#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wb9 h GLN 15 N 0.00 0.00 -0.48 3.17 4.20 -2.07 -3.02 115.11 116.92 1wb9 h GLN 15 Ca 0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 1wb9 h GLN 15 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1wb9 h GLN 15 CO 0.00 0.00 -0.02 0.37 -0.67 0.00 0.00 178.83 178.51 1wb9 h GLN 16 N 0.00 0.81 -0.14 1.46 4.15 -2.05 -2.99 115.11 116.34 1wb9 h GLN 16 Ca 0.00 -0.23 -0.01 0.00 0.77 0.00 0.00 58.65 59.18 1wb9 h GLN 16 Cb 0.42 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 1wb9 h GLN 16 CO 0.00 0.83 0.04 -0.92 -1.93 0.00 0.00 178.83 176.84 1wb9 h TYR 17 N 0.75 0.24 -0.08 3.99 3.20 -1.97 -3.23 116.97 119.87 1wb9 h TYR 17 Ca 0.14 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.02 1wb9 h TYR 17 Cb 0.49 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.64 1wb9 h TYR 17 CO 0.03 0.38 -0.19 -0.07 -1.64 0.00 0.00 178.16 176.66 1wb9 h LEU 18 N 0.03 -0.58 -1.21 2.82 4.07 -1.63 -0.65 115.31 118.17 1wb9 h LEU 18 Ca 0.04 0.09 -0.07 0.00 0.08 0.00 0.00 57.88 58.03 1wb9 h LEU 18 Cb 0.26 0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.24 1wb9 h LEU 18 CO 0.00 -0.25 -0.34 0.08 -1.08 0.00 0.00 178.44 176.86 1wb9 h ARG 19 N -0.27 0.00 0.00 1.13 0.11 -1.67 -2.26 114.38 111.43 1wb9 h ARG 19 Ca 0.08 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 60.02 1wb9 h ARG 19 Cb 0.38 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.44 1wb9 h ARG 19 CO -0.24 0.34 -0.69 -0.07 0.10 0.00 0.00 179.97 179.40 1wb9 h LEU 20 N 0.00 0.00 -0.62 0.08 3.38 -1.48 -3.23 115.31 113.44 1wb9 h LEU 20 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 1wb9 h LEU 20 Cb 0.73 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1wb9 h LEU 20 CO 0.04 0.69 -0.54 0.50 0.09 0.00 0.00 178.44 179.23 1wb9 h LYS 21 N 0.00 0.42 0.00 1.13 1.63 -0.56 -2.91 116.57 116.28 1wb9 h LYS 21 Ca -0.01 -0.26 -0.00 0.00 -0.85 0.00 0.00 60.65 59.53 1wb9 h LYS 21 Cb 1.24 0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.90 1wb9 h LYS 21 CO 0.09 0.86 -0.02 0.00 -3.45 0.00 0.00 179.45 176.92 1wb9 h ALA 22 N 1.09 1.09 -0.17 5.00 0.00 -1.47 -2.47 119.26 122.33 1wb9 h ALA 22 Ca 0.01 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1wb9 h ALA 22 Cb 1.05 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1wb9 h ALA 22 CO 0.09 0.03 -0.43 1.96 0.00 0.00 0.00 179.25 180.91 1wb9 h GLN 23 N 0.00 0.41 -2.47 0.00 4.20 -1.57 -3.35 115.11 112.34 1wb9 h GLN 23 Ca -0.00 -0.21 -0.59 0.00 0.06 0.00 0.00 58.65 57.91 1wb9 h GLN 23 Cb 0.20 0.00 -0.38 0.00 0.30 0.00 0.00 27.48 27.60 1wb9 h GLN 23 CO 0.00 0.76 -0.92 -1.01 -0.67 0.00 0.00 178.83 177.00 1wb9 s HIS 24 N -4.16 1.12 -0.55 2.96 3.76 -1.08 -5.02 115.29 112.32 1wb9 s HIS 24 Ca -0.06 -2.19 0.25 0.00 -0.15 0.00 0.00 55.06 52.91 1wb9 s HIS 24 Cb 0.13 -1.02 0.90 0.00 1.11 0.00 0.00 32.58 33.70 1wb9 s HIS 24 CO 0.80 -0.82 1.75 -1.00 -0.85 0.00 0.00 174.74 174.63 1wb9 h PRO 25 N 6.02 0.00 -0.38 8.40 0.13 -1.59 -3.18 132.00 141.40 1wb9 h PRO 25 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1wb9 h PRO 25 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1wb9 h PRO 25 CO 0.36 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.28 1wb9 n GLU 26 N -2.35 2.34 -4.49 0.86 0.00 -1.26 -4.92 120.64 110.82 1wb9 n GLU 26 Ca 0.04 -2.04 -0.22 0.00 0.00 0.00 0.00 57.16 54.94 1wb9 n GLU 26 Cb 0.34 -1.48 -0.16 0.00 0.00 0.00 0.00 31.44 30.14 1wb9 n GLU 26 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1wb9 s ILE 27 N -1.50 0.93 0.27 3.84 1.01 -1.20 -4.93 121.20 119.61 1wb9 s ILE 27 Ca 0.38 -0.45 -0.29 0.00 0.00 0.00 0.00 60.65 60.29 1wb9 s ILE 27 Cb 0.21 -0.82 -0.14 0.00 0.01 0.00 0.00 42.46 41.73 1wb9 s ILE 27 CO 0.30 0.28 1.13 0.18 0.00 0.00 0.00 174.94 176.83 1wb9 n LEU 28 N 3.22 2.13 -4.05 2.97 4.77 -1.22 -4.76 117.00 120.06 1wb9 n LEU 28 Ca -0.18 1.17 -0.32 0.00 -0.03 0.00 0.00 56.01 56.66 1wb9 n LEU 28 Cb 0.54 -1.32 -0.15 0.00 -2.33 0.00 0.00 43.42 40.17 1wb9 n LEU 28 CO 0.25 -1.15 -0.36 -0.22 -1.33 0.00 0.00 177.39 174.58 1wb9 s LEU 29 N 0.26 4.34 -0.22 2.23 2.96 -1.26 -1.09 118.68 125.91 1wb9 s LEU 29 Ca 0.62 -1.88 -0.29 0.00 -0.22 0.00 0.00 54.13 52.36 1wb9 s LEU 29 Cb -0.71 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 44.37 1wb9 s LEU 29 CO 0.57 -0.32 1.16 -0.36 -1.32 0.00 0.00 176.35 176.08 1wb9 s PHE 30 N 0.99 3.05 -0.31 5.38 0.40 0.11 -4.44 117.98 123.16 1wb9 s PHE 30 Ca 0.04 1.19 -0.00 0.00 -0.60 0.00 0.00 56.93 57.55 1wb9 s PHE 30 Cb -0.20 -3.48 0.06 0.00 0.51 0.00 0.00 43.02 39.92 1wb9 s PHE 30 CO -0.07 -1.14 0.01 -0.47 0.70 0.00 0.00 175.22 174.25 1wb9 s TYR 31 N 3.50 3.36 0.28 0.36 5.04 -0.14 -0.36 117.35 129.39 1wb9 s TYR 31 Ca 0.50 -2.16 -0.29 0.00 -2.44 0.00 0.00 57.07 52.68 1wb9 s TYR 31 Cb -0.18 -2.29 -0.10 0.00 0.35 0.00 0.00 41.96 39.74 1wb9 s TYR 31 CO 0.12 -0.86 1.33 0.50 -1.34 0.00 0.00 175.55 175.31 1wb9 s ARG 32 N 1.17 4.35 -0.40 4.97 3.00 -0.85 -1.24 118.95 129.95 1wb9 s ARG 32 Ca -0.03 2.18 0.07 0.00 -1.00 0.00 0.00 55.73 56.96 1wb9 s ARG 32 Cb -0.20 -3.11 0.18 0.00 0.00 0.00 0.00 34.95 31.81 1wb9 s ARG 32 CO -0.03 -0.24 0.58 -1.64 0.00 0.00 0.00 175.30 173.96 1wb9 s MET 33 N -1.04 0.79 7.59 5.12 -1.94 -0.54 -4.94 119.30 124.35 1wb9 s MET 33 Ca 0.53 -0.41 0.00 0.00 -1.71 0.00 0.00 55.69 54.10 1wb9 s MET 33 Cb -0.39 -0.08 0.00 0.00 2.01 0.00 0.00 34.83 36.37 1wb9 s MET 33 CO 0.47 -1.20 0.00 0.41 -0.01 0.00 0.00 175.02 174.69 1wb9 n GLY 34 N 4.34 3.10 1.17 -0.03 0.00 -1.26 -2.79 105.19 109.71 1wb9 n GLY 34 Ca 0.11 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.15 1wb9 n GLY 34 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wb9 n ASP 35 N 9.45 3.39 -4.18 1.61 8.00 -1.26 -4.95 116.55 128.61 1wb9 n ASP 35 Ca 0.00 -2.30 -0.13 0.00 0.71 0.00 0.00 54.79 53.08 1wb9 n ASP 35 Cb 0.00 -0.47 -0.10 0.00 -0.02 0.00 0.00 41.12 40.52 1wb9 n ASP 35 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1wb9 s PHE 36 N -1.74 1.00 0.06 1.24 0.08 -1.12 -0.38 117.98 117.12 1wb9 s PHE 36 Ca 0.35 -0.78 0.01 0.00 0.12 0.00 0.00 56.93 56.63 1wb9 s PHE 36 Cb 0.22 -0.55 -0.04 0.00 -0.57 0.00 0.00 43.02 42.08 1wb9 s PHE 36 CO 0.17 -0.05 0.13 0.71 -0.10 0.00 0.00 175.22 176.08 1wb9 s TYR 37 N -3.05 3.34 -0.01 0.36 2.02 -0.59 -1.47 117.35 117.96 1wb9 s TYR 37 Ca 0.09 0.17 0.02 0.00 -0.37 0.00 0.00 57.07 56.99 1wb9 s TYR 37 Cb 0.01 -1.70 -0.00 0.00 -0.40 0.00 0.00 41.96 39.87 1wb9 s TYR 37 CO -0.02 0.56 -0.06 0.99 -1.57 0.00 0.00 175.55 175.45 1wb9 s THR 38 N -1.40 0.52 0.07 -0.71 2.01 -0.37 -1.81 115.64 113.95 1wb9 s THR 38 Ca 0.30 -0.26 0.09 0.00 0.31 0.00 0.00 61.69 62.14 1wb9 s THR 38 Cb -0.12 -0.45 -0.03 0.00 0.01 0.00 0.00 72.50 71.90 1wb9 s THR 38 CO 0.23 0.16 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.31 1wb9 s LEU 39 N -0.02 2.22 0.25 4.42 1.02 -0.73 -0.97 118.68 124.86 1wb9 s LEU 39 Ca 0.01 -0.63 0.01 0.00 0.02 0.00 0.00 54.13 53.54 1wb9 s LEU 39 Cb -0.04 -1.16 -0.05 0.00 0.02 0.00 0.00 46.19 44.96 1wb9 s LEU 39 CO -0.00 0.19 0.09 -0.36 0.02 0.00 0.00 176.35 176.29 1wb9 s PHE 40 N -0.91 1.51 0.00 0.29 2.99 -1.26 -1.94 117.98 118.66 1wb9 s PHE 40 Ca 0.11 -1.17 0.00 0.00 0.00 0.00 0.00 56.93 55.87 1wb9 s PHE 40 Cb -0.10 -0.88 0.00 0.00 0.00 0.00 0.00 43.02 42.04 1wb9 s PHE 40 CO 0.03 -0.32 0.00 0.66 -0.00 0.00 0.00 175.22 175.59 1wb9 n TYR 41 N -0.44 0.00 0.30 0.36 4.01 -1.06 -2.06 117.16 118.27 1wb9 n TYR 41 Ca -0.01 0.00 0.17 0.00 -0.16 0.00 0.00 57.90 57.91 1wb9 n TYR 41 Cb 0.66 0.01 0.74 0.00 -0.31 0.00 0.00 39.34 40.45 1wb9 n TYR 41 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1wb9 h ASP 42 N 2.21 0.00 -0.22 7.72 5.19 -1.99 -2.33 116.42 127.00 1wb9 h ASP 42 Ca 0.00 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.27 1wb9 h ASP 42 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1wb9 h ASP 42 CO 0.00 0.00 -0.38 0.44 -3.12 0.00 0.00 179.24 176.18 1wb9 h ASP 43 N 0.00 0.80 -0.54 6.45 5.19 -1.81 -2.41 116.42 124.10 1wb9 h ASP 43 Ca 0.00 -0.36 -0.05 0.00 -0.62 0.00 0.00 57.03 56.00 1wb9 h ASP 43 Cb 0.41 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.67 1wb9 h ASP 43 CO 0.00 1.09 0.14 0.00 -3.12 0.00 0.00 179.24 177.35 1wb9 h ALA 44 N 0.95 0.70 0.65 3.45 0.00 -1.13 -1.73 119.26 122.15 1wb9 h ALA 44 Ca 0.06 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1wb9 h ALA 44 Cb 0.93 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.52 1wb9 h ALA 44 CO 0.08 0.39 -0.31 0.87 0.00 0.00 0.00 179.25 180.29 1wb9 h LYS 45 N 0.75 -0.83 -0.67 0.00 1.57 -1.51 -0.46 116.57 115.42 1wb9 h LYS 45 Ca 0.17 0.06 0.12 0.00 -1.87 0.00 0.00 60.65 59.13 1wb9 h LYS 45 Cb 0.32 0.19 -0.09 0.00 0.08 0.00 0.00 32.23 32.73 1wb9 h LYS 45 CO -0.00 -0.52 0.21 -0.09 -0.57 0.00 0.00 179.45 178.49 1wb9 h ARG 46 N -1.02 0.35 -0.34 3.15 2.43 -1.49 -2.46 114.38 115.00 1wb9 h ARG 46 Ca -0.09 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 58.91 1wb9 h ARG 46 Cb 0.70 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 1wb9 h ARG 46 CO 0.15 0.23 -0.39 0.00 -1.51 0.00 0.00 179.97 178.45 1wb9 h ALA 47 N 1.51 0.68 -0.91 2.80 0.00 -1.19 -1.90 119.26 120.25 1wb9 h ALA 47 Ca 0.36 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1wb9 h ALA 47 Cb 0.53 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1wb9 h ALA 47 CO -0.40 0.67 0.60 1.03 0.00 0.00 0.00 179.25 181.15 1wb9 h SER 48 N 0.66 1.03 1.18 0.00 0.87 -0.64 -1.88 113.55 114.77 1wb9 h SER 48 Ca 0.06 -0.02 -0.14 0.00 -1.23 0.00 0.00 61.79 60.45 1wb9 h SER 48 Cb 0.95 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.63 1wb9 h SER 48 CO 0.09 0.74 -0.86 0.06 -0.53 0.00 0.00 176.83 176.33 1wb9 h GLN 49 N 1.22 0.00 0.00 2.24 3.07 -1.33 -2.99 115.11 117.31 1wb9 h GLN 49 Ca 0.34 0.00 -0.09 0.00 0.09 0.00 0.00 58.65 58.99 1wb9 h GLN 49 Cb -0.12 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.42 1wb9 h GLN 49 CO -0.08 0.48 -0.70 -0.07 0.09 0.00 0.00 178.83 178.55 1wb9 h LEU 50 N 0.00 0.00 -0.65 0.06 3.38 -1.06 -3.40 115.31 113.64 1wb9 h LEU 50 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1wb9 h LEU 50 Cb 1.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1wb9 h LEU 50 CO 0.06 0.36 0.00 0.18 0.09 0.00 0.00 178.44 179.14 1wb9 n LEU 51 N -3.05 0.65 -3.30 1.67 4.77 -0.73 -4.98 117.00 112.03 1wb9 n LEU 51 Ca -0.01 -0.78 -0.10 0.00 -0.03 0.00 0.00 56.01 55.10 1wb9 n LEU 51 Cb 0.70 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 1wb9 n LEU 51 CO 0.40 0.16 0.11 0.47 -1.33 0.00 0.00 177.39 177.21 1wb9 n ASP 52 N -0.24 -6.78 -4.18 -1.43 8.00 -1.14 -5.06 116.55 105.72 1wb9 n ASP 52 Ca 0.00 -0.32 -0.11 0.00 0.71 0.00 0.00 54.79 55.07 1wb9 n ASP 52 Cb 0.02 -4.01 -0.10 0.00 -0.02 0.00 0.00 41.12 37.00 1wb9 n ASP 52 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1wb9 s ILE 53 N -2.91 0.24 0.45 0.53 -4.36 -1.19 -5.09 121.20 108.87 1wb9 s ILE 53 Ca 0.03 -1.93 -0.11 0.00 -0.26 0.00 0.00 60.65 58.38 1wb9 s ILE 53 Cb -0.01 -2.10 -0.06 0.00 1.25 0.00 0.00 42.46 41.55 1wb9 s ILE 53 CO 0.80 -0.44 0.83 -0.44 0.24 0.00 0.00 174.94 175.93 1wb9 s SER 54 N -3.09 6.48 0.37 4.36 0.01 -1.26 -4.58 113.70 115.99 1wb9 s SER 54 Ca 0.25 1.19 0.05 0.00 1.31 0.00 0.00 55.95 58.75 1wb9 s SER 54 Cb 0.07 -2.35 -0.01 0.00 0.21 0.00 0.00 66.02 63.94 1wb9 s SER 54 CO 0.03 -0.49 0.54 -0.76 0.41 0.00 0.00 173.24 172.96 1wb9 s LEU 55 N -4.12 3.86 0.00 2.44 1.43 -1.26 -4.33 118.68 116.69 1wb9 s LEU 55 Ca 0.52 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.55 1wb9 s LEU 55 Cb -0.10 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 43.26 1wb9 s LEU 55 CO 0.35 -0.54 0.00 0.41 0.23 0.00 0.00 176.35 176.80 1wb9 n THR 56 N -1.78 0.00 -3.71 5.49 -1.04 -1.26 -4.90 114.28 107.08 1wb9 n THR 56 Ca 0.01 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.66 1wb9 n THR 56 Cb 0.58 -0.33 -0.09 0.00 -1.82 0.00 0.00 70.33 68.67 1wb9 n THR 56 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1wb9 s PRO 67 N -1.83 4.09 -0.06 -2.82 0.02 -1.26 -5.13 135.00 128.01 1wb9 s PRO 67 Ca 0.00 -0.26 -0.03 0.00 0.02 0.00 0.00 61.00 60.73 1wb9 s PRO 67 Cb 0.00 -3.48 0.03 0.00 0.02 0.00 0.00 34.50 31.08 1wb9 s PRO 67 CO 0.00 0.14 0.13 1.41 -0.33 0.00 0.00 177.00 178.35 1wb9 s MET 68 N 0.82 0.09 0.10 5.54 1.75 -1.26 -2.55 119.30 123.78 1wb9 s MET 68 Ca 0.07 0.33 0.07 0.00 -1.25 0.00 0.00 55.69 54.91 1wb9 s MET 68 Cb -0.13 -0.15 -0.03 0.00 2.84 0.00 0.00 34.83 37.35 1wb9 s MET 68 CO 0.02 -0.15 -0.18 0.00 -0.65 0.00 0.00 175.02 174.07 1wb9 s ALA 69 N 1.02 1.57 -0.01 4.11 0.00 -0.82 -4.16 121.76 123.48 1wb9 s ALA 69 Ca -0.08 -1.18 0.03 0.00 0.00 0.00 0.00 51.96 50.74 1wb9 s ALA 69 Cb -0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 1wb9 s ALA 69 CO -0.05 0.27 -0.11 0.20 0.00 0.00 0.00 175.76 176.07 1wb9 s GLY 70 N -1.93 0.52 -0.06 0.00 0.00 -1.26 -1.78 107.32 102.80 1wb9 s GLY 70 Ca 0.04 -0.46 0.06 0.00 0.00 0.00 0.00 44.72 44.36 1wb9 s GLY 70 CO 0.04 -0.39 -0.25 -0.26 0.00 0.00 0.00 173.10 172.24 1wb9 s ILE 71 N -0.26 2.02 0.67 0.90 -5.25 -0.75 -4.88 121.20 113.64 1wb9 s ILE 71 Ca 0.04 -1.05 -0.17 0.00 -0.99 0.00 0.00 60.65 58.48 1wb9 s ILE 71 Cb -0.04 -1.71 -0.02 0.00 2.95 0.00 0.00 42.46 43.63 1wb9 s ILE 71 CO -0.00 0.56 0.91 -2.65 -1.79 0.00 0.00 174.94 171.97 1wb9 n PRO 72 N 3.00 0.66 -0.00 0.37 -0.02 -1.26 -1.53 135.00 136.21 1wb9 n PRO 72 Ca -0.18 0.27 -0.18 0.00 -2.02 0.00 0.00 63.50 61.40 1wb9 n PRO 72 Cb 0.52 -2.15 -0.09 0.00 -0.02 0.00 0.00 33.50 31.76 1wb9 n PRO 72 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1wb9 h TYR 73 N 0.07 0.89 0.00 6.00 3.20 -1.05 -3.22 116.97 122.86 1wb9 h TYR 73 Ca -0.48 -0.43 0.00 0.00 3.14 0.00 0.00 58.73 60.96 1wb9 h TYR 73 Cb 1.35 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.50 1wb9 h TYR 73 CO 0.38 1.25 0.00 0.72 -1.64 0.00 0.00 178.16 178.87 1wb9 n HIS 74 N -4.04 0.16 -0.35 -3.82 8.25 -1.26 -2.57 115.22 111.60 1wb9 n HIS 74 Ca -0.09 0.07 0.05 0.00 -0.26 0.00 0.00 57.72 57.48 1wb9 n HIS 74 Cb 0.73 -0.61 0.12 0.00 1.12 0.00 0.00 29.99 31.36 1wb9 n HIS 74 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1wb9 n ALA 75 N -1.56 2.25 -0.36 -1.41 0.00 -1.22 -4.81 120.51 113.42 1wb9 n ALA 75 Ca 0.03 -1.44 -0.03 0.00 0.00 0.00 0.00 53.44 52.00 1wb9 n ALA 75 Cb 0.17 -0.33 0.10 0.00 0.00 0.00 0.00 19.45 19.39 1wb9 n ALA 75 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1wb9 h VAL 76 N 1.09 1.25 -0.34 0.00 3.04 -1.51 -1.97 116.25 117.81 1wb9 h VAL 76 Ca 0.00 -0.45 -0.09 0.00 -1.01 0.00 0.00 66.70 65.15 1wb9 h VAL 76 Cb 0.80 -0.15 -0.02 0.00 -2.01 0.00 0.00 31.29 29.91 1wb9 h VAL 76 CO 0.03 0.24 -0.15 -0.33 -1.01 0.00 0.00 177.57 176.35 1wb9 h GLU 77 N 1.29 0.62 -0.08 4.17 4.39 -1.87 -0.62 114.58 122.48 1wb9 h GLU 77 Ca 0.35 -0.20 0.02 0.00 0.34 0.00 0.00 59.36 59.86 1wb9 h GLU 77 Cb -0.14 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.43 1wb9 h GLU 77 CO -0.07 0.74 -0.04 -0.97 -1.16 0.00 0.00 179.01 177.51 1wb9 h ASN 78 N 0.56 -0.14 0.26 1.42 -1.24 -1.69 -0.06 115.58 114.69 1wb9 h ASN 78 Ca 0.09 0.03 -0.11 0.00 0.71 0.00 0.00 56.30 57.03 1wb9 h ASN 78 Cb 0.58 0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.70 1wb9 h ASN 78 CO 0.04 -0.06 -0.43 1.88 -1.29 0.00 0.00 177.43 177.57 1wb9 h TYR 79 N -0.04 0.25 -0.60 0.67 0.05 -1.20 -2.22 116.97 113.88 1wb9 h TYR 79 Ca 0.05 -0.07 -0.05 0.00 0.05 0.00 0.00 58.73 58.71 1wb9 h TYR 79 Cb 0.11 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 1wb9 h TYR 79 CO -0.15 0.61 0.18 -0.07 -1.05 0.00 0.00 178.16 177.68 1wb9 h LEU 80 N 0.18 0.84 -0.92 3.88 3.38 -0.99 -1.76 115.31 119.91 1wb9 h LEU 80 Ca 0.01 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1wb9 h LEU 80 Cb 0.84 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1wb9 h LEU 80 CO 0.07 0.80 0.35 0.00 0.09 0.00 0.00 178.44 179.74 1wb9 h ALA 81 N 1.32 1.15 -0.11 1.53 0.00 -0.43 -1.74 119.26 120.97 1wb9 h ALA 81 Ca 0.20 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1wb9 h ALA 81 Cb 0.26 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1wb9 h ALA 81 CO -0.01 0.63 -0.47 0.87 0.00 0.00 0.00 179.25 180.28 1wb9 h LYS 82 N 1.11 0.52 -0.27 0.00 1.57 -1.19 -2.29 116.57 116.01 1wb9 h LYS 82 Ca 0.26 -0.40 -0.05 0.00 -1.87 0.00 0.00 60.65 58.59 1wb9 h LYS 82 Cb 0.15 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1wb9 h LYS 82 CO -0.03 1.03 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.78 1wb9 h LEU 83 N 0.12 0.50 -0.88 2.94 3.38 -1.22 -1.50 115.31 118.64 1wb9 h LEU 83 Ca -0.03 -0.34 -0.11 0.00 0.09 0.00 0.00 57.88 57.49 1wb9 h LEU 83 Cb 1.10 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1wb9 h LEU 83 CO 0.10 0.72 -0.40 -0.37 0.09 0.00 0.00 178.44 178.58 1wb9 h VAL 84 N 0.27 1.31 0.00 1.22 -1.51 -1.41 -1.22 116.25 114.90 1wb9 h VAL 84 Ca 0.07 -1.52 0.00 0.00 -1.23 0.00 0.00 66.70 64.03 1wb9 h VAL 84 Cb 0.48 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 31.28 1wb9 h VAL 84 CO 0.02 0.46 0.00 -1.13 -1.23 0.00 0.00 177.57 175.69 1wb9 h ASN 85 N 0.27 0.00 -0.40 4.19 -0.73 -1.14 -2.48 115.58 115.29 1wb9 h ASN 85 Ca 0.03 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.20 1wb9 h ASN 85 Cb 0.83 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.42 1wb9 h ASN 85 CO 0.07 0.00 0.00 0.00 -0.37 0.00 0.00 177.43 177.13 1wb9 n GLN 86 N -2.86 2.43 -0.12 6.67 6.02 -0.59 -4.98 117.38 123.95 1wb9 n GLN 86 Ca -0.00 -2.24 0.00 0.00 -0.01 0.00 0.00 57.00 54.75 1wb9 n GLN 86 Cb 0.22 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.00 1wb9 n GLN 86 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1wb9 n GLY 87 N 1.36 0.88 3.77 1.08 0.00 -0.69 -4.58 105.19 107.01 1wb9 n GLY 87 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1wb9 n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wb9 s GLU 88 N -0.88 4.09 0.65 1.61 0.41 -0.55 -3.42 118.70 120.61 1wb9 s GLU 88 Ca 0.00 0.15 -0.11 0.00 -0.41 0.00 0.00 54.97 54.61 1wb9 s GLU 88 Cb 0.00 -3.35 -0.02 0.00 -1.78 0.00 0.00 34.13 28.98 1wb9 s GLU 88 CO 0.00 0.40 1.04 -1.12 -0.49 0.00 0.00 175.26 175.09 1wb9 s SER 89 N -0.04 5.87 -0.10 -0.19 0.01 -1.26 -3.80 113.70 114.18 1wb9 s SER 89 Ca 0.18 1.50 -0.04 0.00 1.31 0.00 0.00 55.95 58.91 1wb9 s SER 89 Cb -0.14 -2.48 0.05 0.00 0.21 0.00 0.00 66.02 63.66 1wb9 s SER 89 CO 0.06 -1.12 0.20 -0.69 0.41 0.00 0.00 173.24 172.11 1wb9 s VAL 90 N -3.12 -0.22 -0.14 3.43 1.01 -0.12 -3.42 120.40 117.82 1wb9 s VAL 90 Ca 0.56 0.26 -0.13 0.00 0.00 0.00 0.00 61.98 62.67 1wb9 s VAL 90 Cb -0.12 -0.34 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 1wb9 s VAL 90 CO 0.54 0.11 0.28 0.00 0.00 0.00 0.00 175.10 176.03 1wb9 s ALA 91 N 1.90 3.65 -0.19 5.51 0.00 -0.25 -0.79 121.76 131.59 1wb9 s ALA 91 Ca -0.02 -0.46 -0.05 0.00 0.00 0.00 0.00 51.96 51.42 1wb9 s ALA 91 Cb -0.12 -2.32 -0.03 0.00 0.00 0.00 0.00 23.12 20.65 1wb9 s ALA 91 CO -0.07 0.21 0.01 0.42 0.00 0.00 0.00 175.76 176.33 1wb9 s ILE 92 N 0.06 4.12 -0.19 0.00 -1.09 0.16 -0.71 121.20 123.55 1wb9 s ILE 92 Ca 0.17 -0.26 -0.02 0.00 -2.23 0.00 0.00 60.65 58.30 1wb9 s ILE 92 Cb -0.13 -2.85 -0.01 0.00 -1.58 0.00 0.00 42.46 37.89 1wb9 s ILE 92 CO 0.05 0.45 -0.09 0.00 -1.23 0.00 0.00 174.94 174.12 1wb9 n GLU 94 N 4.40 2.60 -3.90 0.00 -0.58 -1.26 -2.01 120.64 119.88 1wb9 n GLU 94 Ca -0.19 -2.19 -0.09 0.00 -0.42 0.00 0.00 57.16 54.27 1wb9 n GLU 94 Cb 0.51 -1.38 -0.06 0.00 -0.57 0.00 0.00 31.44 29.94 1wb9 n GLU 94 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1wb9 s ARG 108 N -1.81 1.17 -0.03 3.49 0.52 -1.26 -4.92 118.95 116.11 1wb9 s ARG 108 Ca 0.23 -1.09 -0.29 0.00 -0.52 0.00 0.00 55.73 54.06 1wb9 s ARG 108 Cb 0.17 0.40 0.11 0.00 0.52 0.00 0.00 34.95 36.15 1wb9 s ARG 108 CO 0.07 -0.44 0.93 -1.59 0.02 0.00 0.00 175.30 174.29 1wb9 s LYS 109 N -3.94 0.76 -0.50 3.54 -2.85 -1.26 -5.11 119.74 110.38 1wb9 s LYS 109 Ca 0.14 -0.28 -0.28 0.00 -1.00 0.00 0.00 55.97 54.55 1wb9 s LYS 109 Cb 0.03 0.35 -0.00 0.00 -2.06 0.00 0.00 37.83 36.15 1wb9 s LYS 109 CO -0.02 -0.33 1.58 0.08 0.10 0.00 0.00 175.35 176.76 1wb9 s VAL 110 N -3.04 3.66 -0.79 1.79 1.01 -1.26 -4.43 120.40 117.34 1wb9 s VAL 110 Ca 0.05 0.58 0.13 0.00 0.00 0.00 0.00 61.98 62.75 1wb9 s VAL 110 Cb -0.01 -4.15 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 1wb9 s VAL 110 CO -0.08 -0.91 0.61 0.55 0.00 0.00 0.00 175.10 175.27 1wb9 n VAL 111 N 7.07 0.00 -3.67 2.92 3.14 -0.48 -4.95 118.33 122.36 1wb9 n VAL 111 Ca 0.17 -0.24 -0.12 0.00 -2.96 0.00 0.00 64.34 61.19 1wb9 n VAL 111 Cb 0.49 1.04 -0.08 0.00 -1.06 0.00 0.00 33.84 34.23 1wb9 n VAL 111 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 1wb9 s ARG 112 N -2.08 0.65 -0.02 1.45 3.52 -1.18 -5.03 118.95 116.26 1wb9 s ARG 112 Ca 0.07 0.90 0.03 0.00 -0.13 0.00 0.00 55.73 56.60 1wb9 s ARG 112 Cb 0.10 0.24 -0.00 0.00 -1.56 0.00 0.00 34.95 33.73 1wb9 s ARG 112 CO 0.48 -0.11 -0.12 0.42 -0.81 0.00 0.00 175.30 175.17 1wb9 s ILE 113 N 0.76 0.97 -0.09 4.11 1.01 -1.26 0.38 121.20 127.08 1wb9 s ILE 113 Ca -0.04 -0.49 0.04 0.00 0.00 0.00 0.00 60.65 60.16 1wb9 s ILE 113 Cb -0.05 -0.83 -0.01 0.00 0.01 0.00 0.00 42.46 41.58 1wb9 s ILE 113 CO -0.06 0.28 -0.21 0.68 0.00 0.00 0.00 174.94 175.64 1wb9 s VAL 114 N -0.08 2.40 0.10 2.92 -7.23 0.03 -4.98 120.40 113.56 1wb9 s VAL 114 Ca 0.01 -0.92 0.09 0.00 -1.81 0.00 0.00 61.98 59.35 1wb9 s VAL 114 Cb -0.07 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 34.91 1wb9 s VAL 114 CO 0.00 0.56 -0.20 0.42 -0.31 0.00 0.00 175.10 175.57 1wb9 s THR 115 N 0.06 2.69 0.42 5.32 -4.23 -1.26 -0.95 115.64 117.69 1wb9 s THR 115 Ca -0.09 -1.48 0.11 0.00 -1.18 0.00 0.00 61.69 59.05 1wb9 s THR 115 Cb -0.15 -2.20 0.30 0.00 1.34 0.00 0.00 72.50 71.79 1wb9 s THR 115 CO 0.06 0.16 2.00 -0.65 -0.54 0.00 0.00 174.62 175.65 1wb9 h PRO 116 N 3.98 0.48 -0.08 3.99 0.11 -1.82 -2.33 132.00 136.33 1wb9 h PRO 116 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1wb9 h PRO 116 Cb 1.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1wb9 h PRO 116 CO 0.45 0.31 0.00 0.41 -0.21 0.00 0.00 178.00 178.96 1wb9 n GLY 117 N -1.50 0.63 0.11 -0.55 0.00 -1.26 -4.37 105.19 98.24 1wb9 n GLY 117 Ca 0.08 -0.57 0.05 0.00 0.00 0.00 0.00 46.02 45.58 1wb9 n GLY 117 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wb9 n THR 118 N 0.81 1.28 -2.85 2.61 -2.24 -0.88 -3.79 114.28 109.22 1wb9 n THR 118 Ca 0.17 -1.49 -0.32 0.00 -2.27 0.00 0.00 64.05 60.14 1wb9 n THR 118 Cb 0.48 0.13 -0.04 0.00 -2.10 0.00 0.00 70.33 68.79 1wb9 n THR 118 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1wb9 s ILE 119 N -1.82 4.67 0.00 2.28 -4.36 -1.18 -4.86 121.20 115.92 1wb9 s ILE 119 Ca 0.18 0.91 0.00 0.00 -0.26 0.00 0.00 60.65 61.48 1wb9 s ILE 119 Cb 0.15 -3.68 0.00 0.00 1.25 0.00 0.00 42.46 40.18 1wb9 s ILE 119 CO 0.02 -0.44 0.07 -1.54 0.24 0.00 0.00 174.94 173.29 1wb9 n SER 120 N -1.02 0.00 -4.74 4.36 3.41 -1.26 -4.71 113.62 109.67 1wb9 n SER 120 Ca 0.04 -1.00 -0.41 0.00 -0.26 0.00 0.00 58.87 57.24 1wb9 n SER 120 Cb 0.54 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.44 1wb9 n SER 120 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1wb9 s ASP 121 N 0.00 7.38 0.37 4.04 1.01 -1.26 -4.84 116.67 123.36 1wb9 s ASP 121 Ca 0.00 1.99 0.12 0.00 0.71 0.00 0.00 52.55 55.37 1wb9 s ASP 121 Cb 0.00 -2.60 0.90 0.00 1.01 0.00 0.00 42.92 42.23 1wb9 s ASP 121 CO 0.00 -0.13 1.84 -0.08 0.21 0.00 0.00 175.17 177.01 1wb9 h GLU 122 N 5.09 0.58 0.00 8.23 4.81 -1.97 -2.22 114.58 129.11 1wb9 h GLU 122 Ca -0.44 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 58.71 1wb9 h GLU 122 Cb 1.21 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 1wb9 h GLU 122 CO 0.72 0.39 -0.21 0.00 -0.73 0.00 0.00 179.01 179.17 1wb9 h ALA 123 N 1.61 1.36 0.00 2.92 0.00 -1.97 -3.12 119.26 120.06 1wb9 h ALA 123 Ca 0.49 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1wb9 h ALA 123 Cb 0.94 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1wb9 h ALA 123 CO -0.23 0.26 -1.08 1.28 0.00 0.00 0.00 179.25 179.47 1wb9 n LEU 124 N -3.86 0.67 -4.73 0.00 4.77 -0.85 -4.81 117.00 108.19 1wb9 n LEU 124 Ca -0.02 -0.20 -0.26 0.00 -0.03 0.00 0.00 56.01 55.50 1wb9 n LEU 124 Cb 0.30 -0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 41.26 1wb9 n LEU 124 CO 0.34 0.13 -0.27 -0.76 -1.33 0.00 0.00 177.39 175.49 1wb9 s LEU 125 N -3.54 3.57 -0.16 2.23 1.43 -1.13 -4.82 118.68 116.27 1wb9 s LEU 125 Ca 0.05 -0.26 -0.17 0.00 -1.03 0.00 0.00 54.13 52.72 1wb9 s LEU 125 Cb 0.15 -2.20 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 1wb9 s LEU 125 CO 0.83 0.08 0.42 -1.58 0.23 0.00 0.00 176.35 176.33 1wb9 s GLN 126 N -3.03 4.27 0.29 1.70 2.00 -1.26 -4.94 119.66 118.68 1wb9 s GLN 126 Ca 0.29 0.31 0.02 0.00 -2.00 0.00 0.00 55.36 53.99 1wb9 s GLN 126 Cb -0.10 -3.47 0.60 0.00 0.80 0.00 0.00 33.01 30.85 1wb9 s GLN 126 CO 0.21 0.10 1.81 1.49 -0.50 0.00 0.00 175.29 178.40 1wb9 h GLU 127 N 6.94 0.88 -0.36 1.67 4.81 -1.98 -2.93 114.58 123.60 1wb9 h GLU 127 Ca -0.39 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 58.65 1wb9 h GLU 127 Cb 1.17 -0.20 -0.08 0.00 0.63 0.00 0.00 28.75 30.27 1wb9 h GLU 127 CO 0.75 0.58 -0.00 0.54 -0.73 0.00 0.00 179.01 180.14 1wb9 n ARG 128 N -4.68 2.23 -3.99 1.92 1.74 -1.26 -4.68 116.66 107.94 1wb9 n ARG 128 Ca 0.20 -3.05 -0.18 0.00 -0.77 0.00 0.00 57.85 54.05 1wb9 n ARG 128 Cb 0.42 -1.85 -0.16 0.00 -1.02 0.00 0.00 32.46 29.85 1wb9 n ARG 128 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1wb9 s GLN 129 N -3.11 0.46 0.60 5.56 -0.21 -1.11 -4.64 119.66 117.22 1wb9 s GLN 129 Ca 0.44 0.02 -0.19 0.00 0.02 0.00 0.00 55.36 55.65 1wb9 s GLN 129 Cb 0.39 -0.60 -0.03 0.00 1.00 0.00 0.00 33.01 33.77 1wb9 s GLN 129 CO 0.04 -0.12 1.29 -0.51 -2.12 0.00 0.00 175.29 173.86 1wb9 s ASP 130 N 1.01 4.94 -0.29 5.90 1.01 -1.26 -4.63 116.67 123.34 1wb9 s ASP 130 Ca -0.10 2.60 -0.04 0.00 0.71 0.00 0.00 52.55 55.72 1wb9 s ASP 130 Cb -0.14 -2.62 0.10 0.00 1.01 0.00 0.00 42.92 41.28 1wb9 s ASP 130 CO -0.01 -1.78 0.13 0.21 0.21 0.00 0.00 175.17 173.93 1wb9 s ASN 131 N -1.33 3.59 -0.01 0.27 2.47 -1.26 -4.99 114.94 113.69 1wb9 s ASN 131 Ca 0.78 -1.35 -0.00 0.00 0.42 0.00 0.00 52.86 52.71 1wb9 s ASN 131 Cb -0.36 -0.42 -0.04 0.00 -1.45 0.00 0.00 41.25 38.98 1wb9 s ASN 131 CO 0.40 -0.43 0.06 -0.76 -3.72 0.00 0.00 177.10 172.65 1wb9 s LEU 132 N 2.02 3.81 -0.01 3.21 1.43 -1.26 -4.51 118.68 123.37 1wb9 s LEU 132 Ca 0.09 0.11 -0.13 0.00 -1.03 0.00 0.00 54.13 53.17 1wb9 s LEU 132 Cb -0.16 -2.21 -0.05 0.00 0.03 0.00 0.00 46.19 43.80 1wb9 s LEU 132 CO -0.35 0.28 0.37 -0.22 0.23 0.00 0.00 176.35 176.66 1wb9 s LEU 133 N -1.68 4.46 0.06 1.79 2.96 -0.07 -1.43 118.68 124.76 1wb9 s LEU 133 Ca 0.22 0.89 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 1wb9 s LEU 133 Cb -0.12 -2.