0.00 178.44 178.78 1bu7 h VAL 281 N 0.80 0.33 0.00 1.22 -1.51 -0.88 -2.44 116.25 113.77 1bu7 h VAL 281 Ca 0.18 -1.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.53 1bu7 h VAL 281 Cb 0.27 1.87 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 1bu7 h VAL 281 CO -0.01 0.16 -0.09 0.29 -1.23 0.00 0.00 177.57 176.69 1bu7 n LYS 282 N -3.22 0.19 -3.23 5.19 4.76 -0.73 -4.22 118.16 116.90 1bu7 n LYS 282 Ca 0.02 0.14 -0.24 0.00 -2.87 0.00 0.00 58.31 55.35 1bu7 n LYS 282 Cb 0.47 -1.71 -0.06 0.00 -1.84 0.00 0.00 35.03 31.89 1bu7 n LYS 282 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1bu7 n ASN 283 N -2.04 1.80 0.13 4.39 3.02 -0.58 -4.99 115.26 117.00 1bu7 n ASN 283 Ca 0.06 -3.07 0.15 0.00 -0.03 0.00 0.00 54.58 51.68 1bu7 n ASN 283 Cb 0.41 -0.64 0.69 0.00 -0.61 0.00 0.00 39.78 39.63 1bu7 n ASN 283 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1bu7 h PRO 284 N 3.77 0.00 -0.14 3.52 0.13 -1.71 0.27 132.00 137.84 1bu7 h PRO 284 Ca 0.12 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.17 1bu7 h PRO 284 Cb 0.79 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 1bu7 h PRO 284 CO 0.62 0.00 -0.25 0.45 -0.23 0.00 0.00 178.00 178.58 1bu7 h HIS 285 N 0.00 0.28 -0.18 1.56 3.86 -1.94 0.17 115.15 118.89 1bu7 h HIS 285 Ca 0.13 -0.05 -0.13 0.00 -1.16 0.00 0.00 60.37 59.15 1bu7 h HIS 285 Cb 0.53 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.93 1bu7 h HIS 285 CO 0.00 0.49 -0.41 0.28 0.86 0.00 0.00 177.93 179.15 1bu7 h VAL 286 N 0.23 1.33 -0.36 2.45 2.07 -0.81 -2.58 116.25 118.58 1bu7 h VAL 286 Ca 0.04 -1.65 0.07 0.00 0.82 0.00 0.00 66.70 65.98 1bu7 h VAL 286 Cb 0.57 1.91 -0.07 0.00 -1.52 0.00 0.00 31.29 32.19 1bu7 h VAL 286 CO 0.04 0.51 -0.10 0.25 0.02 0.00 0.00 177.57 178.29 1bu7 h LEU 287 N 0.27 -0.36 -0.97 2.57 6.46 -1.14 -0.80 115.31 121.34 1bu7 h LEU 287 Ca 0.00 0.11 0.06 0.00 -0.12 0.00 0.00 57.88 57.93 1bu7 h LEU 287 Cb 1.01 0.24 -0.06 0.00 -0.73 0.00 0.00 40.66 41.11 1bu7 h LEU 287 CO 0.09 -0.13 0.62 -0.61 -0.62 0.00 0.00 178.44 177.79 1bu7 h GLN 288 N -0.01 1.11 -0.47 1.25 4.15 -0.85 0.26 115.11 120.56 1bu7 h GLN 288 Ca 0.18 -0.07 -0.04 0.00 0.77 0.00 0.00 58.65 59.49 1bu7 h GLN 288 Cb 0.28 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 1bu7 h GLN 288 CO -0.38 0.74 0.14 -0.22 -1.93 0.00 0.00 178.83 177.18 1bu7 h LYS 289 N 1.15 0.73 -0.30 1.69 3.64 -1.00 0.75 116.57 123.23 1bu7 h LYS 289 Ca 0.41 -0.16 -0.12 0.00 -1.27 0.00 0.00 60.65 59.51 1bu7 h LYS 289 Cb 0.13 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1bu7 h LYS 289 CO -0.16 0.70 -0.32 0.00 -2.27 0.00 0.00 179.45 177.40 1bu7 h ALA 290 N 1.00 0.88 -0.04 5.00 0.00 -0.58 -2.42 119.26 123.10 1bu7 h ALA 290 Ca 0.15 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 1bu7 h ALA 290 Cb 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1bu7 h ALA 290 CO -0.00 0.63 -0.44 0.00 0.00 0.00 0.00 179.25 179.44 1bu7 h ALA 291 N 1.10 1.20 -0.60 0.00 0.00 -0.21 -1.94 119.26 118.81 1bu7 h ALA 291 Ca 0.06 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 1bu7 h ALA 291 Cb 0.82 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1bu7 h ALA 291 CO 0.07 0.57 0.08 0.93 0.00 0.00 0.00 179.25 180.90 1bu7 h GLU 292 N 0.07 1.00 -0.68 0.00 5.08 -0.41 -1.62 114.58 118.02 1bu7 h GLU 292 Ca 0.00 -0.28 -0.06 0.00 -1.00 0.00 0.00 59.36 58.03 1bu7 h GLU 292 Cb 0.81 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.91 1bu7 h GLU 292 CO 0.06 0.95 0.19 1.49 -1.00 0.00 0.00 179.01 180.70 1bu7 h GLU 293 N 0.90 1.05 -0.54 2.33 4.81 -1.10 -0.85 114.58 121.18 1bu7 h GLU 293 Ca 0.18 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1bu7 h GLU 293 Cb 0.44 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1bu7 h GLU 293 CO 0.01 0.91 0.30 0.00 -0.73 0.00 0.00 179.01 179.51 1bu7 h ALA 294 N 1.19 0.70 -0.41 2.92 0.00 -1.13 -0.49 119.26 122.03 1bu7 h ALA 294 Ca 0.22 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1bu7 h ALA 294 Cb 0.32 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1bu7 h ALA 294 CO -0.00 0.21 -0.10 0.00 0.00 0.00 0.00 179.25 179.36 1bu7 h ALA 295 N 1.13 0.57 -0.35 0.00 0.00 -1.02 -1.03 119.26 118.55 1bu7 h ALA 295 Ca 0.19 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1bu7 h ALA 295 Cb 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1bu7 h ALA 295 CO -0.03 0.44 -0.14 -0.09 0.00 0.00 0.00 179.25 179.43 1bu7 h ARG 296 N 0.61 0.72 0.06 0.00 2.43 -0.85 -3.37 114.38 113.98 1bu7 h ARG 296 Ca 0.10 -0.30 -0.12 0.00 -0.81 0.00 0.00 59.98 58.85 1bu7 h ARG 296 Cb 0.63 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1bu7 h ARG 296 CO 0.04 0.90 -0.59 0.28 -1.51 0.00 0.00 179.97 179.10 1bu7 h VAL 297 N 0.50 1.52 -0.59 0.20 2.07 -1.09 -3.40 116.25 115.45 1bu7 h VAL 297 Ca 0.08 -2.41 -0.73 0.00 0.82 0.00 0.00 66.70 64.47 1bu7 h VAL 297 Cb 0.67 3.13 -0.09 0.00 -1.52 0.00 0.00 31.29 33.49 1bu7 h VAL 297 CO 0.05 0.63 2.67 0.18 0.02 0.00 0.00 177.57 181.12 1bu7 n LEU 298 N -4.34 6.81 -0.11 2.57 4.77 -0.40 -4.70 117.00 121.62 1bu7 n LEU 298 Ca -0.15 -4.36 0.14 0.00 -0.03 0.00 0.00 56.01 51.61 1bu7 n LEU 298 Cb 0.67 -1.58 0.66 0.00 -2.33 0.00 0.00 43.42 40.85 1bu7 n LEU 298 CO 0.39 1.24 0.92 1.33 -1.33 0.00 0.00 177.39 179.94 1bu7 n VAL 299 N 4.30 0.00 -4.29 4.08 0.24 -1.26 -4.85 118.33 116.56 1bu7 n VAL 299 Ca 0.47 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.34 62.43 1bu7 n VAL 299 Cb 0.38 -0.16 -0.10 0.00 -1.47 0.00 0.00 33.84 32.48 1bu7 n VAL 299 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1bu7 s ASP 300 N -2.42 4.09 0.22 -1.34 1.01 -1.26 -5.05 116.67 111.92 1bu7 s ASP 300 Ca 0.31 -0.54 -0.09 0.00 0.71 0.00 0.00 52.55 52.94 1bu7 s ASP 300 Cb 0.20 -0.65 0.32 0.00 1.01 0.00 0.00 42.92 43.80 1bu7 s ASP 300 CO 0.46 0.15 1.69 -0.65 0.21 0.00 0.00 175.17 177.02 1bu7 h PRO 301 N 3.44 0.20 -4.86 8.23 0.10 -1.85 -3.36 132.00 133.90 1bu7 h PRO 301 Ca -0.49 -0.01 -0.65 0.00 0.10 0.00 0.00 66.00 64.95 1bu7 h PRO 301 Cb 1.18 -0.04 -0.18 0.00 0.10 0.00 0.00 31.00 32.06 1bu7 h PRO 301 CO 0.50 0.13 -0.52 0.08 0.10 0.00 0.00 178.00 178.29 1bu7 s VAL 302 N -6.11 5.22 