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.99 1wb9 s LEU 133 CO 0.13 0.33 -0.05 0.00 -1.32 0.00 0.00 176.35 175.44 1wb9 s ALA 134 N -1.09 0.64 0.00 5.97 0.00 -0.65 -0.16 121.76 126.47 1wb9 s ALA 134 Ca 0.23 -1.17 0.02 0.00 0.00 0.00 0.00 51.96 51.04 1wb9 s ALA 134 Cb -0.16 0.20 -0.01 0.00 0.00 0.00 0.00 23.12 23.16 1wb9 s ALA 134 CO 0.12 -0.28 -0.06 0.00 0.00 0.00 0.00 175.76 175.55 1wb9 s ALA 135 N -3.41 0.48 0.06 0.00 0.00 -0.54 -1.04 121.76 117.31 1wb9 s ALA 135 Ca 0.05 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 51.73 1wb9 s ALA 135 Cb 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.05 1wb9 s ALA 135 CO -0.07 0.09 -0.16 -1.50 0.00 0.00 0.00 175.76 174.13 1wb9 s ILE 136 N -0.36 1.24 0.39 0.00 2.07 0.40 -1.73 121.20 123.22 1wb9 s ILE 136 Ca -0.00 -1.22 -0.15 0.00 -1.41 0.00 0.00 60.65 57.88 1wb9 s ILE 136 Cb -0.04 -1.15 0.06 0.00 0.13 0.00 0.00 42.46 41.47 1wb9 s ILE 136 CO -0.00 -0.08 0.79 -2.67 -1.91 0.00 0.00 174.94 171.06 1wb9 n TRP 137 N 1.53 -2.37 -3.80 3.50 4.27 -0.66 -3.56 117.44 116.35 1wb9 n TRP 137 Ca -0.19 -1.85 -0.13 0.00 -3.89 0.00 0.00 57.50 51.43 1wb9 n TRP 137 Cb 0.54 0.92 -0.14 0.00 -1.36 0.00 0.00 31.31 31.28 1wb9 n TRP 137 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 1wb9 s GLN 138 N -2.09 0.10 0.47 -2.67 0.74 -1.26 -0.73 119.66 114.22 1wb9 s GLN 138 Ca 0.16 0.22 0.08 0.00 0.05 0.00 0.00 55.36 55.87 1wb9 s GLN 138 Cb -0.05 -0.04 0.03 0.00 1.10 0.00 0.00 33.01 34.05 1wb9 s GLN 138 CO 0.12 -0.07 0.59 -0.51 -0.55 0.00 0.00 175.29 174.87 1wb9 s ASP 139 N 0.49 5.32 0.49 6.67 1.01 0.82 -4.98 116.67 126.49 1wb9 s ASP 139 Ca -0.04 -0.66 0.25 0.00 0.71 0.00 0.00 52.55 52.81 1wb9 s ASP 139 Cb -0.05 -0.29 1.26 0.00 1.01 0.00 0.00 42.92 44.85 1wb9 s ASP 139 CO -0.02 -0.94 2.00 0.77 0.21 0.00 0.00 175.17 177.19 1wb9 h SER 140 N 0.58 0.00 0.38 0.27 4.64 -2.03 -3.19 113.55 114.19 1wb9 h SER 140 Ca -0.37 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.73 1wb9 h SER 140 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1wb9 h SER 140 CO 0.47 0.17 -0.95 0.11 -0.87 0.00 0.00 176.83 175.75 1wb9 h LYS 141 N 0.00 0.38 0.00 4.77 1.57 -2.02 -3.50 116.57 117.76 1wb9 h LYS 141 Ca -0.00 -0.41 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1wb9 h LYS 141 Cb 0.44 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1wb9 h LYS 141 CO 0.02 1.09 0.00 0.41 -0.57 0.00 0.00 179.45 180.40 1wb9 n GLY 142 N 0.97 -0.76 3.96 3.86 0.00 -1.21 -5.04 105.19 106.98 1wb9 n GLY 142 Ca -0.06 -1.15 -0.23 0.00 0.00 0.00 0.00 46.02 44.58 1wb9 n GLY 142 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wb9 s PHE 143 N -3.00 3.46 0.01 1.61 0.08 -1.19 -0.13 117.98 118.82 1wb9 s PHE 143 Ca 0.00 0.04 0.05 0.00 0.12 0.00 0.00 56.93 57.14 1wb9 s PHE 143 Cb 0.00 -1.62 -0.01 0.00 -0.57 0.00 0.00 43.02 40.82 1wb9 s PHE 143 CO 0.00 0.46 -0.14 0.20 -0.10 0.00 0.00 175.22 175.63 1wb9 s GLY 144 N -3.71 0.74 -0.13 4.36 0.00 0.09 -4.00 107.32 104.66 1wb9 s GLY 144 Ca 0.34 -0.69 -0.11 0.00 0.00 0.00 0.00 44.72 44.27 1wb9 s GLY 144 CO 0.29 -0.61 0.34 -0.47 0.00 0.00 0.00 173.10 172.65 1wb9 s TYR 145 N -0.50 -0.40 0.01 1.90 5.04 -0.38 -1.65 117.35 121.36 1wb9 s TYR 145 Ca 0.04 0.95 0.00 0.00 -2.44 0.00 0.00 57.07 55.63 1wb9 s TYR 145 Cb -0.06 0.14 -0.01 0.00 0.35 0.00 0.00 41.96 42.38 1wb9 s TYR 145 CO 0.00 -0.21 -0.02 0.00 -1.34 0.00 0.00 175.55 173.99 1wb9 s ALA 146 N 0.47 0.07 0.06 3.97 0.00 -0.70 -0.61 121.76 125.01 1wb9 s ALA 146 Ca -0.02 -0.28 0.04 0.00 0.00 0.00 0.00 51.96 51.69 1wb9 s ALA 146 Cb -0.04 0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.12 1wb9 s ALA 146 CO -0.02 -0.07 -0.11 0.95 0.00 0.00 0.00 175.76 176.51 1wb9 s THR 147 N -0.68 0.82 -0.01 0.00 -4.23 -0.21 -1.47 115.64 109.85 1wb9 s THR 147 Ca -0.07 -1.19 -0.00 0.00 -1.18 0.00 0.00 61.69 59.25 1wb9 s THR 147 Cb -0.05 -0.83 0.02 0.00 1.34 0.00 0.00 72.50 72.98 1wb9 s THR 147 CO -0.00 -0.31 0.03 -0.22 -0.54 0.00 0.00 174.62 173.58 1wb9 s LEU 148 N -1.65 1.44 -0.49 4.79 2.96 0.78 -1.52 118.68 124.98 1wb9 s LEU 148 Ca -0.06 0.04 -0.15 0.00 -0.22 0.00 0.00 54.13 53.74 1wb9 s LEU 148 Cb -0.10 -0.01 0.09 0.00 0.50 0.00 0.00 46.19 46.67 1wb9 s LEU 148 CO 0.01 -0.08 0.41 -0.62 -1.32 0.00 0.00 176.35 174.76 1wb9 s ASP 149 N 0.62 6.12 0.57 3.68 -1.08 -0.68 -0.90 116.67 125.01 1wb9 s ASP 149 Ca -0.05 -1.47 0.34 0.00 -0.52 0.00 0.00 52.55 50.85 1wb9 s ASP 149 Cb -0.07 -2.18 1.73 0.00 -1.46 0.00 0.00 42.92 40.94 1wb9 s ASP 149 CO -0.02 -0.70 2.15 -0.29 0.52 0.00 0.00 175.17 176.83 1wb9 h ILE 150 N 5.82 0.27 0.16 4.11 2.10 -1.81 0.84 117.51 128.99 1wb9 h ILE 150 Ca -0.28 -0.35 -0.01 0.00 1.08 0.00 0.00 64.86 65.30 1wb9 h ILE 150 Cb 1.11 1.27 0.00 0.00 -1.09 0.00 0.00 36.82 38.11 1wb9 h ILE 150 CO 0.91 0.05 -0.07 0.28 -1.08 0.00 0.00 178.15 178.24 1wb9 h SER 151 N 0.00 -0.18 1.78 2.19 0.02 -1.91 -3.36 113.55 112.09 1wb9 h SER 151 Ca -0.00 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1wb9 h SER 151 Cb 0.27 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1wb9 h SER 151 CO 0.01 0.39 -0.18 0.77 -1.14 0.00 0.00 176.83 176.68 1wb9 h SER 152 N -0.87 0.00 0.00 3.07 4.64 -1.80 -3.36 113.55 115.23 1wb9 h SER 152 Ca -0.02 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1wb9 h SER 152 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1wb9 h SER 152 CO 0.04 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 1wb9 n GLY 153 N 1.13 0.72 3.62 -0.77 0.00 0.27 -4.90 105.19 105.27 1wb9 n GLY 153 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1wb9 n GLY 153 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wb9 s ARG 154 N -0.04 3.74 -0.12 1.61 3.52 -1.22 -4.62 118.95 121.82 1wb9 s ARG 154 Ca 0.00 1.57 0.01 0.00 -0.13 0.00 0.00 55.73 57.18 1wb9 s ARG 154 Cb 0.00 -4.04 0.02 0.00 -1.56 0.00 0.00 34.95 29.36 1wb9 s ARG 154 CO 0.00 -1.37 -0.16 0.12 -0.81 0.00 0.00 175.30 173.09 1wb9 s PHE 155 N 5.36 2.08 0.05 5.12 5.36 -1.26 -1.68 117.98 133.01 1wb9 s PHE 155 Ca 0.71 -1.03 0.04 0.00 -0.96 0.00 0.00 56.93 55.69 1wb9 s PHE 155 Cb -0.23 -1.50 -0.02 0.00 -0.34 0.00 0.00 43.02 40.92 1wb9 s PHE 155 CO 0.30 -0.53 -0.12 1.03 -1.46 0.00 0.00 175.22 174.44 1wb9 s ARG 156 N 1.07 0.73 0.13 10.12 1.81 -0.58 -2.42 118.95 129.82 1wb9 s ARG 156 Ca -0.04 -0.78 0.02 0.00 -1.72 0.00 0.00 55.73 53.21 1wb9 s ARG 156 Cb -0.15 -0.67 -0.04 0.00 -0.45 0.00 0.00 34.95 33.64 1wb9 s ARG 156 CO -0.03 0.15 -0.05 -0.48 -0.68 0.00 0.00 175.30 174.20 1wb9 s LEU 157 N -1.39 2.40 0.25 2.53 0.05 -0.38 -1.05 118.68 121.10 1wb9 s LEU 157 Ca -0.03 -1.06 -0.17 0.00 0.05 0.00 0.00 54.13 52.92 1wb9 s LEU 157 Cb -0.09 -0.14 0.01 0.00 -2.05 0.00 0.00 46.19 43.92 1wb9 s LEU 157 CO 0.01 -0.46 0.58 -0.94 -0.55 0.00 0.00 176.35 175.00 1wb9 s SER 158 N -3.12 -0.19 -0.44 1.48 1.04 0.22 -1.60 113.70 111.09 1wb9 s SER 158 Ca 0.17 -0.71 0.08 0.00 0.48 0.00 0.00 55.95 55.96 1wb9 s SER 158 Cb 0.05 0.64 0.25 0.00 0.10 0.00 0.00 66.02 67.06 1wb9 s SER 158 CO -0.01 -1.21 0.58 -0.62 0.98 0.00 0.00 173.24 172.96 1wb9 n GLU 159 N -0.41 1.12 -1.56 4.02 1.02 -1.26 -1.25 120.64 122.32 1wb9 n GLU 159 Ca -0.04 -3.54 -0.52 0.00 -0.02 0.00 0.00 57.16 53.04 1wb9 n GLU 159 Cb 0.61 -1.45 -0.06 0.00 -0.02 0.00 0.00 31.44 30.52 1wb9 n GLU 159 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1wb9 n PRO 160 N 1.25 0.87 0.23 3.49 -0.02 -1.26 -4.77 135.00 134.79 1wb9 n PRO 160 Ca 0.23 0.31 0.12 0.00 -2.02 0.00 0.00 63.50 62.14 1wb9 n PRO 160 Cb 0.51 -1.85 0.37 0.00 -0.02 0.00 0.00 33.50 32.50 1wb9 n PRO 160 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wb9 h ALA 161 N 3.71 0.96 -2.95 3.55 0.00 -1.94 -3.14 119.26 119.46 1wb9 h ALA 161 Ca -0.46 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.29 1wb9 h ALA 161 Cb 1.36 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.09 1wb9 h ALA 161 CO 0.72 0.15 0.09 0.16 0.00 0.00 0.00 179.25 180.37 1wb9 s ASP 162 N -6.09 0.09 0.27 0.00 1.47 -1.26 -4.85 116.67 106.30 1wb9 s ASP 162 Ca 0.03 -1.03 -0.01 0.00 1.18 0.00 0.00 52.55 52.73 1wb9 s ASP 162 Cb 0.08 0.73 0.51 0.00 -0.34 0.00 0.00 42.92 43.90 1wb9 s ASP 162 CO 0.64 -1.41 1.80 -0.09 0.68 0.00 0.00 175.17 176.79 1wb9 h ARG 163 N 2.08 0.78 -0.12 2.11 2.43 -2.00 -1.97 114.38 117.69 1wb9 h ARG 163 Ca -0.27 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.82 1wb9 h ARG 163 Cb 1.25 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1wb9 h ARG 163 CO 0.35 0.52 -0.07 0.93 -1.51 0.00 0.00 179.97 180.18 1wb9 h GLU 164 N 0.81 0.26 -0.05 0.20 3.07 -1.99 -1.43 114.58 115.46 1wb9 h GLU 164 Ca 0.46 -0.12 -0.04 0.00 -0.50 0.00 0.00 59.36 59.16 1wb9 h GLU 164 Cb 0.53 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1wb9 h GLU 164 CO -0.30 0.62 -0.16 1.15 -1.40 0.00 0.00 179.01 178.92 1wb9 h THR 165 N -0.10 1.15 -0.00 1.13 2.02 -1.94 -1.05 112.91 114.11 1wb9 h THR 165 Ca 0.02 -0.67 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 1wb9 h THR 165 Cb 0.55 1.29 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 1wb9 h THR 165 CO 0.02 0.20 -0.01 -0.03 0.37 0.00 0.00 175.52 176.07 1wb9 h MET 166 N 0.07 0.01 -0.63 6.66 -1.53 -1.15 -1.67 114.93 116.70 1wb9 h MET 166 Ca 0.01 -0.01 0.12 0.00 -3.44 0.00 0.00 59.70 56.39 1wb9 h MET 166 Cb 0.34 0.00 -0.09 0.00 -0.55 0.00 0.00 31.60 31.29 1wb9 h MET 166 CO 0.02 0.54 0.13 0.00 0.14 0.00 0.00 176.91 177.75 1wb9 h ALA 167 N 0.47 0.75 -0.88 0.39 0.00 -1.09 -0.44 119.26 118.46 1wb9 h ALA 167 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1wb9 h ALA 167 Cb 0.54 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1wb9 h ALA 167 CO 0.00 -0.31 0.48 0.00 0.00 0.00 0.00 179.25 179.42 1wb9 h ALA 168 N 1.51 1.12 -0.43 0.00 0.00 -1.15 -1.96 119.26 118.35 1wb9 h ALA 168 Ca 0.33 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1wb9 h ALA 168 Cb 0.51 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1wb9 h ALA 168 CO -0.43 0.63 -0.20 0.93 0.00 0.00 0.00 179.25 180.19 1wb9 h GLU 169 N 1.23 0.90 -0.49 0.00 4.39 -0.31 -1.19 114.58 119.11 1wb9 h GLU 169 Ca 0.31 -0.39 0.01 0.00 0.34 0.00 0.00 59.36 59.63 1wb9 h GLU 169 Cb 0.03 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 1wb9 h GLU 169 CO -0.05 1.04 0.32 -0.07 -1.16 0.00 0.00 179.01 179.09 1wb9 h LEU 170 N 0.73 0.53 -0.34 1.33 3.38 -0.97 0.29 115.31 120.25 1wb9 h LEU 170 Ca 0.10 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1wb9 h LEU 170 Cb 0.76 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1wb9 h LEU 170 CO 0.06 0.38 0.07 -0.61 0.09 0.00 0.00 178.44 178.43 1wb9 h GLN 171 N 0.64 0.56 -0.32 1.13 5.75 -1.26 0.14 115.11 121.74 1wb9 h GLN 171 Ca 0.19 -0.14 -0.01 0.00 -0.15 0.00 0.00 58.65 58.54 1wb9 h GLN 171 Cb -0.04 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.42 1wb9 h GLN 171 CO -0.06 0.63 0.18 -0.09 -2.65 0.00 0.00 178.83 176.84 1wb9 h ARG 172 N 0.40 0.44 0.00 1.69 2.43 -0.99 -3.14 114.38 115.21 1wb9 h ARG 172 Ca 0.11 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.11 1wb9 h ARG 172 Cb 0.33 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 1wb9 h ARG 172 CO 0.00 0.37 -0.78 1.79 -1.51 0.00 0.00 179.97 179.84 1wb9 h THR 173 N 0.40 0.71 -6.83 0.20 1.35 -0.93 -3.49 112.91 104.31 1wb9 h THR 173 Ca 0.11 -2.08 -0.56 0.00 -0.55 0.00 0.00 66.41 63.33 1wb9 h THR 173 Cb 0.05 2.26 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 1wb9 h THR 173 CO -0.02 0.40 -1.02 -3.20 -0.25 0.00 0.00 175.52 171.43 1wb9 n ASN 174 N -3.10 -4.44 -4.74 5.36 5.15 0.47 -4.81 115.26 109.15 1wb9 n ASN 174 Ca -0.01 -1.19 -0.41 0.00 -0.60 0.00 0.00 54.58 52.36 1wb9 n ASN 174 Cb 0.75 -1.82 -0.02 0.00 -0.53 0.00 0.00 39.78 38.16 1wb9 n ASN 174 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1wb9 s PRO 175 N -6.71 4.28 0.43 1.20 0.04 -1.26 -4.74 135.00 128.24 1wb9 s PRO 175 Ca 0.37 2.28 0.19 0.00 0.04 0.00 0.00 61.00 63.88 1wb9 s PRO 175 Cb -0.20 -3.12 0.99 0.00 0.04 0.00 0.00 34.50 32.21 1wb9 s PRO 175 CO 0.95 -0.41 1.91 0.00 0.04 0.00 0.00 177.00 179.48 1wb9 h ALA 176 N 5.20 1.30 -3.29 8.56 0.00 -1.56 -3.44 119.26 126.03 1wb9 h ALA 176 Ca -0.46 -0.24 -0.20 0.00 0.00 0.00 0.00 54.91 54.01 1wb9 h ALA 176 Cb 1.22 -0.04 -0.28 0.00 0.00 0.00 0.00 17.79 18.68 1wb9 h ALA 176 CO 0.79 0.33 -0.54 -2.00 0.00 0.00 0.00 179.25 177.82 1wb9 s GLU 177 N -4.12 0.17 -0.25 0.00 2.12 -1.18 -4.30 118.70 111.14 1wb9 s GLU 177 Ca -0.02 0.29 -0.03 0.00 0.36 0.00 0.00 54.97 55.56 1wb9 s GLU 177 Cb 0.13 0.01 0.08 0.00 0.26 0.00 0.00 34.13 34.61 1wb9 s GLU 177 CO 0.67 -0.07 0.09 -1.17 -0.54 0.00 0.00 175.26 174.23 1wb9 s LEU 178 N 0.46 1.09 0.03 2.70 2.96 0.32 -1.64 118.68 124.59 1wb9 s LEU 178 Ca -0.03 -1.12 -0.28 0.00 -0.22 0.00 0.00 54.13 52.48 1wb9 s LEU 178 Cb -0.04 -0.52 -0.04 0.00 0.50 0.00 0.00 46.19 46.08 1wb9 s LEU 178 CO -0.02 -0.38 0.90 -0.76 -1.32 0.00 0.00 176.35 174.77 1wb9 s LEU 179 N 1.93 4.41 0.02 -0.68 1.43 -0.21 -1.19 118.68 124.38 1wb9 s LEU 179 Ca 0.05 1.59 0.00 0.00 -1.03 0.00 0.00 54.13 54.74 1wb9 s LEU 179 Cb -0.17 -3.44 -0.02 0.00 0.03 0.00 0.00 46.19 42.59 1wb9 s LEU 179 CO -0.21 -0.14 -0.03 -0.72 0.23 0.00 0.00 176.35 175.48 1wb9 s TYR 180 N 0.55 0.26 0.64 0.29 -0.85 -0.83 -0.45 117.35 116.95 1wb9 s TYR 180 Ca 0.46 -0.51 -0.16 0.00 -0.52 0.00 0.00 57.07 56.35 1wb9 s TYR 180 Cb -0.21 -0.19 -0.01 0.00 0.38 0.00 0.00 41.96 41.93 1wb9 s TYR 180 CO 0.26 -0.18 1.11 0.00 -1.52 0.00 0.00 175.55 175.23 1wb9 s ALA 181 N -1.40 2.51 0.18 9.51 0.00 -1.23 -0.89 121.76 130.44 1wb9 s ALA 181 Ca -0.15 0.60 -0.13 0.00 0.00 0.00 0.00 51.96 52.28 1wb9 s ALA 181 Cb -0.10 -3.33 0.14 0.00 0.00 0.00 0.00 23.12 19.84 1wb9 s ALA 181 CO -0.01 -1.18 1.80 0.93 0.00 0.00 0.00 175.76 177.30 1wb9 h GLU 182 N 0.24 0.55 -0.75 0.00 5.08 -1.60 -2.62 114.58 115.47 1wb9 h GLU 182 Ca -0.47 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1wb9 h GLU 182 Cb 1.25 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1wb9 h GLU 182 CO 0.55 0.36 0.00 -0.40 -1.00 0.00 0.00 179.01 178.52 1wb9 n ASP 183 N -4.84 1.83 -4.69 1.42 5.75 -1.26 -4.91 116.55 109.85 1wb9 n ASP 183 Ca 0.05 -2.17 -0.44 0.00 -0.01 0.00 0.00 54.79 52.22 1wb9 n ASP 183 Cb 0.12 -0.45 -0.04 0.00 -1.03 0.00 0.00 41.12 39.72 1wb9 n ASP 183 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1wb9 n PHE 184 N 0.11 2.51 -0.02 2.11 7.35 -0.99 -4.88 117.46 123.66 1wb9 n PHE 184 Ca 0.06 -0.01 -0.22 0.00 -0.76 0.00 0.00 57.45 56.53 1wb9 n PHE 184 Cb 0.40 -2.67 -0.13 0.00 0.35 0.00 0.00 39.48 37.42 1wb9 n PHE 184 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1wb9 h ALA 185 N 7.82 0.28 -0.57 3.13 0.00 -1.92 -3.39 119.26 124.61 1wb9 h ALA 185 Ca -0.46 -1.21 -0.73 0.00 0.00 0.00 0.00 54.91 52.51 1wb9 h ALA 185 Cb 1.23 0.61 -0.10 0.00 0.00 0.00 0.00 17.79 19.53 1wb9 h ALA 185 CO 0.93 0.95 2.56 -1.91 0.00 0.00 0.00 179.25 181.78 1wb9 n GLU 186 N -3.90 3.81 0.27 0.00 4.07 -1.26 -4.73 120.64 118.89 1wb9 n GLU 186 Ca -0.29 -3.19 0.15 0.00 -0.06 0.00 0.00 57.16 53.77 1wb9 n GLU 186 Cb 0.90 -2.88 0.74 0.00 -0.06 0.00 0.00 31.44 30.14 1wb9 n GLU 186 CO 0.00 0.00 0.00 0.52 -0.06 0.00 0.00 177.13 177.59 1wb9 h MET 187 N 5.34 0.00 -0.05 5.31 2.86 -2.00 -2.66 114.93 123.73 1wb9 h MET 187 Ca 0.58 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 58.19 1wb9 h MET 187 Cb 0.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 1wb9 h MET 187 CO 1.65 0.09 -0.08 0.66 1.06 0.00 0.00 176.91 180.28 1wb9 h SER 188 N 0.00 0.07 -0.92 1.22 4.64 -1.98 -1.22 113.55 115.36 1wb9 h SER 188 Ca -0.00 -0.01 0.06 0.00 -0.47 0.00 0.00 61.79 61.37 1wb9 h SER 188 Cb 0.42 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 62.43 1wb9 h SER 188 CO 0.01 0.16 0.60 -0.07 -0.87 0.00 0.00 176.83 176.66 1wb9 h LEU 189 N 0.07 0.93 -0.76 5.97 3.38 -1.89 -3.34 115.31 119.67 1wb9 h LEU 189 Ca 0.02 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1wb9 h LEU 189 Cb 0.20 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1wb9 h LEU 189 CO 0.01 0.60 -0.01 2.30 0.09 0.00 0.00 178.44 181.43 1wb9 n ILE 190 N -4.49 0.00 -0.24 1.22 -5.35 -0.96 -4.86 119.36 104.68 1wb9 n ILE 190 Ca 0.14 -0.49 -0.00 0.00 -0.27 0.00 0.00 62.75 62.12 1wb9 n ILE 190 Cb 0.19 1.02 0.12 0.00 -1.74 0.00 0.00 39.64 39.22 1wb9 n ILE 190 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1wb9 h GLU 191 N 0.17 0.62 -0.04 6.28 4.81 -1.37 -2.08 114.58 122.98 1wb9 h GLU 191 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1wb9 h GLU 191 Cb 0.04 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.28 1wb9 h GLU 191 CO 0.00 0.41 0.00 0.41 -0.73 0.00 0.00 179.01 179.10 1wb9 n GLY 192 N -1.29 -0.63 3.83 1.92 0.00 -1.26 -4.95 105.19 102.80 1wb9 n GLY 192 Ca 0.10 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1wb9 n GLY 192 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wb9 s ARG 193 N -1.95 4.12 0.57 1.61 0.52 -0.78 -5.05 118.95 117.98 1wb9 s ARG 193 Ca 0.32 0.99 -0.17 0.00 -0.52 0.00 0.00 55.73 56.36 1wb9 s ARG 193 Cb 0.16 -2.22 -0.05 0.00 0.52 0.00 0.00 34.95 33.36 1wb9 s ARG 193 CO 0.25 -0.05 1.05 -0.98 0.02 0.00 0.00 175.30 175.60 1wb9 s ARG 194 N -3.35 3.43 -1.22 3.54 1.70 -1.26 -4.37 118.95 117.42 1wb9 s ARG 194 Ca 0.60 1.23 -0.06 0.00 -0.47 0.00 0.00 55.73 57.03 1wb9 s ARG 194 Cb -0.09 -2.05 0.01 0.00 -0.57 0.00 0.00 34.95 32.25 1wb9 s ARG 194 CO 0.18 -0.72 0.78 0.41 -1.08 0.00 0.00 175.30 174.87 1wb9 n GLY 195 N -0.84 -0.31 3.78 3.88 0.00 -1.22 -4.58 105.19 105.89 1wb9 n GLY 195 Ca 0.09 0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1wb9 n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wb9 s LEU 196 N -6.02 4.21 -0.31 0.99 1.43 -1.26 -0.52 118.68 117.20 1wb9 s LEU 196 Ca 0.39 2.03 -0.02 0.00 -1.03 0.00 0.00 54.13 55.49 1wb9 s LEU 196 Cb -0.17 -4.10 0.12 0.00 0.03 0.00 0.00 46.19 42.06 1wb9 s LEU 196 CO 0.48 -0.39 0.18 -0.13 0.23 0.00 0.00 176.35 176.71 1wb9 s ARG 197 N -2.33 0.33 0.08 1.70 1.81 -0.33 -4.88 118.95 115.32 1wb9 s ARG 197 Ca 0.55 -0.76 -0.31 0.00 -1.72 0.00 0.00 55.73 53.50 1wb9 s ARG 197 Cb -0.22 -1.14 -0.07 0.00 -0.45 0.00 0.00 34.95 33.06 1wb9 s ARG 197 CO 0.28 -1.09 1.45 0.50 -0.68 0.00 0.00 175.30 175.76 1wb9 s ARG 198 N 1.78 4.28 0.13 3.54 3.52 -1.26 -1.96 118.95 128.97 1wb9 s ARG 198 Ca 0.12 2.10 0.08 0.00 -0.13 0.00 0.00 55.73 57.90 1wb9 s ARG 198 Cb -0.18 -3.40 -0.04 0.00 -1.56 0.00 0.00 34.95 29.78 1wb9 s ARG 198 CO -0.23 -0.54 -0.18 1.03 -0.81 0.00 0.00 175.30 174.56 1wb9 s ARG 199 N 1.75 1.14 0.63 5.12 1.81 -0.07 -4.93 118.95 124.40 1wb9 s ARG 199 Ca 0.66 -1.25 -0.16 0.00 -1.72 0.00 0.00 55.73 53.26 1wb9 s ARG 199 Cb -0.36 -1.26 -0.01 0.00 -0.45 0.00 0.00 34.95 32.87 1wb9 s ARG 199 CO 0.29 0.27 1.13 -1.25 -0.68 0.00 0.00 175.30 175.06 1wb9 s PRO 200 N -2.33 2.89 0.28 3.54 0.04 -1.26 -1.60 135.00 136.55 1wb9 s PRO 200 Ca 0.10 1.50 -0.03 0.00 0.04 0.00 0.00 61.00 62.61 1wb9 s PRO 200 Cb -0.08 -1.95 0.38 0.00 0.04 0.00 0.00 34.50 32.90 1wb9 s PRO 200 CO 0.05 -1.20 1.88 1.25 0.04 0.00 0.00 177.00 179.02 1wb9 h LEU 201 N 0.34 0.90 -1.50 -3.56 5.85 -1.96 -2.91 115.31 112.47 1wb9 h LEU 201 Ca -0.48 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.15 1wb9 h LEU 201 Cb 1.26 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.06 1wb9 h LEU 201 CO 0.54 0.76 0.00 4.11 -0.34 0.00 0.00 178.44 183.51 1wb9 h TRP 202 N 0.99 0.00 0.00 1.25 5.08 -2.00 0.99 115.95 122.26 1wb9 h TRP 202 Ca 0.24 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.21 1wb9 h TRP 202 Cb 0.10 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.26 1wb9 h TRP 202 CO 0.01 0.00 0.00 0.39 -1.28 0.00 0.00 178.44 177.56 1wb9 n GLU 203 N -2.45 0.05 -0.58 0.12 1.02 -1.10 -3.08 120.64 114.61 1wb9 n GLU 203 Ca -0.01 0.13 0.08 0.00 -0.02 0.00 0.00 57.16 57.34 1wb9 n GLU 203 Cb 0.11 -1.57 0.31 0.00 -0.02 0.00 0.00 31.44 30.27 1wb9 n GLU 203 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1wb9 n PHE 204 N -1.66 1.31 -2.61 -0.32 3.72 0.34 -3.14 117.46 115.11 1wb9 n PHE 204 Ca 0.06 -0.78 -0.42 0.00 -0.05 0.00 0.00 57.45 56.26 1wb9 n PHE 204 Cb 0.30 -0.35 -0.04 0.00 -0.94 0.00 0.00 39.48 38.46 1wb9 n PHE 204 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1wb9 s GLU 205 N -2.58 4.57 0.18 -1.08 -6.30 -1.18 -4.72 118.70 107.60 1wb9 s GLU 205 Ca 0.46 1.57 -0.12 0.00 -2.50 0.00 0.00 54.97 54.38 1wb9 s GLU 205 Cb 0.35 -3.37 0.09 0.00 0.00 0.00 0.00 34.13 31.19 1wb9 s GLU 205 CO 0.13 -0.01 1.79 0.97 0.02 0.00 0.00 175.26 178.16 1wb9 h ILE 206 N 4.31 1.20 -0.52 -3.70 6.09 -1.93 -1.94 117.51 121.03 1wb9 h ILE 206 Ca -0.42 -0.52 -0.11 0.00 -1.37 0.00 0.00 64.86 62.44 1wb9 h ILE 206 Cb 1.21 0.42 -0.02 0.00 0.47 0.00 0.00 36.82 38.91 1wb9 h ILE 206 CO 0.75 0.22 -0.12 0.44 -3.07 0.00 0.00 178.15 176.37 1wb9 h ASP 207 N 0.84 1.00 -0.17 2.19 3.32 -2.00 -1.03 116.42 120.58 1wb9 h ASP 207 Ca 0.22 -0.36 -0.00 0.00 0.02 0.00 0.00 57.03 56.91 1wb9 h ASP 207 Cb 0.06 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1wb9 h ASP 207 CO -0.03 1.13 0.09 0.74 -1.72 0.00 0.00 179.24 179.45 1wb9 h THR 208 N 0.87 1.10 -0.48 0.35 2.02 -1.94 -2.23 112.91 112.59 1wb9 h THR 208 Ca 0.13 -0.27 0.05 0.00 0.77 0.00 0.00 66.41 67.10 1wb9 h THR 208 Cb 0.68 0.97 -0.05 0.00 -1.74 0.00 0.00 68.15 68.01 1wb9 h THR 208 CO 0.05 0.09 0.20 0.00 0.37 0.00 0.00 175.52 176.24 1wb9 h ALA 209 N 0.99 0.59 -0.34 6.16 0.00 -1.08 -0.72 119.26 124.86 1wb9 h ALA 209 Ca 0.06 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1wb9 h ALA 209 Cb 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1wb9 h ALA 209 CO -0.01 -0.17 0.13 0.00 0.00 0.00 0.00 179.25 179.19 1wb9 h ARG 210 N 0.40 0.52 -0.37 0.00 3.08 -1.16 -0.28 114.38 116.57 1wb9 h ARG 210 Ca 0.22 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 1wb9 h ARG 210 Cb 0.19 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1wb9 h ARG 210 CO -0.20 0.53 0.21 0.37 -1.07 0.00 0.00 179.97 179.81 1wb9 h GLN 211 N 0.40 0.52 -0.42 0.04 -0.00 -0.96 -0.09 115.11 114.60 1wb9 h GLN 211 Ca 0.11 -0.06 -0.14 0.00 -0.00 0.00 0.00 58.65 58.57 1wb9 h GLN 211 Cb 0.21 -0.10 -0.01 0.00 0.00 0.00 0.00 27.48 27.58 1wb9 h GLN 211 CO -0.01 0.41 -0.27 1.96 0.00 0.00 0.00 178.83 180.92 1wb9 h GLN 212 N 0.48 0.93 -0.45 1.69 1.08 -1.07 -1.38 115.11 116.39 1wb9 h GLN 212 Ca 0.13 -0.44 -0.10 0.00 -1.45 0.00 0.00 58.65 56.79 1wb9 h GLN 212 Cb 0.04 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.44 1wb9 h GLN 212 CO -0.02 1.09 -0.12 -0.07 -0.95 0.00 0.00 178.83 178.76 1wb9 h LEU 213 N 0.76 0.89 -0.64 1.46 3.38 -0.83 -1.84 115.31 118.48 1wb9 h LEU 213 Ca 0.09 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1wb9 h LEU 213 Cb 0.85 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 1wb9 h LEU 213 CO 0.08 1.05 0.32 0.78 0.09 0.00 0.00 178.44 180.75 1wb9 h ASN 214 N 0.72 0.84 -0.07 -0.43 2.35 -0.88 -2.20 115.58 115.90 1wb9 h ASN 214 Ca 0.11 -0.13 0.02 0.00 -0.55 0.00 0.00 56.30 55.76 1wb9 h ASN 214 Cb 0.67 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.80 1wb9 h ASN 214 CO 0.05 0.73 -0.06 0.25 -1.65 0.00 0.00 177.43 176.75 1wb9 h LEU 215 N 0.89 -0.20 -0.78 1.61 5.85 -1.14 -0.14 115.31 121.40 1wb9 h LEU 215 Ca 0.22 0.04 0.12 0.00 0.84 0.00 0.00 57.88 59.10 1wb9 h LEU 215 Cb 0.11 