0.43 3.15 1.01 -1.26 -4.77 120.40 118.06 1bu7 s VAL 302 Ca -0.13 0.06 -0.25 0.00 0.00 0.00 0.00 61.98 61.66 1bu7 s VAL 302 Cb 0.19 -3.53 -0.08 0.00 0.00 0.00 0.00 36.38 32.96 1bu7 s VAL 302 CO 0.74 0.20 1.27 -2.84 0.00 0.00 0.00 175.10 174.47 1bu7 s PRO 303 N 1.74 3.84 0.35 2.72 0.02 -1.26 -5.03 135.00 137.38 1bu7 s PRO 303 Ca 0.07 2.07 0.05 0.00 0.02 0.00 0.00 61.00 63.20 1bu7 s PRO 303 Cb -0.16 -2.63 -0.01 0.00 0.02 0.00 0.00 34.50 31.72 1bu7 s PRO 303 CO 0.10 -0.57 0.50 -1.54 -0.33 0.00 0.00 177.00 175.16 1bu7 s SER 304 N -0.91 5.99 0.17 2.53 1.04 -1.26 -4.99 113.70 116.27 1bu7 s SER 304 Ca 0.60 -0.04 -0.15 0.00 0.48 0.00 0.00 55.95 56.84 1bu7 s SER 304 Cb -0.36 -1.39 0.11 0.00 0.10 0.00 0.00 66.02 64.48 1bu7 s SER 304 CO 0.45 -0.44 1.75 0.22 0.98 0.00 0.00 173.24 176.20 1bu7 h TYR 305 N 0.82 0.25 -0.71 5.02 3.20 -1.96 -2.31 116.97 121.28 1bu7 h TYR 305 Ca -0.47 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.48 1bu7 h TYR 305 Cb 1.25 -0.05 -0.05 0.00 1.54 0.00 0.00 36.73 39.42 1bu7 h TYR 305 CO 0.43 0.09 0.41 0.87 -1.64 0.00 0.00 178.16 178.33 1bu7 h LYS 306 N 0.30 0.75 -0.16 1.82 6.56 -1.99 -2.21 116.57 121.64 1bu7 h LYS 306 Ca 0.20 -0.05 -0.00 0.00 -1.06 0.00 0.00 60.65 59.74 1bu7 h LYS 306 Cb 0.19 -0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 31.68 1bu7 h LYS 306 CO -0.21 0.50 0.10 1.96 -2.06 0.00 0.00 179.45 179.73 1bu7 h GLN 307 N 0.77 0.22 -0.87 3.15 4.20 -1.88 -2.38 115.11 118.33 1bu7 h GLN 307 Ca 0.31 -0.02 0.10 0.00 0.06 0.00 0.00 58.65 59.10 1bu7 h GLN 307 Cb 0.14 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 27.82 1bu7 h GLN 307 CO -0.16 0.20 0.56 0.28 -0.67 0.00 0.00 178.83 179.04 1bu7 h VAL 308 N 0.18 0.95 0.00 -0.54 2.07 -1.05 0.60 116.25 118.47 1bu7 h VAL 308 Ca 0.06 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 1bu7 h VAL 308 Cb 0.04 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 29.86 1bu7 h VAL 308 CO -0.01 0.15 -0.00 0.11 0.02 0.00 0.00 177.57 177.84 1bu7 h LYS 309 N 0.83 0.00 -0.11 1.57 1.79 -0.89 -2.27 116.57 117.48 1bu7 h LYS 309 Ca 0.40 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.87 1bu7 h LYS 309 Cb 0.44 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1bu7 h LYS 309 CO -0.17 0.00 0.00 1.04 -1.08 0.00 0.00 179.45 179.24 1bu7 n GLN 310 N -3.09 1.70 -1.99 3.15 1.13 0.20 -4.56 117.38 113.91 1bu7 n GLN 310 Ca -0.01 -1.03 -0.41 0.00 -1.94 0.00 0.00 57.00 53.61 1bu7 n GLN 310 Cb 0.19 -1.43 -0.00 0.00 0.11 0.00 0.00 30.24 29.11 1bu7 n GLN 310 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1bu7 n LEU 311 N 0.25 7.79 -0.04 1.08 4.77 -0.86 -4.77 117.00 125.23 1bu7 n LEU 311 Ca 0.17 -4.77 -0.11 0.00 -0.03 0.00 0.00 56.01 51.28 1bu7 n LEU 311 Cb 0.33 -1.41 -0.04 0.00 -2.33 0.00 0.00 43.42 39.97 1bu7 n LEU 311 CO 0.14 1.89 0.89 0.50 -1.33 0.00 0.00 177.39 179.48 1bu7 h LYS 312 N 4.93 0.24 -0.54 3.23 3.64 -1.86 -1.45 116.57 124.77 1bu7 h LYS 312 Ca 0.65 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.90 1bu7 h LYS 312 Cb 0.38 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 1bu7 h LYS 312 CO 1.55 0.24 -0.05 -0.92 -2.27 0.00 0.00 179.45 178.01 1bu7 h TYR 313 N 0.17 1.06 -0.92 1.91 3.20 -1.98 -0.41 116.97 120.00 1bu7 h TYR 313 Ca 0.06 -0.19 0.07 0.00 3.14 0.00 0.00 58.73 61.82 1bu7 h TYR 313 Cb 0.08 -0.27 -0.07 0.00 1.54 0.00 0.00 36.73 38.00 1bu7 h TYR 313 CO -0.04 0.97 0.57 0.28 -1.64 0.00 0.00 178.16 178.30 1bu7 h VAL 314 N 0.88 1.02 -0.86 1.81 2.07 -1.85 -0.61 116.25 118.71 1bu7 h VAL 314 Ca 0.15 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 1bu7 h VAL 314 Cb 0.58 -0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1bu7 h VAL 314 CO 0.04 0.19 0.44 1.23 0.02 0.00 0.00 177.57 179.48 1bu7 h GLY 315 N 1.02 1.31 1.03 2.17 0.00 -0.30 -1.62 103.07 106.67 1bu7 h GLY 315 Ca 0.41 -0.63 -0.05 0.00 0.00 0.00 0.00 47.33 47.06 1bu7 h GLY 315 CO -0.19 0.60 0.21 -0.33 0.00 0.00 0.00 176.54 176.82 1bu7 h MET 316 N 1.22 1.03 -0.36 4.80 2.07 -0.19 -0.52 114.93 122.98 1bu7 h MET 316 Ca 0.30 -0.22 0.02 0.00 -2.07 0.00 0.00 59.70 57.72 1bu7 h MET 316 Cb 0.08 -0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 29.64 1bu7 h MET 316 CO -0.04 0.90 0.21 0.28 1.07 0.00 0.00 176.91 179.33 1bu7 h VAL 317 N 0.97 1.04 -0.58 -2.22 2.07 -0.78 -0.17 116.25 116.57 1bu7 h VAL 317 Ca 0.21 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.56 1bu7 h VAL 317 Cb 0.30 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1bu7 h VAL 317 CO -0.01 0.08 0.25 -0.07 0.02 0.00 0.00 177.57 177.84 1bu7 h LEU 318 N 0.43 0.79 -0.85 2.57 3.38 -1.09 -0.94 115.31 119.61 1bu7 h LEU 318 Ca 0.14 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1bu7 h LEU 318 Cb 0.00 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1bu7 h LEU 318 CO -0.07 0.74 0.05 0.78 0.09 0.00 0.00 178.44 180.03 1bu7 h ASN 319 N 0.80 0.87 0.39 -0.43 2.35 -0.79 -0.87 115.58 117.91 1bu7 h ASN 319 Ca 0.20 -0.21 -0.13 0.00 -0.55 0.00 0.00 56.30 55.61 1bu7 h ASN 319 Cb 0.18 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1bu7 h ASN 319 CO -0.02 0.90 -0.54 -0.08 -1.65 0.00 0.00 177.43 176.04 1bu7 h GLU 320 N 0.85 0.16 -0.54 0.81 4.57 -0.74 0.11 114.58 119.80 1bu7 h GLU 320 Ca 0.17 -0.10 -0.08 0.00 -1.18 0.00 0.00 59.36 58.17 1bu7 h GLU 320 Cb 0.44 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 1bu7 h GLU 320 CO 0.02 0.67 0.02 0.00 -1.18 0.00 0.00 179.01 178.54 1bu7 h ALA 321 N 1.31 1.02 -0.25 2.92 0.00 -0.85 -2.22 119.26 121.20 1bu7 h ALA 321 Ca -0.00 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 1bu7 h ALA 321 Cb 1.