0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.16 1wb9 h LEU 215 CO -0.03 -0.09 0.39 -0.61 -0.34 0.00 0.00 178.44 177.77 1wb9 h GLN 216 N -0.08 0.61 -0.01 1.25 5.75 -1.08 -2.84 115.11 118.71 1wb9 h GLN 216 Ca 0.05 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1wb9 h GLN 216 Cb 0.15 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.57 1wb9 h GLN 216 CO -0.12 0.40 -0.43 1.19 -2.65 0.00 0.00 178.83 177.22 1wb9 n PHE 217 N -4.86 0.00 -2.60 3.99 3.72 -0.85 -4.86 117.46 111.99 1wb9 n PHE 217 Ca 0.14 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.42 1wb9 n PHE 217 Cb 0.34 -0.11 0.02 0.00 -0.94 0.00 0.00 39.48 38.79 1wb9 n PHE 217 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wb9 n GLY 218 N 1.41 0.04 3.49 1.37 0.00 -0.20 -5.01 105.19 106.28 1wb9 n GLY 218 Ca 0.09 -0.32 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 1wb9 n GLY 218 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wb9 s THR 219 N -2.83 2.61 -0.03 2.61 -4.23 -0.41 -5.04 115.64 108.32 1wb9 s THR 219 Ca 0.14 -2.25 0.02 0.00 -1.18 0.00 0.00 61.69 58.42 1wb9 s THR 219 Cb -0.06 -2.35 -0.25 0.00 1.34 0.00 0.00 72.50 71.18 1wb9 s THR 219 CO 0.17 -0.34 0.72 0.08 -0.54 0.00 0.00 174.62 174.72 1wb9 h ARG 220 N 2.41 0.15 -4.61 3.99 0.11 -1.96 -3.41 114.38 111.05 1wb9 h ARG 220 Ca -0.42 -0.25 -0.28 0.00 0.10 0.00 0.00 59.98 59.13 1wb9 h ARG 220 Cb 1.25 0.09 -0.14 0.00 1.11 0.00 0.00 29.97 32.28 1wb9 h ARG 220 CO 0.58 0.91 -0.58 0.16 0.10 0.00 0.00 179.97 181.14 1wb9 s ASP 221 N -6.66 0.43 -0.18 0.08 1.47 -1.26 -5.01 116.67 105.54 1wb9 s ASP 221 Ca -0.09 -1.44 0.12 0.00 1.18 0.00 0.00 52.55 52.31 1wb9 s ASP 221 Cb 0.07 0.42 0.66 0.00 -0.34 0.00 0.00 42.92 43.74 1wb9 s ASP 221 CO 0.82 -0.89 1.52 0.18 0.68 0.00 0.00 175.17 177.48 1wb9 n LEU 222 N -0.34 4.74 -0.21 2.11 4.77 -1.26 -4.59 117.00 122.22 1wb9 n LEU 222 Ca 0.03 -2.40 -0.07 0.00 -0.03 0.00 0.00 56.01 53.54 1wb9 n LEU 222 Cb 0.65 -0.63 0.03 0.00 -2.33 0.00 0.00 43.42 41.14 1wb9 n LEU 222 CO 0.32 0.59 1.06 0.58 -1.33 0.00 0.00 177.39 178.62 1wb9 h VAL 223 N 3.32 1.19 -0.03 4.08 2.07 -1.95 -2.69 116.25 122.24 1wb9 h VAL 223 Ca 0.00 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.07 1wb9 h VAL 223 Cb 1.63 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1wb9 h VAL 223 CO 0.37 0.20 0.16 1.23 0.02 0.00 0.00 177.57 179.55 1wb9 h GLY 224 N 0.79 0.00 -1.48 2.17 0.00 -2.02 -1.41 103.07 101.13 1wb9 h GLY 224 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1wb9 h GLY 224 CO -0.04 0.00 -0.22 0.69 0.00 0.00 0.00 176.54 176.97 1wb9 n PHE 225 N -3.12 0.00 -1.27 5.60 3.72 -1.02 -4.98 117.46 116.39 1wb9 n PHE 225 Ca -0.02 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.32 1wb9 n PHE 225 Cb 0.23 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.74 1wb9 n PHE 225 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wb9 n GLY 226 N 1.38 0.82 0.03 1.37 0.00 -0.53 -4.34 105.19 103.92 1wb9 n GLY 226 Ca 0.12 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1wb9 n GLY 226 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1wb9 n VAL 227 N -2.91 0.92 0.27 1.61 0.24 -1.19 -4.79 118.33 112.47 1wb9 n VAL 227 Ca -0.07 -0.96 0.12 0.00 -2.04 0.00 0.00 64.34 61.39 1wb9 n VAL 227 Cb 0.24 0.54 0.74 0.00 -1.47 0.00 0.00 33.84 33.89 1wb9 n VAL 227 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1wb9 h GLU 228 N 0.11 0.00 -0.50 7.34 4.57 -1.87 -2.47 114.58 121.76 1wb9 h GLU 228 Ca 0.00 0.00 -0.34 0.00 -1.18 0.00 0.00 59.36 57.84 1wb9 h GLU 228 Cb 0.47 0.00 -0.24 0.00 -0.16 0.00 0.00 28.75 28.83 1wb9 h GLU 228 CO 0.00 0.09 -0.42 0.27 -1.18 0.00 0.00 179.01 177.78 1wb9 n ASN 229 N -3.85 3.80 -3.00 1.04 6.94 -1.26 -4.72 115.26 114.20 1wb9 n ASN 229 Ca -0.02 -3.81 -0.27 0.00 -0.02 0.00 0.00 54.58 50.46 1wb9 n ASN 229 Cb 0.19 -0.51 -0.04 0.00 -2.36 0.00 0.00 39.78 37.05 1wb9 n ASN 229 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wb9 n ALA 230 N -0.93 4.54 -0.34 -2.53 0.00 -0.93 -4.95 120.51 115.37 1wb9 n ALA 230 Ca 0.37 -4.68 -0.04 0.00 0.00 0.00 0.00 53.44 49.10 1wb9 n ALA 230 Cb 0.89 -0.76 0.09 0.00 0.00 0.00 0.00 19.45 19.67 1wb9 n ALA 230 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1wb9 h PRO 231 N 3.13 1.24 -0.63 0.00 0.13 -1.84 -0.35 132.00 133.67 1wb9 h PRO 231 Ca 0.14 -0.12 0.10 0.00 -0.87 0.00 0.00 66.00 65.25 1wb9 h PRO 231 Cb 0.53 -0.25 -0.08 0.00 0.13 0.00 0.00 31.00 31.33 1wb9 h PRO 231 CO 0.81 0.88 0.22 0.00 -0.23 0.00 0.00 178.00 179.68 1wb9 h ARG 232 N 1.25 0.38 -0.29 0.86 3.08 -1.92 -1.54 114.38 116.19 1wb9 h ARG 232 Ca 0.32 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.27 1wb9 h ARG 232 Cb -0.03 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1wb9 h ARG 232 CO -0.06 0.25 -0.14 0.78 -1.07 0.00 0.00 179.97 179.74 1wb9 h GLY 233 N 0.39 0.67 1.35 0.04 0.00 -1.45 -3.16 103.07 100.90 1wb9 h GLY 233 Ca 0.33 -0.59 0.01 0.00 0.00 0.00 0.00 47.33 47.07 1wb9 h GLY 233 CO -0.34 0.54 0.43 1.41 0.00 0.00 0.00 176.54 178.58 1wb9 h LEU 234 N 0.36 0.76 -0.50 3.11 3.38 -0.80 -1.26 115.31 120.36 1wb9 h LEU 234 Ca 0.07 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1wb9 h LEU 234 Cb 0.65 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1wb9 h LEU 234 CO 0.04 0.55 0.31 0.00 0.09 0.00 0.00 178.44 179.44 1wb9 h ALA 236 N 1.21 0.70 -0.23 0.00 0.00 -1.39 -2.71 119.26 116.83 1wb9 h ALA 236 Ca 0.19 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1wb9 h ALA 236 Cb -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1wb9 h ALA 236 CO -0.07 0.48 -0.11 0.00 0.00 0.00 0.00 179.25 179.55 1wb9 h ALA 237 N 0.96 1.39 -0.16 0.00 0.00 -0.71 -1.79 119.26 118.96 1wb9 h ALA 237 Ca 0.15 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1wb9 h ALA 237 Cb 0.46 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.14 1wb9 h ALA 237 CO 0.02 0.42 -0.58 0.78 0.00 0.00 0.00 179.25 179.89 1wb9 h GLY 238 N 0.83 0.74 0.97 0.00 0.00 -0.91 -0.52 103.07 104.18 1wb9 h GLY 238 Ca 0.07 -0.99 -0.00 0.00 0.00 0.00 0.00 47.33 46.41 1wb9 h GLY 238 CO 0.02 0.88 0.17 0.00 0.00 0.00 0.00 176.54 177.62 1wb9 h LEU 240 N 0.37 0.15 -0.37 0.00 6.46 -1.27 -1.19 115.31 119.47 1wb9 h LEU 240 Ca 0.10 0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.82 1wb9 h LEU 240 Cb 0.02 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 39.92 1wb9 h LEU 240 CO -0.02 0.12 0.02 0.25 -0.62 0.00 0.00 178.44 178.19 1wb9 h LEU 241 N 0.23 0.63 -0.44 2.25 5.85 -0.93 -0.01 115.31 122.88 1wb9 h LEU 241 Ca 0.09 -0.30 0.08 0.00 0.84 0.00 0.00 57.88 58.59 1wb9 h LEU 241 Cb 0.03 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.83 1wb9 h LEU 241 CO -0.07 0.77 0.07 1.56 -0.34 0.00 0.00 178.44 180.42 1wb9 h GLN 242 N 0.47 0.19 -0.21 1.25 1.08 -1.11 -1.60 115.11 115.17 1wb9 h GLN 242 Ca 0.11 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1wb9 h GLN 242 Cb 0.44 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.81 1wb9 h GLN 242 CO 0.02 0.12 0.13 -0.92 -0.95 0.00 0.00 178.83 177.23 1wb9 h TYR 243 N 0.19 0.27 -0.77 2.96 3.20 -0.72 -1.92 116.97 120.18 1wb9 h TYR 243 Ca 0.22 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.13 1wb9 h TYR 243 Cb 0.29 -0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.42 1wb9 h TYR 243 CO -0.23 0.19 0.48 0.00 -1.64 0.00 0.00 178.16 176.96 1wb9 h ALA 244 N 1.06 1.02 -0.34 1.82 0.00 -0.58 -1.16 119.26 121.07 1wb9 h ALA 244 Ca 0.08 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1wb9 h ALA 244 Cb -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1wb9 h ALA 244 CO -0.02 0.27 -0.13 0.87 0.00 0.00 0.00 179.25 180.25 1wb9 h LYS 245 N 0.93 0.60 -0.16 0.00 1.57 -1.08 -2.52 116.57 115.91 1wb9 h LYS 245 Ca 0.31 -0.19 -0.11 0.00 -1.87 0.00 0.00 60.65 58.79 1wb9 h LYS 245 Cb 0.04 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1wb9 h LYS 245 CO -0.12 0.71 -0.38 0.22 -0.57 0.00 0.00 179.45 179.31 1wb9 h ASP 246 N 0.55 0.38 0.78 0.86 3.58 -0.44 0.84 116.42 122.96 1wb9 h ASP 246 Ca 0.10 -0.16 -0.15 0.00 0.42 0.00 0.00 57.03 57.24 1wb9 h ASP 246 Cb 0.54 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.47 1wb9 h ASP 246 CO 0.03 0.73 -0.73 0.71 -2.88 0.00 0.00 179.24 177.10 1wb9 h THR 247 N 0.30 1.50 0.01 2.25 1.35 -1.00 -3.35 112.91 113.98 1wb9 h THR 247 Ca 0.03 -2.54 -0.33 0.00 -0.55 0.00 0.00 66.41 63.02 1wb9 h THR 247 Cb 0.82 2.38 -0.05 0.00 -1.73 0.00 0.00 68.15 69.56 1wb9 h THR 247 CO 0.07 0.72 -1.98 0.00 -0.25 0.00 0.00 175.52 174.08 1wb9 n GLN 248 N -3.63 0.66 -4.10 4.72 1.13 -0.98 -4.94 117.38 110.25 1wb9 n GLN 248 Ca -0.01 0.19 -0.32 0.00 -1.94 0.00 0.00 57.00 54.93 1wb9 n GLN 248 Cb 0.72 -1.69 -0.02 0.00 0.11 0.00 0.00 30.24 29.36 1wb9 n GLN 248 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1wb9 n ARG 249 N -3.00 -3.39 -3.71 -1.09 5.12 0.27 -4.97 116.66 105.89 1wb9 n ARG 249 Ca -0.24 0.40 -0.14 0.00 -1.93 0.00 0.00 57.85 55.93 1wb9 n ARG 249 Cb 1.08 -4.90 -0.08 0.00 -1.16 0.00 0.00 32.46 27.41 1wb9 n ARG 249 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1wb9 s THR 250 N -3.56 0.05 0.76 0.55 2.01 -1.26 -5.12 115.64 109.06 1wb9 s THR 250 Ca 0.45 -0.39 -0.15 0.00 0.31 0.00 0.00 61.69 61.92 1wb9 s THR 250 Cb -0.24 -0.71 0.05 0.00 0.01 0.00 0.00 72.50 71.61 1wb9 s THR 250 CO 0.91 -0.21 1.19 0.35 -0.69 0.00 0.00 174.62 176.16 1wb9 n THR 251 N 1.16 2.86 -3.48 -0.82 -2.24 -1.26 -4.90 114.28 105.60 1wb9 n THR 251 Ca -0.21 -0.30 -0.27 0.00 -2.27 0.00 0.00 64.05 61.00 1wb9 n THR 251 Cb 0.56 -1.26 -0.09 0.00 -2.10 0.00 0.00 70.33 67.45 1wb9 n THR 251 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1wb9 n LEU 252 N -2.71 2.97 0.20 3.22 4.77 -1.26 -4.80 117.00 119.40 1wb9 n LEU 252 Ca 0.14 -5.26 0.15 0.00 -0.03 0.00 0.00 56.01 51.01 1wb9 n LEU 252 Cb 0.50 -0.46 0.62 0.00 -2.33 0.00 0.00 43.42 41.74 1wb9 n LEU 252 CO 0.48 2.00 0.93 1.55 -1.33 0.00 0.00 177.39 181.02 1wb9 h PRO 253 N 4.44 0.00 0.00 3.23 0.13 -1.94 -2.41 132.00 135.45 1wb9 h PRO 253 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1wb9 h PRO 253 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1wb9 h PRO 253 CO 0.75 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.13 1wb9 n HIS 254 N -2.64 0.37 -3.14 1.56 1.44 -1.26 -4.47 115.22 107.08 1wb9 n HIS 254 Ca 0.01 0.12 -0.46 0.00 -2.01 0.00 0.00 57.72 55.39 1wb9 n HIS 254 Cb 0.24 -0.70 -0.02 0.00 0.12 0.00 0.00 29.99 29.63 1wb9 n HIS 254 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1wb9 s ILE 255 N -3.09 5.21 -0.38 0.61 1.01 -0.91 -4.48 121.20 119.17 1wb9 s ILE 255 Ca 0.09 -2.05 0.04 0.00 0.00 0.00 0.00 60.65 58.73 1wb9 s ILE 255 Cb 0.13 -4.61 0.06 0.00 0.01 0.00 0.00 42.46 38.05 1wb9 s ILE 255 CO 0.45 -1.25 0.85 -2.11 0.00 0.00 0.00 174.94 172.88 1wb9 n ARG 256 N 5.16 1.21 -3.52 2.79 1.85 -1.26 -4.70 116.66 118.19 1wb9 n ARG 256 Ca 0.18 -1.19 -0.15 0.00 -1.00 0.00 0.00 57.85 55.69 1wb9 n ARG 256 Cb 0.48 -1.08 -0.05 0.00 -1.05 0.00 0.00 32.46 30.76 1wb9 n ARG 256 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1wb9 s SER 257 N -0.65 -0.54 0.05 2.89 0.15 -1.26 -4.83 113.70 109.51 1wb9 s SER 257 Ca 0.06 0.29 0.01 0.00 0.70 0.00 0.00 55.95 57.01 1wb9 s SER 257 Cb 0.04 0.53 -0.03 0.00 -1.71 0.00 0.00 66.02 64.85 1wb9 s SER 257 CO 0.05 -0.75 -0.06 -0.51 1.20 0.00 0.00 173.24 173.16 1wb9 s ILE 258 N -2.42 0.45 0.01 6.45 2.07 -1.26 -4.32 121.20 122.18 1wb9 s ILE 258 Ca -0.05 -1.31 0.02 0.00 -1.41 0.00 0.00 60.65 57.90 1wb9 s ILE 258 Cb -0.01 -0.87 -0.01 0.00 0.13 0.00 0.00 42.46 41.71 1wb9 s ILE 258 CO -0.01 -0.58 -0.06 -0.89 -1.91 0.00 0.00 174.94 171.48 1wb9 s THR 259 N -2.15 0.49 -0.08 4.00 2.01 -1.02 -4.74 115.64 114.15 1wb9 s THR 259 Ca -0.05 -0.44 -0.11 0.00 0.31 0.00 0.00 61.69 61.41 1wb9 s THR 259 Cb -0.05 -0.45 -0.05 0.00 0.01 0.00 0.00 72.50 71.96 1wb9 s THR 259 CO -0.02 0.02 0.26 -0.32 -0.69 0.00 0.00 174.62 173.87 1wb9 s MET 260 N -0.46 3.73 -0.37 4.92 1.75 -1.26 -1.24 119.30 126.37 1wb9 s MET 260 Ca -0.00 0.10 -0.11 0.00 -1.25 0.00 0.00 55.69 54.43 1wb9 s MET 260 Cb -0.04 -3.23 0.03 0.00 2.84 0.00 0.00 34.83 34.42 1wb9 s MET 260 CO -0.00 0.67 0.20 -1.21 -0.65 0.00 0.00 175.02 174.03 1wb9 s GLU 261 N -0.84 2.84 -0.06 4.11 2.02 -0.63 -4.96 118.70 121.18 1wb9 s GLU 261 Ca 0.18 -1.07 -0.12 0.00 0.02 0.00 0.00 54.97 53.99 1wb9 s GLU 261 Cb -0.14 -3.70 -0.05 0.00 0.10 0.00 0.00 34.13 30.34 1wb9 s GLU 261 CO 0.07 -0.68 0.30 1.03 0.02 0.00 0.00 175.26 176.01 1wb9 s ARG 262 N 1.55 3.80 0.28 1.61 0.52 -1.26 -4.64 118.95 120.81 1wb9 s ARG 262 Ca 0.02 0.19 0.01 0.00 -0.52 0.00 0.00 55.73 55.42 1wb9 s ARG 262 Cb -0.19 -3.24 0.68 0.00 0.52 0.00 0.00 34.95 32.72 1wb9 s ARG 262 CO 0.06 0.66 1.64 1.49 0.02 0.00 0.00 175.30 179.17 1wb9 h GLU 263 N 5.07 0.18 0.00 3.54 4.81 -1.97 -0.28 114.58 125.93 1wb9 h GLU 263 Ca -0.51 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1wb9 h GLU 263 Cb 1.22 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1wb9 h GLU 263 CO 0.62 0.12 0.00 0.00 -0.73 0.00 0.00 179.01 179.02 1wb9 n GLN 264 N -5.25 0.19 0.17 1.92 0.00 -1.26 -2.92 117.38 110.22 1wb9 n GLN 264 Ca 0.20 0.35 0.13 0.00 0.00 0.00 0.00 57.00 57.69 1wb9 n GLN 264 Cb 0.66 -1.82 0.35 0.00 0.00 0.00 0.00 30.24 29.43 1wb9 n GLN 264 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.06 176.62 1wb9 h ASP 265 N 0.00 0.00 -4.50 2.61 3.32 -1.45 -3.44 116.42 112.97 1wb9 h ASP 265 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 1wb9 h ASP 265 Cb 0.44 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 39.80 1wb9 h ASP 265 CO 0.00 0.00 -0.73 -0.94 -1.72 0.00 0.00 179.24 175.85 1wb9 s SER 266 N -5.24 1.30 -0.24 6.45 1.04 -1.15 -1.62 113.70 114.25 1wb9 s SER 266 Ca 0.08 -0.77 -0.29 0.00 0.48 0.00 0.00 55.95 55.45 1wb9 s SER 266 Cb 0.09 0.02 -0.00 0.00 0.10 0.00 0.00 66.02 66.23 1wb9 s SER 266 CO 0.60 -0.26 1.25 -0.63 0.98 0.00 0.00 173.24 175.18 1wb9 s ILE 267 N -2.27 4.26 0.11 -1.02 1.01 -0.36 -4.84 121.20 118.10 1wb9 s ILE 267 Ca 0.02 1.48 -0.30 0.00 0.00 0.00 0.00 60.65 61.85 1wb9 s ILE 267 Cb -0.04 -4.11 -0.07 0.00 0.01 0.00 0.00 42.46 38.26 1wb9 s ILE 267 CO -0.00 -0.30 1.18 -0.63 0.00 0.00 0.00 174.94 175.18 1wb9 s ILE 268 N 3.87 3.89 -0.06 2.92 1.01 -0.04 -4.66 121.20 128.13 1wb9 s ILE 268 Ca 0.54 1.46 -0.00 0.00 0.00 0.00 0.00 60.65 62.65 1wb9 s ILE 268 Cb -0.19 -3.93 0.03 0.00 0.01 0.00 0.00 42.46 38.38 1wb9 s ILE 268 CO 0.18 0.17 -0.02 -0.04 0.00 0.00 0.00 174.94 175.23 1wb9 s MET 269 N 0.45 0.65 0.83 2.79 -1.94 -1.26 -1.90 119.30 118.92 1wb9 s MET 269 Ca 0.55 0.02 -0.12 0.00 -1.71 0.00 0.00 55.69 54.44 1wb9 s MET 269 Cb -0.30 -0.86 0.09 0.00 2.01 0.00 0.00 34.83 35.77 1wb9 s MET 269 CO 0.32 -0.20 1.16 0.16 -0.01 0.00 0.00 175.02 176.46 1wb9 s ASP 270 N 1.45 4.34 0.19 3.03 1.47 -1.26 -4.76 116.67 121.12 1wb9 s ASP 270 Ca -0.03 0.86 -0.12 0.00 1.18 0.00 0.00 52.55 54.43 1wb9 s ASP 270 Cb -0.13 -1.39 0.11 0.00 -0.34 0.00 0.00 42.92 41.17 1wb9 s ASP 270 CO -0.03 -2.02 1.86 0.00 0.68 0.00 0.00 175.17 175.66 1wb9 h ALA 271 N -1.13 0.81 -0.79 2.11 0.00 -1.87 -0.88 119.26 117.51 1wb9 h ALA 271 Ca -0.47 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 1wb9 h ALA 271 Cb 1.32 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1wb9 h ALA 271 CO 0.65 0.24 0.48 0.00 0.00 0.00 0.00 179.25 180.61 1wb9 h ALA 272 N 1.23 1.00 -0.14 0.00 0.00 -1.95 -0.13 119.26 119.27 1wb9 h ALA 272 Ca 0.23 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1wb9 h ALA 272 Cb -0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 1wb9 h ALA 272 CO -0.05 0.46 0.04 1.15 0.00 0.00 0.00 179.25 180.84 1wb9 h THR 273 N 1.08 1.20 -0.44 0.00 2.02 -1.66 -0.11 112.91 114.98 1wb9 h THR 273 Ca 0.28 -0.61 0.08 0.00 0.77 0.00 0.00 66.41 66.93 1wb9 h THR 273 Cb -0.05 1.34 -0.07 0.00 -1.74 0.00 0.00 68.15 67.63 1wb9 h THR 273 CO -0.05 0.18 0.03 -0.09 0.37 0.00 0.00 175.52 175.96 1wb9 h ARG 274 N 0.03 0.14 -0.23 6.66 2.43 -0.82 -1.51 114.38 121.09 1wb9 h ARG 274 Ca 0.04 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1wb9 h ARG 274 Cb 0.25 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1wb9 h ARG 274 CO 0.00 0.10 0.10 0.00 -1.51 0.00 0.00 179.97 178.66 1wb9 h ARG 275 N 0.15 0.33 0.00 0.20 3.08 -0.90 -3.00 114.38 114.24 1wb9 h ARG 275 Ca 0.22 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 1wb9 h ARG 275 Cb 0.31 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1wb9 h ARG 275 CO -0.34 0.36 -0.10 -0.91 -1.07 0.00 0.00 179.97 177.91 1wb9 h ASN 276 N 0.23 0.00 0.42 7.04 2.35 -0.59 -1.96 115.58 123.07 1wb9 h ASN 276 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1wb9 h ASN 276 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1wb9 h ASN 276 CO -0.01 0.10 -0.42 0.18 -1.65 0.00 0.00 177.43 175.63 1wb9 n LEU 277 N -3.40 0.66 -3.68 1.61 4.77 -0.61 -4.98 117.00 111.38 1wb9 n LEU 277 Ca -0.01 -0.08 -0.28 0.00 -0.03 0.00 0.00 56.01 55.61 1wb9 n LEU 277 Cb 0.27 -0.21 0.04 0.00 -2.33 0.00 0.00 43.42 41.19 1wb9 n LEU 277 CO 0.29 0.15 -0.08 -0.62 -1.33 0.00 0.00 177.39 175.79 1wb9 n GLU 278 N -1.24 -2.11 0.17 3.23 1.02 -0.74 -4.65 120.64 116.33 1wb9 n GLU 278 Ca 0.08 0.51 -0.10 0.00 -0.02 0.00 0.00 57.16 57.63 1wb9 n GLU 278 Cb 0.34 -4.48 -0.05 0.00 -0.02 0.00 0.00 31.44 27.22 1wb9 n GLU 278 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1wb9 h ILE 279 N -1.81 0.24 0.00 -3.67 2.04 -1.85 -1.32 117.51 111.14 1wb9 h ILE 279 Ca -0.65 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 64.51 1wb9 h ILE 279 Cb 1.36 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 1wb9 h ILE 279 CO 0.51 0.06 -1.14 0.35 0.00 0.00 0.00 178.15 177.93 1wb9 n THR 280 N -5.11 0.04 -4.81 -0.27 -2.24 -1.26 -1.03 114.28 99.60 1wb9 n THR 280 Ca -0.08 -0.07 -0.24 0.00 -2.27 0.00 0.00 64.05 61.39 1wb9 n THR 280 Cb 0.24 0.16 -0.15 0.00 -2.10 0.00 0.00 70.33 68.48 1wb9 n THR 280 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1wb9 s GLN 281 N -2.17 1.38 0.75 -0.78 0.74 -1.26 -4.58 119.66 113.74 1wb9 s GLN 281 Ca -0.01 -0.60 -0.08 0.00 0.05 0.00 0.00 55.36 54.71 1wb9 s GLN 281 Cb 0.02 -1.33 0.08 0.00 1.10 0.00 0.00 33.01 32.88 1wb9 s GLN 281 CO 0.12 0.36 1.08 0.54 -0.55 0.00 0.00 175.29 176.84 1wb9 s ASN 282 N -0.39 4.58 0.57 6.67 2.20 -0.10 -4.28 114.94 124.18 1wb9 s ASN 282 Ca 0.06 0.49 0.32 0.00 -0.94 0.00 0.00 52.86 52.79 1wb9 s ASN 282 Cb -0.07 -1.04 1.72 0.00 -2.00 0.00 0.00 41.25 39.87 1wb9 s ASN 282 CO -0.01 -1.78 2.16 -0.07 -2.94 0.00 0.00 177.10 174.47 1wb9 h LEU 283 N -0.80 0.00 0.00 3.54 3.38 -1.89 -1.79 115.31 117.75 1wb9 h LEU 283 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1wb9 h LEU 283 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1wb9 h LEU 283 CO 0.59 0.06 -0.44 0.00 0.09 0.00 0.00 178.44 178.74 1wb9 n ALA 284 N -2.23 2.99 0.00 1.53 0.00 -1.26 -4.97 120.51 116.58 1wb9 n ALA 284 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1wb9 n ALA 284 Cb 0.18 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1wb9 n ALA 284 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wb9 n GLY 285 N 1.41 1.77 2.05 0.00 0.00 -0.67 -5.12 105.19 104.64 1wb9 n GLY 285 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 1wb9 n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wb9 n GLY 286 N -0.56 -0.68 0.22 -0.02 0.00 -1.26 -4.71 105.19 98.18 1wb9 n GLY 286 Ca 0.00 -1.79 0.07 0.00 0.00 0.00 0.00 46.02 44.30 1wb9 n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wb9 n ALA 287 N -3.29 3.36 -2.11 4.61 0.00 -1.26 -0.93 120.51 120.88 1wb9 n ALA 287 Ca -0.11 -0.48 -0.28 0.00 0.00 0.00 0.00 53.44 52.58 1wb9 n ALA 287 Cb 0.31 -0.52 0.02 0.00 0.00 0.00 0.00 19.45 19.26 1wb9 n ALA 287 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1wb9 s GLU 288 N -1.97 3.22 -1.61 0.00 0.41 -1.26 -4.19 118.70 113.30 1wb9 s GLU 288 Ca 0.10 0.18 -0.01 0.00 -0.41 0.00 0.00 54.97 54.83 1wb9 s GLU 288 Cb 0.11 -2.27 0.00 0.00 -1.78 0.00 0.00 34.13 30.19 1wb9 s GLU 288 CO 0.44 -0.53 0.16 -1.71 -0.49 0.00 0.00 175.26 173.14 1wb9 n ASN 289 N -2.51 -5.68 -4.72 -0.19 5.15 -1.26 -4.50 115.26 101.56 1wb9 n ASN 289 Ca 0.03 -0.09 -0.25 0.00 -0.60 0.00 0.00 54.58 53.68 1wb9 n ASN 289 Cb 0.56 -4.65 -0.08 0.00 -0.53 0.00 0.00 39.78 35.09 1wb9 n ASN 289 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1wb9 s THR 290 N -3.02 2.44 0.27 -0.44 -4.23 -1.26 -4.85 115.64 104.55 1wb9 s THR 290 Ca 0.08 -1.75 -0.04 0.00 -1.18 0.00 0.00 61.69 58.80 1wb9 s THR 290 Cb -0.04 -2.96 0.21 0.00 1.34 0.00 0.00 72.50 71.06 1wb9 s THR 290 CO 0.10 -0.06 1.89 0.25 -0.54 0.00 0.00 174.62 176.26 1wb9 h LEU 291 N 1.52 0.98 -0.75 4.79 5.85 -1.01 -2.80 115.31 123.88 1wb9 h LEU 291 Ca -0.43 -0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.09 1wb9 h LEU 291 Cb 1.25 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 1wb9 h LEU 291 CO 0.69 0.79 -0.24 0.00 -0.34 0.00 0.00 178.44 179.34 1wb9 h ALA 292 N 1.36 0.93 0.00 1.25 0.00 -1.34 -1.60 119.26 119.87 1wb9 h ALA 292 Ca 0.27 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1wb9 h ALA 292 Cb 0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1wb9 h ALA 292 CO -0.04 0.61 -0.09 0.66 0.00 0.00 0.00 179.25 180.39 1wb9 h SER 293 N 0.59 0.00 0.05 0.00 4.64 -1.72 0.38 113.55 117.50 1wb9 h SER 293 Ca 0.08 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.15 1wb9 h SER 293 Cb 0.73 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.80 1wb9 h SER 293 CO 0.06 0.09 -1.34 0.58 -0.87 0.00 0.00 176.83 175.35 1wb9 h VAL 294 N 0.00 0.95 0.00 0.95 2.07 -1.47 -3.42 116.25 115.34 1wb9 h VAL 294 Ca -0.00 -2.27 -0.12 0.00 0.82 0.00 0.00 66.70 65.12 1wb9 h VAL 294 Cb 0.25 2.48 -0.02 0.00 -1.52 0.00 0.00 31.29 32.48 1wb9 h VAL 294 CO 0.01 0.53 -0.73 -0.07 0.02 0.00 0.00 177.57 177.34 1wb9 h LEU 295 N -0.64 0.00 -7.79 2.57 3.38 -1.20 -3.42 115.31 108.21 1wb9 h LEU 295 Ca -0.33 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 56.91 1wb9 h LEU 295 Cb 1.52 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 42.09 1wb9 h LEU 295 CO -0.08 0.54 1.10 -0.62 0.09 0.00 0.00 178.44 179.47 1wb9 s ASP 296 N -6.32 6.95 -0.46 -0.43 2.15 0.13 -4.70 116.67 113.99 1wb9 s ASP 296 Ca 0.02 -2.75 0.03 0.00 0.43 0.00 0.00 52.55 50.29 1wb9 s ASP 296 Cb 0.08 -2.38 0.47 0.00 -0.30 0.00 0.00 42.92 40.79 1wb9 s ASP 296 CO 0.76 -0.80 1.62 0.00 -0.17 0.00 0.00 175.17 176.58 1wb9 s THR 298 N -4.48 2.18 -0.24 0.00 -4.23 -1.26 -4.90 115.64 102.70 1wb9 s THR 298 Ca 0.57 0.06 0.14 0.00 -1.18 0.00 0.00 61.69 61.28 1wb9 s THR 298 Cb 0.46 -2.13 -0.20 0.00 1.34 0.00 0.00 72.50 71.97 1wb9 s THR 298 CO 0.02 -0.08 0.41 1.33 -0.54 0.00 0.00 174.62 175.76 1wb9 n VAL 299 N -4.23 0.00 -4.17 2.29 0.24 -1.26 -4.92 118.33 106.28 1wb9 n VAL 299 Ca 0.11 -0.27 -0.28 0.00 -2.04 0.00 0.00 64.34 61.86 1wb9 n VAL 299 Cb 0.52 0.45 -0.08 0.00 -1.47 0.00 0.00 33.84 33.27 1wb9 n VAL 299 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1wb9 s THR 300 N -2.76 3.87 0.30 3.34 -4.23 -1.26 -4.62 115.64 110.26 1wb9 s THR 300 Ca -0.02 -1.27 0.01 0.00 -1.18 0.00 0.00 61.69 59.23 1wb9 s THR 300 Cb 0.10 -2.92 0.15 0.00 1.34 0.00 0.00 72.50 71.17 1wb9 s THR 300 CO 0.59 -0.04 1.83 -0.65 -0.54 0.00 0.00 174.62 175.81 1wb9 h PRO 301 N 2.89 0.71 -0.56 3.99 0.11 -1.86 -2.12 132.00 135.16 1wb9 h PRO 301 Ca -0.47 -0.15 -0.05 0.00 0.11 0.00 0.00 66.00 65.43 1wb9 h PRO 301 Cb 1.19 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 1wb9 h PRO 301 CO 0.59 0.68 0.14 0.00 -0.21 0.00 0.00 178.00 179.20 1wb9 h MET 302 N 0.68 0.86 -0.47 1.05 -0.00 -1.84 -2.03 114.93 113.19 1wb9 h MET 302 Ca 0.15 -0.18 -0.04 0.00 -0.00 0.00 0.00 59.70 59.63 1wb9 h MET 302 Cb 0.33 -0.13 -0.02 0.00 -0.00 0.00 0.00 31.60 31.78 1wb9 h MET 302 CO 0.01 0.77 0.15 0.78 -0.00 0.00 0.00 176.91 178.62 1wb9 h GLY 303 N 0.98 0.77 0.77 -3.00 0.00 -1.72 -2.07 103.07 98.81 1wb9 h GLY 303 Ca 0.18 -0.45 0.04 0.00 0.00 0.00 0.00 47.33 47.10 1wb9 h GLY 303 CO -0.00 0.42 0.34 0.23 0.00 0.00 0.00 176.54 177.53 1wb9 h SER 304 N 0.62 0.52 -0.26 0.19 0.87 -1.21 -1.26 113.55 113.01 1wb9 h SER 304 Ca 0.15 0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.60 1wb9 h SER 304 Cb 0.26 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 1wb9 h SER 304 CO -0.01 0.35 -0.31 0.03 -0.53 0.00 0.00 176.83 176.36 1wb9 h ARG 305 N 0.65 0.77 -0.33 2.24 3.08 -1.26 -2.47 114.38 117.06 1wb9 h ARG 305 Ca 0.26 -0.36 -0.05 0.00 0.07 0.00 0.00 59.98 59.90 1wb9 h ARG 305 Cb 0.11 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1wb9 h ARG 305 CO -0.14 0.98 0.02 1.98 -1.07 0.00 0.00 179.97 181.74 1wb9 h MET 306 N 0.65 0.57 -0.56 0.04 4.05 -1.04 -2.10 114.93 116.54 1wb9 h MET 306 Ca 0.07 -0.17 0.05 0.00 -0.28 0.00 0.00 59.70 59.38 1wb9 h MET 306 Cb 0.85 -0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.54 1wb9 h MET 306 CO 0.07 0.68 0.28 1.25 0.23 0.00 0.00 176.91 179.43 1wb9 h LEU 307 N 0.38 0.40 -1.35 3.39 5.85 -1.19 -0.88 115.31 121.91 1wb9 h LEU 307 Ca 0.10 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1wb9 h LEU 307 Cb 0.41 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1wb9 h LEU 307 CO 0.01 0.26 -0.16 0.11 -0.34 0.00 0.00 178.44 178.33 1wb9 h LYS 308 N 0.53 0.24 -0.14 1.25 1.57 -1.26 0.14 116.57 118.91 1wb9 h LYS 308 Ca 0.25 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 1wb9 h LYS 308 Cb 0.18 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1wb9 h LYS 308 CO -0.18 0.40 0.01 0.00 -0.57 0.00 0.00 179.45 179.11 1wb9 h ARG 309 N 0.22 0.23 -0.84 3.15 3.08 -0.68 -2.78 114.38 116.78 1wb9 h ARG 309 Ca 0.04 -0.07 0.08 0.00 0.07 0.00 0.00 59.98 60.11 1wb9 h ARG 309 Cb 0.42 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.37 1wb9 h ARG 309 CO 0.03 0.44 0.50 -1.49 -1.07 0.00 0.00 179.97 178.37 1wb9 h TRP 310 N -0.01 0.91 -0.11 3.04 4.06 -0.55 -1.33 115.95 121.96 1wb9 h TRP 310 Ca 0.04 0.03 -0.07 0.00 2.06 0.00 0.00 58.89 60.95 1wb9 h TRP 310 Cb 0.33 -0.28 -0.01 0.00 -1.00 0.00 0.00 29.16 28.19 1wb9 h TRP 310 CO 0.02 0.41 -0.25 -0.07 -3.56 0.00 0.00 178.44 174.99 1wb9 h LEU 311 N 0.86 0.19 0.00 -4.49 3.38 -0.88 -2.58 115.31 111.80 1wb9 h LEU 311 Ca 0.39 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1wb9 h LEU 311 Cb 0.29 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1wb9 h LEU 311 CO -0.22 0.46 -0.44 1.41 0.09 0.00 0.00 178.44 179.74 1wb9 n HIS 312 N -4.17 0.29 -3.55 1.13 8.25 -0.99 -4.47 115.22 111.71 1wb9 n HIS 312 Ca -0.01 0.08 -0.27 0.00 -0.26 0.00 0.00 57.72 57.26 1wb9 n HIS 312 Cb 0.35 -0.50 -0.11 0.00 1.12 0.00 0.00 29.99 30.86 1wb9 n HIS 312 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1wb9 n MET 313 N -1.80 0.72 -2.13 -0.41 1.56 -0.54 -4.98 117.12 109.55 1wb9 n MET 313 Ca 0.05 -3.60 -0.40 0.00 -0.27 0.00 0.00 57.70 53.48 1wb9 n MET 313 Cb 0.38 -1.86 -0.02 0.00 2.15 0.00 0.00 33.22 33.87 1wb9 n MET 313 CO 0.00 0.00 0.00 -2.14 -0.73 0.00 0.00 175.97 173.10 1wb9 s PRO 314 N -0.46 4.28 -0.09 2.12 0.02 -1.23 -4.75 135.00 134.90 1wb9 s PRO 314 Ca 0.31 2.16 -0.05 0.00 0.02 0.00 0.00 61.00 63.43 1wb9 s PRO 314 Cb 0.02 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.50 1wb9 s PRO 314 CO -0.19 -0.23 0.13 0.54 -0.33 0.00 0.00 177.00 176.92 1wb9 s VAL 315 N -1.18 5.31 -0.89 3.83 0.11 -0.01 -1.22 120.40 126.35 1wb9 s VAL 315 Ca 0.51 0.04 0.24 0.00 -2.93 0.00 0.00 61.98 59.84 1wb9 s VAL 315 Cb -0.38 -3.35 -0.05 0.00 -1.53 0.00 0.00 36.38 31.07 1wb9 s VAL 315 CO 0.51 0.54 1.25 0.54 -3.33 0.00 0.00 175.10 174.61 1wb9 n ARG 316 N 1.74 0.08 -2.46 1.54 1.74 -0.64 -4.75 116.66 113.91 1wb9 n ARG 316 Ca -0.18 0.01 -0.42 0.00 -0.77 0.00 0.00 57.85 56.49 1wb9 n ARG 316 Cb 0.54 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.42 1wb9 n ARG 316 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1wb9 s ASP 317 N -3.29 6.26 0.54 0.55 2.15 -1.26 -4.88 116.67 116.73 1wb9 s ASP 317 Ca 0.09 0.23 0.30 0.00 0.43 0.00 0.00 52.55 53.60 1wb9 s ASP 317 Cb 0.16 -2.55 1.50 0.00 -0.30 0.00 0.00 42.92 41.73 1wb9 s ASP 317 CO 0.75 -1.61 2.07 0.71 -0.17 0.00 0.00 175.17 176.91 1wb9 h THR 318 N 6.29 0.40 -0.40 1.71 1.35 -1.99 -2.45 112.91 117.82 1wb9 h THR 318 Ca -0.26 -0.53 0.05 0.00 -0.55 0.00 0.00 66.41 65.12 1wb9 h THR 318 Cb 1.08 1.38 -0.05 0.00 -1.73 0.00 0.00 68.15 68.83 1wb9 h THR 318 CO 1.18 0.10 0.12 0.03 -0.25 0.00 0.00 175.52 176.69 1wb9 h ARG 319 N 0.00 0.26 -0.82 4.72 3.08 -2.00 0.28 114.38 119.91 1wb9 h ARG 319 Ca -0.00 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1wb9 h ARG 319 Cb 0.37 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.33 1wb9 h ARG 319 CO 0.01 0.17 0.43 0.28 -1.07 0.00 0.00 179.97 179.80 1wb9 h VAL 320 N 0.26 1.24 -0.15 2.04 2.07 -1.86 -2.98 116.25 116.88 1wb9 h VAL 320 Ca 0.19 -0.62 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 1wb9 h VAL 320 Cb 0.19 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1wb9 h VAL 320 CO -0.21 0.28 -0.11 -0.07 0.02 0.00 0.00 177.57 177.48 1wb9 h LEU 321 N 1.15 0.35 -1.24 2.57 3.38 -0.93 -2.16 115.31 118.44 1wb9 h LEU 321 Ca 0.29 -0.45 0.11 0.00 0.09 0.00 0.00 57.88 57.92 1wb9 h LEU 321 Cb 0.05 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 40.63 1wb9 h LEU 321 CO -0.04 0.73 0.57 -0.07 0.09 0.00 0.00 178.44 179.71 1wb9 h LEU 322 N -0.01 0.74 -0.35 1.67 3.38 -0.55 -0.00 115.31 120.18 1wb9 h LEU 322 Ca 0.03 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1wb9 h LEU 322 Cb 0.61 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1wb9 h LEU 322 CO 0.03 0.42 -0.04 -0.33 0.09 0.00 0.00 178.44 178.60 1wb9 h GLU 323 N 0.81 0.65 -0.42 1.13 5.08 -1.34 -0.50 114.58 119.99 1wb9 h GLU 323 Ca 0.42 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1wb9 h GLU 323 Cb 0.52 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1wb9 h GLU 323 CO -0.19 0.79 0.23 0.00 -1.00 0.00 0.00 179.01 178.85 1wb9 h ARG 324 N 0.45 0.59 -0.25 2.33 3.08 -0.81 -1.50 114.38 118.26 1wb9 h ARG 324 Ca 0.10 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 60.11 1wb9 h ARG 324 Cb 0.52 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.43 1wb9 h ARG 324 CO 0.03 0.47 0.06 1.96 -1.07 0.00 0.00 179.97 181.42 1wb9 h GLN 325 N 0.55 0.16 -0.40 0.04 4.20 -0.94 -0.85 115.11 117.87 1wb9 h GLN 325 Ca 0.15 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.77 1wb9 h GLN 325 Cb 0.05 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 1wb9 h GLN 325 CO -0.02 0.11 -0.08 1.96 -0.67 0.00 0.00 178.83 180.13 1wb9 h GLN 326 N 0.17 0.69 -0.38 1.46 4.20 -0.93 -1.42 115.11 118.90 1wb9 h GLN 326 Ca 0.11 -0.20 -0.05 0.00 0.06 0.00 0.00 58.65 58.57 1wb9 h GLN 326 Cb 0.10 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1wb9 h GLN 326 CO -0.14 0.76 0.05 1.15 -0.67 0.00 0.00 178.83 179.98 1wb9 h THR 327 N 0.64 1.25 -0.76 -0.54 2.02 -1.11 -1.21 112.91 113.20 1wb9 h THR 327 Ca 0.12 -0.89 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 1wb9 h THR 327 Cb 0.51 1.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.98 1wb9 h THR 327 CO 0.03 0.30 0.44 0.40 0.37 0.00 0.00 175.52 177.06 1wb9 h ILE 328 N 0.47 1.22 -0.61 3.11 2.04 -0.67 -0.66 117.51 122.41 1wb9 h ILE 328 Ca 0.11 -0.51 -0.06 0.00 1.00 0.00 0.00 64.86 65.41 1wb9 h ILE 328 Cb 0.39 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 1wb9 h ILE 328 CO 0.01 0.23 0.16 1.23 0.00 0.00 0.00 178.15 179.79 1wb9 h GLY 329 N 1.04 1.04 2.00 5.37 0.00 -1.16 -3.15 103.07 108.21 1wb9 h GLY 329 Ca 0.27 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.85 1wb9 h GLY 329 CO -0.05 0.60 -0.51 0.00 0.00 0.00 0.00 176.54 176.58 1wb9 h ALA 330 N 1.05 0.74 -0.00 3.60 0.00 -0.87 -3.08 119.26 120.69 1wb9 h ALA 330 Ca 0.19 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1wb9 h ALA 330 Cb 0.33 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1wb9 h ALA 330 CO -0.00 0.63 -0.26 1.28 0.00 0.00 0.00 179.25 180.91 1wb9 n LEU 331 N -3.32 0.43 -0.23 0.00 4.77 -0.28 -4.47 117.00 113.89 1wb9 n LEU 331 Ca 0.01 0.09 -0.03 0.00 -0.03 0.00 0.00 56.01 56.06 1wb9 n LEU 331 Cb 0.69 -0.28 0.04 0.00 -2.33 0.00 0.00 43.42 41.53 1wb9 n LEU 331 CO 0.40 0.09 0.66 -0.61 -1.33 0.00 0.00 177.39 176.60 1wb9 h GLN 332 N 0.27 -0.09 0.00 3.23 4.15 -1.49 0.49 115.11 121.67 1wb9 h GLN 332 Ca 0.00 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1wb9 h GLN 332 Cb 0.47 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.18 1wb9 h GLN 332 CO 0.00 -0.06 0.00 -0.25 -1.93 0.00 0.00 178.83 176.59 1wb9 n ASP 333 N -5.46 0.00 -0.10 -0.69 8.00 -1.26 -3.70 116.55 113.34 1wb9 n ASP 333 Ca 0.07 -1.10 0.04 0.00 0.71 0.00 0.00 54.79 54.51 1wb9 n ASP 333 Cb 0.37 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.45 1wb9 n ASP 333 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1wb9 n PHE 334 N -0.90 0.00 0.07 1.24 3.72 0.15 -4.74 117.46 117.00 1wb9 n PHE 334 Ca 0.17 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.55 1wb9 n PHE 334 Cb 0.08 0.00 0.22 0.00 -0.94 0.00 0.00 39.48 38.84 1wb9 n PHE 334 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1wb9 h THR 335 N 0.49 1.29 -0.58 4.37 1.35 -1.60 -1.73 112.91 116.50 1wb9 h THR 335 Ca 0.00 -1.42 -0.05 0.00 -0.55 0.00 0.00 66.41 64.39 1wb9 h THR 335 Cb 0.22 1.57 -0.02 0.00 -1.73 0.00 0.00 68.15 68.19 1wb9 h THR 335 CO 0.00 0.43 0.19 0.00 -0.25 0.00 0.00 175.52 175.89 1wb9 h ALA 336 N 1.35 0.76 -0.09 6.62 0.00 -1.86 -2.10 119.26 123.94 1wb9 h ALA 336 Ca 0.03 -0.20 -0.19 0.00 0.00 0.00 0.00 54.91 54.55 1wb9 h ALA 336 Cb 0.77 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1wb9 h ALA 336 CO 0.06 0.42 -0.74 0.78 0.00 0.00 0.00 179.25 179.77 1wb9 h GLY 337 N 0.82 0.54 1.05 0.00 0.00 -1.84 -3.36 103.07 100.28 1wb9 h GLY 337 Ca 0.19 -0.77 -0.23 0.00 0.00 0.00 0.00 47.33 46.52 1wb9 h GLY 337 CO -0.01 0.68 -0.90 1.41 0.00 0.00 0.00 176.54 177.72 1wb9 h LEU 338 N 0.33 0.78 -0.45 3.11 3.38 -1.21 -3.38 115.31 117.87 1wb9 h LEU 338 Ca -0.04 -0.75 -0.02 0.00 0.09 0.00 0.00 57.88 57.16 1wb9 h LEU 338 Cb 1.33 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1wb9 h LEU 338 CO 0.13 1.43 0.21 1.56 0.09 0.00 0.00 178.44 181.87 1wb9 h GLN 339 N 0.20 0.66 -0.70 1.13 4.20 -1.53 -0.16 115.11 118.91 1wb9 h GLN 339 Ca -0.12 -0.10 0.03 0.00 0.06 0.00 0.00 58.65 58.53 1wb9 h GLN 339 Cb 1.58 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 29.20 1wb9 h GLN 339 CO 0.18 0.56 0.46 -1.35 -0.67 0.00 0.00 178.83 178.01 1wb9 h PRO 340 N 0.59 0.83 -0.04 1.46 0.11 -1.77 0.58 132.00 133.76 1wb9 h PRO 340 Ca 0.16 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.14 1wb9 h PRO 340 Cb 0.13 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.05 1wb9 h PRO 340 CO -0.02 0.55 -0.29 0.28 -0.21 0.00 0.00 178.00 178.31 1wb9 h VAL 341 N 0.85 1.46 -0.95 3.15 2.07 -1.65 -3.27 116.25 117.92 1wb9 h VAL 341 Ca 0.27 -1.78 0.07 0.00 0.82 0.00 0.00 66.70 66.09 1wb9 h VAL 341 Cb 0.04 2.47 -0.06 0.00 -1.52 0.00 0.00 31.29 32.22 1wb9 h VAL 341 CO -0.08 0.50 0.61 -0.07 0.02 0.00 0.00 177.57 178.56 1wb9 h LEU 342 N -0.29 0.95 -1.45 2.57 3.38 -0.75 -2.18 115.31 117.54 1wb9 h LEU 342 Ca -0.02 0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.10 1wb9 h LEU 342 Cb 0.96 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.47 1wb9 h LEU 342 CO 0.06 0.60 0.53 -0.09 0.09 0.00 0.00 178.44 179.62 1wb9 h ARG 343 N 1.07 0.53 0.00 1.13 2.43 -0.94 -1.41 114.38 117.20 1wb9 h ARG 343 Ca 0.42 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 1wb9 h ARG 343 Cb 0.23 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1wb9 h ARG 343 CO -0.17 0.35 0.00 1.04 -1.51 0.00 0.00 179.97 179.69 1wb9 n GLN 344 N -4.51 0.13 0.09 0.20 1.13 -0.82 -2.80 117.38 110.79 1wb9 n GLN 344 Ca 0.15 0.22 -0.05 0.00 -1.94 0.00 0.00 57.00 55.39 1wb9 n GLN 344 Cb 0.48 -1.69 0.13 0.00 0.11 0.00 0.00 30.24 29.27 1wb9 n GLN 344 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1wb9 h VAL 345 N 0.00 1.39 -0.32 5.09 2.07 -1.31 -3.37 116.25 119.79 1wb9 h VAL 345 Ca 0.00 -1.97 0.00 0.00 0.82 0.00 0.00 66.70 65.55 1wb9 h VAL 345 Cb 0.49 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1wb9 h VAL 345 CO 0.00 0.58 0.00 0.61 0.02 0.00 0.00 177.57 178.78 1wb9 n GLY 346 N 0.24 -0.05 2.66 2.17 0.00 -1.12 -4.01 105.19 105.08 1wb9 n GLY 346 Ca -0.02 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 1wb9 n GLY 346 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wb9 n ASP 347 N -1.34 6.70 -0.07 1.61 -0.08 -1.26 -4.61 116.55 117.50 1wb9 n ASP 347 Ca 0.00 -3.13 0.02 0.00 -1.51 0.00 0.00 54.79 50.17 1wb9 n ASP 347 Cb 0.00 -1.41 0.34 0.00 2.34 0.00 0.00 41.12 42.38 1wb9 n ASP 347 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1wb9 h LEU 348 N 6.60 0.61 -0.12 -2.67 5.85 -1.95 -2.30 115.31 121.33 1wb9 h LEU 348 Ca 0.56 -0.04 0.04 0.00 0.84 0.00 0.00 57.88 59.28 1wb9 h LEU 348 Cb 0.45 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 1wb9 h LEU 348 CO 1.55 0.49 -0.21 -0.08 -0.34 0.00 0.00 178.44 179.85 1wb9 h GLU 349 N 0.69 -0.26 -0.01 1.25 4.81 -1.88 -0.58 114.58 118.60 1wb9 h GLU 349 Ca 0.18 0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.29 1wb9 h GLU 349 Cb 0.02 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1wb9 h GLU 349 CO -0.03 -0.17 -0.65 0.00 -0.73 0.00 0.00 179.01 177.43 1wb9 h ARG 350 N -0.27 0.06 -0.83 1.92 3.08 -1.77 -2.68 114.38 113.89 1wb9 h ARG 350 Ca 0.10 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 1wb9 h ARG 350 Cb 0.41 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.43 1wb9 h ARG 350 CO -0.27 0.68 0.45 0.82 -1.07 0.00 0.00 179.97 180.58 1wb9 h ILE 351 N 0.04 1.24 0.00 2.04 2.04 -1.23 -2.89 117.51 118.75 1wb9 h ILE 351 Ca -0.01 -0.61 -0.08 0.00 1.00 0.00 0.00 64.86 65.16 1wb9 h ILE 351 Cb 1.15 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1wb9 h ILE 351 CO 0.09 0.27 -0.40 -0.07 0.00 0.00 0.00 178.15 178.04 1wb9 h LEU 352 N 1.16 0.00 -0.74 1.44 3.38 -0.78 -2.27 115.31 117.50 1wb9 h LEU 352 Ca 0.29 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.21 1wb9 h LEU 352 Cb 0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1wb9 h LEU 352 CO -0.05 0.40 0.28 0.00 0.09 0.00 0.00 178.44 179.16 1wb9 h ALA 353 N 1.60 0.96 0.00 1.53 0.00 -1.30 -0.49 119.26 121.56 1wb9 h ALA 353 Ca -0.00 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1wb9 h ALA 353 Cb 0.86 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1wb9 h ALA 353 CO 0.05 0.60 -0.56 0.00 0.00 0.00 0.00 179.25 179.34 1wb9 h ARG 354 N 1.07 0.00 -0.10 0.00 3.08 -1.30 -1.00 114.38 116.13 1wb9 h ARG 354 Ca 0.24 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.28 1wb9 h ARG 354 Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 1wb9 h ARG 354 CO -0.02 0.56 0.02 1.25 -1.07 0.00 0.00 179.97 180.72 1wb9 h LEU 355 N 0.00 0.16 -1.20 3.04 5.85 -1.26 0.33 115.31 122.24 1wb9 h LEU 355 Ca -0.01 -0.25 0.08 0.00 0.84 0.00 0.00 57.88 58.54 1wb9 h LEU 355 Cb 1.01 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.94 1wb9 h LEU 355 CO 0.07 0.36 0.57 0.00 -0.34 0.00 0.00 178.44 179.11 1wb9 h ALA 356 N 0.80 1.58 -0.01 1.25 0.00 -0.73 -1.99 119.26 120.17 1wb9 h ALA 356 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1wb9 h ALA 356 Cb 0.27 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1wb9 h ALA 356 CO 0.00 0.27 -0.14 1.28 0.00 0.00 0.00 179.25 180.66 1wb9 n LEU 357 N -4.50 1.22 -3.12 0.00 4.77 -0.41 -4.65 117.00 110.30 1wb9 n LEU 357 Ca 0.14 -0.36 -0.23 0.00 -0.03 0.00 0.00 56.01 55.53 1wb9 n LEU 357 Cb 0.24 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.31 1wb9 n LEU 357 CO 0.32 0.21 0.04 0.54 -1.33 0.00 0.00 177.39 177.18 1wb9 n ARG 358 N -0.29 -5.44 -0.05 3.23 1.74 -0.36 -4.90 116.66 110.60 1wb9 n ARG 358 Ca 0.15 0.90 0.06 0.00 -0.77 0.00 0.00 57.85 58.19 1wb9 n ARG 358 Cb 0.35 -5.80 0.08 0.00 -1.02 0.00 0.00 32.46 26.07 1wb9 n ARG 358 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1wb9 n THR 359 N -4.61 0.26 -1.93 0.55 -2.24 0.10 -5.00 114.28 101.41 1wb9 n THR 359 Ca -0.09 -0.63 -0.41 0.00 -2.27 0.00 0.00 64.05 60.64 1wb9 n THR 359 Cb 0.61 1.06 -0.02 0.00 -2.10 0.00 0.00 70.33 69.88 1wb9 n THR 359 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wb9 s ALA 360 N -1.00 3.64 0.32 6.98 0.00 -0.80 -4.96 121.76 125.93 1wb9 s ALA 360 Ca 0.17 1.42 0.07 0.00 0.00 0.00 0.00 51.96 53.62 1wb9 s ALA 360 Cb 0.11 -3.58 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 1wb9 s ALA 360 CO 0.16 -0.84 0.34 1.03 0.00 0.00 0.00 175.76 176.45 1wb9 s ARG 361 N -0.74 2.90 0.25 0.00 0.52 -1.26 -4.95 118.95 115.67 1wb9 s ARG 361 Ca 0.59 -1.16 -0.04 0.00 -0.52 0.00 0.00 55.73 54.60 1wb9 s ARG 361 Cb -0.44 -2.61 0.47 0.00 0.52 0.00 0.00 34.95 32.89 1wb9 s ARG 361 CO 0.48 0.13 1.69 -1.35 0.02 0.00 0.00 175.30 176.27 1wb9 h PRO 362 N 1.16 0.29 0.00 3.54 0.11 -1.79 0.67 132.00 135.98 1wb9 h PRO 362 Ca -0.46 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 1wb9 h PRO 362 Cb 1.25 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1wb9 h PRO 362 CO 0.57 0.19 -0.14 0.00 -0.21 0.00 0.00 178.00 178.42 1wb9 h ARG 363 N 0.30 0.00 -0.65 1.05 3.08 -1.79 -1.04 114.38 115.32 1wb9 h ARG 363 Ca 0.42 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.43 1wb9 h ARG 363 Cb 0.72 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 1wb9 h ARG 363 CO -0.50 0.14 0.26 -0.44 -1.07 0.00 0.00 179.97 178.36 1wb9 h ASP 364 N 0.00 0.90 -0.08 7.04 3.32 -1.25 0.95 116.42 127.30 1wb9 h ASP 364 Ca -0.00 -0.17 -0.15 0.00 0.02 0.00 0.00 57.03 56.73 1wb9 h ASP 364 Cb 0.44 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1wb9 h ASP 364 CO 0.02 0.83 -0.46 -0.07 -1.72 0.00 0.00 179.24 177.83 1wb9 h LEU 365 N 0.92 0.69 -0.74 1.55 3.38 -1.18 -1.05 115.31 118.88 1wb9 h LEU 365 Ca 0.22 -0.33 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 1wb9 h LEU 365 Cb 0.21 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1wb9 h LEU 365 CO -0.02 1.05 -0.06 0.00 0.09 0.00 0.00 178.44 179.50 1wb9 h ALA 366 N 0.98 0.94 -0.50 1.53 0.00 -1.11 -0.62 119.26 120.47 1wb9 h ALA 366 Ca 0.03 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.51 1wb9 h ALA 366 Cb 1.00 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1wb9 h ALA 366 CO 0.09 0.63 -0.13 0.00 0.00 0.00 0.00 179.25 179.84 1wb9 h ARG 367 N 0.82 0.95 -0.46 0.00 3.08 -0.80 -1.77 114.38 116.20 1wb9 h ARG 367 Ca 0.14 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 1wb9 h ARG 367 Cb 0.57 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1wb9 h ARG 367 CO 0.03 1.02 0.25 1.98 -1.07 0.00 0.00 179.97 182.18 1wb9 h MET 368 N 0.84 0.64 -0.15 0.04 4.05 -0.92 -1.11 114.93 118.33 1wb9 h MET 368 Ca 0.13 -0.08 0.04 0.00 -0.28 0.00 0.00 59.70 59.51 1wb9 h MET 368 Cb 0.68 -0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 31.32 1wb9 h MET 368 CO 0.05 0.51 -0.09 -0.09 0.23 0.00 0.00 176.91 177.52 1wb9 h ARG 369 N 0.60 -0.08 -0.90 0.39 2.43 -1.09 -0.84 114.38 114.89 1wb9 h ARG 369 Ca 0.16 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.39 1wb9 h ARG 369 Cb 0.06 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.57 1wb9 h ARG 369 CO -0.03 -0.05 0.59 1.25 -1.51 0.00 0.00 179.97 180.22 1wb9 h HIS 370 N -0.09 1.05 -0.31 2.20 2.76 -1.01 -1.16 115.15 118.60 1wb9 h HIS 370 Ca 0.09 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.25 1wb9 h HIS 370 Cb 0.21 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 1wb9 h HIS 370 CO -0.22 0.57 0.04 0.00 -1.30 0.00 0.00 177.93 177.01 1wb9 h ALA 371 N 1.50 0.41 -0.86 5.26 0.00 -0.80 -2.72 119.26 122.06 1wb9 h ALA 371 Ca 0.38 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 55.22 1wb9 h ALA 371 Cb 0.15 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1wb9 h ALA 371 CO -0.14 0.11 0.56 0.74 0.00 0.00 0.00 179.25 180.52 1wb9 h PHE 372 N 0.33 0.79 0.00 0.00 0.04 -0.64 -1.40 116.94 116.06 1wb9 h PHE 372 Ca 0.09 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.88 1wb9 h PHE 372 Cb 0.36 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.26 1wb9 h PHE 372 CO 0.03 0.31 0.00 1.04 -0.60 0.00 0.00 178.31 179.09 1wb9 n GLN 373 N -4.54 0.21 0.09 1.51 6.02 -0.49 -2.39 117.38 117.79 1wb9 n GLN 373 Ca 0.16 0.40 0.12 0.00 -0.01 0.00 0.00 57.00 57.67 1wb9 n GLN 373 Cb 0.43 -1.87 0.15 0.00 1.02 0.00 0.00 30.24 29.97 1wb9 n GLN 373 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1wb9 h GLN 374 N 0.00 0.00 -0.17 -1.09 1.08 -1.16 -3.41 115.11 110.36 1wb9 h GLN 374 Ca 0.00 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1wb9 h GLN 374 Cb 0.43 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.85 1wb9 h GLN 374 CO 0.00 0.00 -0.11 -0.07 -0.95 0.00 0.00 178.83 177.70 1wb9 h LEU 375 N 0.00 0.39 -0.86 1.46 3.38 -1.47 -1.38 115.31 116.83 1wb9 h LEU 375 Ca 0.00 -0.43 0.11 0.00 0.09 0.00 0.00 57.88 57.64 1wb9 h LEU 375 Cb 0.82 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.38 1wb9 h LEU 375 CO 0.00 0.74 0.49 -0.65 0.09 0.00 0.00 178.44 179.12 1wb9 h PRO 376 N 0.05 0.78 -0.22 1.13 0.11 -1.79 0.68 132.00 132.74 1wb9 h PRO 376 Ca 0.04 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.07 1wb9 h PRO 376 Cb 0.60 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1wb9 h PRO 376 CO 0.03 0.51 0.03 1.49 -0.21 0.00 0.00 178.00 179.86 1wb9 h GLU 377 N 0.80 0.37 -0.97 1.05 4.57 -1.80 -0.70 114.58 117.91 1wb9 h GLU 377 Ca 0.43 -0.10 0.01 0.00 -1.18 0.00 0.00 59.36 58.51 1wb9 h GLU 377 Cb 0.43 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.93 1wb9 h GLU 377 CO -0.27 0.51 0.63 -0.07 -1.18 0.00 0.00 179.01 178.64 1wb9 h LEU 378 N 0.17 1.12 -0.85 1.64 3.38 -0.90 -1.06 115.31 118.80 1wb9 h LEU 378 Ca 0.07 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1wb9 h LEU 378 Cb 0.32 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1wb9 h LEU 378 CO 0.00 0.82 0.24 0.03 0.09 0.00 0.00 178.44 179.62 1wb9 h ARG 379 N 1.31 1.08 -0.04 1.13 3.08 -0.54 -1.40 114.38 119.00 1wb9 h ARG 379 Ca 0.35 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1wb9 h ARG 379 Cb -0.14 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 29.74 1wb9 h ARG 379 CO -0.07 0.91 -0.04 0.00 -1.07 0.00 0.00 179.97 179.70 1wb9 h ALA 380 N 1.21 0.06 -0.70 0.04 0.00 -0.79 -2.58 119.26 116.50 1wb9 h ALA 380 Ca 0.23 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.94 1wb9 h ALA 380 Cb 0.27 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1wb9 h ALA 380 CO -0.01 -0.16 0.46 1.96 0.00 0.00 0.00 179.25 181.49 1wb9 h GLN 381 N -0.37 0.68 0.00 0.00 4.20 -1.12 -2.94 115.11 115.56 1wb9 h GLN 381 Ca 0.01 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1wb9 h GLN 381 Cb 0.54 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1wb9 h GLN 381 CO 0.01 0.45 -0.40 1.28 -0.67 0.00 0.00 178.83 179.50 1wb9 n LEU 382 N -4.48 0.65 -0.27 1.46 4.77 -0.54 -4.26 117.00 114.33 1wb9 n LEU 382 Ca 0.10 0.31 0.01 0.00 -0.03 0.00 0.00 56.01 56.41 1wb9 n LEU 382 Cb 0.24 -0.25 0.14 0.00 -2.33 0.00 0.00 43.42 41.22 1wb9 n LEU 382 CO 0.34 -0.06 1.13 -0.08 -1.33 0.00 0.00 177.39 177.38 1wb9 h GLU 383 N 0.00 0.74 -0.00 3.23 4.81 -1.27 -2.42 114.58 119.67 1wb9 h GLU 383 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1wb9 h GLU 383 Cb 0.69 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1wb9 h GLU 383 CO 0.00 0.49 -0.18 0.25 -0.73 0.00 0.00 179.01 178.85 1wb9 n THR 384 N -4.75 0.00 -2.03 0.32 -2.24 -1.26 -4.88 114.28 99.43 1wb9 n THR 384 Ca 0.12 -0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.42 1wb9 n THR 384 Cb 0.23 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.42 1wb9 n THR 384 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1wb9 s VAL 385 N -2.61 3.30 -1.04 2.28 1.01 -0.91 -4.92 120.40 117.50 1wb9 s VAL 385 Ca 0.24 0.71 -0.19 0.00 0.00 0.00 0.00 61.98 62.74 1wb9 s VAL 385 Cb 0.19 -3.45 0.11 0.00 0.00 0.00 0.00 36.38 33.23 1wb9 s VAL 385 CO 0.52 -0.01 1.33 -0.62 0.00 0.00 0.00 175.10 176.33 1wb9 s ASP 386 N 2.29 6.70 -0.30 3.32 2.15 -1.26 -4.74 116.67 124.82 1wb9 s ASP 386 Ca 0.70 -2.11 -0.16 0.00 0.43 0.00 0.00 52.55 51.42 1wb9 s ASP 386 Cb -0.37 -2.46 0.17 0.00 -0.30 0.00 0.00 42.92 39.96 1wb9 s ASP 386 CO 0.30 -1.13 1.06 -0.55 -0.17 0.00 0.00 175.17 174.68 1wb9 s SER 387 N 3.91 -0.44 0.15 -0.34 0.15 -1.26 -4.87 113.70 111.00 1wb9 s SER 387 Ca 0.40 0.62 -0.16 0.00 0.70 0.00 0.00 55.95 57.50 1wb9 s SER 387 Cb -0.02 1.48 0.07 0.00 -1.71 0.00 0.00 66.02 65.83 1wb9 s SER 387 CO -0.06 -0.09 1.73 0.00 1.20 0.00 0.00 173.24 176.02 1wb9 h ALA 388 N 7.25 0.37 0.00 5.45 0.00 -1.99 -2.14 119.26 128.20 1wb9 h ALA 388 Ca -0.16 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1wb9 h ALA 388 Cb 1.12 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1wb9 h ALA 388 CO 0.09 -0.33 -0.26 -1.35 0.00 0.00 0.00 179.25 177.40 1wb9 h PRO 389 N 0.19 0.00 -0.25 0.00 0.11 -1.96 -0.45 132.00 129.65 1wb9 h PRO 389 Ca 0.16 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.15 1wb9 h PRO 389 Cb 0.