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1bu7 h ALA 321 CO 0.08 0.61 -0.09 -0.07 0.00 0.00 0.00 179.25 179.78 1bu7 h LEU 322 N 0.84 0.38 0.16 0.00 3.38 -0.70 -0.58 115.31 118.78 1bu7 h LEU 322 Ca 0.16 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1bu7 h LEU 322 Cb 0.47 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1bu7 h LEU 322 CO 0.02 0.51 -0.08 -0.09 0.09 0.00 0.00 178.44 178.89 1bu7 h ARG 323 N 0.38 -0.20 -0.33 1.13 2.43 -0.37 -2.60 114.38 114.82 1bu7 h ARG 323 Ca 0.08 0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.11 1bu7 h ARG 323 Cb 0.39 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1bu7 h ARG 323 CO 0.02 0.10 -0.39 -0.07 -1.51 0.00 0.00 179.97 178.12 1bu7 h LEU 324 N -0.52 0.91 -6.30 3.80 3.38 -1.36 -3.39 115.31 111.83 1bu7 h LEU 324 Ca -0.02 -0.49 -0.58 0.00 0.09 0.00 0.00 57.88 56.88 1bu7 h LEU 324 Cb 0.40 -0.26 -0.39 0.00 0.09 0.00 0.00 40.66 40.50 1bu7 h LEU 324 CO 0.04 1.22 -0.95 0.79 0.09 0.00 0.00 178.44 179.62 1bu7 n TRP 325 N -4.12 0.09 -1.78 1.13 7.02 -0.23 -4.88 117.44 114.67 1bu7 n TRP 325 Ca -0.03 -3.57 -0.42 0.00 -1.02 0.00 0.00 57.50 52.46 1bu7 n TRP 325 Cb 0.54 -0.11 -0.03 0.00 -2.42 0.00 0.00 31.31 29.29 1bu7 n TRP 325 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 1bu7 s PRO 326 N -0.74 4.15 0.00 -0.99 0.04 -0.98 -4.64 135.00 131.84 1bu7 s PRO 326 Ca 0.33 2.54 0.27 0.00 0.04 0.00 0.00 61.00 64.19 1bu7 s PRO 326 Cb 0.08 -3.16 0.93 0.00 0.04 0.00 0.00 34.50 32.39 1bu7 s PRO 326 CO -0.15 -0.73 1.71 0.25 0.04 0.00 0.00 177.00 178.12 1bu7 n THR 327 N 4.09 0.00 -3.64 1.26 -2.24 -1.26 -3.27 114.28 109.22 1bu7 n THR 327 Ca 0.16 -0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.57 1bu7 n THR 327 Cb 0.36 -0.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.36 1bu7 n THR 327 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bu7 s ALA 328 N -2.98 4.14 -1.21 6.98 0.00 -1.26 -1.58 121.76 125.86 1bu7 s ALA 328 Ca 0.13 -3.74 0.25 0.00 0.00 0.00 0.00 51.96 48.60 1bu7 s ALA 328 Cb 0.18 -2.82 1.15 0.00 0.00 0.00 0.00 23.12 21.63 1bu7 s ALA 328 CO 0.60 -2.15 1.81 -0.35 0.00 0.00 0.00 175.76 175.67 1bu7 n PRO 329 N 2.54 0.17 -3.76 0.00 -0.04 -1.20 -4.79 135.00 127.93 1bu7 n PRO 329 Ca 0.19 0.07 -0.13 0.00 -0.04 0.00 0.00 63.50 63.59 1bu7 n PRO 329 Cb 0.37 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 1bu7 n PRO 329 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bu7 s ALA 330 N -2.79 -0.78 0.04 0.55 0.00 -1.26 -1.39 121.76 116.13 1bu7 s ALA 330 Ca 0.18 0.30 -0.02 0.00 0.00 0.00 0.00 51.96 52.41 1bu7 s ALA 330 Cb 0.16 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.36 1bu7 s ALA 330 CO 0.41 -0.28 0.01 -0.59 0.00 0.00 0.00 175.76 175.31 1bu7 s PHE 331 N -1.47 0.37 -0.03 0.00 -0.71 -1.14 -4.97 117.98 110.03 1bu7 s PHE 331 Ca -0.13 -0.80 0.02 0.00 -1.04 0.00 0.00 56.93 54.98 1bu7 s PHE 331 Cb -0.05 -0.27 -0.03 0.00 -1.21 0.00 0.00 43.02 41.46 1bu7 s PHE 331 CO 0.03 -0.34 -0.06 0.45 -1.34 0.00 0.00 175.22 173.97 1bu7 s SER 332 N -2.41 4.73 0.10 1.98 0.15 -1.26 -0.61 113.70 116.38 1bu7 s SER 332 Ca -0.01 -0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.60 1bu7 s SER 332 Cb 0.02 -1.16 -0.04 0.00 -1.71 0.00 0.00 66.02 63.13 1bu7 s SER 332 CO -0.07 0.32 -0.09 -0.76 1.20 0.00 0.00 173.24 173.84 1bu7 s LEU 333 N -1.19 2.45 0.06 3.45 1.43 -0.04 -1.16 118.68 123.69 1bu7 s LEU 333 Ca 0.15 -0.89 0.04 0.00 -1.03 0.00 0.00 54.13 52.41 1bu7 s LEU 333 Cb -0.11 -0.24 -0.03 0.00 0.03 0.00 0.00 46.19 45.84 1bu7 s LEU 333 CO 0.05 -0.33 -0.13 -0.72 0.23 0.00 0.00 176.35 175.46 1bu7 s TYR 334 N -2.89 1.08 -0.09 0.29 1.13 -0.25 -1.48 117.35 115.15 1bu7 s TYR 334 Ca 0.09 -0.46 -0.30 0.00 -1.41 0.00 0.00 57.07 54.99 1bu7 s TYR 334 Cb 0.00 -0.62 -0.02 0.00 -1.10 0.00 0.00 41.96 40.22 1bu7 s TYR 334 CO -0.01 0.02 1.17 0.00 -2.51 0.00 0.00 175.55 174.22 1bu7 s ALA 335 N -1.27 3.52 0.23 9.51 0.00 0.00 -2.14 121.76 131.61 1bu7 s ALA 335 Ca -0.04 0.54 0.14 0.00 0.00 0.00 0.00 51.96 52.61 1bu7 s ALA 335 Cb -0.10 -3.52 0.52 0.00 0.00 0.00 0.00 23.12 20.02 1bu7 s ALA 335 CO 0.02 -0.81 1.68 0.87 0.00 0.00 0.00 175.76 177.51 1bu7 h LYS 336 N 7.51 0.00 -3.70 0.00 1.57 -1.55 0.15 116.57 120.55 1bu7 h LYS 336 Ca -0.32 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.39 1bu7 h LYS 336 Cb 1.15 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.34 1bu7 h LYS 336 CO 0.89 0.49 -0.21 -1.21 -0.57 0.00 0.00 179.45 178.85 1bu7 s GLU 337 N -3.65 1.23 0.27 3.15 0.41 -1.26 -4.76 118.70 114.10 1bu7 s GLU 337 Ca -0.01 -1.08 -0.29 0.00 -0.41 0.00 0.00 54.97 53.18 1bu7 s GLU 337 Cb 0.12 0.42 -0.14 0.00 -1.78 0.00 0.00 34.13 32.75 1bu7 s GLU 337 CO 0.73 -0.48 1.11 -0.25 -0.49 0.00 0.00 175.26 175.88 1bu7 n ASP 338 N -0.26 1.63 -3.65 -0.19 8.00 -1.26 -4.12 116.55 116.70 1bu7 n ASP 338 Ca -0.08 1.17 -0.06 0.00 0.71 0.00 0.00 54.79 56.53 1bu7 n ASP 338 Cb 0.63 -1.32 -0.02 0.00 -0.02 0.00 0.00 41.12 40.40 1bu7 n ASP 338 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1bu7 s THR 339 N -0.82 0.00 -0.18 -3.53 -1.32 -0.68 -4.91 115.64 104.19 1bu7 s THR 339 Ca 0.61 -0.41 -0.01 0.00 -1.21 0.00 0.00 61.69 60.66 1bu7 s THR 339 Cb -0.70 -1.57 -0.00 0.00 -1.51 0.00 0.00 72.50 68.71 1bu7 s THR 339 CO 0.58 0.00 -0.11 -0.69 -2.21 0.00 0.00 174.62 172.19 1bu7 s VAL 340 N -3.33 2.93 -0.11 5.08 1.01 -1.26 -0.21 120.40 124.51 1bu7 s VAL 340 Ca 0.09 -0.66 -0.22 0.00 0.00 0.00 0.00 61.98 61.19 1bu7 s VAL 340 Cb -0.02 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1bu7 s VAL 340 CO -0.02 0.48 0.64 -0.22 0.00 0.00 0.00 175.10 175.98 1bu7 s LEU 341 N 1.11 4.27 -1.53 3.92 2.96 -0.44 -4.15 118.68 124.83 1bu7 s LEU 341 Ca 0.01 1.04 0.00 0.00 -0.22 0.00 0.00 54.13 54.96 1bu7 s LEU 341 Cb -0.14 -2.97 0.00 0.00 0.50 0.00 0.00 46.19 43.58 1bu7 s LEU 341 CO -0.03 -0.13 0.00 0.61 -1.32 0.00 0.00 176.35 175.48 1bu7 n GLY 342 N 3.28 1.34 2.69 7.98 0.00 -1.26 -1.20 105.19 118.02 1bu7 n GLY 342 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1bu7 n GLY 342 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bu7 n GLY 343 N -1.16 0.19 0.00 -0.02 0.00 -1.26 -4.77 105.19 98.17 1bu7 n GLY 343 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1bu7 n GLY 343 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bu7 n GLU 344 N -0.55 1.31 -3.97 1.61 1.02 -0.60 -3.71 120.64 115.75 1bu7 n GLU 344 Ca 0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.81 1bu7 n GLU 344 Cb 0.30 -0.66 -0.14 0.00 -0.02 0.00 0.00 31.44 30.92 1bu7 n GLU 344 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1bu7 s TYR 345 N -1.32 3.55 0.29 -0.32 2.02 -0.34 -0.96 117.35 120.27 1bu7 s TYR 345 Ca 0.00 -2.57 -0.30 0.00 -0.37 0.00 0.00 57.07 53.83 1bu7 s TYR 345 Cb 0.00 -2.65 -0.10 0.00 -0.40 0.00 0.00 41.96 38.81 1bu7 s TYR 345 CO 0.00 -0.92 1.46 -2.14 -1.57 0.00 0.00 175.55 172.38 1bu7 s PRO 346 N 1.04 4.23 0.05 -1.71 0.02 -1.26 -1.33 135.00 136.05 1bu7 s PRO 346 Ca 0.04 2.38 0.06 0.00 0.02 0.00 0.00 61.00 63.50 1bu7 s PRO 346 Cb -0.20 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.23 1bu7 s PRO 346 CO -0.06 -0.44 -0.17 -0.51 -0.33 0.00 0.00 177.00 175.49 1bu7 s LEU 347 N -0.84 2.20 0.04 -5.54 1.43 0.71 -4.94 118.68 111.75 1bu7 s LEU 347 Ca 0.58 -0.53 -0.04 0.00 -1.03 0.00 0.00 54.13 53.10 1bu7 s LEU 347 Cb -0.43 -0.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.98 1bu7 s LEU 347 CO 0.48 0.07 0.26 -1.61 0.23 0.00 0.00 176.35 175.78 1bu7 s GLU 348 N -1.35 3.53 0.15 1.70 2.02 -1.26 -1.69 118.70 121.80 1bu7 s GLU 348 Ca 0.04 -0.21 -0.34 0.00 0.02 0.00 0.00 54.97 54.48 1bu7 s GLU 348 Cb -0.09 -3.03 -0.16 0.00 0.10 0.00 0.00 34.13 30.95 1bu7 s GLU 348 CO 0.02 0.61 1.21 1.17 0.02 0.00 0.00 175.26 178.29 1bu7 n LYS 349 N 0.70 1.15 0.00 1.61 4.81 -1.26 -0.82 118.16 124.35 1bu7 n LYS 349 Ca -0.08 0.41 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 1bu7 n LYS 349 Cb 0.52 -1.95 0.00 0.00 0.02 0.00 0.00 35.03 33.62 1bu7 n LYS 349 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bu7 n GLY 350 N 2.16 1.43 3.77 3.14 0.00 0.52 -4.95 105.19 111.25 1bu7 n GLY 350 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1bu7 n GLY 350 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bu7 s ASP 351 N -2.57 6.50 -0.04 1.61 1.01 0.00 -4.61 116.67 118.57 1bu7 s ASP 351 Ca 0.00 2.47 -0.03 0.00 0.71 0.00 0.00 52.55 55.70 1bu7 s ASP 351 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 1bu7 s ASP 351 CO 0.00 -0.70 0.14 -1.61 0.21 0.00 0.00 175.17 173.20 1bu7 s GLU 352 N -2.20 3.33 0.05 8.23 2.02 -1.26 -0.82 118.70 128.05 1bu7 s GLU 352 Ca 0.56 -0.31 0.09 0.00 0.02 0.00 0.00 54.97 55.32 1bu7 s GLU 352 Cb -0.34 -3.05 -0.03 0.00 0.10 0.00 0.00 34.13 30.81 1bu7 s GLU 352 CO 0.43 0.70 -0.24 -0.51 0.02 0.00 0.00 175.26 175.66 1bu7 s LEU 353 N -1.59 2.18 -0.13 1.80 1.02 -0.55 -2.79 118.68 118.62 1bu7 s LEU 353 Ca 0.22 -0.58 0.02 0.00 0.02 0.00 0.00 54.13 53.81 1bu7 s LEU 353 Cb -0.12 -1.15 0.01 0.00 0.02 0.00 0.00 46.19 44.95 1bu7 s LEU 353 CO 0.13 0.21 -0.18 -0.04 0.02 0.00 0.00 176.35 176.48 1bu7 s MET 354 N -1.29 2.61 -0.29 1.70 -1.94 0.66 -0.86 119.30 119.90 1bu7 s MET 354 Ca 0.10 -0.70 -0.22 0.00 -1.71 0.00 0.00 55.69 53.16 1bu7 s MET 354 Cb -0.10 -2.17 -0.01 0.00 2.01 0.00 0.00 34.83 34.56 1bu7 s MET 354 CO 0.02 -0.06 0.71 0.08 -0.01 0.00 0.00 175.02 175.77 1bu7 s VAL 355 N 0.95 4.88 -0.85 -6.03 1.01 0.22 -0.96 120.40 119.63 1bu7 s VAL 355 Ca -0.06 1.12 -0.16 0.00 0.00 0.00 0.00 61.98 62.89 1bu7 s VAL 355 Cb -0.15 -4.05 0.18 0.00 0.00 0.00 0.00 36.38 32.36 1bu7 s VAL 355 CO -0.03 -0.13 0.88 -0.22 0.00 0.00 0.00 175.10 175.60 1bu7 s LEU 356 N 2.74 6.13 0.17 3.92 2.96 -0.76 -2.88 118.68 130.97 1bu7 s LEU 356 Ca 0.29 -2.41 -0.12 0.00 -0.22 0.00 0.00 54.13 51.67 1bu7 s LEU 356 Cb -0.15 -2.28 0.07 0.00 0.50 0.00 0.00 46.19 44.33 1bu7 s LEU 356 CO 0.11 -0.76 1.70 0.40 -1.32 0.00 0.00 176.35 176.48 1bu7 h ILE 357 N 5.19 1.24 -0.09 6.68 2.04 -1.54 -1.41 117.51 129.62 1bu7 h ILE 357 Ca 0.10 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1bu7 h ILE 357 Cb 1.04 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1bu7 h ILE 357 CO 0.89 0.30 0.03 -0.65 0.00 0.00 0.00 178.15 178.72 1bu7 h PRO 358 N 0.82 0.12 -0.06 2.37 0.11 -1.88 -1.70 132.00 131.78 1bu7 h PRO 358 Ca 0.19 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 66.13 1bu7 h PRO 358 Cb 0.27 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.37 1bu7 h PRO 358 CO -0.01 0.11 -0.57 0.37 -0.21 0.00 0.00 178.00 177.70 1bu7 h GLN 359 N 0.12 0.50 -0.89 1.05 5.75 -1.69 -3.02 115.11 116.93 1bu7 h GLN 359 Ca 0.03 -0.45 0.23 0.00 -0.15 0.00 0.00 58.65 58.31 1bu7 h GLN 359 Cb 0.04 0.11 -0.13 0.00 1.07 0.00 0.00 27.48 28.57 1bu7 h GLN 359 CO -0.00 1.09 0.32 1.25 -2.65 0.00 0.00 178.83 178.83 1bu7 h LEU 360 N 0.07 0.17 0.00 -2.39 5.85 -0.85 0.12 115.31 118.27 1bu7 h LEU 360 Ca -0.05 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1bu7 h LEU 360 Cb 1.24 0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.47 1bu7 h LEU 360 CO 0.12 -0.09 0.00 1.41 -0.34 0.00 0.00 178.44 179.54 1bu7 n HIS 361 N -5.14 0.00 -0.62 1.25 8.25 -0.68 -1.90 115.22 116.38 1bu7 n HIS 361 Ca 0.22 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.74 1bu7 n HIS 361 Cb 0.69 -0.01 0.11 0.00 1.12 0.00 0.00 29.99 31.90 1bu7 n HIS 361 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1bu7 n ARG 362 N -1.01 2.21 -1.91 -0.41 1.74 0.39 -4.86 116.66 112.81 1bu7 n ARG 362 Ca 0.20 -2.20 -0.42 0.00 -0.77 0.00 0.00 57.85 54.66 1bu7 n ARG 362 Cb 0.10 -1.35 -0.03 0.00 -1.02 0.00 0.00 32.46 30.15 1bu7 n ARG 362 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1bu7 s ASP 363 N -1.96 5.72 0.45 0.55 -1.08 -0.80 -4.84 116.67 114.72 1bu7 s ASP 363 Ca 0.22 1.36 0.30 0.00 -0.52 0.00 0.00 52.55 53.91 1bu7 s ASP 363 Cb 0.18 -2.52 1.18 0.00 -1.46 0.00 0.00 42.92 40.29 1bu7 s ASP 363 CO 0.04 -1.83 1.88 0.11 0.52 0.00 0.00 175.17 175.89 1bu7 h LYS 364 N 13.64 0.00 0.00 4.34 1.57 -1.92 -1.32 116.57 132.88 1bu7 h LYS 364 Ca -0.34 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.37 1bu7 h LYS 364 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1bu7 h LYS 364 CO 1.03 0.00 -0.32 1.15 -0.57 0.00 0.00 179.45 180.74 1bu7 h THR 365 N 0.00 0.98 0.00 -0.16 2.02 -1.88 -1.10 112.91 112.76 1bu7 h THR 365 Ca 0.00 -1.22 -0.16 0.00 0.77 0.00 0.00 66.41 65.80 1bu7 h THR 365 Cb 0.51 1.71 -0.02 0.00 -1.74 0.00 0.00 68.15 68.61 1bu7 h THR 365 CO 0.00 0.32 -0.95 0.40 0.37 0.00 0.00 175.52 175.66 1bu7 h ILE 366 N 0.00 0.88 0.00 3.11 1.08 -1.72 -3.41 117.51 117.44 1bu7 h ILE 366 Ca -0.00 -2.00 0.00 0.00 -0.39 0.00 0.00 64.86 62.46 1bu7 h ILE 366 Cb 0.68 2.00 0.00 0.00 -3.07 0.00 0.00 36.82 36.43 1bu7 h ILE 366 CO 0.04 