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.29 1wb9 h PRO 389 CO -0.21 0.26 -0.33 0.28 -0.21 0.00 0.00 178.00 177.78 1wb9 h VAL 390 N 0.00 1.31 -0.28 3.15 2.07 -1.89 -2.04 116.25 118.57 1wb9 h VAL 390 Ca -0.00 -1.52 -0.05 0.00 0.82 0.00 0.00 66.70 65.95 1wb9 h VAL 390 Cb 0.46 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 1wb9 h VAL 390 CO 0.03 0.48 -0.03 1.56 0.02 0.00 0.00 177.57 179.63 1wb9 h GLN 391 N 0.38 0.44 -0.27 1.57 1.08 -1.00 -0.03 115.11 117.27 1wb9 h GLN 391 Ca 0.03 -0.09 -0.14 0.00 -1.45 0.00 0.00 58.65 57.00 1wb9 h GLN 391 Cb 0.91 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 28.27 1wb9 h GLN 391 CO 0.08 0.49 -0.37 0.00 -0.95 0.00 0.00 178.83 178.08 1wb9 h ALA 392 N 1.55 0.41 -0.86 3.87 0.00 -1.06 -2.08 119.26 121.10 1wb9 h ALA 392 Ca 0.09 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1wb9 h ALA 392 Cb 0.33 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1wb9 h ALA 392 CO 0.01 0.49 0.55 -0.07 0.00 0.00 0.00 179.25 180.23 1wb9 h LEU 393 N 0.46 1.01 -0.25 0.00 3.38 -0.92 -1.84 115.31 117.14 1wb9 h LEU 393 Ca 0.03 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1wb9 h LEU 393 Cb 0.95 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1wb9 h LEU 393 CO 0.09 0.75 0.12 -0.09 0.09 0.00 0.00 178.44 179.40 1wb9 h ARG 394 N 1.18 0.37 0.38 1.13 2.43 -0.85 -0.38 114.38 118.64 1wb9 h ARG 394 Ca 0.31 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 1wb9 h ARG 394 Cb -0.09 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1wb9 h ARG 394 CO -0.06 0.38 -0.28 1.49 -1.51 0.00 0.00 179.97 179.98 1wb9 h GLU 395 N 0.27 -0.63 -0.40 0.20 4.57 -1.26 -3.12 114.58 114.21 1wb9 h GLU 395 Ca 0.09 0.04 0.08 0.00 -1.18 0.00 0.00 59.36 58.39 1wb9 h GLU 395 Cb 0.13 0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.84 1wb9 h GLU 395 CO -0.01 -0.42 0.28 -0.22 -1.18 0.00 0.00 179.01 177.46 1wb9 h LYS 396 N -0.65 0.19 0.00 1.92 3.64 -1.20 -0.79 116.57 119.69 1wb9 h LYS 396 Ca -0.03 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 1wb9 h LYS 396 Cb 0.56 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1wb9 h LYS 396 CO 0.01 0.13 -0.17 1.98 -2.27 0.00 0.00 179.45 179.12 1wb9 h MET 397 N 0.20 0.00 0.00 1.90 4.05 -1.00 -3.10 114.93 116.98 1wb9 h MET 397 Ca 0.18 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.60 1wb9 h MET 397 Cb 0.47 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.27 1wb9 h MET 397 CO -0.03 0.17 0.00 0.41 0.23 0.00 0.00 176.91 177.69 1wb9 n GLY 398 N -0.98 -0.83 1.26 1.39 0.00 -0.30 -4.59 105.19 101.13 1wb9 n GLY 398 Ca -0.02 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1wb9 n GLY 398 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wb9 n GLU 399 N -0.41 0.00 -3.68 1.61 2.13 -1.26 -4.88 120.64 114.16 1wb9 n GLU 399 Ca 0.00 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.61 1wb9 n GLU 399 Cb 0.00 -0.15 0.04 0.00 0.27 0.00 0.00 31.44 31.60 1wb9 n GLU 399 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1wb9 n PHE 400 N -2.13 -1.95 -0.28 4.31 3.72 -1.26 -4.86 117.46 115.01 1wb9 n PHE 400 Ca 0.00 0.85 0.03 0.00 -0.05 0.00 0.00 57.45 58.29 1wb9 n PHE 400 Cb 0.00 -4.45 0.25 0.00 -0.94 0.00 0.00 39.48 34.33 1wb9 n PHE 400 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wb9 h ALA 401 N 0.87 1.52 0.00 4.37 0.00 -1.98 -1.40 119.26 122.64 1wb9 h ALA 401 Ca -0.61 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.12 1wb9 h ALA 401 Cb 1.36 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1wb9 h ALA 401 CO 0.56 0.37 -0.71 0.93 0.00 0.00 0.00 179.25 180.40 1wb9 h GLU 402 N 1.01 0.00 -0.04 0.00 4.39 -1.99 -1.92 114.58 116.03 1wb9 h GLU 402 Ca 0.36 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.86 1wb9 h GLU 402 Cb 0.14 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.81 1wb9 h GLU 402 CO -0.13 0.71 -0.77 -0.07 -1.16 0.00 0.00 179.01 177.59 1wb9 h LEU 403 N 0.00 0.74 -0.44 1.33 4.07 -1.86 -2.09 115.31 117.06 1wb9 h LEU 403 Ca -0.01 -0.71 0.09 0.00 0.08 0.00 0.00 57.88 57.33 1wb9 h LEU 403 Cb 1.28 -0.22 -0.10 0.00 1.08 0.00 0.00 40.66 42.70 1wb9 h LEU 403 CO 0.09 1.35 -0.25 -0.09 -1.08 0.00 0.00 178.44 178.46 1wb9 h ARG 404 N 0.20 -0.16 -0.47 1.13 2.43 -1.19 -1.62 114.38 114.71 1wb9 h ARG 404 Ca -0.08 0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 58.97 1wb9 h ARG 404 Cb 1.44 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 31.01 1wb9 h ARG 404 CO 0.15 -0.11 -0.21 0.22 -1.51 0.00 0.00 179.97 178.52 1wb9 h ASP 405 N -0.16 0.98 -0.25 -3.80 3.58 -1.38 -1.34 116.42 114.04 1wb9 h ASP 405 Ca 0.21 -0.37 0.06 0.00 0.42 0.00 0.00 57.03 57.35 1wb9 h ASP 405 Cb 0.49 -0.27 -0.06 0.00 1.72 0.00 0.00 39.33 41.21 1wb9 h ASP 405 CO -0.54 1.15 -0.11 0.25 -2.88 0.00 0.00 179.24 177.11 1wb9 h LEU 406 N 0.83 -0.37 -0.73 2.28 5.85 -1.00 -1.95 115.31 120.21 1wb9 h LEU 406 Ca 0.11 0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 1wb9 h LEU 406 Cb 0.78 0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 1wb9 h LEU 406 CO 0.06 -0.14 -0.52 -0.07 -0.34 0.00 0.00 178.44 177.43 1wb9 h LEU 407 N -0.07 0.00 -0.36 2.25 3.38 -0.96 0.92 115.31 120.47 1wb9 h LEU 407 Ca 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1wb9 h LEU 407 Cb 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1wb9 h LEU 407 CO -0.30 0.52 0.16 -0.33 0.09 0.00 0.00 178.44 178.58 1wb9 h GLU 408 N 0.00 0.52 -0.02 1.13 5.08 -0.95 -2.35 114.58 117.99 1wb9 h GLU 408 Ca -0.01 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.05 1wb9 h GLU 408 Cb 1.07 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1wb9 h GLU 408 CO 0.07 0.49 -0.89 0.00 -1.00 0.00 0.00 179.01 177.68 1wb9 h ARG 409 N 0.44 0.41 0.10 2.33 3.08 -1.20 -3.38 114.38 116.16 1wb9 h ARG 409 Ca 0.12 -0.41 -0.29 0.00 0.07 0.00 0.00 59.98 59.48 1wb9 h ARG 409 Cb 0.15 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1wb9 h ARG 409 CO -0.01 1.07 -1.40 0.00 -1.07 0.00 0.00 179.97 178.56 1wb9 h ALA 410 N 0.79 0.27 -4.03 0.04 0.00 -0.78 -3.39 119.26 112.15 1wb9 h ALA 410 Ca -0.07 -1.05 -0.69 0.00 0.00 0.00 0.00 54.91 53.10 1wb9 h ALA 410 Cb 1.51 0.17 -0.23 0.00 0.00 0.00 0.00 17.79 19.23 1wb9 h ALA 410 CO 0.15 1.14 -0.87 0.42 0.00 0.00 0.00 179.25 180.09 1wb9 s ILE 411 N -2.64 2.28 1.04 0.00 1.01 -0.89 -1.34 121.20 120.67 1wb9 s ILE 411 Ca -0.06 -1.60 -0.15 0.00 0.00 0.00 0.00 60.65 58.84 1wb9 s ILE 411 Cb 0.07 -1.97 0.21 0.00 0.01 0.00 0.00 42.46 40.78 1wb9 s ILE 411 CO 0.86 0.19 1.13 0.27 0.00 0.00 0.00 174.94 177.39 1wb9 s ILE 412 N -0.98 1.87 0.08 2.92 -4.36 -0.76 -4.57 121.20 115.40 1wb9 s ILE 412 Ca 0.14 0.00 -0.25 0.00 -0.26 0.00 0.00 60.65 60.28 1wb9 s ILE 412 Cb -0.10 -2.61 -0.16 0.00 1.25 0.00 0.00 42.46 40.84 1wb9 s ILE 412 CO 0.05 0.00 1.67 0.44 0.24 0.00 0.00 174.94 177.34 1wb9 h ASP 413 N -2.00 -0.12 -2.96 4.36 5.19 -1.93 -3.36 116.42 115.60 1wb9 h ASP 413 Ca -0.50 -0.04 -0.61 0.00 -0.62 0.00 0.00 57.03 55.27 1wb9 h ASP 413 Cb 1.31 0.03 -0.40 0.00 0.18 0.00 0.00 39.33 40.45 1wb9 h ASP 413 CO 0.49 -0.04 -0.77 0.42 -3.12 0.00 0.00 179.24 176.22 1wb9 s THR 414 N -5.97 1.45 1.02 0.35 -4.23 -1.26 -5.04 115.64 101.97 1wb9 s THR 414 Ca -0.14 -3.09 -0.12 0.00 -1.18 0.00 0.00 61.69 57.16 1wb9 s THR 414 Cb 0.05 -1.99 0.20 0.00 1.34 0.00 0.00 72.50 72.11 1wb9 s THR 414 CO 0.65 -1.05 1.08 -2.16 -0.54 0.00 0.00 174.62 172.60 1wb9 s PRO 415 N -0.28 0.22 0.85 3.99 0.04 -1.26 -5.02 135.00 133.54 1wb9 s PRO 415 Ca 0.25 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 61.80 1wb9 s PRO 415 Cb -0.09 -1.70 0.10 0.00 0.04 0.00 0.00 34.50 32.85 1wb9 s PRO 415 CO -0.12 -2.90 1.10 -2.14 0.04 0.00 0.00 177.00 172.99 1wb9 s PRO 416 N -4.85 1.61 0.20 0.56 0.02 -1.26 -4.78 135.00 126.49 1wb9 s PRO 416 Ca 0.66 0.61 -0.09 0.00 0.02 0.00 0.00 61.00 62.20 1wb9 s PRO 416 Cb -0.20 -1.87 0.12 0.00 0.02 0.00 0.00 34.50 32.57 1wb9 s PRO 416 CO 0.59 -1.94 1.74 0.28 -0.33 0.00 0.00 177.00 177.33 1wb9 h VAL 417 N -1.32 1.26 -3.30 3.83 2.07 -1.98 -3.37 116.25 113.44 1wb9 h VAL 417 Ca -0.49 -0.87 -0.65 0.00 0.82 0.00 0.00 66.70 65.52 1wb9 h VAL 417 Cb 1.29 0.48 -0.15 0.00 -1.52 0.00 0.00 31.29 31.38 1wb9 h VAL 417 CO 0.58 0.34 -0.74 -0.76 0.02 0.00 0.00 177.57 177.01 1wb9 s LEU 418 N -9.65 2.94 0.04 2.57 1.43 -1.26 -4.00 118.68 110.75 1wb9 s LEU 418 Ca -0.12 -0.52 0.26 0.00 -1.03 0.00 0.00 54.13 52.71 1wb9 s LEU 418 Cb 0.15 -1.69 0.65 0.00 0.03 0.00 0.00 46.19 45.33 1wb9 s LEU 418 CO 0.83 0.14 1.53 0.55 0.23 0.00 0.00 176.35 179.63 1wb9 n VAL 419 N 0.37 0.12 -0.33 -1.59 3.14 -1.26 -4.46 118.33 114.32 1wb9 n VAL 419 Ca -0.12 -0.08 0.19 0.00 -2.96 0.00 0.00 64.34 61.36 1wb9 n VAL 419 Cb 0.54 -0.07 0.43 0.00 -1.06 0.00 0.00 33.84 33.68 1wb9 n VAL 419 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 1wb9 h ARG 420 N 0.00 0.51 -0.20 1.45 2.43 -1.99 -1.51 114.38 115.07 1wb9 h ARG 420 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1wb9 h ARG 420 Cb 0.57 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1wb9 h ARG 420 CO 0.00 0.34 0.00 -0.25 -1.51 0.00 0.00 179.97 178.55 1wb9 n ASP 421 N -4.75 3.00 0.00 -3.80 8.00 -1.26 -5.09 116.55 112.65 1wb9 n ASP 421 Ca 0.26 -1.90 0.00 0.00 0.71 0.00 0.00 54.79 53.86 1wb9 n ASP 421 Cb 0.77 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 1wb9 n ASP 421 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wb9 n GLY 422 N 1.22 -0.17 2.23 0.44 0.00 -0.57 -4.95 105.19 103.39 1wb9 n GLY 422 Ca 0.15 -1.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.04 1wb9 n GLY 422 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wb9 n GLY 423 N 0.00 0.29 0.44 -0.02 0.00 -1.26 -4.84 105.19 99.80 1wb9 n GLY 423 Ca 0.00 -0.48 -0.18 0.00 0.00 0.00 0.00 46.02 45.36 1wb9 n GLY 423 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wb9 n VAL 424 N -3.64 0.96 -2.50 1.61 0.31 -1.26 -4.51 118.33 109.30 1wb9 n VAL 424 Ca -0.12 -0.25 -0.41 0.00 -0.01 0.00 0.00 64.34 63.55 1wb9 n VAL 424 Cb 0.52 -1.71 -0.04 0.00 -0.91 0.00 0.00 33.84 31.71 1wb9 n VAL 424 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1wb9 s ILE 425 N -2.32 3.94 0.58 2.52 -1.09 -1.26 -1.82 121.20 121.74 1wb9 s ILE 425 Ca -0.24 1.59 -0.17 0.00 -2.23 0.00 0.00 60.65 59.61 1wb9 s ILE 425 Cb 0.09 -4.02 -0.04 0.00 -1.58 0.00 0.00 42.46 36.91 1wb9 s ILE 425 CO 0.31 0.24 1.06 0.00 -1.23 0.00 0.00 174.94 175.31 1wb9 s ALA 426 N 0.08 2.76 0.51 9.38 0.00 -0.45 -4.73 121.76 129.31 1wb9 s ALA 426 Ca 0.51 0.44 -0.20 0.00 0.00 0.00 0.00 51.96 52.71 1wb9 s ALA 426 Cb -0.29 -3.24 -0.07 0.00 0.00 0.00 0.00 23.12 19.52 1wb9 s ALA 426 CO 0.33 -0.73 1.10 -1.54 0.00 0.00 0.00 175.76 174.93 1wb9 s SER 427 N -2.62 6.00 0.00 0.00 1.04 -1.26 -3.32 113.70 113.53 1wb9 s SER 427 Ca 0.64 2.12 0.00 0.00 0.48 0.00 0.00 55.95 59.19 1wb9 s SER 427 Cb -0.16 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.38 1wb9 s SER 427 CO 0.34 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 174.15 1wb9 n GLY 428 N 0.09 1.60 0.13 7.32 0.00 -1.26 -4.90 105.19 108.16 1wb9 n GLY 428 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 1wb9 n GLY 428 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1wb9 h TYR 429 N 0.00 0.75 -3.20 1.61 3.20 -1.77 -3.46 116.97 114.10 1wb9 h TYR 429 Ca 0.00 -0.55 -0.33 0.00 3.14 0.00 0.00 58.73 60.99 1wb9 h TYR 429 Cb 0.00 -0.03 -0.37 0.00 1.54 0.00 0.00 36.73 37.87 1wb9 h TYR 429 CO 0.00 1.49 -0.68 1.21 -1.64 0.00 0.00 178.16 178.54 1wb9 s ASN 430 N -7.35 0.89 0.23 -2.11 3.84 -1.26 -5.05 114.94 104.13 1wb9 s ASN 430 Ca -0.09 0.21 -0.03 0.00 0.21 0.00 0.00 52.86 53.16 1wb9 s ASN 430 Cb 0.05 0.08 0.25 0.00 -0.55 0.00 0.00 41.25 41.08 1wb9 s ASN 430 CO 0.90 -0.24 1.68 -0.08 -2.79 0.00 0.00 177.10 176.57 1wb9 h GLU 431 N 8.35 0.78 -0.42 0.43 4.81 -1.99 -2.10 114.58 124.43 1wb9 h GLU 431 Ca -0.14 -0.27 -0.02 0.00 -0.13 0.00 0.00 59.36 58.80 1wb9 h GLU 431 Cb 1.12 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 1wb9 h GLU 431 CO 0.16 0.87 0.19 1.49 -0.73 0.00 0.00 179.01 180.99 1wb9 h GLU 432 N 0.70 0.62 -0.68 1.92 4.81 -1.99 -2.24 114.58 117.71 1wb9 h GLU 432 Ca 0.11 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1wb9 h GLU 432 Cb 0.62 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 1wb9 h GLU 432 CO 0.04 0.55 0.42 1.25 -0.73 0.00 0.00 179.01 180.54 1wb9 h LEU 433 N 0.54 0.82 -1.42 1.64 5.85 -1.91 -1.94 115.31 118.89 1wb9 h LEU 433 Ca 0.14 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1wb9 h LEU 433 Cb 0.15 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1wb9 h LEU 433 CO -0.02 0.63 0.03 0.44 -0.34 0.00 0.00 178.44 179.18 1wb9 h ASP 434 N 0.93 0.37 -0.16 1.25 3.32 -1.24 -1.95 116.42 118.94 1wb9 h ASP 434 Ca 0.25 -0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.16 1wb9 h ASP 434 Cb -0.04 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 1wb9 h ASP 434 CO -0.05 0.41 -0.22 -0.33 -1.72 0.00 0.00 179.24 177.34 1wb9 h GLU 435 N 0.40 0.43 -0.44 3.56 5.08 -0.93 -1.76 114.58 120.92 1wb9 h GLU 435 Ca 0.09 -0.25 -0.09 0.00 -1.00 0.00 0.00 59.36 58.11 1wb9 h GLU 435 Cb 0.22 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1wb9 h GLU 435 CO 0.00 0.83 -0.09 -1.49 -1.00 0.00 0.00 179.01 177.26 1wb9 h TRP 436 N 0.06 0.86 -0.67 4.33 -0.00 -1.18 -1.65 115.95 117.70 1wb9 h TRP 436 Ca 0.02 -0.15 -0.05 0.00 -0.00 0.00 0.00 58.89 58.70 1wb9 h TRP 436 Cb 0.78 -0.22 -0.03 0.00 -0.00 0.00 0.00 29.16 29.68 1wb9 h TRP 436 CO 0.09 0.85 0.22 0.00 -0.00 0.00 0.00 178.44 179.59 1wb9 h ARG 437 N 0.72 1.02 -0.35 0.49 3.08 -1.34 -0.80 114.38 117.20 1wb9 h ARG 437 Ca 0.12 -0.20 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 1wb9 h ARG 437 Cb 0.57 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1wb9 h ARG 437 CO 0.04 0.87 -0.04 0.00 -1.07 0.00 0.00 179.97 179.76 1wb9 h ALA 438 N 1.24 0.48 -0.32 0.04 0.00 -0.86 0.00 119.26 119.84 1wb9 h ALA 438 Ca 0.22 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1wb9 h ALA 438 Cb 0.27 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1wb9 h ALA 438 CO -0.01 0.29 -0.12 -0.07 0.00 0.00 0.00 179.25 179.34 1wb9 h LEU 439 N 0.45 0.54 -0.30 0.00 3.38 -1.12 -1.12 115.31 117.14 1wb9 h LEU 439 Ca 0.09 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1wb9 h LEU 439 Cb 0.53 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1wb9 h LEU 439 CO 0.03 0.69 -0.14 0.00 0.09 0.00 0.00 178.44 179.11 1wb9 h ALA 440 N 1.36 0.42 -0.47 1.53 0.00 -0.94 -2.43 119.26 118.73 1wb9 h ALA 440 Ca 0.09 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1wb9 h ALA 440 Cb 0.51 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1wb9 h ALA 440 CO 0.03 0.31 0.16 -0.44 0.00 0.00 0.00 179.25 179.31 1wb9 h ASP 441 N 0.38 0.63 0.52 0.00 3.32 -0.72 -1.52 116.42 119.03 1wb9 h ASP 441 Ca 0.07 -0.08 -0.17 0.00 0.02 0.00 0.00 57.03 56.86 1wb9 h ASP 441 Cb 0.67 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1wb9 h ASP 441 CO 0.04 0.60 -0.75 1.23 -1.72 0.00 0.00 179.24 178.64 1wb9 h GLY 442 N 0.85 0.20 1.34 2.75 0.00 -1.13 0.30 103.07 107.37 1wb9 h GLY 442 Ca 0.16 -0.29 -0.20 0.00 0.00 0.00 0.00 47.33 47.00 1wb9 h GLY 442 CO -0.01 0.26 -0.70 0.00 0.00 0.00 0.00 176.54 176.09 1wb9 h ALA 443 N 1.11 0.47 -0.10 3.60 0.00 -1.16 -0.63 119.26 122.55 1wb9 h ALA 443 Ca -0.02 -0.58 -0.18 0.00 0.00 0.00 0.00 54.91 54.13 1wb9 h ALA 443 Cb 1.31 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1wb9 h ALA 443 CO 0.11 0.71 -0.68 1.79 0.00 0.00 0.00 179.25 181.18 1wb9 h THR 444 N 0.47 1.36 -0.86 0.00 1.35 -1.17 -2.05 112.91 112.01 1wb9 h THR 444 Ca -0.03 -2.04 0.05 0.00 -0.55 0.00 0.00 66.41 63.84 1wb9 h THR 444 Cb 1.30 2.02 -0.06 0.00 -1.73 0.00 0.00 68.15 69.68 1wb9 h THR 444 CO 0.14 0.62 0.54 0.44 -0.25 0.00 0.00 175.52 177.00 1wb9 h ASP 445 N 0.31 0.87 -0.33 5.36 3.32 -0.37 -1.97 116.42 123.62 1wb9 h ASP 445 Ca -0.02 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 1wb9 h ASP 445 Cb 1.24 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 1wb9 h ASP 445 CO 0.12 0.58 0.03 0.22 -1.72 0.00 0.00 179.24 178.47 1wb9 h TYR 446 N 1.02 0.60 -0.43 4.55 3.20 -0.78 -2.27 116.97 122.85 1wb9 h TYR 446 Ca 0.36 -0.09 -0.12 0.00 3.14 0.00 0.00 58.73 62.02 1wb9 h TYR 446 Cb 0.09 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 1wb9 h TYR 446 CO -0.03 0.65 -0.21 -0.07 -1.64 0.00 0.00 178.16 176.86 1wb9 h LEU 447 N 0.37 0.87 -1.20 2.82 3.38 -1.19 0.19 115.31 120.55 1wb9 h LEU 447 Ca 0.10 -0.31 0.06 0.00 0.09 0.00 0.00 57.88 57.82 1wb9 h LEU 447 Cb 0.39 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 1wb9 h LEU 447 CO 0.01 1.05 0.56 -0.33 0.09 0.00 0.00 178.44 179.82 1wb9 h GLU 448 N 0.75 0.94 -0.04 1.13 5.08 -1.29 -0.06 114.58 121.08 1wb9 h GLU 448 Ca 0.10 -0.06 -0.19 0.00 -1.00 0.00 0.00 59.36 58.22 1wb9 h GLU 448 Cb 0.74 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1wb9 h GLU 448 CO 0.06 0.62 -0.79 0.00 -1.00 0.00 0.00 179.01 177.90 1wb9 h ARG 449 N 0.97 0.34 -0.75 2.33 3.08 -0.70 -3.03 114.38 116.61 1wb9 h ARG 449 Ca 0.37 -0.31 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 1wb9 h ARG 449 Cb 0.21 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 1wb9 h ARG 449 CO -0.14 0.97 0.33 1.25 -1.07 0.00 0.00 179.97 181.31 1wb9 h LEU 450 N 0.22 1.00 0.15 3.04 6.46 -0.08 -0.51 115.31 125.59 1wb9 h LEU 450 Ca -0.04 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.59 1wb9 h LEU 450 Cb 1.38 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 41.04 1wb9 h LEU 450 CO 0.13 0.87 -0.14 -0.08 -0.62 0.00 0.00 178.44 178.60 1wb9 h GLU 451 N 1.08 -0.30 -0.54 1.25 4.81 -0.92 0.78 114.58 120.73 1wb9 h GLU 451 Ca 0.26 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.46 1wb9 h GLU 451 Cb 0.16 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1wb9 h GLU 451 CO -0.03 -0.20 0.14 0.28 -0.73 0.00 0.00 179.01 178.48 1wb9 h VAL 452 N -0.31 1.22 -0.48 0.32 2.07 -1.40 -1.48 116.25 116.19 1wb9 h VAL 452 Ca 0.00 -0.78 -0.12 0.00 0.82 0.00 0.00 66.70 66.62 1wb9 h VAL 452 Cb 0.30 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1wb9 h VAL 452 CO -0.04 0.29 -0.16 -0.09 0.02 0.00 0.00 177.57 177.60 1wb9 h ARG 453 N 0.80 0.95 -0.12 1.57 2.43 -0.72 -2.07 114.38 117.21 1wb9 h ARG 453 Ca 0.18 -0.39 -0.19 0.00 -0.81 0.00 0.00 59.98 58.77 1wb9 h ARG 453 Cb 0.27 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1wb9 h ARG 453 CO -0.00 1.05 -0.71 0.93 -1.51 0.00 0.00 179.97 179.72 1wb9 h GLU 454 N 0.80 0.56 -0.13 0.20 4.39 -0.61 -2.38 114.58 117.40 1wb9 h GLU 454 Ca 0.11 -0.44 -0.00 0.00 0.34 0.00 0.00 59.36 59.38 1wb9 h GLU 454 Cb 0.73 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 1wb9 h GLU 454 CO 0.06 1.06 0.08 0.00 -1.16 0.00 0.00 179.01 179.05 1wb9 h ARG 455 N 0.39 0.18 0.84 2.33 3.08 -1.25 -2.05 114.38 117.89 1wb9 h ARG 455 Ca -0.03 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 1wb9 h ARG 455 Cb 1.30 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.32 1wb9 h ARG 455 CO 0.13 0.16 -0.43 1.49 -1.07 0.00 0.00 179.97 180.25 1wb9 h GLU 456 N 0.14 -1.12 -0.51 0.04 4.22 -1.36 -1.07 114.58 114.93 1wb9 h GLU 456 Ca 0.05 0.08 0.08 0.00 0.08 0.00 0.00 59.36 59.64 1wb9 h GLU 456 Cb 0.03 0.25 -0.10 0.00 0.50 0.00 0.00 28.75 29.44 1wb9 h GLU 456 CO -0.01 -0.75 -0.46 0.00 -2.18 0.00 0.00 179.01 175.62 1wb9 h ARG 457 N -1.16 -0.27 0.00 1.92 3.08 -1.47 -2.87 114.38 113.61 1wb9 h ARG 457 Ca -0.11 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1wb9 h ARG 457 Cb 0.90 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1wb9 h ARG 457 CO 0.17 -0.18 0.00 1.79 -1.07 0.00 0.00 179.97 180.68 1wb9 h THR 458 N -0.28 0.00 -0.92 2.04 1.35 -1.29 -3.47 112.91 110.34 1wb9 h THR 458 Ca 0.15 -0.70 -0.26 0.00 -0.55 0.00 0.00 66.41 65.05 1wb9 h THR 458 Cb 0.57 1.67 -0.08 0.00 -1.73 0.00 0.00 68.15 68.59 1wb9 h THR 458 CO -0.65 0.00 -0.26 0.61 -0.25 0.00 0.00 175.52 174.97 1wb9 n GLY 459 N 0.67 0.96 3.19 5.82 0.00 -0.41 -4.99 105.19 110.42 1wb9 n GLY 459 Ca 0.03 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 1wb9 n GLY 459 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wb9 s LEU 460 N -3.08 5.43 0.00 0.99 1.43 -1.17 -4.97 118.68 117.31 1wb9 s LEU 460 Ca 0.00 -1.89 0.24 0.00 -1.03 0.00 0.00 54.13 51.45 1wb9 s LEU 460 Cb 0.00 -1.94 1.26 0.00 0.03 0.00 0.00 46.19 45.54 1wb9 s LEU 460 CO 0.00 -0.61 1.79 -0.90 0.23 0.00 0.00 176.35 176.86 1wb9 n ASP 461 N 4.79 0.00 -0.26 2.29 3.85 -1.26 -1.73 116.55 124.23 1wb9 n ASP 461 Ca -0.06 -0.22 0.12 0.00 -0.71 0.00 0.00 54.79 53.91 1wb9 n ASP 461 Cb 0.41 -0.22 0.13 0.00 -1.35 0.00 0.00 41.12 40.09 1wb9 n ASP 461 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1wb9 n THR 462 N -1.22 0.00 -1.99 2.12 -2.24 -1.26 -4.98 114.28 104.71 1wb9 n THR 462 Ca 0.13 -0.14 -0.42 0.00 -2.27 0.00 0.00 64.05 61.35 1wb9 n THR 462 Cb 0.16 0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 1wb9 n THR 462 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1wb9 s LEU 463 N -2.65 4.37 0.23 3.22 0.20 -0.71 -4.53 118.68 118.81 1wb9 s LEU 463 Ca 0.17 2.57 -0.11 0.00 0.69 0.00 0.00 54.13 57.45 1wb9 s LEU 463 Cb 0.18 -3.60 -0.01 0.00 -0.43 0.00 0.00 46.19 42.33 1wb9 s LEU 463 CO 0.63 -0.77 0.42 -1.59 -0.29 0.00 0.00 176.35 174.74 1wb9 s LYS 464 N 0.89 1.46 -0.10 1.98 -2.85 -0.34 -4.86 119.74 115.92 1wb9 s LYS 464 Ca 0.67 -1.27 -0.01 0.00 -1.00 0.00 0.00 55.97 54.36 1wb9 s LYS 464 Cb -0.42 0.44 -0.03 0.00 -2.06 0.00 0.00 37.83 35.76 1wb9 s LYS 464 CO 0.33 -0.59 -0.07 0.08 0.10 0.00 0.00 175.35 175.20 1wb9 s VAL 465 N -4.02 3.68 0.11 1.79 1.01 -1.26 0.20 120.40 121.91 1wb9 s VAL 465 Ca 0.23 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.77 1wb9 s VAL 465 Cb 0.01 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 1wb9 s VAL 465 CO 0.08 0.56 0.07 0.61 0.00 0.00 0.00 175.10 176.42 1wb9 n GLY 466 N 2.75 3.75 3.16 4.51 0.00 -0.43 -4.96 105.19 113.97 1wb9 n GLY 466 Ca -0.18 -1.83 -0.13 0.00 0.00 0.00 0.00 46.02 43.89 1wb9 n GLY 466 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1wb9 s PHE 467 N -2.25 -0.35 0.29 1.61 5.36 -1.26 -1.08 117.98 120.30 1wb9 s PHE 467 Ca 0.10 0.83 -0.10 0.00 -0.96 0.00 0.00 56.93 56.79 1wb9 s PHE 467 Cb 0.00 0.11 0.00 0.00 -0.34 0.00 0.00 43.02 42.80 1wb9 s PHE 467 CO 0.07 -0.19 0.51 0.54 -1.46 0.00 0.00 175.22 174.69 1wb9 s ASN 468 N 0.49 0.21 0.19 6.13 2.20 -0.60 -4.99 114.94 118.58 1wb9 s ASN 468 Ca -0.03 -1.12 -0.07 0.00 -0.94 0.00 0.00 52.86 50.70 1wb9 s ASN 468 Cb -0.04 0.64 0.11 0.00 -2.00 0.00 0.00 41.25 39.95 1wb9 s ASN 468 CO -0.03 -1.24 1.63 0.00 -2.94 0.00 0.00 177.10 174.52 1wb9 h ALA 469 N 2.19 0.83 -0.10 3.54 0.00 -2.03 0.36 119.26 124.05 1wb9 h ALA 469 Ca -0.27 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.25 1wb9 h ALA 469 Cb 1.25 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1wb9 h ALA 469 CO 0.37 0.65 -0.09 0.28 0.00 0.00 0.00 179.25 180.46 1wb9 h VAL 470 N 0.85 1.35 -0.22 0.00 2.07 -2.04 -3.33 116.25 114.93 1wb9 h VAL 470 Ca 0.13 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.43 1wb9 h VAL 470 Cb 0.66 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.36 1wb9 h VAL 470 CO 0.05 0.35 0.00 1.41 0.02 0.00 0.00 177.57 179.40 1wb9 n HIS 471 N -4.66 0.27 -2.02 1.57 8.25 -1.23 -5.07 115.22 112.33 1wb9 n HIS 471 Ca -0.07 -0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 1wb9 n HIS 471 Cb 0.32 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.43 1wb9 n HIS 471 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wb9 n GLY 472 N 1.13 2.54 3.80 -1.41 0.00 0.11 -4.56 105.19 106.81 1wb9 n GLY 472 Ca 0.14 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1wb9 n GLY 472 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wb9 s TYR 473 N 0.00 3.39 0.11 1.61 2.02 -1.26 -1.55 117.35 121.67 1wb9 s TYR 473 Ca 0.00 1.66 -0.10 0.00 -0.37 0.00 0.00 57.07 58.26 1wb9 s TYR 473 Cb 0.00 -2.93 0.01 0.00 -0.40 0.00 0.00 41.96 38.64 1wb9 s TYR 473 CO 0.00 -0.15 0.26 1.52 -1.57 0.00 0.00 175.55 175.61 1wb9 s TYR 474 N -1.93 0.10 -0.16 2.71 -0.85 -0.24 -4.83 117.35 112.14 1wb9 s TYR 474 Ca 0.58 -0.50 -0.06 0.00 -0.52 0.00 0.00 57.07 56.58 1wb9 s TYR 474 Cb -0.14 0.02 -0.03 0.00 0.38 0.00 0.00 41.96 42.18 1wb9 s TYR 474 CO 0.19 -0.61 0.02 0.42 -1.52 0.00 0.00 175.55 174.05 1wb9 s ILE 475 N -3.86 4.41 -0.12 -3.49 1.01 0.44 -1.31 121.20 118.28 1wb9 s ILE 475 Ca 0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 60.65 60.53 1wb9 s ILE 475 Cb 0.04 -2.96 -0.02 0.00 0.01 0.00 0.00 42.46 39.53 1wb9 s ILE 475 CO -0.10 0.49 -0.07 -1.58 0.00 0.00 0.00 174.94 173.68 1wb9 s GLN 476 N 0.25 3.30 0.07 2.79 0.74 0.13 0.03 119.66 126.97 1wb9 s GLN 476 Ca 0.01 -0.58 0.08 0.00 0.05 0.00 0.00 55.36 54.93 1wb9 s GLN 476 Cb -0.13 -2.73 -0.03 0.00 1.10 0.00 0.00 33.01 31.22 1wb9 s GLN 476 CO 0.01 0.37 -0.22 0.42 -0.55 0.00 0.00 175.29 175.32 1wb9 s ILE 477 N -0.02 1.79 0.71 -2.34 1.01 -0.50 -1.20 121.20 120.65 1wb9 s ILE 477 Ca -0.01 -1.39 -0.13 0.00 0.00 0.00 0.00 60.65 59.12 1wb9 s ILE 477 Cb -0.14 -1.58 0.03 0.00 0.01 0.00 0.00 42.46 40.78 1wb9 s ILE 477 CO 0.03 0.12 1.11 -0.94 0.00 0.00 0.00 174.94 175.26 1wb9 s SER 478 N -1.52 4.80 0.24 3.58 1.04 -1.26 -0.83 113.70 119.75 1wb9 s SER 478 Ca 0.08 1.94 -0.07 0.00 0.48 0.00 0.00 55.95 58.39 1wb9 s SER 478 Cb -0.09 -2.54 0.41 0.00 0.10 0.00 0.00 66.02 63.90 1wb9 s SER 478 CO 0.03 -1.83 1.68 -0.09 0.98 0.00 0.00 173.24 174.00 1wb9 h ARG 479 N -0.47 0.21 0.00 4.02 2.43 -1.65 -1.03 114.38 117.89 1wb9 h ARG 479 Ca -0.45 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 58.63 1wb9 h ARG 479 Cb 1.24 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 1wb9 h ARG 479 CO 0.53 0.14 -0.35 0.78 -1.51 0.00 0.00 179.97 179.55 1wb9 h GLY 480 N 0.22 0.00 0.61 2.80 0.00 -1.92 -2.99 103.07 101.78 1wb9 h GLY 480 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 1wb9 h GLY 480 CO -0.52 0.00 -0.98 -1.06 0.00 0.00 0.00 176.54 173.98 1wb9 n GLN 481 N -3.68 0.25 0.26 4.80 6.02 -0.80 -4.63 117.38 119.60 1wb9 n GLN 481 Ca -0.01 -0.00 0.17 0.00 -0.01 0.00 0.00 57.00 57.15 