0.30 -1.08 0.79 -0.69 0.00 0.00 178.15 177.51 1bu7 n TRP 367 N -4.49 0.29 0.00 1.37 7.02 -0.58 -5.05 117.44 116.00 1bu7 n TRP 367 Ca -0.25 0.09 0.00 0.00 -1.02 0.00 0.00 57.50 56.32 1bu7 n TRP 367 Cb 0.58 -0.47 0.00 0.00 -2.42 0.00 0.00 31.31 29.00 1bu7 n TRP 367 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1bu7 n GLY 368 N 1.35 0.69 0.17 6.99 0.00 -0.42 -4.73 105.19 109.24 1bu7 n GLY 368 Ca 0.01 -2.02 0.09 0.00 0.00 0.00 0.00 46.02 44.10 1bu7 n GLY 368 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1bu7 h ASP 369 N 0.00 0.00 0.00 1.61 5.19 -1.95 -3.34 116.42 117.93 1bu7 h ASP 369 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1bu7 h ASP 369 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1bu7 h ASP 369 CO 0.00 0.17 0.00 -0.90 -3.12 0.00 0.00 179.24 175.39 1bu7 n ASP 370 N -3.06 4.70 0.32 6.45 5.75 -1.26 -4.63 116.55 124.82 1bu7 n ASP 370 Ca 0.02 -2.26 0.21 0.00 -0.01 0.00 0.00 54.79 52.75 1bu7 n ASP 370 Cb 0.61 -0.97 1.09 0.00 -1.03 0.00 0.00 41.12 40.81 1bu7 n ASP 370 CO 0.00 0.00 0.00 -0.37 -0.11 0.00 0.00 177.20 176.72 1bu7 h VAL 371 N 0.90 0.10 -0.00 2.12 -1.51 -1.89 -2.28 116.25 113.69 1bu7 h VAL 371 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 1bu7 h VAL 371 Cb 0.94 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.19 1bu7 h VAL 371 CO 0.00 0.01 -0.25 -0.62 -1.23 0.00 0.00 177.57 175.48 1bu7 n GLU 372 N -3.21 0.40 -2.99 5.19 -0.58 -1.26 -4.87 120.64 113.32 1bu7 n GLU 372 Ca -0.02 -0.18 -0.38 0.00 -0.42 0.00 0.00 57.16 56.15 1bu7 n GLU 372 Cb 0.11 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.43 1bu7 n GLU 372 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1bu7 s GLU 373 N -2.73 4.47 -0.61 3.49 0.41 -0.86 -5.01 118.70 117.86 1bu7 s GLU 373 Ca 0.20 1.09 -0.24 0.00 -0.41 0.00 0.00 54.97 55.61 1bu7 s GLU 373 Cb 0.19 -3.07 0.05 0.00 -1.78 0.00 0.00 34.13 29.52 1bu7 s GLU 373 CO 0.57 0.47 0.98 0.12 -0.49 0.00 0.00 175.26 176.91 1bu7 s PHE 374 N -1.33 2.70 -0.39 1.61 5.36 -1.26 -4.98 117.98 119.69 1bu7 s PHE 374 Ca 0.40 -0.23 0.01 0.00 -0.96 0.00 0.00 56.93 56.15 1bu7 s PHE 374 Cb -0.20 -4.21 0.14 0.00 -0.34 0.00 0.00 43.02 38.40 1bu7 s PHE 374 CO 0.24 -1.54 0.23 0.50 -1.46 0.00 0.00 175.22 173.19 1bu7 s ARG 375 N 4.16 0.82 0.57 10.12 3.52 -1.26 -5.00 118.95 131.88 1bu7 s ARG 375 Ca 0.27 -1.60 0.29 0.00 -0.13 0.00 0.00 55.73 54.57 1bu7 s ARG 375 Cb -0.14 -1.66 1.47 0.00 -1.56 0.00 0.00 34.95 33.06 1bu7 s ARG 375 CO 0.15 -1.20 1.91 -1.35 -0.81 0.00 0.00 175.30 174.00 1bu7 h PRO 376 N 6.85 0.00 0.00 5.12 0.11 -1.94 -1.90 132.00 140.24 1bu7 h PRO 376 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1bu7 h PRO 376 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1bu7 h PRO 376 CO 0.34 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.06 1bu7 h GLU 377 N 0.00 0.00 -0.37 1.05 3.07 -1.94 -0.39 114.58 116.00 1bu7 h GLU 377 Ca 0.28 0.00 0.11 0.00 -0.50 0.00 0.00 59.36 59.25 1bu7 h GLU 377 Cb 1.32 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.22 1bu7 h GLU 377 CO -0.00 0.00 0.32 0.00 -1.40 0.00 0.00 179.01 177.92 1bu7 h ARG 378 N 0.00 0.00 -0.68 2.33 3.08 -1.75 -2.20 114.38 115.17 1bu7 h ARG 378 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bu7 h ARG 378 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1bu7 h ARG 378 CO 0.00 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.09 1bu7 n PHE 379 N -4.10 0.96 -0.32 3.04 3.72 -0.15 -4.48 117.46 116.12 1bu7 n PHE 379 Ca 0.06 -0.51 0.05 0.00 -0.05 0.00 0.00 57.45 57.00 1bu7 n PHE 379 Cb 0.49 -0.03 0.20 0.00 -0.94 0.00 0.00 39.48 39.21 1bu7 n PHE 379 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1bu7 h GLU 380 N 3.97 0.83 -4.19 -1.08 4.57 -1.53 -3.35 114.58 113.81 1bu7 h GLU 380 Ca 0.00 -0.05 -0.68 0.00 -1.18 0.00 0.00 59.36 57.45 1bu7 h GLU 380 Cb 1.00 -0.19 -0.37 0.00 -0.16 0.00 0.00 28.75 29.03 1bu7 h GLU 380 CO 0.02 0.55 -0.57 1.21 -1.18 0.00 0.00 179.01 179.04 1bu7 s ASN 381 N -5.63 4.96 0.59 1.04 3.84 -1.26 -4.99 114.94 113.50 1bu7 s ASN 381 Ca -0.12 -2.39 0.30 0.00 0.21 0.00 0.00 52.86 50.86 1bu7 s ASN 381 Cb 0.21 -1.75 1.81 0.00 -0.55 0.00 0.00 41.25 40.97 1bu7 s ASN 381 CO 0.79 -0.41 2.22 1.55 -2.79 0.00 0.00 177.10 178.46 1bu7 h PRO 382 N 7.47 0.00 -0.00 0.43 0.13 -1.91 -0.41 132.00 137.71 1bu7 h PRO 382 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 1bu7 h PRO 382 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1bu7 h PRO 382 CO 0.65 0.00 -0.04 -1.13 -0.23 0.00 0.00 178.00 177.25 1bu7 n SER 383 N -3.79 0.10 -0.29 1.44 3.41 -1.26 -2.20 113.62 111.02 1bu7 n SER 383 Ca -0.02 -0.08 0.11 0.00 -0.26 0.00 0.00 58.87 58.62 1bu7 n SER 383 Cb 0.14 -0.27 0.53 0.00 -0.26 0.00 0.00 64.21 64.35 1bu7 n SER 383 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bu7 n ALA 384 N -1.29 2.58 -2.83 7.33 0.00 -0.16 -4.62 120.51 121.52 1bu7 n ALA 384 Ca 0.12 -0.34 -0.40 0.00 0.00 0.00 0.00 53.44 52.83 1bu7 n ALA 384 Cb 0.27 -1.23 -0.11 0.00 0.00 0.00 0.00 19.45 18.38 1bu7 n ALA 384 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bu7 s ILE 385 N -1.92 4.57 0.73 0.00 -1.09 -0.94 -5.07 121.20 117.48 1bu7 s ILE 385 Ca 0.34 -0.83 -0.16 0.00 -2.23 0.00 0.00 60.65 57.77 1bu7 s ILE 385 Cb 0.17 -3.54 0.04 0.00 -1.58 0.00 0.00 42.46 37.55 1bu7 s ILE 385 CO 0.27 -0.21 1.26 -2.84 -1.23 0.00 0.00 174.94 172.19 1bu7 s PRO 386 N 1.56 2.08 0.36 2.79 0.02 -1.26 -4.94 135.00 135.60 1bu7 s PRO 386 Ca 0.02 1.93 -0.28 0.00 0.02 0.00 0.00 61.00 62.69 1bu7 s PRO 386 Cb -0.19 -1.81 -0.11 0.00 0.02 0.00 0.00 34.50 32.42 1bu7 s PRO 386 CO 0.07 -1.92 1.44 -1.14 -0.33 0.00 0.00 177.00 175.11 1bu7 s GLN 387 N -3.74 4.18 0.00 5.54 0.74 -1.26 -2.20 119.66 122.92 1bu7 s GLN 387 Ca 0.78 2.47 0.00 0.00 0.05 0.00 0.00 55.36 58.66 1bu7 s GLN 387 Cb -0.34 -3.00 0.00 0.00 1.10 0.00 0.00 33.01 30.77 1bu7 s GLN 387 CO 0.45 -0.44 0.00 0.72 -0.55 0.00 0.00 175.29 175.47 1bu7 n HIS 388 N 0.67 0.00 0.05 1.67 8.25 -1.26 -4.88 115.22 119.73 1bu7 n HIS 388 Ca 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.37 1bu7 n HIS 388 Cb 0.40 -0.45 -0.13 0.00 1.12 0.00 0.00 