1wb9 n GLN 481 Cb 0.45 -1.58 0.63 0.00 1.02 0.00 0.00 30.24 30.76 1wb9 n GLN 481 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1wb9 h SER 482 N 0.00 0.00 0.74 1.08 4.64 -1.06 -1.33 113.55 117.62 1wb9 h SER 482 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1wb9 h SER 482 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1wb9 h SER 482 CO 0.00 0.00 0.00 1.12 -0.87 0.00 0.00 176.83 177.08 1wb9 h HIS 483 N 0.00 0.00 -0.33 4.77 2.07 -1.82 -2.09 115.15 117.76 1wb9 h HIS 483 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1wb9 h HIS 483 Cb 0.54 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.52 1wb9 h HIS 483 CO 0.00 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.14 1wb9 n LEU 484 N -2.76 2.38 -4.66 6.12 4.77 -0.50 -4.94 117.00 117.41 1wb9 n LEU 484 Ca 0.00 -1.08 -0.46 0.00 -0.03 0.00 0.00 56.01 54.44 1wb9 n LEU 484 Cb 0.23 -0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 41.07 1wb9 n LEU 484 CO 0.23 0.54 1.12 0.00 -1.33 0.00 0.00 177.39 177.95 1wb9 n ALA 485 N 0.79 1.03 -1.71 -1.18 0.00 -0.79 -4.93 120.51 113.72 1wb9 n ALA 485 Ca 0.17 0.45 -0.38 0.00 0.00 0.00 0.00 53.44 53.68 1wb9 n ALA 485 Cb 0.42 -2.30 0.06 0.00 0.00 0.00 0.00 19.45 17.62 1wb9 n ALA 485 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1wb9 n PRO 486 N 3.05 1.27 0.24 0.00 -0.02 -1.26 -4.89 135.00 133.38 1wb9 n PRO 486 Ca 0.16 0.48 0.16 0.00 -2.02 0.00 0.00 63.50 62.28 1wb9 n PRO 486 Cb 0.28 -2.47 0.64 0.00 -0.02 0.00 0.00 33.50 31.93 1wb9 n PRO 486 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1wb9 h ILE 487 N 0.85 0.00 0.00 4.25 6.09 -1.99 -1.33 117.51 125.37 1wb9 h ILE 487 Ca -0.50 -0.42 0.00 0.00 -1.37 0.00 0.00 64.86 62.56 1wb9 h ILE 487 Cb 1.33 1.35 0.00 0.00 0.47 0.00 0.00 36.82 39.97 1wb9 h ILE 487 CO 0.54 0.00 0.00 -0.55 -3.07 0.00 0.00 178.15 175.07 1wb9 h ASN 488 N 0.00 0.00 -3.22 2.19 -1.07 -1.99 -3.45 115.58 108.04 1wb9 h ASN 488 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 56.30 55.84 1wb9 h ASN 488 Cb 0.46 0.00 0.03 0.00 -2.07 0.00 0.00 38.32 36.74 1wb9 h ASN 488 CO 0.00 0.00 0.69 -0.31 0.07 0.00 0.00 177.43 177.88 1wb9 s TYR 489 N -3.26 3.23 -0.33 4.14 1.51 -0.50 -4.82 117.35 117.32 1wb9 s TYR 489 Ca 0.07 1.09 -0.08 0.00 -1.01 0.00 0.00 57.07 57.14 1wb9 s TYR 489 Cb 0.10 -3.65 0.02 0.00 -0.11 0.00 0.00 41.96 38.32 1wb9 s TYR 489 CO 0.53 -2.16 0.12 -1.64 -1.11 0.00 0.00 175.55 171.29 1wb9 s MET 490 N 0.39 2.85 0.25 -0.62 -1.94 -0.39 -4.96 119.30 114.88 1wb9 s MET 490 Ca 0.60 -1.03 -0.30 0.00 -1.71 0.00 0.00 55.69 53.25 1wb9 s MET 490 Cb -0.37 -3.49 -0.10 0.00 2.01 0.00 0.00 34.83 32.88 1wb9 s MET 490 CO 0.35 -0.59 1.36 0.50 -0.01 0.00 0.00 175.02 176.63 1wb9 s ARG 491 N 1.47 4.33 0.00 2.03 3.52 -1.26 -1.37 118.95 127.67 1wb9 s ARG 491 Ca 0.01 2.19 0.00 0.00 -0.13 0.00 0.00 55.73 57.80 1wb9 s ARG 491 Cb -0.19 -3.13 0.00 0.00 -1.56 0.00 0.00 34.95 30.07 1wb9 s ARG 491 CO 0.04 -0.30 0.00 0.54 -0.81 0.00 0.00 175.30 174.76 1wb9 n ARG 492 N 2.09 4.65 -3.47 5.12 5.12 -0.60 -4.92 116.66 124.65 1wb9 n ARG 492 Ca 0.05 0.00 -0.02 0.00 -1.93 0.00 0.00 57.85 55.95 1wb9 n ARG 492 Cb 0.41 -0.59 -0.04 0.00 -1.16 0.00 0.00 32.46 31.08 1wb9 n ARG 492 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1wb9 s GLN 493 N -0.42 0.51 -0.01 5.56 0.74 -1.18 -5.01 119.66 119.85 1wb9 s GLN 493 Ca 0.00 1.15 -0.21 0.00 0.05 0.00 0.00 55.36 56.36 1wb9 s GLN 493 Cb 0.00 0.54 -0.05 0.00 1.10 0.00 0.00 33.01 34.60 1wb9 s GLN 493 CO 0.00 -0.38 0.60 0.99 -0.55 0.00 0.00 175.29 175.94 1wb9 s THR 494 N 2.80 4.93 0.33 -0.34 2.01 -1.26 -1.26 115.64 122.84 1wb9 s THR 494 Ca 0.05 1.25 0.09 0.00 0.31 0.00 0.00 61.69 63.38 1wb9 s THR 494 Cb -0.13 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 1wb9 s THR 494 CO -0.18 0.40 0.08 -0.76 -0.69 0.00 0.00 174.62 173.47 1wb9 s LEU 495 N -0.10 3.16 0.28 4.42 1.02 0.69 -5.01 118.68 123.14 1wb9 s LEU 495 Ca 0.31 -0.83 0.01 0.00 0.02 0.00 0.00 54.13 53.65 1wb9 s LEU 495 Cb -0.18 -1.60 0.67 0.00 0.02 0.00 0.00 46.19 45.09 1wb9 s LEU 495 CO 0.17 -0.24 1.68 0.50 0.02 0.00 0.00 176.35 178.48 1wb9 h LYS 496 N 1.68 0.32 0.00 1.70 3.64 -2.04 -3.05 116.57 118.82 1wb9 h LYS 496 Ca -0.43 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 58.84 1wb9 h LYS 496 Cb 1.25 -0.07 -0.18 0.00 -0.41 0.00 0.00 32.23 32.82 1wb9 h LYS 496 CO 0.64 0.21 -0.70 -1.71 -2.27 0.00 0.00 179.45 175.62 1wb9 n ASN 497 N -5.11 1.22 -3.56 4.20 5.15 -1.26 -4.97 115.26 110.93 1wb9 n ASN 497 Ca 0.20 -2.71 -0.09 0.00 -0.60 0.00 0.00 54.58 51.38 1wb9 n ASN 497 Cb 0.62 -0.37 -0.02 0.00 -0.53 0.00 0.00 39.78 39.48 1wb9 n ASN 497 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wb9 s ALA 498 N -1.30 -1.58 0.05 5.20 0.00 -1.15 -1.80 121.76 121.17 1wb9 s ALA 498 Ca 0.31 0.42 0.08 0.00 0.00 0.00 0.00 51.96 52.76 1wb9 s ALA 498 Cb 0.32 0.75 -0.03 0.00 0.00 0.00 0.00 23.12 24.17 1wb9 s ALA 498 CO -0.10 -0.83 -0.22 -1.21 0.00 0.00 0.00 175.76 173.41 1wb9 s GLU 499 N -3.60 1.45 -0.01 0.00 0.41 -0.01 -0.22 118.70 116.72 1wb9 s GLU 499 Ca 0.05 -0.98 0.08 0.00 -0.41 0.00 0.00 54.97 53.71 1wb9 s GLU 499 Cb -0.02 -1.58 -0.02 0.00 -1.78 0.00 0.00 34.13 30.73 1wb9 s GLU 499 CO -0.07 0.40 -0.25 1.03 -0.49 0.00 0.00 175.26 175.88 1wb9 s ARG 500 N -1.22 2.11 0.12 1.61 0.52 -0.39 -1.41 118.95 120.28 1wb9 s ARG 500 Ca 0.08 -0.93 0.04 0.00 -0.52 0.00 0.00 55.73 54.40 1wb9 s ARG 500 Cb -0.09 -2.06 -0.04 0.00 0.52 0.00 0.00 34.95 33.28 1wb9 s ARG 500 CO 0.02 0.56 -0.10 0.71 0.02 0.00 0.00 175.30 176.51 1wb9 s TYR 501 N -0.64 1.13 0.16 -0.53 2.02 0.10 -1.56 117.35 118.03 1wb9 s TYR 501 Ca 0.10 -0.72 0.08 0.00 -0.37 0.00 0.00 57.07 56.17 1wb9 s TYR 501 Cb -0.10 -0.60 -0.04 0.00 -0.40 0.00 0.00 41.96 40.82 1wb9 s TYR 501 CO -0.00 0.02 -0.10 0.96 -1.57 0.00 0.00 175.55 174.85 1wb9 s ILE 502 N -2.90 3.22 0.17 2.71 -4.36 -0.47 -0.42 121.20 119.15 1wb9 s ILE 502 Ca 0.10 -1.55 0.07 0.00 -0.26 0.00 0.00 60.65 59.01 1wb9 s ILE 502 Cb 0.00 -2.57 -0.04 0.00 1.25 0.00 0.00 42.46 41.10 1wb9 s ILE 502 CO -0.00 -0.05 -0.14 0.27 0.24 0.00 0.00 174.94 175.27 1wb9 s ILE 503 N -1.55 1.54 0.38 8.37 -4.36 -1.26 -1.26 121.20 123.05 1wb9 s ILE 503 Ca 0.24 -2.07 0.09 0.00 -0.26 0.00 0.00 60.65 58.64 1wb9 s ILE 503 Cb -0.09 -1.90 0.31 0.00 1.25 0.00 0.00 42.46 42.03 1wb9 s ILE 503 CO 0.15 -0.58 1.94 -0.65 0.24 0.00 0.00 174.94 176.03 1wb9 h PRO 504 N 2.82 0.63 -0.09 0.37 0.11 -2.00 -1.13 132.00 132.72 1wb9 h PRO 504 Ca -0.38 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.67 1wb9 h PRO 504 Cb 1.21 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1wb9 h PRO 504 CO 0.60 0.42 -0.04 1.49 -0.21 0.00 0.00 178.00 180.26 1wb9 h GLU 505 N 0.65 0.13 -0.14 1.05 4.81 -1.99 -0.45 114.58 118.64 1wb9 h GLU 505 Ca 0.34 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.43 1wb9 h GLU 505 Cb 0.47 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1wb9 h GLU 505 CO -0.12 0.18 -0.41 1.25 -0.73 0.00 0.00 179.01 179.18 1wb9 h LEU 506 N 0.13 0.60 -0.86 1.64 5.85 -1.63 -2.83 115.31 118.22 1wb9 h LEU 506 Ca 0.03 -0.59 -0.12 0.00 0.84 0.00 0.00 57.88 58.04 1wb9 h LEU 506 Cb 0.16 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1wb9 h LEU 506 CO 0.01 1.09 -0.48 0.11 -0.34 0.00 0.00 178.44 178.83 1wb9 h LYS 507 N 0.14 0.21 0.87 1.25 1.79 -1.24 0.07 116.57 119.66 1wb9 h LYS 507 Ca -0.01 -0.11 -0.04 0.00 -2.18 0.00 0.00 60.65 58.30 1wb9 h LYS 507 Cb 1.03 0.01 0.01 0.00 -1.58 0.00 0.00 32.23 31.69 1wb9 h LYS 507 CO 0.09 0.65 -0.42 1.49 -1.08 0.00 0.00 179.45 180.18 1wb9 h GLU 508 N 0.17 -1.13 0.00 3.15 4.81 -1.10 -2.16 114.58 118.32 1wb9 h GLU 508 Ca 0.01 0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1wb9 h GLU 508 Cb 0.91 0.26 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 1wb9 h GLU 508 CO 0.07 -0.75 -0.16 1.88 -0.73 0.00 0.00 179.01 179.33 1wb9 h TYR 509 N -1.22 0.00 -0.28 0.92 0.05 -1.45 -2.30 116.97 112.69 1wb9 h TYR 509 Ca -0.12 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.68 1wb9 h TYR 509 Cb 0.90 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.62 1wb9 h TYR 509 CO -0.01 0.16 0.13 1.49 -1.05 0.00 0.00 178.16 178.88 1wb9 h GLU 510 N 0.00 0.26 -0.45 4.88 4.81 -0.77 -1.55 114.58 121.77 1wb9 h GLU 510 Ca -0.00 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.16 1wb9 h GLU 510 Cb 0.60 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1wb9 h GLU 510 CO 0.02 0.18 0.07 0.22 -0.73 0.00 0.00 179.01 178.77 1wb9 h ASP 511 N 0.27 0.64 -0.70 1.04 3.58 -0.83 -0.70 116.42 119.72 1wb9 h ASP 511 Ca 0.12 -0.12 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 1wb9 h ASP 511 Cb 0.05 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 40.90 1wb9 h ASP 511 CO -0.09 0.67 0.33 0.11 -2.88 0.00 0.00 179.24 177.38 1wb9 h LYS 512 N 0.66 1.03 -0.16 0.28 1.57 -1.15 -2.15 116.57 116.66 1wb9 h LYS 512 Ca 0.15 -0.15 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1wb9 h LYS 512 Cb 0.31 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1wb9 h LYS 512 CO 0.00 0.81 -0.35 0.28 -0.57 0.00 0.00 179.45 179.62 1wb9 h VAL 513 N 1.02 1.35 0.01 0.50 2.07 -0.62 -2.96 116.25 117.63 1wb9 h VAL 513 Ca 0.25 -1.62 -0.22 0.00 0.82 0.00 0.00 66.70 65.93 1wb9 h VAL 513 Cb 0.13 1.98 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1wb9 h VAL 513 CO -0.03 0.49 -0.94 -0.07 0.02 0.00 0.00 177.57 177.04 1wb9 h LEU 514 N 0.15 0.40 -0.04 2.57 3.38 -1.11 -1.31 115.31 119.35 1wb9 h LEU 514 Ca 0.00 -0.33 -0.26 0.00 0.09 0.00 0.00 57.88 57.38 1wb9 h LEU 514 Cb 0.96 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.60 1wb9 h LEU 514 CO 0.08 1.14 -1.05 0.71 0.09 0.00 0.00 178.44 179.42 1wb9 h THR 515 N 0.16 1.33 -0.23 0.22 1.35 -1.51 -1.51 112.91 112.73 1wb9 h THR 515 Ca -0.07 -2.39 -0.03 0.00 -0.55 0.00 0.00 66.41 63.37 1wb9 h THR 515 Cb 1.58 2.47 -0.01 0.00 -1.73 0.00 0.00 68.15 70.46 1wb9 h THR 515 CO 0.15 0.73 0.04 0.28 -0.25 0.00 0.00 175.52 176.47 1wb9 h SER 516 N 0.30 0.36 -0.80 5.36 0.02 -1.56 -1.79 113.55 115.44 1wb9 h SER 516 Ca -0.12 -0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 60.56 1wb9 h SER 516 Cb 1.70 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 64.10 1wb9 h SER 516 CO 0.19 0.52 0.42 0.11 -1.14 0.00 0.00 176.83 176.94 1wb9 h LYS 517 N 0.19 1.13 -0.49 3.45 1.57 -1.28 -1.97 116.57 119.18 1wb9 h LYS 517 Ca 0.07 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 1wb9 h LYS 517 Cb 0.31 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1wb9 h LYS 517 CO 0.00 0.85 0.09 0.78 -0.57 0.00 0.00 179.45 180.60 1wb9 h GLY 518 N 1.12 0.86 0.97 3.86 0.00 -1.18 -0.90 103.07 107.81 1wb9 h GLY 518 Ca 0.28 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 1wb9 h GLY 518 CO -0.04 0.53 0.18 0.50 0.00 0.00 0.00 176.54 177.70 1wb9 h LYS 519 N 0.68 0.74 -0.70 4.80 1.57 -1.22 -1.96 116.57 120.47 1wb9 h LYS 519 Ca 0.15 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 1wb9 h LYS 519 Cb 0.38 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 1wb9 h LYS 519 CO 0.01 0.67 0.25 0.00 -0.57 0.00 0.00 179.45 179.81 1wb9 h ALA 520 N 1.03 1.12 -0.18 3.86 0.00 -1.20 -1.91 119.26 121.97 1wb9 h ALA 520 Ca 0.16 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1wb9 h ALA 520 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1wb9 h ALA 520 CO -0.01 0.62 -0.04 1.25 0.00 0.00 0.00 179.25 181.06 1wb9 h LEU 521 N 1.02 0.36 -1.54 0.00 5.85 -0.99 -0.55 115.31 119.47 1wb9 h LEU 521 Ca 0.23 -0.37 -0.04 0.00 0.84 0.00 0.00 57.88 58.55 1wb9 h LEU 521 Cb 0.24 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1wb9 h LEU 521 CO -0.01 0.64 -0.09 0.00 -0.34 0.00 0.00 178.44 178.63 1wb9 h ALA 522 N 0.73 1.62 -0.02 1.25 0.00 -1.31 -2.25 119.26 119.28 1wb9 h ALA 522 Ca 0.05 -0.16 -0.26 0.00 0.00 0.00 0.00 54.91 54.54 1wb9 h ALA 522 Cb 0.48 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.22 1wb9 h ALA 522 CO 0.02 0.28 -1.00 1.25 0.00 0.00 0.00 179.25 179.80 1wb9 h LEU 523 N 0.18 0.91 -0.92 0.00 5.85 -1.08 -2.44 115.31 117.80 1wb9 h LEU 523 Ca 0.04 -0.72 0.07 0.00 0.84 0.00 0.00 57.88 58.10 1wb9 h LEU 523 Cb 0.28 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 1wb9 h LEU 523 CO 0.02 1.51 0.58 -0.33 -0.34 0.00 0.00 178.44 179.88 1wb9 h GLU 524 N 0.40 1.02 -0.52 1.25 5.08 -0.88 -0.30 114.58 120.63 1wb9 h GLU 524 Ca -0.12 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.07 1wb9 h GLU 524 Cb 1.65 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.65 1wb9 h GLU 524 CO 0.20 0.67 -0.12 0.87 -1.00 0.00 0.00 179.01 179.63 1wb9 h LYS 525 N 1.05 1.00 -0.32 2.33 1.57 -1.33 -1.00 116.57 119.87 1wb9 h LYS 525 Ca 0.40 -0.38 -0.15 0.00 -1.87 0.00 0.00 60.65 58.64 1wb9 h LYS 525 Cb 0.18 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1wb9 h LYS 525 CO -0.18 1.06 -0.42 1.96 -0.57 0.00 0.00 179.45 181.31 1wb9 h GLN 526 N 0.87 0.80 -0.47 3.15 1.08 -1.05 -1.84 115.11 117.65 1wb9 h GLN 526 Ca 0.13 -0.43 -0.06 0.00 -1.45 0.00 0.00 58.65 56.84 1wb9 h GLN 526 Cb 0.69 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.12 1wb9 h GLN 526 CO 0.05 1.06 0.03 -0.07 -0.95 0.00 0.00 178.83 178.95 1wb9 h LEU 527 N 0.65 0.71 -0.35 1.46 3.38 -0.94 -1.87 115.31 118.35 1wb9 h LEU 527 Ca 0.05 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1wb9 h LEU 527 Cb 0.98 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1wb9 h LEU 527 CO 0.09 0.76 -0.11 0.22 0.09 0.00 0.00 178.44 179.49 1wb9 h TYR 528 N 0.71 0.78 -0.38 1.13 3.20 -1.00 -2.41 116.97 118.98 1wb9 h TYR 528 Ca 0.14 -0.18 -0.05 0.00 3.14 0.00 0.00 58.73 61.79 1wb9 h TYR 528 Cb 0.39 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1wb9 h TYR 528 CO 0.02 0.86 0.02 0.93 -1.64 0.00 0.00 178.16 178.34 1wb9 h GLU 529 N 0.47 0.60 0.00 1.82 4.39 -1.21 -2.02 114.58 118.63 1wb9 h GLU 529 Ca 0.08 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 1wb9 h GLU 529 Cb 0.62 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1wb9 h GLU 529 CO 0.04 0.61 -0.19 1.49 -1.16 0.00 0.00 179.01 179.80 1wb9 h GLU 530 N 0.57 0.00 -0.62 2.33 4.81 -1.07 -2.45 114.58 118.16 1wb9 h GLU 530 Ca 0.12 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1wb9 h GLU 530 Cb 0.34 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 1wb9 h GLU 530 CO 0.01 0.19 0.12 -0.07 -0.73 0.00 0.00 179.01 178.53 1wb9 h LEU 531 N 0.00 0.93 -0.51 1.64 3.38 -0.87 -2.14 115.31 117.75 1wb9 h LEU 531 Ca -0.00 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.78 1wb9 h LEU 531 Cb 0.49 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1wb9 h LEU 531 CO 0.02 0.92 0.34 -0.26 0.09 0.00 0.00 178.44 179.55 1wb9 h PHE 532 N 0.93 0.64 -0.35 1.13 0.04 -1.44 -0.69 116.94 117.19 1wb9 h PHE 532 Ca 0.19 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.98 1wb9 h PHE 532 Cb 0.37 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 1wb9 h PHE 532 CO 0.02 0.40 0.22 -0.44 -0.60 0.00 0.00 178.31 177.91 1wb9 h ASP 533 N 0.69 0.41 0.80 2.17 3.32 -1.30 0.02 116.42 122.54 1wb9 h ASP 533 Ca 0.19 -0.02 -0.23 0.00 0.02 0.00 0.00 57.03 56.99 1wb9 h ASP 533 Cb -0.08 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.33 1wb9 h ASP 533 CO -0.04 0.32 -1.29 -0.07 -1.72 0.00 0.00 179.24 176.44 1wb9 h LEU 534 N 0.48 0.00 0.13 1.55 3.38 -1.07 -3.38 115.31 116.40 1wb9 h LEU 534 Ca 0.13 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.91 1wb9 h LEU 534 Cb -0.03 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.74 1wb9 h LEU 534 CO -0.03 0.92 -0.84 -0.07 0.09 0.00 0.00 178.44 178.51 1wb9 h LEU 535 N 0.00 0.43 -2.05 1.67 3.38 -0.76 -3.39 115.31 114.59 1wb9 h LEU 535 Ca -0.14 -0.94 0.06 0.00 0.09 0.00 0.00 57.88 56.95 1wb9 h LEU 535 Cb 1.82 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.42 1wb9 h LEU 535 CO 0.10 1.40 0.17 -0.07 0.09 0.00 0.00 178.44 180.12 1wb9 h LEU 536 N -0.40 0.00 -2.20 1.67 3.38 -1.17 -1.11 115.31 115.48 1wb9 h LEU 536 Ca -0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1wb9 h LEU 536 Cb 1.62 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.37 1wb9 h LEU 536 CO 0.13 0.00 -0.06 -0.65 0.09 0.00 0.00 178.44 177.95 1wb9 h PRO 537 N 0.00 0.00 -0.29 1.13 0.11 -1.76 -2.40 132.00 128.78 1wb9 h PRO 537 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1wb9 h PRO 537 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 1wb9 h PRO 537 CO -0.00 0.06 0.00 0.72 -0.21 0.00 0.00 178.00 178.57 1wb9 n HIS 538 N -3.67 0.38 -0.22 0.65 8.25 -0.42 -4.60 115.22 115.59 1wb9 n HIS 538 Ca -0.02 -0.19 -0.02 0.00 -0.26 0.00 0.00 57.72 57.23 1wb9 n HIS 538 Cb 0.17 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.37 1wb9 n HIS 538 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1wb9 h LEU 539 N 2.32 0.53 -0.52 2.41 5.85 -1.50 -0.76 115.31 123.64 1wb9 h LEU 539 Ca 0.00 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.78 1wb9 h LEU 539 Cb 0.52 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 1wb9 h LEU 539 CO 0.00 0.34 0.30 -0.08 -0.34 0.00 0.00 178.44 178.67 1wb9 h GLU 540 N 0.66 0.58 -0.57 1.25 4.81 -1.84 0.19 114.58 119.67 1wb9 h GLU 540 Ca 0.29 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.39 1wb9 h GLU 540 Cb 0.18 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1wb9 h GLU 540 CO -0.18 0.38 0.00 0.00 -0.73 0.00 0.00 179.01 178.49 1wb9 h ALA 541 N 1.24 0.94 -0.67 2.92 0.00 -1.79 -2.40 119.26 119.49 1wb9 h ALA 541 Ca 0.21 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1wb9 h ALA 541 Cb 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1wb9 h ALA 541 CO -0.11 0.64 0.10 -0.07 0.00 0.00 0.00 179.25 179.81 1wb9 h LEU 542 N 0.90 1.08 -0.92 0.00 3.38 -0.75 -1.00 115.31 118.00 1wb9 h LEU 542 Ca 0.16 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1wb9 h LEU 542 Cb 0.52 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1wb9 h LEU 542 CO 0.03 1.07 0.40 1.56 0.09 0.00 0.00 178.44 181.58 1wb9 h GLN 543 N 1.04 1.18 -0.27 1.13 4.20 -0.84 -1.87 115.11 119.69 1wb9 h GLN 543 Ca 0.20 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1wb9 h GLN 543 Cb 0.46 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1wb9 h GLN 543 CO 0.01 0.90 0.06 1.96 -0.67 0.00 0.00 178.83 181.09 1wb9 h GLN 544 N 1.17 0.43 -0.23 1.46 4.20 -0.93 -1.84 115.11 119.38 1wb9 h GLN 544 Ca 0.28 -0.11 0.06 0.00 0.06 0.00 0.00 58.65 58.94 1wb9 h GLN 544 Cb 0.11 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 27.78 1wb9 h GLN 544 CO -0.04 0.54 -0.15 1.03 -0.67 0.00 0.00 178.83 179.54 1wb9 h SER 545 N 0.26 -0.49 -0.11 1.46 0.87 -0.98 -0.62 113.55 113.94 1wb9 h SER 545 Ca 0.08 0.10 -0.05 0.00 -1.23 0.00 0.00 61.79 60.69 1wb9 h SER 545 Cb 0.30 0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 1wb9 h SER 545 CO 0.00 -0.19 -0.08 0.00 -0.53 0.00 0.00 176.83 176.04 1wb9 h ALA 546 N 1.01 1.40 -0.46 6.23 0.00 -1.23 0.93 119.26 127.14 1wb9 h ALA 546 Ca 0.13 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1wb9 h ALA 546 Cb 0.33 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1wb9 h ALA 546 CO -0.31 0.42 -0.18 1.03 0.00 0.00 0.00 179.25 180.21 1wb9 h SER 547 N 0.39 0.95 -0.61 0.00 0.87 -0.91 -0.40 113.55 113.83 1wb9 h SER 547 Ca 0.08 -0.39 -0.05 0.00 -1.23 0.00 0.00 61.79 60.20 1wb9 h SER 547 Cb 0.38 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 1wb9 h SER 547 CO 0.02 1.12 0.20 0.00 -0.53 0.00 0.00 176.83 177.64 1wb9 h ALA 548 N 0.86 0.79 -0.39 6.23 0.00 -0.54 -1.13 119.26 125.07 1wb9 h ALA 548 Ca 0.11 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1wb9 h ALA 548 Cb 0.74 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1wb9 h ALA 548 CO 0.06 0.45 -0.20 -0.07 0.00 0.00 0.00 179.25 179.49 1wb9 h LEU 549 N 0.86 0.75 -0.45 0.00 3.38 -0.73 0.10 115.31 119.23 1wb9 h LEU 549 Ca 0.20 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1wb9 h LEU 549 Cb 0.28 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1wb9 h LEU 549 CO -0.01 0.95 0.03 0.00 0.09 0.00 0.00 178.44 179.50 1wb9 h ALA 550 N 1.11 0.60 -0.42 1.53 0.00 -0.91 -1.59 119.26 119.59 1wb9 h ALA 550 Ca 0.10 -0.25 -0.15 0.00 0.00 0.00 0.00 54.91 54.61 1wb9 h ALA 550 Cb 0.70 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1wb9 h ALA 550 CO 0.05 0.37 -0.32 1.49 0.00 0.00 0.00 179.25 180.84 1wb9 h GLU 551 N 0.63 0.94 -0.40 0.00 4.81 -0.88 -2.17 114.58 117.50 1wb9 h GLU 551 Ca 0.13 -0.45 0.04 0.00 -0.13 0.00 0.00 59.36 58.95 1wb9 h GLU 551 Cb 0.45 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 1wb9 h GLU 551 CO 0.02 1.11 0.18 -0.07 -0.73 0.00 0.00 179.01 179.52 1wb9 h LEU 552 N 0.78 0.25 -0.49 1.64 3.38 -0.80 -0.74 115.31 119.34 1wb9 h LEU 552 Ca 0.08 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.18 1wb9 h LEU 552 Cb 0.90 -0.02 -0.09 0.00 0.09 0.00 0.00 40.66 41.55 1wb9 h LEU 552 CO 0.08 0.18 -0.06 -0.78 0.09 0.00 0.00 178.44 177.96 1wb9 h ASP 553 N 0.37 -0.32 -0.13 -0.43 3.58 -1.08 0.34 116.42 118.76 1wb9 h ASP 553 Ca 0.17 0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.75 1wb9 h ASP 553 Cb 0.11 0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 1wb9 h ASP 553 CO -0.14 -0.12 0.06 0.58 -2.88 0.00 0.00 179.24 176.74 1wb9 h VAL 554 N 0.06 1.13 -0.06 2.25 2.07 -0.73 -0.85 116.25 120.11 1wb9 h VAL 554 Ca 0.24 -0.38 -0.24 0.00 0.82 0.00 0.00 66.70 67.14 1wb9 h VAL 554 Cb 0.37 1.15 0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1wb9 h VAL 554 CO -0.46 0.12 -0.92 -0.07 0.02 0.00 0.00 177.57 176.27 1wb9 h LEU 555 N 0.07 0.85 -1.01 2.57 3.38 -0.70 0.14 115.31 120.62 1wb9 h LEU 555 Ca 0.04 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.38 1wb9 h LEU 555 Cb 0.14 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 1wb9 h LEU 555 CO -0.00 1.43 0.59 0.58 0.09 0.00 0.00 178.44 181.12 1wb9 h VAL 556 N 0.42 1.25 -0.16 1.22 2.07 -0.33 -1.13 116.25 119.59 1wb9 h VAL 556 Ca -0.09 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 1wb9 h VAL 556 Cb 1.55 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1wb9 h VAL 556 CO 0.18 0.25 -0.07 -1.13 0.02 0.00 0.00 177.57 176.83 1wb9 h ASN 557 N 1.29 0.33 -0.02 0.57 -1.24 -0.67 -1.75 115.58 114.09 1wb9 h ASN 557 Ca 0.34 -0.40 0.01 0.00 0.71 0.00 0.00 56.30 56.96 1wb9 h ASN 557 Cb -0.10 -0.09 -0.00 0.00 0.73 0.00 0.00 38.32 38.86 1wb9 h ASN 557 CO -0.07 0.66 0.01 -0.07 -1.29 0.00 0.00 177.43 176.68 1wb9 h LEU 558 N 0.01 0.00 -0.18 0.34 3.38 -0.55 0.10 115.31 118.41 1wb9 h LEU 558 Ca 0.04 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1wb9 h LEU 558 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1wb9 h LEU 558 CO 0.02 0.00 -0.34 0.00 0.09 0.00 0.00 178.44 178.21 1wb9 h ALA 559 N 1.99 0.28 -0.43 1.53 0.00 -0.97 -0.50 119.26 121.16 1wb9 h ALA 559 Ca 0.01 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1wb9 h ALA 559 Cb 0.04 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1wb9 h ALA 559 CO -0.00 0.33 0.07 1.49 0.00 0.00 0.00 179.25 181.14 1wb9 h GLU 560 N 0.19 0.72 -0.08 0.00 4.22 -0.73 -2.60 114.58 116.30 1wb9 h GLU 560 Ca 0.01 -0.20 0.02 0.00 0.08 0.00 0.00 59.36 59.27 1wb9 h GLU 560 Cb 0.93 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 1wb9 h GLU 560 CO 0.08 0.75 -0.05 0.00 -2.18 0.00 0.00 179.01 177.61 1wb9 h ARG 561 N 0.58 -0.06 -0.84 1.92 2.47 -0.78 0.05 114.38 117.73 1wb9 h ARG 561 Ca 0.13 0.00 0.06 0.00 -1.26 0.00 0.00 59.98 58.92 1wb9 h ARG 561 Cb 0.38 0.01 -0.06 0.00 -1.65 0.00 0.00 29.97 28.66 1wb9 h ARG 561 CO 0.01 -0.04 0.51 0.00 0.56 0.00 0.00 179.97 181.02 1wb9 h ALA 562 N 1.02 1.14 0.00 0.04 0.00 -1.00 -0.91 119.26 119.55 1wb9 h ALA 562 Ca 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1wb9 h ALA 562 Cb 0.14 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1wb9 h ALA 562 CO -0.12 0.25 -0.15 -0.92 0.00 0.00 0.00 179.25 178.32 1wb9 h TYR 563 N 0.94 0.14 -0.73 0.00 3.20 -1.18 -0.96 116.97 118.37 1wb9 h TYR 563 Ca 0.36 -0.08 0.07 0.00 3.14 0.00 0.00 58.73 62.22 1wb9 h TYR 563 Cb 0.17 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.36 1wb9 h TYR 563 CO -0.04 0.90 0.42 1.15 -1.64 0.00 0.00 178.16 178.95 1wb9 h THR 564 N -0.66 0.96 -0.69 1.81 2.02 -0.95 -3.20 112.91 112.20 1wb9 h THR 564 Ca -0.02 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1wb9 h THR 564 Cb 0.94 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1wb9 h THR 564 CO 0.03 0.14 0.00 0.18 0.37 0.00 0.00 175.52 176.24 1wb9 n LEU 565 N -4.75 4.01 -3.24 2.58 4.77 -0.35 -4.96 117.00 115.06 1wb9 n LEU 565 Ca 0.10 -2.08 -0.15 0.00 -0.03 0.00 0.00 56.01 53.85 1wb9 n LEU 565 Cb 0.20 -0.49 0.08 0.00 -2.33 0.00 0.00 43.42 40.88 1wb9 n LEU 565 CO 0.29 0.94 0.07 0.59 -1.33 0.00 0.00 177.39 177.95 1wb9 n ASN 566 N 1.47 -3.93 -4.97 -1.43 3.02 -0.97 -4.97 115.26 103.47 1wb9 n ASN 566 Ca 0.24 -0.62 -0.21 0.00 -0.03 0.00 0.00 54.58 53.96 1wb9 n ASN 566 Cb 0.65 -4.91 0.01 0.00 -0.61 0.00 0.00 39.78 34.92 1wb9 n ASN 566 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1wb9 s TYR 567 N -3.35 3.05 0.12 3.10 2.02 -0.40 -4.38 117.35 