29.99 30.93 1bu7 n HIS 388 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1bu7 h ALA 389 N 0.00 0.37 -3.63 -1.41 0.00 -1.81 -3.44 119.26 109.35 1bu7 h ALA 389 Ca 0.00 -1.02 -0.61 0.00 0.00 0.00 0.00 54.91 53.28 1bu7 h ALA 389 Cb 0.17 0.02 -0.38 0.00 0.00 0.00 0.00 17.79 17.60 1bu7 h ALA 389 CO 0.00 1.25 -0.78 0.12 0.00 0.00 0.00 179.25 179.84 1bu7 s PHE 390 N -2.67 2.43 -0.35 0.00 5.36 -1.26 -4.53 117.98 116.95 1bu7 s PHE 390 Ca -0.02 -1.79 0.15 0.00 -0.96 0.00 0.00 56.93 54.30 1bu7 s PHE 390 Cb 0.09 -1.62 0.44 0.00 -0.34 0.00 0.00 43.02 41.59 1bu7 s PHE 390 CO 0.83 -0.78 0.97 1.63 -1.46 0.00 0.00 175.22 176.41 1bu7 n LYS 391 N 4.66 1.63 0.18 10.12 5.02 -1.26 -4.89 118.16 133.63 1bu7 n LYS 391 Ca -0.11 -3.55 0.14 0.00 -2.02 0.00 0.00 58.31 52.77 1bu7 n LYS 391 Cb 0.44 -1.50 0.59 0.00 -0.02 0.00 0.00 35.03 34.55 1bu7 n LYS 391 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1bu7 h PRO 392 N 2.91 0.00 -0.32 1.97 0.13 -1.95 -2.67 132.00 132.07 1bu7 h PRO 392 Ca -0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1bu7 h PRO 392 Cb 1.10 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 1bu7 h PRO 392 CO 0.58 0.00 0.01 1.19 -0.23 0.00 0.00 178.00 179.55 1bu7 n PHE 393 N -2.49 1.13 -3.05 1.56 3.72 -1.26 -4.73 117.46 112.34 1bu7 n PHE 393 Ca 0.01 -0.94 0.00 0.00 -0.05 0.00 0.00 57.45 56.47 1bu7 n PHE 393 Cb 0.21 -0.37 0.00 0.00 -0.94 0.00 0.00 39.48 38.38 1bu7 n PHE 393 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bu7 n GLY 394 N -0.45 -1.32 2.88 1.37 0.00 -1.01 -0.79 105.19 105.86 1bu7 n GLY 394 Ca 0.24 -1.44 -0.15 0.00 0.00 0.00 0.00 46.02 44.68 1bu7 n GLY 394 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1bu7 s ASN 395 N -4.00 0.29 0.93 1.61 3.84 -1.26 -4.82 114.94 111.53 1bu7 s ASN 395 Ca 0.00 -0.03 0.00 0.00 0.21 0.00 0.00 52.86 53.04 1bu7 s ASN 395 Cb 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 41.25 40.62 1bu7 s ASN 395 CO 0.00 -0.01 0.00 0.61 -2.79 0.00 0.00 177.10 174.91 1bu7 n GLY 396 N 3.38 2.79 0.14 1.21 0.00 -1.26 -1.46 105.19 110.00 1bu7 n GLY 396 Ca -0.17 -0.31 0.12 0.00 0.00 0.00 0.00 46.02 45.65 1bu7 n GLY 396 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bu7 n GLN 397 N 14.00 0.19 -0.49 1.61 10.64 -1.26 -1.73 117.38 140.34 1bu7 n GLN 397 Ca 0.00 0.46 0.09 0.00 -1.83 0.00 0.00 57.00 55.71 1bu7 n GLN 397 Cb 0.00 -1.89 0.31 0.00 -0.86 0.00 0.00 30.24 27.79 1bu7 n GLN 397 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 1bu7 n ARG 398 N -2.26 3.40 -0.88 2.61 5.12 -0.97 -4.97 116.66 118.71 1bu7 n ARG 398 Ca 0.02 -2.72 -0.29 0.00 -1.93 0.00 0.00 57.85 52.92 1bu7 n ARG 398 Cb 0.21 -1.75 0.18 0.00 -1.16 0.00 0.00 32.46 29.94 1bu7 n ARG 398 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1bu7 s ALA 399 N -1.76 0.81 0.01 7.54 0.00 -0.53 -4.46 121.76 123.37 1bu7 s ALA 399 Ca 0.45 0.02 -0.30 0.00 0.00 0.00 0.00 51.96 52.13 1bu7 s ALA 399 Cb 0.29 -3.26 -0.08 0.00 0.00 0.00 0.00 23.12 20.07 1bu7 s ALA 399 CO 0.22 -2.97 1.84 0.00 0.00 0.00 0.00 175.76 174.85 1bu7 h ILE 401 N 5.56 0.40 0.00 0.00 2.10 -1.91 -3.12 117.51 120.53 1bu7 h ILE 401 Ca -0.46 -1.18 0.00 0.00 1.08 0.00 0.00 64.86 64.30 1bu7 h ILE 401 Cb 1.21 1.88 0.00 0.00 -1.09 0.00 0.00 36.82 38.83 1bu7 h ILE 401 CO 0.95 0.19 0.00 0.61 -1.08 0.00 0.00 178.15 178.81 1bu7 n GLY 402 N 0.51 -0.90 0.17 8.18 0.00 -1.26 -4.53 105.19 107.35 1bu7 n GLY 402 Ca 0.01 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.82 1bu7 n GLY 402 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1bu7 h GLN 403 N 0.00 0.13 -0.48 1.61 4.15 -1.89 0.13 115.11 118.75 1bu7 h GLN 403 Ca 0.00 -0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.29 1bu7 h GLN 403 Cb 0.00 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 1bu7 h GLN 403 CO 0.00 0.08 -0.17 1.96 -1.93 0.00 0.00 178.83 178.77 1bu7 h GLN 404 N 0.13 0.95 0.31 1.69 1.08 -1.80 -1.71 115.11 115.76 1bu7 h GLN 404 Ca 0.20 -0.37 -0.01 0.00 -1.45 0.00 0.00 58.65 57.02 1bu7 h GLN 404 Cb 0.27 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 1bu7 h GLN 404 CO -0.31 1.04 -0.21 0.35 -0.95 0.00 0.00 178.83 178.75 1bu7 h PHE 405 N 0.83 -0.56 -0.79 2.96 3.04 -1.70 0.42 116.94 121.13 1bu7 h PHE 405 Ca 0.12 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.08 1bu7 h PHE 405 Cb 0.73 0.21 -0.04 0.00 2.56 0.00 0.00 35.95 39.40 1bu7 h PHE 405 CO 0.05 -0.33 0.52 0.00 -2.02 0.00 0.00 178.31 176.53 1bu7 h ALA 406 N 0.14 1.02 -0.15 2.41 0.00 -0.88 -0.89 119.26 120.90 1bu7 h ALA 406 Ca -0.03 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1bu7 h ALA 406 Cb 0.44 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1bu7 h ALA 406 CO 0.01 0.39 -0.61 -0.07 0.00 0.00 0.00 179.25 178.97 1bu7 h LEU 407 N 1.05 0.59 -0.17 0.00 4.07 -1.21 -0.97 115.31 118.67 1bu7 h LEU 407 Ca 0.30 -0.34 -0.02 0.00 0.08 0.00 0.00 57.88 57.90 1bu7 h LEU 407 Cb -0.08 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.48 1bu7 h LEU 407 CO -0.08 1.06 0.03 -0.74 -1.08 0.00 0.00 178.44 177.63 1bu7 h HIS 408 N 0.39 0.30 0.20 1.13 2.76 -0.50 -0.60 115.15 118.83 1bu7 h HIS 408 Ca -0.01 -0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.14 1bu7 h HIS 408 Cb 1.16 -0.08 -0.04 0.00 1.55 0.00 0.00 27.41 30.00 1bu7 h HIS 408 CO 0.05 0.44 -0.39 1.49 -1.30 0.00 0.00 177.93 178.21 1bu7 h GLU 409 N 0.08 -0.65 -0.62 5.26 4.81 -1.12 -0.65 114.58 121.69 1bu7 h GLU 409 Ca 0.05 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1bu7 h GLU 409 Cb 0.29 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1bu7 h GLU 409 CO 0.00 -0.43 0.15 0.00 -0.73 0.00 0.00 179.01 178.00 1bu7 h ALA 410 N -0.18 1.08 -0.19 2.92 0.00 -1.15 -0.47 119.26 121.27 1bu7 h ALA 410 Ca 0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1bu7 h ALA 410 Cb 0.67 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1bu7 h ALA 410 CO -0.17 0.61 0.01 1.15 0.00 0.00 0.00 179.25 180.84 1bu7 h THR 411 N 0.93 1.25 0.01 0.00 2.02 -0.99 -0.86 112.91 115.26 1bu7 h THR 411 Ca 0.20 -0.83 0.01 0.00 0.77 0.00 0.00 66.41 66.56 1bu7 h THR 411 Cb 0.34 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 1bu7 h THR 411 CO 0.00 0.25 -0.06 0.25 0.37 0.00 0.00 175.52 176.33 1bu7 h LEU 412 N 0.10 -0.17 -0.25 2.58 5.85 -0.93 -1.59 115.31 120.91 1bu7 h LEU 412 Ca 0.06 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.73 1bu7 h LEU 412 Cb 0.37 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1bu7 h LEU 412 CO 0.01 -0.09 -0.13 0.58 -0.34 0.00 0.00 178.44 178.47 1bu7 h VAL 413 N -0.11 1.30 -0.74 1.05 2.07 -1.04 -0.80 116.25 117.97 1bu7 h VAL 413 Ca 0.02 -1.21 -0.06 0.00 0.82 0.00 0.00 66.70 66.27 1bu7 h VAL 413 Cb 0.14 1.