117.50 1wb9 s TYR 567 Ca 0.19 -0.02 0.04 0.00 -0.37 0.00 0.00 57.07 56.91 1wb9 s TYR 567 Cb -0.02 -2.35 -0.04 0.00 -0.40 0.00 0.00 41.96 39.14 1wb9 s TYR 567 CO 0.69 -0.41 -0.11 -0.08 -1.57 0.00 0.00 175.55 174.08 1wb9 s THR 568 N -2.48 1.09 -0.24 -0.71 -1.32 -0.04 -4.83 115.64 107.11 1wb9 s THR 568 Ca 0.51 -1.85 -0.29 0.00 -1.21 0.00 0.00 61.69 58.85 1wb9 s THR 568 Cb -0.10 -1.61 0.01 0.00 -1.51 0.00 0.00 72.50 69.29 1wb9 s THR 568 CO 0.36 -0.63 1.03 0.00 -2.21 0.00 0.00 174.62 173.16 1wb9 s PRO 570 N 3.20 3.49 0.15 0.00 0.04 -1.26 -4.71 135.00 135.91 1wb9 s PRO 570 Ca 0.44 1.18 0.06 0.00 0.04 0.00 0.00 61.00 62.72 1wb9 s PRO 570 Cb -0.15 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 1wb9 s PRO 570 CO 0.07 -0.67 0.01 0.95 0.04 0.00 0.00 177.00 177.39 1wb9 s THR 571 N -2.42 3.85 -0.13 1.26 -4.23 -0.23 -5.01 115.64 108.73 1wb9 s THR 571 Ca 0.63 -1.27 -0.06 0.00 -1.18 0.00 0.00 61.69 59.81 1wb9 s THR 571 Cb -0.15 -2.91 -0.04 0.00 1.34 0.00 0.00 72.50 70.74 1wb9 s THR 571 CO 0.34 -0.04 0.07 -0.36 -0.54 0.00 0.00 174.62 174.09 1wb9 s PHE 572 N -1.60 3.36 0.36 3.99 0.08 -1.26 -0.43 117.98 122.49 1wb9 s PHE 572 Ca 0.27 0.29 0.09 0.00 0.12 0.00 0.00 56.93 57.70 1wb9 s PHE 572 Cb -0.10 -1.94 -0.06 0.00 -0.57 0.00 0.00 43.02 40.35 1wb9 s PHE 572 CO 0.19 0.48 0.02 0.96 -0.10 0.00 0.00 175.22 176.76 1wb9 s ILE 573 N -0.54 2.44 0.11 0.64 -4.36 -0.45 -4.87 121.20 114.17 1wb9 s ILE 573 Ca 0.11 -1.97 -0.02 0.00 -0.26 0.00 0.00 60.65 58.50 1wb9 s ILE 573 Cb -0.12 -2.83 -0.22 0.00 1.25 0.00 0.00 42.46 40.54 1wb9 s ILE 573 CO 0.02 -0.15 1.25 0.44 0.24 0.00 0.00 174.94 176.74 1wb9 h ASP 574 N 1.78 0.40 -2.24 4.36 3.32 -1.98 -3.37 116.42 118.69 1wb9 h ASP 574 Ca -0.43 -0.37 -0.54 0.00 0.02 0.00 0.00 57.03 55.71 1wb9 h ASP 574 Cb 1.25 -0.13 -0.08 0.00 0.22 0.00 0.00 39.33 40.60 1wb9 h ASP 574 CO 0.70 1.23 -0.60 -0.54 -1.72 0.00 0.00 179.24 178.30 1wb9 s LYS 575 N -2.95 2.54 0.39 3.56 -0.14 -1.26 -4.65 119.74 117.22 1wb9 s LYS 575 Ca -0.04 -1.26 -0.25 0.00 -1.36 0.00 0.00 55.97 53.05 1wb9 s LYS 575 Cb 0.08 -2.32 -0.11 0.00 -1.68 0.00 0.00 37.83 33.80 1wb9 s LYS 575 CO 0.86 0.38 1.02 -2.30 -0.76 0.00 0.00 175.35 174.56 1wb9 n PRO 576 N -0.95 1.39 0.00 -1.68 -0.02 -1.26 -4.06 135.00 128.42 1wb9 n PRO 576 Ca -0.07 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 1wb9 n PRO 576 Cb 0.58 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1wb9 n PRO 576 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wb9 n GLY 577 N 1.17 2.76 2.71 -1.23 0.00 -1.26 -4.10 105.19 105.24 1wb9 n GLY 577 Ca 0.09 -0.16 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 1wb9 n GLY 577 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wb9 s ILE 578 N -1.18 0.09 -0.28 -0.61 1.01 -0.52 -0.30 121.20 119.42 1wb9 s ILE 578 Ca 0.00 0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.95 1wb9 s ILE 578 Cb 0.00 -0.32 0.08 0.00 0.01 0.00 0.00 42.46 42.23 1wb9 s ILE 578 CO 0.00 0.20 0.02 -0.13 0.00 0.00 0.00 174.94 175.04 1wb9 s ARG 579 N 2.09 1.23 -0.11 2.79 0.52 -0.05 -0.89 118.95 124.52 1wb9 s ARG 579 Ca 0.05 -1.16 0.01 0.00 -0.52 0.00 0.00 55.73 54.11 1wb9 s ARG 579 Cb -0.12 -2.49 -0.02 0.00 0.52 0.00 0.00 34.95 32.84 1wb9 s ARG 579 CO -0.04 -0.80 -0.15 0.42 0.02 0.00 0.00 175.30 174.75 1wb9 s ILE 580 N 1.40 2.91 -0.19 1.52 1.01 -0.03 -1.04 121.20 126.77 1wb9 s ILE 580 Ca 0.03 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 59.93 1wb9 s ILE 580 Cb -0.18 -2.19 -0.01 0.00 0.01 0.00 0.00 42.46 40.09 1wb9 s ILE 580 CO -0.13 0.54 -0.07 -0.89 0.00 0.00 0.00 174.94 174.39 1wb9 s THR 581 N 0.11 3.26 -1.17 2.92 2.01 0.23 -1.39 115.64 121.60 1wb9 s THR 581 Ca -0.07 -0.55 -0.24 0.00 0.31 0.00 0.00 61.69 61.14 1wb9 s THR 581 Cb -0.15 -2.45 0.01 0.00 0.01 0.00 0.00 72.50 69.92 1wb9 s THR 581 CO 0.05 0.46 0.75 -0.62 -0.69 0.00 0.00 174.62 174.57 1wb9 n GLU 582 N 4.40 -1.01 -2.67 4.92 -0.58 -1.22 -0.67 120.64 123.80 1wb9 n GLU 582 Ca -0.18 0.35 -0.33 0.00 -0.42 0.00 0.00 57.16 56.57 1wb9 n GLU 582 Cb 0.51 -3.69 -0.06 0.00 -0.57 0.00 0.00 31.44 27.64 1wb9 n GLU 582 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1wb9 s GLY 583 N -3.52 2.32 0.16 0.62 0.00 -0.30 -3.36 107.32 103.25 1wb9 s GLY 583 Ca 0.47 0.37 0.03 0.00 0.00 0.00 0.00 44.72 45.59 1wb9 s GLY 583 CO 0.89 0.65 -0.05 0.50 0.00 0.00 0.00 173.10 175.09 1wb9 s ARG 584 N -3.42 1.10 -0.27 2.90 0.52 -0.39 -1.64 118.95 117.75 1wb9 s ARG 584 Ca 0.62 -1.50 -0.29 0.00 -0.52 0.00 0.00 55.73 54.04 1wb9 s ARG 584 Cb -0.10 -0.49 0.01 0.00 0.52 0.00 0.00 34.95 34.89 1wb9 s ARG 584 CO 0.19 -0.02 1.06 -1.58 0.02 0.00 0.00 175.30 174.97 1wb9 s HIS 585 N -3.46 3.25 0.37 -0.53 5.65 -1.26 -4.73 115.29 114.59 1wb9 s HIS 585 Ca 0.20 1.34 0.29 0.00 0.25 0.00 0.00 55.06 57.14 1wb9 s HIS 585 Cb 0.04 -3.47 1.45 0.00 -1.18 0.00 0.00 32.58 29.43 1wb9 s HIS 585 CO 0.02 -0.61 2.06 -1.00 -0.65 0.00 0.00 174.74 174.56 1wb9 h PRO 586 N 7.75 0.00 0.00 2.88 0.13 -1.94 -2.28 132.00 138.54 1wb9 h PRO 586 Ca -0.20 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.81 1wb9 h PRO 586 Cb 1.06 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 1wb9 h PRO 586 CO 1.00 0.11 -0.78 0.28 -0.23 0.00 0.00 178.00 178.39 1wb9 h VAL 587 N 0.00 0.85 -0.99 1.56 2.07 -1.93 -3.38 116.25 114.44 1wb9 h VAL 587 Ca -0.00 -1.90 0.03 0.00 0.82 0.00 0.00 66.70 65.64 1wb9 h VAL 587 Cb 0.37 1.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.96 1wb9 h VAL 587 CO 0.01 0.29 0.65 0.58 0.02 0.00 0.00 177.57 179.12 1wb9 h VAL 588 N -1.00 1.19 0.00 2.57 2.07 -1.96 -1.22 116.25 117.91 1wb9 h VAL 588 Ca -0.19 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1wb9 h VAL 588 Cb 1.00 -0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1wb9 h VAL 588 CO -0.12 0.23 -0.09 1.05 0.02 0.00 0.00 177.57 178.67 1wb9 h GLU 589 N 1.27 0.00 0.00 1.57 4.11 -1.63 -2.54 114.58 117.37 1wb9 h GLU 589 Ca 0.38 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.81 1wb9 h GLU 589 Cb -0.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 1wb9 h GLU 589 CO -0.11 0.09 -1.40 1.04 0.07 0.00 0.00 179.01 178.70 1wb9 n GLN 590 N -3.74 0.63 -0.12 1.06 1.13 -0.51 -4.67 117.38 111.15 1wb9 n GLN 590 Ca -0.02 -0.00 -0.19 0.00 -1.94 0.00 0.00 57.00 54.84 1wb9 n GLN 590 Cb 0.19 -1.71 -0.12 0.00 0.11 0.00 0.00 30.24 28.71 1wb9 n GLN 590 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 1wb9 n VAL 591 N -2.52 1.51 -2.62 5.09 0.24 -0.89 -4.91 118.33 114.24 1wb9 n VAL 591 Ca -0.02 -0.55 -0.40 0.00 -2.04 0.00 0.00 64.34 61.33 1wb9 n VAL 591 Cb 0.56 -1.48 -0.05 0.00 -1.47 0.00 0.00 33.84 31.39 1wb9 n VAL 591 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1wb9 s LEU 592 N -6.65 4.57 -0.03 1.34 1.43 -0.98 -4.96 118.68 113.39 1wb9 s LEU 592 Ca -0.35 2.09 0.17 0.00 -1.03 0.00 0.00 54.13 55.01 1wb9 s LEU 592 Cb 0.09 -3.66 0.54 0.00 0.03 0.00 0.00 46.19 43.20 1wb9 s LEU 592 CO 0.60 -0.01 1.44 0.59 0.23 0.00 0.00 176.35 179.19 1wb9 n ASN 593 N 1.25 3.43 -4.89 2.29 5.03 -1.26 -4.87 115.26 116.23 1wb9 n ASN 593 Ca -0.01 -2.13 -0.29 0.00 0.87 0.00 0.00 54.58 53.01 1wb9 n ASN 593 Cb 0.46 -0.44 -0.03 0.00 -1.02 0.00 0.00 39.78 38.75 1wb9 n ASN 593 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1wb9 s GLU 594 N -1.43 3.68 0.30 3.52 2.56 -1.26 -5.04 118.70 121.02 1wb9 s GLU 594 Ca 0.40 0.15 -0.29 0.00 0.00 0.00 0.00 54.97 55.22 1wb9 s GLU 594 Cb 0.23 -2.58 -0.10 0.00 2.00 0.00 0.00 34.13 33.68 1wb9 s GLU 594 CO 0.24 0.15 1.43 -2.14 -0.56 0.00 0.00 175.26 174.38 1wb9 s PRO 595 N -3.58 4.25 -0.09 4.30 0.02 -1.26 -4.98 135.00 133.66 1wb9 s PRO 595 Ca 0.46 2.35 -0.27 0.00 0.02 0.00 0.00 61.00 63.56 1wb9 s PRO 595 Cb -0.11 -3.07 -0.02 0.00 0.02 0.00 0.00 34.50 31.32 1wb9 s PRO 595 CO 0.30 -0.40 0.90 0.12 -0.33 0.00 0.00 177.00 177.59 1wb9 s PHE 596 N -0.49 3.54 -0.47 6.54 5.36 -1.26 -5.03 117.98 126.17 1wb9 s PHE 596 Ca 0.56 1.48 -0.22 0.00 -0.96 0.00 0.00 56.93 57.79 1wb9 s PHE 596 Cb -0.43 -3.06 0.03 0.00 -0.34 0.00 0.00 43.02 39.23 1wb9 s PHE 596 CO 0.49 -0.12 0.74 0.42 -1.46 0.00 0.00 175.22 175.29 1wb9 s ILE 597 N 1.57 4.71 0.64 3.12 -1.09 -1.26 -5.05 121.20 123.83 1wb9 s ILE 597 Ca 0.45 0.18 -0.17 0.00 -2.23 0.00 0.00 60.65 58.87 1wb9 s ILE 597 Cb -0.18 -4.31 -0.01 0.00 -1.58 0.00 0.00 42.46 36.38 1wb9 s ILE 597 CO 0.19 -0.74 1.21 0.00 -1.23 0.00 0.00 174.94 174.37 1wb9 s ALA 598 N 3.13 2.40 0.02 9.38 0.00 -1.26 -4.88 121.76 130.55 1wb9 s ALA 598 Ca 0.25 0.97 -0.00 0.00 0.00 0.00 0.00 51.96 53.18 1wb9 s ALA 598 Cb -0.14 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 1wb9 s ALA 598 CO 0.20 -1.42 -0.03 -0.80 0.00 0.00 0.00 175.76 173.71 1wb9 s ASN 599 N -1.76 0.26 0.61 0.00 0.01 -0.65 -4.83 114.94 108.57 1wb9 s ASN 599 Ca 0.77 -0.52 -0.10 0.00 -0.71 0.00 0.00 52.86 52.30 1wb9 s ASN 599 Cb -0.30 0.10 -0.03 0.00 0.41 0.00 0.00 41.25 41.43 1wb9 s ASN 599 CO 0.38 -0.31 1.00 -2.16 -1.51 0.00 0.00 177.10 174.50 1wb9 s PRO 600 N -1.55 3.45 -0.03 -0.60 0.04 -1.26 -1.15 135.00 133.90 1wb9 s PRO 600 Ca -0.15 0.60 -0.02 0.00 0.04 0.00 0.00 61.00 61.47 1wb9 s PRO 600 Cb -0.09 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.34 1wb9 s PRO 600 CO -0.01 -0.59 0.07 -1.17 0.04 0.00 0.00 177.00 175.33 1wb9 s LEU 601 N -5.14 1.50 -0.37 -3.56 2.96 -0.49 -4.96 118.68 108.62 1wb9 s LEU 601 Ca 0.54 0.14 0.01 0.00 -0.22 0.00 0.00 54.13 54.60 1wb9 s LEU 601 Cb -0.11 0.19 0.12 0.00 0.50 0.00 0.00 46.19 46.89 1wb9 s LEU 601 CO 0.52 -0.06 0.17 0.21 -1.32 0.00 0.00 176.35 175.87 1wb9 s ASN 602 N 0.37 3.83 -0.08 3.68 2.47 -1.26 -0.85 114.94 123.10 1wb9 s ASN 602 Ca -0.03 -2.16 0.03 0.00 0.42 0.00 0.00 52.86 51.12 1wb9 s ASN 602 Cb -0.04 -0.96 -0.02 0.00 -1.45 0.00 0.00 41.25 38.78 1wb9 s ASN 602 CO -0.01 -0.34 -0.16 -0.76 -3.72 0.00 0.00 177.10 172.11 1wb9 s LEU 603 N 0.96 2.61 0.31 3.21 1.43 -0.07 -4.91 118.68 122.23 1wb9 s LEU 603 Ca 0.14 -0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 52.88 1wb9 s LEU 603 Cb -0.21 -1.54 0.00 0.00 0.03 0.00 0.00 46.19 44.47 1wb9 s LEU 603 CO -0.11 0.27 0.48 -0.94 0.23 0.00 0.00 176.35 176.28 1wb9 s SER 604 N -0.26 0.48 0.59 2.29 1.04 -0.55 -1.44 113.70 115.84 1wb9 s SER 604 Ca 0.01 -1.28 0.38 0.00 0.48 0.00 0.00 55.95 55.55 1wb9 s SER 604 Cb -0.13 0.64 2.07 0.00 0.10 0.00 0.00 66.02 68.70 1wb9 s SER 604 CO 0.03 -1.26 2.17 -0.65 0.98 0.00 0.00 173.24 174.51 1wb9 h PRO 605 N 2.17 0.00 -0.00 4.02 0.11 -1.97 -1.85 132.00 134.48 1wb9 h PRO 605 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1wb9 h PRO 605 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1wb9 h PRO 605 CO 0.39 0.00 -0.70 1.04 -0.21 0.00 0.00 178.00 178.51 1wb9 n GLN 606 N -2.86 0.18 -3.04 1.05 3.00 -1.26 -4.57 117.38 109.88 1wb9 n GLN 606 Ca -0.03 -0.13 -0.18 0.00 -0.01 0.00 0.00 57.00 56.65 1wb9 n GLN 606 Cb 0.09 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 28.80 1wb9 n GLN 606 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 1wb9 n ARG 607 N -1.29 0.68 0.05 -1.09 0.63 -0.73 -3.68 116.66 111.23 1wb9 n ARG 607 Ca 0.06 -2.67 0.06 0.00 -0.92 0.00 0.00 57.85 54.38 1wb9 n ARG 607 Cb 0.35 -1.35 -0.06 0.00 0.45 0.00 0.00 32.46 31.85 1wb9 n ARG 607 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1wb9 n ARG 608 N 1.69 0.62 -3.97 -0.14 1.74 -0.17 -1.48 116.66 114.96 1wb9 n ARG 608 Ca 0.18 0.12 -0.16 0.00 -0.77 0.00 0.00 57.85 57.21 1wb9 n ARG 608 Cb 0.56 -1.77 -0.16 0.00 -1.02 0.00 0.00 32.46 30.07 1wb9 n ARG 608 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1wb9 s MET 609 N -3.17 0.31 -0.18 5.56 0.00 -0.87 -0.28 119.30 120.68 1wb9 s MET 609 Ca -0.03 0.02 -0.04 0.00 0.00 0.00 0.00 55.69 55.65 1wb9 s MET 609 Cb 0.10 -0.44 -0.02 0.00 0.00 0.00 0.00 34.83 34.46 1wb9 s MET 609 CO 0.81 -0.09 -0.03 -0.51 0.00 0.00 0.00 175.02 175.21 1wb9 s LEU 610 N 0.76 3.17 -0.29 4.11 1.43 -0.60 -1.62 118.68 125.63 1wb9 s LEU 610 Ca -0.08 -0.20 -0.22 0.00 -1.03 0.00 0.00 54.13 52.60 1wb9 s LEU 610 Cb -0.11 -1.78 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 1wb9 s LEU 610 CO -0.01 0.11 0.69 -0.63 0.23 0.00 0.00 176.35 176.74 1wb9 s ILE 611 N 0.73 4.89 -0.36 -0.59 -1.09 -0.13 -0.58 121.20 124.06 1wb9 s ILE 611 Ca -0.01 1.06 -0.07 0.00 -2.23 0.00 0.00 60.65 59.39 1wb9 s ILE 611 Cb -0.14 -4.04 0.05 0.00 -1.58 0.00 0.00 42.46 36.74 1wb9 s ILE 611 CO 0.02 -0.14 0.14 -0.63 -1.23 0.00 0.00 174.94 173.10 1wb9 s ILE 612 N 2.72 3.87 0.54 2.92 1.01 -0.03 -1.66 121.20 130.58 1wb9 s ILE 612 Ca 0.28 -1.22 0.08 0.00 0.00 0.00 0.00 60.65 59.79 1wb9 s ILE 612 Cb -0.15 -3.25 0.06 0.00 0.01 0.00 0.00 42.46 39.13 1wb9 s ILE 612 CO 0.11 -0.27 0.62 0.42 0.00 0.00 0.00 174.94 175.82 1wb9 s THR 613 N 1.40 2.07 0.00 2.92 -4.23 -0.89 -1.14 115.64 115.76 1wb9 s THR 613 Ca -0.00 -1.19 0.00 0.00 -1.18 0.00 0.00 61.69 59.32 1wb9 s THR 613 Cb -0.20 -2.26 0.00 0.00 1.34 0.00 0.00 72.50 71.38 1wb9 s THR 613 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 1wb9 n GLY 614 N -2.01 0.83 3.72 3.99 0.00 -1.26 -1.66 105.19 108.79 1wb9 n GLY 614 Ca 0.09 -2.14 -0.38 0.00 0.00 0.00 0.00 46.02 43.59 1wb9 n GLY 614 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wb9 n PRO 615 N 0.08 1.29 0.00 1.61 -0.04 -1.26 -4.89 135.00 131.79 1wb9 n PRO 615 Ca 0.00 0.49 0.00 0.00 -0.04 0.00 0.00 63.50 63.95 1wb9 n PRO 615 Cb 0.00 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 30.95 1wb9 n PRO 615 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1wb9 n ASN 616 N -1.48 0.00 -1.87 3.54 2.85 -1.26 -4.56 115.26 112.48 1wb9 n ASN 616 Ca 0.14 0.00 -0.19 0.00 -0.11 0.00 0.00 54.58 54.41 1wb9 n ASN 616 Cb 0.47 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 41.43 1wb9 n ASN 616 CO 0.00 0.00 0.00 0.23 -2.11 0.00 0.00 177.26 175.38 1wb9 n MET 617 N -1.07 -1.55 0.00 1.20 2.81 -1.26 -1.84 117.12 115.41 1wb9 n MET 617 Ca 0.00 1.08 0.00 0.00 -1.81 0.00 0.00 57.70 56.97 1wb9 n MET 617 Cb 0.00 -5.55 0.00 0.00 -0.71 0.00 0.00 33.22 26.96 1wb9 n MET 617 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1wb9 n GLY 618 N -0.59 2.88 0.14 3.03 0.00 -1.26 -4.92 105.19 104.47 1wb9 n GLY 618 Ca -0.21 -0.22 -0.09 0.00 0.00 0.00 0.00 46.02 45.51 1wb9 n GLY 618 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wb9 h GLY 619 N 0.00 0.44 0.88 -0.02 0.00 -1.70 0.53 103.07 103.19 1wb9 h GLY 619 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1wb9 h GLY 619 CO 0.00 0.17 0.06 0.50 0.00 0.00 0.00 176.54 177.27 1wb9 h LYS 620 N 0.40 0.25 -0.91 4.80 1.57 -1.80 -1.80 116.57 119.08 1wb9 h LYS 620 Ca 0.11 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1wb9 h LYS 620 Cb -0.02 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 1wb9 h LYS 620 CO -0.02 0.34 0.55 0.77 -0.57 0.00 0.00 179.45 180.52 1wb9 h SER 621 N 0.11 1.09 -0.22 0.86 0.02 -1.84 -1.53 113.55 112.04 1wb9 h SER 621 Ca 0.06 -0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 60.81 1wb9 h SER 621 Cb 0.18 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.45 1wb9 h SER 621 CO -0.00 0.83 -0.39 0.74 -1.14 0.00 0.00 176.83 176.87 1wb9 h THR 622 N 1.26 1.32 -0.63 -2.27 2.02 -0.83 0.79 112.91 114.56 1wb9 h THR 622 Ca 0.33 -1.61 0.00 0.00 0.77 0.00 0.00 66.41 65.90 1wb9 h THR 622 Cb -0.06 1.81 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 1wb9 h THR 622 CO -0.06 0.50 0.39 0.22 0.37 0.00 0.00 175.52 176.95 1wb9 h TYR 623 N 0.35 0.81 -0.02 3.16 3.20 -1.08 0.65 116.97 124.05 1wb9 h TYR 623 Ca 0.01 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.83 1wb9 h TYR 623 Cb 0.99 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.99 1wb9 h TYR 623 CO 0.09 0.53 -0.24 0.52 -1.64 0.00 0.00 178.16 177.42 1wb9 h MET 624 N 0.87 0.19 -0.21 1.82 2.86 -0.95 -3.08 114.93 116.43 1wb9 h MET 624 Ca 0.23 -0.19 -0.08 0.00 -2.06 0.00 0.00 59.70 57.60 1wb9 h MET 624 Cb -0.06 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1wb9 h MET 624 CO -0.05 0.89 -0.23 0.00 1.06 0.00 0.00 176.91 178.58 1wb9 h ARG 625 N -0.43 0.37 0.00 1.72 3.08 -0.66 -2.19 114.38 116.28 1wb9 h ARG 625 Ca -0.03 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 59.84 1wb9 h ARG 625 Cb 0.96 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1wb9 h ARG 625 CO 0.05 0.59 -0.28 -0.56 -1.07 0.00 0.00 179.97 178.69 1wb9 h GLN 626 N 0.34 0.00 -0.26 0.04 3.07 -0.94 -0.01 115.11 117.34 1wb9 h GLN 626 Ca 0.05 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.76 1wb9 h GLN 626 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.14 1wb9 h GLN 626 CO 0.04 0.28 0.04 1.15 0.09 0.00 0.00 178.83 180.43 1wb9 h THR 627 N 0.00 1.23 -0.44 1.86 2.02 -1.31 -1.06 112.91 115.21 1wb9 h THR 627 Ca -0.00 -0.80 -0.08 0.00 0.77 0.00 0.00 66.41 66.30 1wb9 h THR 627 Cb 0.54 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 1wb9 h THR 627 CO 0.04 0.25 -0.07 0.00 0.37 0.00 0.00 175.52 176.11 1wb9 h ALA 628 N 0.86 1.05 -0.11 6.16 0.00 -1.09 -2.10 119.26 124.03 1wb9 h ALA 628 Ca 0.08 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 1wb9 h ALA 628 Cb 0.34 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1wb9 h ALA 628 CO 0.01 0.58 -0.58 -0.07 0.00 0.00 0.00 179.25 179.19 1wb9 h LEU 629 N 0.70 0.38 -0.29 0.00 3.38 -0.86 0.61 115.31 119.23 1wb9 h LEU 629 Ca 0.13 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 1wb9 h LEU 629 Cb 0.53 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1wb9 h LEU 629 CO 0.03 0.87 -0.01 0.40 0.09 0.00 0.00 178.44 179.82 1wb9 h ILE 630 N 0.26 1.26 -0.25 1.22 2.04 -1.16 -0.21 117.51 120.66 1wb9 h ILE 630 Ca -0.00 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 64.90 1wb9 h ILE 630 Cb 1.09 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 1wb9 h ILE 630 CO 0.10 0.31 0.14 0.00 0.00 0.00 0.00 178.15 178.70 1wb9 h ALA 631 N 0.82 0.31 -0.57 1.87 0.00 -1.20 -0.65 119.26 119.84 1wb9 h ALA 631 Ca 0.08 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1wb9 h ALA 631 Cb 0.46 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1wb9 h ALA 631 CO 0.02 -0.25 0.34 1.25 0.00 0.00 0.00 179.25 180.61 1wb9 h LEU 632 N 0.30 0.54 -0.26 0.00 6.46 -0.79 -2.01 115.31 119.55 1wb9 h LEU 632 Ca 0.10 0.01 -0.14 0.00 -0.12 0.00 0.00 57.88 57.73 1wb9 h LEU 632 Cb 0.00 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 39.83 1wb9 h LEU 632 CO -0.05 0.37 -0.39 0.24 -0.62 0.00 0.00 178.44 177.99 1wb9 h MET 633 N 0.66 0.72 -0.88 1.25 2.86 -0.83 -2.11 114.93 116.60 1wb9 h MET 633 Ca 0.24 -0.43 0.10 0.00 -2.06 0.00 0.00 59.70 57.55 1wb9 h MET 633 Cb 0.06 0.04 -0.08 0.00 0.06 0.00 0.00 31.60 31.68 1wb9 h MET 633 CO -0.12 1.05 0.52 0.00 1.06 0.00 0.00 176.91 179.42 1wb9 h ALA 634 N 0.66 1.27 -0.21 6.32 0.00 -1.02 -1.83 119.26 124.46 1wb9 h ALA 634 Ca 0.02 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wb9 h ALA 634 Cb 0.98 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1wb9 h ALA 634 CO 0.09 0.14 0.00 0.66 0.00 0.00 0.00 179.25 180.14 1wb9 n TYR 635 N -4.71 0.49 0.29 0.00 4.02 -0.76 -2.30 117.16 114.19 1wb9 n TYR 635 Ca 0.15 -0.20 0.03 0.00 -0.01 0.00 0.00 57.90 57.88 1wb9 n TYR 635 Cb 0.30 -0.11 0.02 0.00 -0.02 0.00 0.00 39.34 39.52 1wb9 n TYR 635 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 176.86 176.29 1wb9 n ILE 636 N 0.20 0.00 -0.05 -0.72 -5.35 -0.73 -0.83 119.36 111.88 1wb9 n ILE 636 Ca 0.08 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 1wb9 n ILE 636 Cb 0.37 1.12 0.00 0.00 -1.74 0.00 0.00 39.64 39.39 1wb9 n ILE 636 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1wb9 n GLY 637 N 0.54 0.79 3.84 3.28 0.00 -0.97 -4.98 105.19 107.69 1wb9 n GLY 637 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1wb9 n GLY 637 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wb9 s SER 638 N -2.40 6.63 1.10 1.61 0.15 -0.94 -3.35 113.70 116.49 1wb9 s SER 638 Ca 0.00 1.56 -0.14 0.00 0.70 0.00 0.00 55.95 58.07 1wb9 s SER 638 Cb 0.00 -2.50 0.24 0.00 -1.71 0.00 0.00 66.02 62.04 1wb9 s SER 638 CO 0.00 -0.58 1.07 -0.31 1.20 0.00 0.00 173.24 174.63 1wb9 s TYR 639 N -2.61 1.55 0.08 3.44 1.51 -1.26 -4.25 117.35 115.81 1wb9 s TYR 639 Ca 0.59 0.90 0.04 0.00 -1.01 0.00 0.00 57.07 57.58 1wb9 s TYR 639 Cb -0.10 -3.25 -0.03 0.00 -0.11 0.00 0.00 41.96 38.47 1wb9 s TYR 639 CO 0.31 -3.40 -0.10 0.14 -1.11 0.00 0.00 175.55 171.39 1wb9 s VAL 640 N -2.85 0.90 -1.08 0.71 -7.23 0.15 -4.75 120.40 106.26 1wb9 s VAL 640 Ca 0.67 -1.50 -0.22 0.00 -1.81 0.00 0.00 61.98 59.12 1wb9 s VAL 640 Cb -0.18 -1.19 -0.01 0.00 0.56 0.00 0.00 36.38 35.55 1wb9 s VAL 640 CO 0.59 -0.48 1.78 -2.16 -0.31 0.00 0.00 175.10 174.52 1wb9 s PRO 641 N -2.43 3.06 0.04 4.82 0.04 -1.26 -0.86 135.00 138.41 1wb9 s PRO 641 Ca 0.02 -1.04 -0.28 0.00 0.04 0.00 0.00 61.00 59.74 1wb9 s PRO 641 Cb -0.05 -5.27 0.09 0.00 0.04 0.00 0.00 34.50 29.31 1wb9 s PRO 641 CO 0.00 -3.04 0.96 0.00 0.04 0.00 0.00 177.00 174.97 1wb9 s ALA 642 N 7.97 -1.81 -0.06 8.56 0.00 -1.26 -1.26 121.76 133.90 1wb9 s ALA 642 Ca 0.61 0.70 0.14 0.00 0.00 0.00 0.00 51.96 53.41 1wb9 s ALA 642 Cb -0.02 0.46 0.09 0.00 0.00 0.00 0.00 23.12 23.66 1wb9 s ALA 642 CO 0.02 -0.84 1.45 1.96 0.00 0.00 0.00 175.76 178.36 1wb9 h GLN 643 N 2.00 0.00 -1.72 0.00 1.08 -0.90 -3.34 115.11 112.23 1wb9 h GLN 643 Ca -0.23 0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.04 1wb9 h GLN 643 Cb 1.23 0.00 -0.25 0.00 -0.05 0.00 0.00 27.48 28.41 1wb9 h GLN 643 CO 0.28 0.58 0.27 0.21 -0.95 0.00 0.00 178.83 179.22 1wb9 s LYS 644 N -3.00 0.54 -0.04 1.46 2.20 -1.16 -4.94 119.74 114.79 1wb9 s LYS 644 Ca 0.03 0.84 0.00 0.00 -0.36 0.00 0.00 55.97 56.48 1wb9 s LYS 644 Cb 0.08 0.16 0.03 0.00 -1.51 0.00 0.00 37.83 36.59 1wb9 s LYS 644 CO 0.75 -0.10 0.00 0.08 -0.36 0.00 0.00 175.35 175.72 1wb9 s VAL 645 N 1.10 0.22 -0.10 4.02 1.01 -1.26 -0.60 120.40 124.80 1wb9 s VAL 645 Ca -0.06 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.04 1wb9 s VAL 645 Cb -0.04 -0.33 -0.01 0.00 0.00 0.00 0.00 36.38 35.99 1wb9 s VAL 645 CO -0.13 0.17 -0.16 -1.61 0.00 0.00 0.00 175.10 173.37 1wb9 s GLU 646 N 1.24 3.08 -0.07 2.72 2.02 -0.21 -1.07 118.70 126.41 1wb9 s GLU 646 Ca -0.07 -0.74 -0.05 0.00 0.02 0.00 0.00 54.97 54.13 1wb9 s GLU 646 Cb -0.13 -2.48 0.03 0.00 0.10 0.00 0.00 34.13 31.64 1wb9 s GLU 646 CO -0.02 0.30 0.18 -1.50 0.02 0.00 0.00 175.26 174.24 1wb9 s ILE 647 N 0.09 -0.02 0.62 -1.63 2.07 0.43 -0.87 121.20 121.89 1wb9 s ILE 647 Ca -0.07 0.08 -0.02 0.00 -1.41 0.00 0.00 60.65 59.22 1wb9 s ILE 647 Cb -0.15 -0.27 0.13 0.00 0.13 0.00 0.00 42.46 42.29 1wb9 s ILE 647 CO 0.05 0.03 0.85 0.61 -1.91 0.00 0.00 174.94 174.57 1wb9 n GLY 648 N 3.54 0.31 3.75 1.50 0.00 0.59 -1.34 105.19 113.55 1wb9 n GLY 648 Ca -0.19 -1.96 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 1wb9 n GLY 648 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wb9 s PRO 649 N -4.70 4.48 -0.07 1.61 0.04 -1.26 -4.74 135.00 130.37 1wb9 s PRO 649 Ca 0.54 1.96 0.04 0.00 0.04 0.00 0.00 61.00 63.59 1wb9 s PRO 649 Cb -0.03 -3.19 -0.00 0.00 0.04 0.00 0.00 34.50 31.32 1wb9 s PRO 649 CO 0.37 -0.07 -0.20 0.42 0.04 0.00 0.00 177.00 177.55 1wb9 s ILE 650 N -0.47 1.72 -0.13 0.56 1.01 -1.26 -4.64 121.20 117.99 1wb9 s ILE 650 Ca 0.51 -0.86 0.13 0.00 0.00 0.00 0.00 60.65 60.43 1wb9 s ILE 650 Cb -0.35 -1.49 -0.24 0.00 0.01 0.00 0.00 42.46 40.40 1wb9 s ILE 650 CO 0.41 0.49 0.33 -0.90 0.00 0.00 0.00 174.94 175.26 1wb9 n ASP 651 N 3.31 0.68 -3.65 3.58 5.75 -0.64 -4.75 116.55 120.82 1wb9 n ASP 651 Ca -0.19 0.19 -0.15 0.00 -0.01 0.00 0.00 54.79 54.62 1wb9 n ASP 651 Cb 0.52 0.29 -0.07 0.00 -1.03 0.00 0.00 41.12 40.83 1wb9 n ASP 651 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1wb9 s ARG 652 N -2.54 0.85 -0.11 0.11 0.52 -1.26 -0.86 118.95 115.66 1wb9 s ARG 652 Ca -0.10 -0.00 0.03 0.00 -0.52 0.00 0.00 55.73 55.13 1wb9 s ARG 652 Cb 0.07 0.39 0.01 0.00 0.52 0.00 0.00 34.95 35.94 1wb9 s ARG 652 CO 0.81 -0.25 -0.20 0.42 0.02 0.00 0.00 175.30 176.10 1wb9 s ILE 653 N -1.33 1.80 -0.12 1.52 1.01 -0.80 -2.07 121.20 121.22 1wb9 s ILE 653 Ca -0.12 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.70 1wb9 s ILE 653 Cb -0.03 -1.59 -0.01 0.00 0.01 0.00 0.00 42.46 40.84 1wb9 s ILE 653 CO 0.06 0.50 -0.17 -0.36 0.00 0.00 0.00 174.94 174.98 1wb9 s PHE 654 N 0.69 2.73 -0.42 3.97 0.08 0.03 -4.54 117.98 120.52 1wb9 s PHE 654 Ca -0.12 -0.78 0.02 0.00 0.12 0.00 0.00 56.93 56.17 1wb9 s PHE 654 Cb -0.16 -1.80 0.14 0.00 -0.57 0.00 0.00 43.02 40.63 1wb9 s PHE 654 CO 0.02 -0.28 0.25 0.99 -0.10 0.00 0.00 175.22 176.11 1wb9 s THR 655 N 0.35 0.97 -1.35 0.64 2.01 -1.26 -1.11 115.64 115.89 1wb9 s THR 655 Ca -0.14 -2.38 -0.10 0.00 0.31 0.00 0.00 61.69 59.38 1wb9 s THR 655 Cb -0.17 -1.69 0.12 0.00 0.01 0.00 0.00 72.50 70.77 1wb9 s THR 655 CO 0.07 -0.96 2.07 -1.14 -0.69 0.00 0.00 174.62 173.97 1wb9 n ARG 656 N 3.56 3.51 -3.95 4.92 3.00 -0.01 -4.44 116.66 123.24 1wb9 n ARG 656 Ca 0.12 -3.20 -0.16 0.00 -0.00 0.00 0.00 57.85 54.61 1wb9 n ARG 656 Cb 0.37 -2.99 -0.15 0.00 0.00 0.00 0.00 32.46 29.68 1wb9 n ARG 656 