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1bu7 h VAL 413 CO -0.06 0.38 0.23 0.25 0.02 0.00 0.00 177.57 178.38 1bu7 h LEU 414 N 0.24 1.09 -0.16 2.57 5.85 -1.20 0.81 115.31 124.51 1bu7 h LEU 414 Ca 0.05 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.61 1bu7 h LEU 414 Cb 0.63 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1bu7 h LEU 414 CO 0.04 1.01 -0.10 1.23 -0.34 0.00 0.00 178.44 180.27 1bu7 h GLY 415 N 1.12 0.03 1.16 3.75 0.00 -1.05 -1.45 103.07 106.62 1bu7 h GLY 415 Ca 0.24 0.13 -0.08 0.00 0.00 0.00 0.00 47.33 47.62 1bu7 h GLY 415 CO -0.01 -0.12 0.09 -0.33 0.00 0.00 0.00 176.54 176.18 1bu7 h MET 416 N -0.10 1.03 -0.57 4.80 2.86 -0.71 -0.68 114.93 121.55 1bu7 h MET 416 Ca 0.10 -0.27 0.04 0.00 -2.06 0.00 0.00 59.70 57.51 1bu7 h MET 416 Cb 0.24 -0.12 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 1bu7 h MET 416 CO -0.22 0.96 0.32 0.52 1.06 0.00 0.00 176.91 179.54 1bu7 h MET 417 N 0.97 0.59 0.00 1.72 2.07 -0.53 -0.69 114.93 119.07 1bu7 h MET 417 Ca 0.19 -0.04 -0.06 0.00 -2.07 0.00 0.00 59.70 57.72 1bu7 h MET 417 Cb 0.43 -0.13 -0.01 0.00 -1.87 0.00 0.00 31.60 30.02 1bu7 h MET 417 CO 0.01 0.39 -0.30 -0.07 1.07 0.00 0.00 176.91 178.02 1bu7 h LEU 418 N 0.61 0.00 -0.16 1.22 3.38 -0.92 -2.06 115.31 117.39 1bu7 h LEU 418 Ca 0.25 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.10 1bu7 h LEU 418 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1bu7 h LEU 418 CO -0.15 0.30 -0.35 0.50 0.09 0.00 0.00 178.44 178.83 1bu7 h LYS 419 N 0.00 0.51 0.00 1.13 3.64 -0.64 -3.38 116.57 117.83 1bu7 h LYS 419 Ca -0.00 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1bu7 h LYS 419 Cb 1.03 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1bu7 h LYS 419 CO 0.04 0.95 -1.08 0.72 -2.27 0.00 0.00 179.45 177.81 1bu7 n HIS 420 N -4.33 0.63 -3.89 1.91 8.25 -0.31 -4.83 115.22 112.66 1bu7 n HIS 420 Ca -0.07 0.18 -0.11 0.00 -0.26 0.00 0.00 57.72 57.47 1bu7 n HIS 420 Cb 0.51 -0.74 -0.10 0.00 1.12 0.00 0.00 29.99 30.77 1bu7 n HIS 420 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1bu7 s PHE 421 N -3.32 0.08 0.22 4.41 0.08 -0.79 -0.86 117.98 117.80 1bu7 s PHE 421 Ca 0.00 -0.22 -0.08 0.00 0.12 0.00 0.00 56.93 56.75 1bu7 s PHE 421 Cb 0.12 -0.07 -0.07 0.00 -0.57 0.00 0.00 43.02 42.43 1bu7 s PHE 421 CO 0.80 -0.30 0.52 -0.51 -0.10 0.00 0.00 175.22 175.63 1bu7 s ASP 422 N -1.54 6.57 0.07 1.36 1.01 -0.02 -4.60 116.67 119.52 1bu7 s ASP 422 Ca -0.13 0.83 0.10 0.00 0.71 0.00 0.00 52.55 54.05 1bu7 s ASP 422 Cb -0.07 -2.19 -0.03 0.00 1.01 0.00 0.00 42.92 41.65 1bu7 s ASP 422 CO 0.00 -0.07 -0.26 -0.36 0.21 0.00 0.00 175.17 174.69 1bu7 s PHE 423 N -1.83 2.28 -0.15 4.23 0.08 -1.26 -1.14 117.98 120.18 1bu7 s PHE 423 Ca 0.46 -0.40 0.02 0.00 0.12 0.00 0.00 56.93 57.12 1bu7 s PHE 423 Cb -0.11 -1.32 0.01 0.00 -0.57 0.00 0.00 43.02 41.03 1bu7 s PHE 423 CO 0.23 0.19 -0.21 -2.00 -0.10 0.00 0.00 175.22 173.33 1bu7 s GLU 424 N -1.49 2.98 -1.18 0.44 2.12 0.09 -4.99 118.70 116.67 1bu7 s GLU 424 Ca 0.12 -0.84 -0.17 0.00 0.36 0.00 0.00 54.97 54.44 1bu7 s GLU 424 Cb -0.10 -2.47 -0.04 0.00 0.26 0.00 0.00 34.13 31.78 1bu7 s GLU 424 CO 0.03 -0.09 2.09 -3.47 -0.54 0.00 0.00 175.26 173.28 1bu7 n ASP 425 N 4.29 3.37 0.24 -1.70 2.03 -1.26 -1.53 116.55 121.99 1bu7 n ASP 425 Ca -0.20 -2.78 0.16 0.00 0.52 0.00 0.00 54.79 52.49 1bu7 n ASP 425 Cb 0.51 -1.45 0.69 0.00 -0.72 0.00 0.00 41.12 40.15 1bu7 n ASP 425 CO 0.00 0.00 0.00 1.12 -1.92 0.00 0.00 177.20 176.40 1bu7 h HIS 426 N 6.88 0.00 -0.18 -0.67 2.07 -1.93 -2.02 115.15 119.31 1bu7 h HIS 426 Ca 0.50 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.02 1bu7 h HIS 426 Cb 0.67 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.65 1bu7 h HIS 426 CO 1.37 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 176.48 1bu7 n THR 427 N -2.82 0.22 -3.67 6.12 -2.24 -1.26 -4.97 114.28 105.66 1bu7 n THR 427 Ca 0.00 -0.61 -0.30 0.00 -2.27 0.00 0.00 64.05 60.87 1bu7 n THR 427 Cb 0.24 1.25 0.04 0.00 -2.10 0.00 0.00 70.33 69.76 1bu7 n THR 427 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1bu7 n ASN 428 N 1.31 -5.03 -4.72 3.42 5.15 -0.76 -4.81 115.26 109.83 1bu7 n ASN 428 Ca 0.15 -0.99 -0.43 0.00 -0.60 0.00 0.00 54.58 52.72 1bu7 n ASN 428 Cb 0.57 -3.51 -0.02 0.00 -0.53 0.00 0.00 39.78 36.28 1bu7 n ASN 428 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1bu7 n TYR 429 N -4.13 2.67 -3.39 1.20 9.36 -1.26 -4.95 117.16 116.64 1bu7 n TYR 429 Ca -0.11 0.24 -0.40 0.00 3.32 0.00 0.00 57.90 60.95 1bu7 n TYR 429 Cb 0.60 -2.59 -0.09 0.00 -0.63 0.00 0.00 39.34 36.63 1bu7 n TYR 429 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1bu7 s GLU 430 N -0.00 3.79 -0.04 2.98 2.56 -1.26 -5.02 118.70 121.71 1bu7 s GLU 430 Ca 0.68 -0.19 -0.36 0.00 0.00 0.00 0.00 54.97 55.11 1bu7 s GLU 430 Cb -0.54 -3.73 -0.14 0.00 2.00 0.00 0.00 34.13 31.72 1bu7 s GLU 430 CO 0.44 -0.41 1.66 -0.11 -0.56 0.00 0.00 175.26 176.29 1bu7 n LEU 431 N 5.37 2.71 -3.77 2.70 7.94 -1.26 -4.95 117.00 125.75 1bu7 n LEU 431 Ca -0.09 1.06 -0.29 0.00 -1.11 0.00 0.00 56.01 55.58 1bu7 n LEU 431 Cb 0.50 -1.29 -0.16 0.00 0.53 0.00 0.00 43.42 43.01 1bu7 n LEU 431 CO 0.39 -0.42 -0.36 -0.62 -1.11 0.00 0.00 177.39 175.27 1bu7 s ASP 432 N 2.44 3.56 -0.39 1.96 -1.08 -1.26 -5.07 116.67 116.84 1bu7 s ASP 432 Ca 0.89 -1.24 -0.14 0.00 -0.52 0.00 0.00 52.55 51.54 1bu7 s ASP 432 Cb -0.84 -0.81 0.02 0.00 -1.46 0.00 0.00 42.92 39.83 1bu7 s ASP 432 CO 0.51 -0.34 0.27 -0.63 0.52 0.00 0.00 175.17 175.49 1bu7 s ILE 433 N 1.67 5.07 0.06 4.11 1.01 -1.26 -0.59 121.20 131.27 1bu7 s ILE 433 Ca 0.03 -0.67 -0.25 0.00 0.00 0.00 0.00 60.65 59.75 1bu7 s ILE 433 Cb -0.17 -3.80 -0.06 0.00 0.01 0.00 0.00 42.46 38.43 1bu7 s ILE 433 CO -0.15 -0.26 0.77 -0.75 0.00 0.00 0.00 174.94 174.55 1bu7 s LYS 434 N 1.65 4.51 -0.14 2.79 2.20 -0.51 -4.88 119.74 125.36 1bu7 s LYS 434 Ca 0.04 1.09 -0.01 0.00 -0.36 0.00 0.00 55.97 56.74 1bu7 s LYS 434 Cb -0.19 -3.35 -0.02 0.00 -1.51 0.00 0.00 37.83 32.76 1bu7 s LYS 434 CO 0.09 0.31 -0.12 -1.21 -0.36 0.00 0.00 175.35 174.07 1bu7 s GLU 435 N -0.17 3.42 0.00 4.03 2.02 -1.26 -2.18 118.70 124.56 1bu7 s GLU 435 Ca 0.39 -0.66 0.00 0.00 0.02 0.00 0.00 54.97 54.71 1bu7 s GLU 435 Cb -0.21 -2.68 0.00 0.00 0.10 0.00 0.00 34.13 31.34 1bu7 s GLU 435 CO 0.24 0.20 0.00 0.25 0.02 0.00 0.00 175.26 175.96 1bu7 n THR 436 N 3.58 0.00 0.47 3.63 -2.24 -1.26 -4.91 114.28 113.55 1bu7 n THR 436 Ca -0.18 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.71 1bu7 n THR 436 Cb 0.53 0.00 0.45 0.00 -2.10 0.00 0.00 70.33 69.20 1bu7 n THR 436 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1bu7 n LEU 437 N 0.00 0.52 -4.42 3.22 7.94 -1.26 -4.85 117.00 118.15 1bu7 n LEU 437 Ca 0.00 0.61 -0.22 0.00 -1.11 0.00 0.00 56.01 55.30 1bu7 n LEU 437 Cb 0.00 -0.53 -0.09 0.00 0.53 0.00 0.00 43.42 43.33 1bu7 n LEU 437 CO 0.00 -0.43 -0.21 0.42 -1.11 0.00 0.00 177.39 176.06 1bu7 s THR 438 N -3.21 0.58 0.02 1.96 -4.23 -1.26 -4.55 115.64 104.94 1bu7 s THR 438 Ca 0.06 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.60 1bu7 s THR 438 Cb 0.10 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.40 1bu7 s THR 438 CO 0.39 0.00 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.66 1bu7 s LEU 439 N -3.48 3.25 0.04 4.79 1.43 -0.61 -4.29 118.68 119.80 1bu7 s LEU 439 Ca 0.31 -0.14 -0.25 0.00 -1.03 0.00 0.00 54.13 53.03 1bu7 s LEU 439 Cb 0.05 -1.88 0.06 0.00 0.03 0.00 0.00 46.19 44.44 1bu7 s LEU 439 CO 0.16 0.27 0.57 -1.59 0.23 0.00 0.00 176.35 175.99 1bu7 s LYS 440 N -1.56 1.07 -0.90 1.70 -2.85 -0.93 -4.61 119.74 111.66 1bu7 s LYS 440 Ca 0.18 -0.14 -0.23 0.00 -1.00 0.00 0.00 55.97 54.79 1bu7 s LYS 440 Cb -0.11 0.49 0.06 0.00 -2.06 0.00 0.00 37.83 36.21 1bu7 s LYS 440 CO 0.09 -0.38 1.30 -1.25 0.10 0.00 0.00 175.35 175.20 1bu7 s PRO 441 N -2.28 3.45 0.18 1.78 0.04 -1.26 -1.43 135.00 135.48 1bu7 s PRO 441 Ca -0.06 -1.01 -0.31 0.00 0.04 0.00 0.00 61.00 59.66 1bu7 s PRO 441 Cb -0.01 -4.88 -0.09 0.00 0.04 0.00 0.00 34.50 29.56 1bu7 s PRO 441 CO -0.00 -2.07 1.43 -2.00 0.04 0.00 0.00 177.00 174.40 1bu7 s GLU 442 N 4.61 4.30 0.00 4.56 2.12 0.24 -2.46 118.70 132.07 1bu7 s GLU 442 Ca 0.38 2.19 0.00 0.00 0.36 0.00 0.00 54.97 57.91 1bu7 s GLU 442 Cb -0.05 -3.18 0.00 0.00 0.26 0.00 0.00 34.13 31.16 1bu7 s GLU 442 CO -0.02 -0.44 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 1bu7 n GLY 443 N 3.01 0.77 3.66 -1.50 0.00 -1.26 -4.53 105.19 105.33 1bu7 n GLY 443 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1bu7 n GLY 443 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1bu7 s PHE 444 N -3.09 1.61 0.07 1.61 5.36 -1.03 -4.97 117.98 117.54 1bu7 s PHE 444 Ca 0.00 -0.12 0.05 0.00 -0.96 0.00 0.00 56.93 55.91 1bu7 s PHE 444 Cb 0.00 -4.08 -0.03 0.00 -0.34 0.00 0.00 43.02 38.57 1bu7 s PHE 444 CO 0.00 -4.69 -0.14 0.14 -1.46 0.00 0.00 175.22 169.06 1bu7 s VAL 445 N 4.38 1.13 0.15 3.12 -7.23 -1.26 -1.57 120.40 119.12 1bu7 s VAL 445 Ca 0.81 -1.30 -0.06 0.00 -1.81 0.00 0.00 61.98 59.63 1bu7 s VAL 445 Cb -0.38 -1.08 -0.02 0.00 0.56 0.00 0.00 36.38 35.46 1bu7 s VAL 445 CO 0.36 -0.21 0.18 0.68 -0.31 0.00 0.00 175.10 175.80 1bu7 s VAL 446 N -1.24 0.09 -0.06 1.32 -7.23 -0.98 -4.62 120.40 107.67 1bu7 s VAL 446 Ca -0.02 -1.59 0.02 0.00 -1.81 0.00 0.00 61.98 58.59 1bu7 s VAL 446 Cb -0.10 -1.89 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 1bu7 s VAL 446 CO 0.02 -0.39 -0.12 -0.54 -0.31 0.00 0.00 175.10 173.76 1bu7 s LYS 447 N -3.99 2.66 0.13 4.82 1.02 -0.58 -0.24 119.74 123.56 1bu7 s LYS 447 Ca 0.19 -0.66 0.05 0.00 0.02 0.00 0.00 55.97 55.57 1bu7 s LYS 447 Cb 0.05 -2.46 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 1bu7 s LYS 447 CO 0.00 0.59 0.08 0.00 -0.92 0.00 0.00 175.35 175.10 1bu7 s ALA 448 N -0.63 3.48 -0.20 5.17 0.00 -1.26 -0.73 121.76 127.59 1bu7 s ALA 448 Ca 0.09 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 50.91 1bu7 s ALA 448 Cb -0.11 -1.31 0.03 0.00 0.00 0.00 0.00 23.12 21.73 1bu7 s ALA 448 CO 0.01 0.60 -0.16 0.15 0.00 0.00 0.00 175.76 176.37 1bu7 s LYS 449 N -2.75 2.59 0.33 0.00 3.01 -0.29 -4.98 119.74 117.64 1bu7 s LYS 449 Ca 0.29 -0.90 -0.29 0.00 -1.01 0.00 0.00 55.97 54.06 1bu7 s LYS 449 Cb -0.11 -2.55 -0.10 0.00 -1.01 0.00 0.00 37.83 34.06 1bu7 s LYS 449 CO 0.22 -0.32 1.37 0.45 0.51 0.00 0.00 175.35 177.58 1bu7 s SER 450 N 1.29 6.65 0.00 2.83 0.15 -1.26 -0.84 113.70 122.52 1bu7 s SER 450 Ca 0.01 2.78 0.25 0.00 0.70 0.00 0.00 55.95 59.69 1bu7 s SER 450 Cb -0.15 -2.65 1.00 0.00 -1.71 0.00 0.00 66.02 62.51 1bu7 s SER 450 CO -0.10 -0.64 1.70 0.29 1.20 0.00 0.00 173.24 175.68 1bu7 n LYS 451 N 0.96 1.63 -3.55 5.44 5.02 -0.04 -4.86 118.16 122.76 1bu7 n LYS 451 Ca 0.01 -0.92 -0.21 0.00 -2.02 0.00 0.00 58.31 55.18 1bu7 n LYS 451 Cb 0.41 -1.44 0.08 0.00 -0.02 0.00 0.00 35.03 34.05 1bu7 n LYS 451 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1bu7 n LYS 452 N 0.12 -6.83 -3.78 1.97 4.76 -1.26 -4.98 118.16 108.17 1bu7 n LYS 452 Ca 0.18 0.80 -0.37 0.00 -2.87 0.00 0.00 58.31 56.06 1bu7 n LYS 452 Cb 0.32 -5.78 -0.13 0.00 -1.84 0.00 0.00 35.03 27.61 1bu7 n LYS 452 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1bu7 s ILE 453 N -3.38 4.07 0.61 -0.18 1.01 -1.26 -5.09 121.20 116.98 1bu7 s ILE 453 Ca 0.24 -0.38 -0.17 0.00 0.00 0.00 0.00 60.65 60.33 1bu7 s ILE 453 Cb -0.11 -2.96 -0.02 0.00 0.01 0.00 0.00 42.46 39.38 1bu7 s ILE 453 CO 0.75 0.27 1.15 -2.84 0.00 0.00 0.00 174.94 174.27 1bu7 s PRO 454 N 1.56 2.95 0.00 2.79 0.02 -1.26 -5.00 135.00 136.07 1bu7 s PRO 454 Ca 0.05 1.62 0.20 0.00 0.02 0.00 0.00 61.00 62.89 1bu7 s PRO 454 Cb -0.16 -1.95 0.16 0.00 0.02 0.00 0.00 34.50 32.58 1bu7 s PRO 454 CO 0.02 -1.17 1.15 1.28 -0.33 0.00 0.00 177.00 177.95