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1wb9 s VAL 657 N 1.09 0.17 0.00 5.15 1.01 -1.26 -1.73 120.40 124.83 1wb9 s VAL 657 Ca 0.44 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.44 1wb9 s VAL 657 Cb 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 36.38 36.28 1wb9 s VAL 657 CO -0.03 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.78 1wb9 n GLY 658 N 3.70 1.51 0.00 4.51 0.00 -1.26 -4.89 105.19 108.76 1wb9 n GLY 658 Ca -0.22 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1wb9 n GLY 658 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1wb9 n THR 669 N 0.00 0.00 -0.07 2.61 5.66 -1.26 -5.07 114.28 116.15 1wb9 n THR 669 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 1wb9 n THR 669 Cb 0.00 0.00 0.04 0.00 -1.55 0.00 0.00 70.33 68.82 1wb9 n THR 669 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 1wb9 h PHE 670 N 0.00 0.92 -0.76 1.09 3.57 -1.89 -3.02 116.94 116.87 1wb9 h PHE 670 Ca 0.00 -0.26 0.08 0.00 3.53 0.00 0.00 57.97 61.32 1wb9 h PHE 670 Cb 0.00 -0.20 -0.07 0.00 2.79 0.00 0.00 35.95 38.47 1wb9 h PHE 670 CO 0.00 1.03 0.42 0.52 -2.23 0.00 0.00 178.31 178.05 1wb9 h MET 671 N 0.64 0.70 -0.28 1.11 2.86 -1.97 -0.45 114.93 117.54 1wb9 h MET 671 Ca 0.06 -0.04 -0.18 0.00 -2.06 0.00 0.00 59.70 57.47 1wb9 h MET 671 Cb 0.92 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.42 1wb9 h MET 671 CO 0.08 0.46 -0.54 0.28 1.06 0.00 0.00 176.91 178.26 1wb9 h VAL 672 N 0.72 1.28 -0.74 -2.22 2.07 -1.99 0.81 116.25 116.19 1wb9 h VAL 672 Ca 0.36 -1.73 -0.02 0.00 0.82 0.00 0.00 66.70 66.13 1wb9 h VAL 672 Cb 0.31 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1wb9 h VAL 672 CO -0.23 0.56 0.39 -0.33 0.02 0.00 0.00 177.57 177.98 1wb9 h GLU 673 N 0.64 1.04 -0.12 1.57 5.08 -1.36 -1.98 114.58 119.46 1wb9 h GLU 673 Ca 0.01 -0.13 -0.16 0.00 -1.00 0.00 0.00 59.36 58.08 1wb9 h GLU 673 Cb 1.15 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 1wb9 h GLU 673 CO 0.12 0.79 -0.61 0.52 -1.00 0.00 0.00 179.01 178.83 1wb9 h MET 674 N 1.03 0.41 0.02 2.33 2.86 -0.82 -0.49 114.93 120.27 1wb9 h MET 674 Ca 0.26 -0.28 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1wb9 h MET 674 Cb 0.07 0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1wb9 h MET 674 CO -0.04 0.89 -0.01 1.15 1.06 0.00 0.00 176.91 179.97 1wb9 h THR 675 N 0.31 1.10 -0.53 2.22 2.02 -0.77 0.11 112.91 117.37 1wb9 h THR 675 Ca -0.01 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.79 1wb9 h THR 675 Cb 1.14 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.87 1wb9 h THR 675 CO 0.11 0.09 0.21 -0.33 0.37 0.00 0.00 175.52 175.97 1wb9 h GLU 676 N -0.18 0.75 -0.37 6.66 5.08 -1.30 -1.39 114.58 123.83 1wb9 h GLU 676 Ca -0.00 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.16 1wb9 h GLU 676 Cb 0.17 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1wb9 h GLU 676 CO 0.00 0.62 -0.11 1.15 -1.00 0.00 0.00 179.01 179.68 1wb9 h THR 677 N 0.75 1.28 -0.51 1.13 2.02 -0.82 -2.33 112.91 114.42 1wb9 h THR 677 Ca 0.18 -1.19 0.09 0.00 0.77 0.00 0.00 66.41 66.26 1wb9 h THR 677 Cb 0.15 1.28 -0.07 0.00 -1.74 0.00 0.00 68.15 67.76 1wb9 h THR 677 CO -0.02 0.40 0.08 0.00 0.37 0.00 0.00 175.52 176.35 1wb9 h ALA 678 N 0.82 0.55 -0.86 6.16 0.00 -0.44 -1.68 119.26 123.80 1wb9 h ALA 678 Ca 0.09 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1wb9 h ALA 678 Cb 0.63 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 1wb9 h ALA 678 CO 0.04 -0.33 0.56 -0.97 0.00 0.00 0.00 179.25 178.56 1wb9 h ASN 679 N 0.21 0.95 -0.38 0.00 -1.24 -1.04 -0.77 115.58 113.31 1wb9 h ASN 679 Ca 0.26 -0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.24 1wb9 h ASN 679 Cb 0.36 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.17 1wb9 h ASN 679 CO -0.35 0.67 0.20 0.40 -1.29 0.00 0.00 177.43 177.06 1wb9 h ILE 680 N 1.12 1.15 -0.21 2.57 2.04 -0.95 -2.54 117.51 120.70 1wb9 h ILE 680 Ca 0.33 -0.40 -0.13 0.00 1.00 0.00 0.00 64.86 65.67 1wb9 h ILE 680 Cb -0.04 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1wb9 h ILE 680 CO -0.10 0.16 -0.41 -0.07 0.00 0.00 0.00 178.15 177.73 1wb9 h LEU 681 N 0.48 0.51 -0.87 1.44 3.38 -0.89 -0.58 115.31 118.78 1wb9 h LEU 681 Ca 0.13 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1wb9 h LEU 681 Cb 0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1wb9 h LEU 681 CO -0.02 0.86 -0.44 0.45 0.09 0.00 0.00 178.44 179.38 1wb9 h HIS 682 N 0.40 0.00 0.00 1.13 3.86 -1.14 -3.39 115.15 116.01 1wb9 h HIS 682 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1wb9 h HIS 682 Cb 0.89 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.36 1wb9 h HIS 682 CO 0.03 0.44 -0.47 0.09 0.86 0.00 0.00 177.93 178.88 1wb9 n ASN 683 N -3.59 2.35 -4.79 2.45 3.02 -0.96 -5.04 115.26 108.69 1wb9 n ASN 683 Ca -0.00 -0.22 -0.34 0.00 -0.03 0.00 0.00 54.58 53.99 1wb9 n ASN 683 Cb 0.54 0.91 -0.00 0.00 -0.61 0.00 0.00 39.78 40.61 1wb9 n ASN 683 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wb9 s ALA 684 N -1.37 2.75 0.44 5.41 0.00 -0.23 -5.06 121.76 123.69 1wb9 s ALA 684 Ca 0.00 0.59 0.03 0.00 0.00 0.00 0.00 51.96 52.58 1wb9 s ALA 684 Cb 0.00 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 1wb9 s ALA 684 CO 0.00 -0.66 0.11 0.95 0.00 0.00 0.00 175.76 176.16 1wb9 s THR 685 N -2.10 0.66 -0.45 0.00 -4.23 -1.26 -4.97 115.64 103.28 1wb9 s THR 685 Ca 0.67 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 59.39 1wb9 s THR 685 Cb -0.18 -2.25 0.20 0.00 1.34 0.00 0.00 72.50 71.61 1wb9 s THR 685 CO 0.29 0.00 1.61 -1.84 -0.54 0.00 0.00 174.62 174.14 1wb9 n GLU 686 N -1.02 0.14 -0.22 3.99 0.28 -1.08 -1.22 120.64 121.51 1wb9 n GLU 686 Ca -0.09 0.50 0.11 0.00 -0.16 0.00 0.00 57.16 57.51 1wb9 n GLU 686 Cb 0.65 -1.85 0.27 0.00 1.43 0.00 0.00 31.44 31.94 1wb9 n GLU 686 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1wb9 n TYR 687 N -2.13 0.58 -3.47 -1.84 4.01 -1.26 -4.44 117.16 108.61 1wb9 n TYR 687 Ca 0.01 -0.29 -0.32 0.00 -0.16 0.00 0.00 57.90 57.14 1wb9 n TYR 687 Cb 0.13 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.11 1wb9 n TYR 687 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1wb9 s SER 688 N -1.28 6.60 -0.24 7.72 0.01 -0.36 -1.63 113.70 124.54 1wb9 s SER 688 Ca 0.38 0.85 -0.07 0.00 1.31 0.00 0.00 55.95 58.42 1wb9 s SER 688 Cb 0.21 -2.20 -0.03 0.00 0.21 0.00 0.00 66.02 64.21 1wb9 s SER 688 CO 0.29 -0.04 0.06 -0.22 0.41 0.00 0.00 173.24 173.74 1wb9 s LEU 689 N -2.74 3.44 -0.14 2.44 2.96 -0.88 -1.62 118.68 122.14 1wb9 s LEU 689 Ca 0.46 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 54.20 1wb9 s LEU 689 Cb -0.12 -1.91 0.01 0.00 0.50 0.00 0.00 46.19 44.68 1wb9 s LEU 689 CO 0.22 -0.01 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.34 1wb9 s VAL 690 N 1.44 1.99 -0.23 1.68 1.01 -0.31 -0.79 120.40 125.18 1wb9 s VAL 690 Ca 0.05 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.10 1wb9 s VAL 690 Cb -0.15 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.49 1wb9 s VAL 690 CO 0.03 0.53 -0.10 -0.76 0.00 0.00 0.00 175.10 174.81 1wb9 s LEU 691 N 0.93 2.97 -0.05 3.92 1.43 -0.27 -1.21 118.68 126.40 1wb9 s LEU 691 Ca -0.05 -0.87 0.06 0.00 -1.03 0.00 0.00 54.13 52.25 1wb9 s LEU 691 Cb -0.15 -1.61 -0.01 0.00 0.03 0.00 0.00 46.19 44.45 1wb9 s LEU 691 CO -0.04 -0.10 -0.24 -0.04 0.23 0.00 0.00 176.35 176.16 1wb9 s MET 692 N 1.29 2.41 -0.65 1.70 -1.94 -0.55 -0.83 119.30 120.73 1wb9 s MET 692 Ca 0.00 -0.86 -0.01 0.00 -1.71 0.00 0.00 55.69 53.11 1wb9 s MET 692 Cb -0.16 -2.06 0.16 0.00 2.01 0.00 0.00 34.83 34.78 1wb9 s MET 692 CO -0.06 0.37 0.46 0.34 -0.01 0.00 0.00 175.02 176.12 1wb9 s ASP 693 N -0.17 5.13 -1.28 3.03 2.15 -0.70 -0.73 116.67 124.10 1wb9 s ASP 693 Ca -0.03 -3.07 -0.01 0.00 0.43 0.00 0.00 52.55 49.88 1wb9 s ASP 693 Cb -0.13 -1.81 -0.00 0.00 -0.30 0.00 0.00 42.92 40.68 1wb9 s ASP 693 CO 0.03 -0.30 0.75 -0.62 -0.17 0.00 0.00 175.17 174.86 1wb9 n GLU 694 N 3.16 -5.03 -2.12 4.34 1.02 0.38 -4.94 120.64 117.45 1wb9 n GLU 694 Ca 0.10 0.66 -0.36 0.00 -0.02 0.00 0.00 57.16 57.54 1wb9 n GLU 694 Cb 0.36 -5.27 0.02 0.00 -0.02 0.00 0.00 31.44 26.53 1wb9 n GLU 694 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1wb9 s ILE 695 N -3.62 2.86 0.00 -3.67 -4.36 -1.26 -3.46 121.20 107.70 1wb9 s ILE 695 Ca 0.02 0.54 0.00 0.00 -0.26 0.00 0.00 60.65 60.95 1wb9 s ILE 695 Cb -0.00 -3.22 0.00 0.00 1.25 0.00 0.00 42.46 40.49 1wb9 s ILE 695 CO 0.80 -0.12 0.00 0.61 0.24 0.00 0.00 174.94 176.47 1wb9 n GLY 696 N 0.35 2.13 3.78 6.27 0.00 -1.26 -4.65 105.19 111.81 1wb9 n GLY 696 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1wb9 n GLY 696 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wb9 s ARG 697 N -0.21 4.17 0.00 1.61 0.52 -1.22 -3.00 118.95 120.82 1wb9 s ARG 697 Ca 0.00 2.48 0.00 0.00 -0.52 0.00 0.00 55.73 57.69 1wb9 s ARG 697 Cb 0.00 -3.00 0.00 0.00 0.52 0.00 0.00 34.95 32.47 1wb9 s ARG 697 CO 0.00 -0.44 0.00 0.41 0.02 0.00 0.00 175.30 175.29 1wb9 n GLY 698 N 0.59 0.32 1.60 -3.53 0.00 -1.26 -4.84 105.19 98.06 1wb9 n GLY 698 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1wb9 n GLY 698 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1wb9 n THR 699 N -1.74 0.00 -0.73 2.61 5.66 -1.16 -4.86 114.28 114.06 1wb9 n THR 699 Ca 0.00 -1.16 -0.31 0.00 -3.05 0.00 0.00 64.05 59.53 1wb9 n THR 699 Cb 0.00 0.47 0.17 0.00 -1.55 0.00 0.00 70.33 69.41 1wb9 n THR 699 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1wb9 s SER 700 N -2.18 2.91 0.11 1.09 1.04 -1.26 -4.69 113.70 110.72 1wb9 s SER 700 Ca 0.13 2.13 -0.24 0.00 0.48 0.00 0.00 55.95 58.44 1wb9 s SER 700 Cb 0.01 -2.55 -0.09 0.00 0.10 0.00 0.00 66.02 63.49 1wb9 s SER 700 CO 0.09 -3.10 1.68 0.74 0.98 0.00 0.00 173.24 173.64 1wb9 h THR 701 N -1.87 0.68 -0.10 2.02 2.02 -1.99 -0.23 112.91 113.45 1wb9 h THR 701 Ca -0.44 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 66.57 1wb9 h THR 701 Cb 1.27 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 1wb9 h THR 701 CO 0.43 0.00 -0.66 1.88 0.37 0.00 0.00 175.52 177.54 1wb9 h TYR 702 N -0.25 0.52 -0.09 3.16 0.05 -1.98 -0.77 116.97 117.61 1wb9 h TYR 702 Ca 0.03 -0.21 -0.02 0.00 0.05 0.00 0.00 58.73 58.57 1wb9 h TYR 702 Cb 0.28 -0.09 -0.00 0.00 1.01 0.00 0.00 36.73 37.93 1wb9 h TYR 702 CO -0.17 0.94 -0.04 -0.44 -1.05 0.00 0.00 178.16 177.41 1wb9 h ASP 703 N 0.29 0.19 -0.37 3.88 3.32 -1.91 -1.99 116.42 119.83 1wb9 h ASP 703 Ca -0.02 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.63 1wb9 h ASP 703 Cb 1.21 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 1wb9 h ASP 703 CO 0.11 0.55 0.21 1.23 -1.72 0.00 0.00 179.24 179.62 1wb9 h GLY 704 N -0.17 0.54 1.22 2.75 0.00 -0.97 0.17 103.07 106.61 1wb9 h GLY 704 Ca 0.02 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 1wb9 h GLY 704 CO 0.01 0.23 0.47 -2.00 0.00 0.00 0.00 176.54 175.25 1wb9 h LEU 705 N 0.47 0.91 -0.08 3.11 5.85 -1.21 -0.07 115.31 124.30 1wb9 h LEU 705 Ca 0.13 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1wb9 h LEU 705 Cb 0.04 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.84 1wb9 h LEU 705 CO -0.02 0.70 -0.05 0.28 -0.34 0.00 0.00 178.44 179.00 1wb9 h SER 706 N 1.06 0.18 -0.59 1.25 0.02 -0.89 -0.47 113.55 114.10 1wb9 h SER 706 Ca 0.28 -0.45 0.03 0.00 -0.84 0.00 0.00 61.79 60.80 1wb9 h SER 706 Cb -0.05 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.40 1wb9 h SER 706 CO -0.05 0.59 0.36 -0.07 -1.14 0.00 0.00 176.83 176.52 1wb9 h LEU 707 N -0.23 0.59 -0.60 5.07 3.38 -0.88 -1.19 115.31 121.43 1wb9 h LEU 707 Ca 0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1wb9 h LEU 707 Cb 0.53 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1wb9 h LEU 707 CO 0.01 0.41 0.04 0.00 0.09 0.00 0.00 178.44 178.99 1wb9 h ALA 708 N 1.26 0.81 -0.30 1.53 0.00 -0.85 0.37 119.26 122.09 1wb9 h ALA 708 Ca 0.24 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1wb9 h ALA 708 Cb 0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1wb9 h ALA 708 CO -0.10 0.62 0.07 2.35 0.00 0.00 0.00 179.25 182.19 1wb9 h TRP 709 N 0.94 0.51 -0.68 0.00 2.91 -0.98 -0.27 115.95 118.38 1wb9 h TRP 709 Ca 0.18 -0.06 -0.01 0.00 1.13 0.00 0.00 58.89 60.12 1wb9 h TRP 709 Cb 0.51 -0.14 -0.03 0.00 -0.51 0.00 0.00 29.16 28.98 1wb9 h TRP 709 CO 0.04 0.54 0.37 0.00 -1.03 0.00 0.00 178.44 178.36 1wb9 h ALA 710 N 0.90 0.87 -0.37 2.65 0.00 -1.01 -1.85 119.26 120.45 1wb9 h ALA 710 Ca 0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1wb9 h ALA 710 Cb 0.29 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1wb9 h ALA 710 CO 0.00 0.39 0.11 0.00 0.00 0.00 0.00 179.25 179.75 1wb9 h ALA 712 N 0.95 -0.09 -0.67 0.00 0.00 -0.97 -0.37 119.26 118.11 1wb9 h ALA 712 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1wb9 h ALA 712 Cb 0.27 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 1wb9 h ALA 712 CO -0.00 -0.58 0.40 0.93 0.00 0.00 0.00 179.25 180.00 1wb9 h GLU 713 N -0.14 0.73 -0.34 0.00 5.08 -1.26 -0.07 114.58 118.58 1wb9 h GLU 713 Ca 0.03 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 1wb9 h GLU 713 Cb 0.17 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1wb9 h GLU 713 CO -0.07 0.48 0.06 -0.97 -1.00 0.00 0.00 179.01 177.51 1wb9 h ASN 714 N 0.75 0.54 -0.66 1.42 -0.73 -0.99 0.14 115.58 116.06 1wb9 h ASN 714 Ca 0.29 -0.25 -0.04 0.00 1.87 0.00 0.00 56.30 58.16 1wb9 h ASN 714 Cb 0.11 -0.14 -0.03 0.00 0.27 0.00 0.00 38.32 38.53 1wb9 h ASN 714 CO -0.15 0.66 0.26 -0.07 -0.37 0.00 0.00 177.43 177.76 1wb9 h LEU 715 N 0.40 0.93 0.01 0.34 3.38 -0.86 -0.08 115.31 119.44 1wb9 h LEU 715 Ca 0.10 -0.14 -0.23 0.00 0.09 0.00 0.00 57.88 57.71 1wb9 h LEU 715 Cb 0.34 -0.24 0.02 0.00 0.09 0.00 0.00 40.66 40.87 1wb9 h LEU 715 CO 0.01 0.83 -0.91 0.00 0.09 0.00 0.00 178.44 178.46 1wb9 h ALA 716 N 1.30 0.09 0.00 1.53 0.00 -0.77 0.15 119.26 121.56 1wb9 h ALA 716 Ca 0.23 -0.66 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 1wb9 h ALA 716 Cb 0.20 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1wb9 h ALA 716 CO -0.02 0.56 -1.52 0.09 0.00 0.00 0.00 179.25 178.36 1wb9 n ASN 717 N -3.98 2.59 -0.04 0.00 3.02 0.47 -4.18 115.26 113.13 1wb9 n ASN 717 Ca -0.11 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.38 1wb9 n ASN 717 Cb 0.82 1.31 -0.02 0.00 -0.61 0.00 0.00 39.78 41.28 1wb9 n ASN 717 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1wb9 n LYS 718 N -1.98 0.35 -0.09 3.52 4.81 -0.37 -4.72 118.16 119.69 1wb9 n LYS 718 Ca -0.05 0.14 -0.14 0.00 -0.87 0.00 0.00 58.31 57.39 1wb9 n LYS 718 Cb 0.40 -1.12 -0.04 0.00 0.02 0.00 0.00 35.03 34.29 1wb9 n LYS 718 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1wb9 h ILE 719 N -0.67 1.30 -4.13 3.15 2.04 -1.22 -3.48 117.51 114.50 1wb9 h ILE 719 Ca 0.00 -1.59 -0.40 0.00 1.00 0.00 0.00 64.86 63.88 1wb9 h ILE 719 Cb 0.67 1.63 0.02 0.00 -0.74 0.00 0.00 36.82 38.40 1wb9 h ILE 719 CO 0.00 0.51 -0.57 0.29 0.00 0.00 0.00 178.15 178.38 1wb9 n LYS 720 N -4.16 -3.76 -0.71 2.37 5.02 0.02 -2.63 118.16 114.31 1wb9 n LYS 720 Ca -0.04 0.89 -0.30 0.00 -2.02 0.00 0.00 58.31 56.83 1wb9 n LYS 720 Cb 0.54 -5.67 0.18 0.00 -0.02 0.00 0.00 35.03 30.06 1wb9 n LYS 720 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wb9 s ALA 721 N -3.09 1.07 -0.24 7.82 0.00 -1.12 -4.47 121.76 121.73 1wb9 s ALA 721 Ca 0.21 0.39 -0.26 0.00 0.00 0.00 0.00 51.96 52.31 1wb9 s ALA 721 Cb -0.10 -3.39 -0.00 0.00 0.00 0.00 0.00 23.12 19.63 1wb9 s ALA 721 CO 0.26 -2.95 0.89 -0.51 0.00 0.00 0.00 175.76 173.45 1wb9 s LEU 722 N -6.70 4.09 -0.05 0.00 1.43 -0.64 -4.68 118.68 112.13 1wb9 s LEU 722 Ca 0.67 1.14 0.01 0.00 -1.03 0.00 0.00 54.13 54.91 1wb9 s LEU 722 Cb -0.23 -3.29 0.02 0.00 0.03 0.00 0.00 46.19 42.72 1wb9 s LEU 722 CO 0.59 -0.56 -0.05 -0.89 0.23 0.00 0.00 176.35 175.68 1wb9 s THR 723 N 2.93 0.57 -0.29 5.49 2.01 0.61 -1.16 115.64 125.79 1wb9 s THR 723 Ca 0.38 -0.14 -0.10 0.00 0.31 0.00 0.00 61.69 62.14 1wb9 s THR 723 Cb -0.15 -0.59 -0.02 0.00 0.01 0.00 0.00 72.50 71.75 1wb9 s THR 723 CO 0.07 0.23 0.15 -0.76 -0.69 0.00 0.00 174.62 173.62 1wb9 s LEU 724 N 0.92 3.96 -0.52 4.42 1.43 -0.35 -1.56 118.68 126.97 1wb9 s LEU 724 Ca -0.11 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 1wb9 s LEU 724 Cb -0.14 -2.02 0.13 0.00 0.03 0.00 0.00 46.19 44.19 1wb9 s LEU 724 CO 0.00 -0.13 0.28 0.12 0.23 0.00 0.00 176.35 176.86 1wb9 s PHE 725 N 1.66 3.36 0.07 0.29 5.36 0.25 -1.48 117.98 127.50 1wb9 s PHE 725 Ca 0.06 -2.96 -0.30 0.00 -0.96 0.00 0.00 56.93 52.77 1wb9 s PHE 725 Cb -0.16 -2.98 -0.06 0.00 -0.34 0.00 0.00 43.02 39.48 1wb9 s PHE 725 CO 0.07 -0.82 1.16 0.00 -1.46 0.00 0.00 175.22 174.17 1wb9 s ALA 726 N 0.05 3.36 0.04 11.12 0.00 0.09 -0.85 121.76 135.56 1wb9 s ALA 726 Ca 0.15 0.81 -0.06 0.00 0.00 0.00 0.00 51.96 52.86 1wb9 s ALA 726 Cb -0.23 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.46 1wb9 s ALA 726 CO -0.02 -0.37 0.11 -0.08 0.00 0.00 0.00 175.76 175.39 1wb9 s THR 727 N 0.83 0.13 -0.28 0.00 -1.32 -0.29 -0.47 115.64 114.23 1wb9 s THR 727 Ca 0.56 -1.06 0.23 0.00 -1.21 0.00 0.00 61.69 60.21 1wb9 s THR 727 Cb -0.29 -0.88 0.01 0.00 -1.51 0.00 0.00 72.50 69.83 1wb9 s THR 727 CO 0.30 -0.58 1.07 1.12 -2.21 0.00 0.00 174.62 174.32 1wb9 h HIS 728 N 3.66 0.00 -2.72 9.09 2.07 -1.90 -3.37 115.15 121.98 1wb9 h HIS 728 Ca -0.32 0.00 -0.57 0.00 -2.85 0.00 0.00 60.37 56.63 1wb9 h HIS 728 Cb 1.19 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.13 1wb9 h HIS 728 CO 0.54 0.00 1.24 0.71 -3.07 0.00 0.00 177.93 177.35 1wb9 s TYR 729 N -3.34 1.91 0.47 6.12 2.02 -1.26 -4.86 117.35 118.41 1wb9 s TYR 729 Ca 0.00 0.64 0.12 0.00 -0.37 0.00 0.00 57.07 57.47 1wb9 s TYR 729 Cb 0.10 -4.16 1.09 0.00 -0.40 0.00 0.00 41.96 38.58 1wb9 s TYR 729 CO 0.78 -2.71 2.10 0.35 -1.57 0.00 0.00 175.55 174.50 1wb9 h PHE 730 N 12.63 0.24 -0.08 2.71 3.57 -1.98 -2.24 116.94 131.79 1wb9 h PHE 730 Ca -0.32 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.21 1wb9 h PHE 730 Cb 1.16 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.81 1wb9 h PHE 730 CO 0.97 0.15 0.07 0.93 -2.23 0.00 0.00 178.31 178.20 1wb9 h GLU 731 N 0.26 0.00 0.00 1.11 3.07 -2.00 -0.99 114.58 116.04 1wb9 h GLU 731 Ca 0.09 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 1wb9 h GLU 731 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1wb9 h GLU 731 CO -0.02 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.87 1wb9 n LEU 732 N -4.11 0.72 0.00 1.33 4.32 -0.84 -2.68 117.00 115.73 1wb9 n LEU 732 Ca -0.01 0.65 0.08 0.00 -0.02 0.00 0.00 56.01 56.71 1wb9 n LEU 732 Cb 0.18 -0.53 0.39 0.00 -1.62 0.00 0.00 43.42 41.84 1wb9 n LEU 732 CO 0.30 -0.50 0.76 0.35 -1.22 0.00 0.00 177.39 177.08 1wb9 n THR 733 N -2.26 0.71 0.49 -5.08 -2.24 -0.37 -2.12 114.28 103.40 1wb9 n THR 733 Ca 0.03 0.18 0.13 0.00 -2.27 0.00 0.00 64.05 62.11 1wb9 n THR 733 Cb 0.27 -0.89 0.32 0.00 -2.10 0.00 0.00 70.33 67.93 1wb9 n THR 733 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1wb9 h GLN 734 N 0.00 0.00 -0.73 -0.78 1.08 -1.70 -3.37 115.11 109.61 1wb9 h GLN 734 Ca 0.00 0.00 0.16 0.00 -1.45 0.00 0.00 58.65 57.36 1wb9 h GLN 734 Cb 0.23 0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 27.54 1wb9 h GLN 734 CO 0.00 0.00 0.06 1.25 -0.95 0.00 0.00 178.83 179.19 1wb9 h LEU 735 N 0.00 -0.22 -1.81 1.46 5.85 -1.65 -1.04 115.31 117.90 1wb9 h LEU 735 Ca 0.00 0.17 0.20 0.00 0.84 0.00 0.00 57.88 59.09 1wb9 h LEU 735 Cb 0.83 0.29 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 1wb9 h LEU 735 CO 0.00 -0.13 0.53 -0.65 -0.34 0.00 0.00 178.44 177.86 1wb9 h PRO 736 N 0.15 0.16 0.00 5.25 0.11 -1.76 -0.54 132.00 135.37 1wb9 h PRO 736 Ca 0.40 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.40 1wb9 h PRO 736 Cb 0.70 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.76 1wb9 h PRO 736 CO -0.60 0.11 -0.50 0.93 -0.21 0.00 0.00 178.00 177.73 1wb9 h GLU 737 N 0.16 0.00 -0.00 1.05 4.39 -1.47 -3.27 114.58 115.45 1wb9 h GLU 737 Ca 0.38 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.08 1wb9 h GLU 737 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1wb9 h GLU 737 CO -0.06 0.50 -0.85 1.63 -1.16 0.00 0.00 179.01 179.06 1wb9 n LYS 738 N -3.74 0.19 -3.60 2.33 5.02 -0.33 -4.99 118.16 113.04 1wb9 n LYS 738 Ca -0.01 -0.15 -0.16 0.00 -2.02 0.00 0.00 58.31 55.97 1wb9 n LYS 738 Cb 0.55 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.99 1wb9 n LYS 738 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wb9 s MET 739 N -2.92 0.90 0.51 1.97 0.23 -0.52 -5.10 119.30 114.38 1wb9 s MET 739 Ca 0.10 0.33 -0.19 0.00 -1.03 0.00 0.00 55.69 54.90 1wb9 s MET 739 Cb 0.17 0.43 -0.08 0.00 -1.53 0.00 0.00 34.83 33.82 1wb9 s MET 739 CO 0.80 -0.24 1.03 -2.00 -2.03 0.00 0.00 175.02 172.58 1wb9 s GLU 740 N -0.84 3.75 0.00 3.16 -6.30 -1.26 -3.82 118.70 113.39 1wb9 s GLU 740 Ca -0.09 1.25 0.00 0.00 -2.50 0.00 0.00 54.97 53.64 1wb9 s GLU 740 Cb -0.02 -2.09 0.00 0.00 0.00 0.00 0.00 34.13 32.02 1wb9 s GLU 740 CO 0.07 -0.46 0.00 0.41 0.02 0.00 0.00 175.26 175.30 1wb9 n GLY 741 N -0.61 0.58 3.15 -1.50 0.00 -1.24 -4.95 105.19 100.63 1wb9 n GLY 741 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1wb9 n GLY 741 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wb9 s VAL 742 N -2.29 1.73 0.16 1.61 1.01 -1.25 -1.00 120.40 120.38 1wb9 s VAL 742 Ca 0.00 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.21 1wb9 s VAL 742 Cb 0.00 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 1wb9 s VAL 742 CO 0.00 0.49 -0.13 0.00 0.00 0.00 0.00 175.10 175.46 1wb9 s ALA 743 N 0.45 1.70 -0.09 5.51 0.00 -0.64 -4.35 121.76 124.34 1wb9 s ALA 743 Ca -0.17 -1.50 -0.14 0.00 0.00 0.00 0.00 51.96 50.14 1wb9 s ALA 743 Cb -0.17 -0.05 -0.05 0.00 0.00 0.00 0.00 23.12 22.85 1wb9 s ALA 743 CO 0.07 0.04 0.36 -0.80 0.00 0.00 0.00 175.76 175.43 1wb9 s ASN 744 N -3.00 6.62 0.34 0.00 0.01 -1.26 -0.96 114.94 116.69 1wb9 s ASN 744 Ca 0.17 0.74 0.04 0.00 -0.71 0.00 0.00 52.86 53.09 1wb9 s ASN 744 Cb -0.01 -2.22 -0.04 0.00 0.41 0.00 0.00 41.25 39.39 1wb9 s ASN 744 CO 0.04 0.19 0.14 0.68 -1.51 0.00 0.00 177.10 176.64 1wb9 s VAL 745 N -0.19 0.51 0.12 1.60 -7.23 -0.66 -1.77 120.40 112.78 1wb9 s VAL 745 Ca 0.21 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 58.14 1wb9 s VAL 745 Cb -0.15 -2.50 0.08 0.00 0.56 0.00 0.00 36.38 34.37 1wb9 s VAL 745 CO 0.09 0.00 0.68 -1.38 -0.31 0.00 0.00 175.10 174.17 1wb9 s HIS 746 N -3.44 -0.48 0.04 2.82 -3.43 0.21 -2.10 115.29 108.90 1wb9 s HIS 746 Ca 0.32 0.29 0.02 0.00 -0.80 0.00 0.00 55.06 54.89 1wb9 s HIS 746 Cb 0.05 0.56 -0.04 0.00 -1.43 0.00 0.00 32.58 31.72 1wb9 s HIS 746 CO 0.17 -0.78 0.07 -0.51 -2.00 0.00 0.00 174.74 171.68 1wb9 s LEU 747 N -2.69 3.78 0.49 5.38 1.43 -0.66 -0.81 118.68 125.60 1wb9 s LEU 747 Ca 0.02 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.18 1wb9 s LEU 747 Cb -0.01 -2.33 -0.01 0.00 0.03 0.00 0.00 46.19 43.87 1wb9 s LEU 747 CO -0.12 0.23 0.05 1.51 0.23 0.00 0.00 176.35 178.25 1wb9 s ASP 748 N -2.02 3.72 0.12 2.29 1.47 -1.26 -4.10 116.67 116.88 1wb9 s ASP 748 Ca 0.25 -1.71 0.05 0.00 1.18 0.00 0.00 52.55 52.33 1wb9 s ASP 748 Cb -0.12 0.63 -0.04 0.00 -0.34 0.00 0.00 42.92 43.05 1wb9 s ASP 748 CO 0.17 -0.93 -0.13 0.00 0.68 0.00 0.00 175.17 174.96 1wb9 s ALA 749 N -3.00 1.43 -0.19 2.11 0.00 -1.26 -2.31 121.76 118.55 1wb9 s ALA 749 Ca 0.09 -1.30 -0.02 0.00 0.00 0.00 0.00 51.96 50.72 1wb9 s ALA 749 Cb 0.01 -0.04 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 1wb9 s ALA 749 CO 0.06 0.05 -0.09 -1.17 0.00 0.00 0.00 175.76 174.61 1wb9 s LEU 750 N -2.55 2.72 -0.06 0.00 2.96 0.26 -4.92 118.68 117.08 1wb9 s LEU 750 Ca 0.09 -0.42 -0.18 0.00 -0.22 0.00 0.00 54.13 53.39 1wb9 s LEU 750 Cb -0.04 -1.67 -0.05 0.00 0.50 0.00 0.00 46.19 44.94 1wb9 s LEU 750 CO 0.02 0.02 0.51 -1.61 -1.32 0.00 0.00 176.35 173.97 1wb9 s GLU 751 N 1.22 4.26 0.14 1.98 2.02 -1.26 -0.33 118.70 126.73 1wb9 s GLU 751 Ca 0.02 0.55 -0.24 0.00 0.02 0.00 0.00 54.97 55.32 1wb9 s GLU 751 Cb -0.14 -3.37 0.07 0.00 0.10 0.00 0.00 34.13 30.79 1wb9 s GLU 751 CO -0.03 0.32 0.75 -3.38 0.02 0.00 0.00 175.26 172.93 1wb9 s HIS 752 N 0.06 -0.36 0.00 1.61 -3.43 -1.02 -5.00 115.29 107.15 1wb9 s HIS 752 Ca 0.27 0.10 0.00 0.00 -0.80 0.00 0.00 55.06 54.64 1wb9 s HIS 752 Cb -0.16 0.60 0.00 0.00 -1.43 0.00 0.00 32.58 31.58 1wb9 s HIS 752 CO 0.13 -0.85 0.00 0.41 -2.00 0.00 0.00 174.74 172.43 1wb9 n GLY 753 N -0.38 2.26 2.07 -1.38 0.00 -1.26 -0.98 105.19 105.52 1wb9 n GLY 753 Ca -0.11 0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 1wb9 n GLY 753 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wb9 n ASP 754 N 2.23 4.87 -1.28 1.61 8.00 -1.26 -5.05 116.55 125.67 1wb9 n ASP 754 Ca 0.00 -3.73 -0.02 0.00 0.71 0.00 0.00 54.79 51.75 1wb9 n ASP 754 Cb 0.00 -0.35 -0.00 0.00 -0.02 0.00 0.00 41.12 40.74 1wb9 n ASP 754 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 1wb9 n THR 755 N -0.69 0.00 -3.75 -3.53 5.66 -0.15 -5.06 114.28 106.76 1wb9 n THR 755 Ca 0.43 -0.24 -0.15 0.00 -3.05 0.00 0.00 64.05 61.04 1wb9 n THR 755 Cb 0.94 0.15 -0.16 0.00 -1.55 0.00 0.00 70.33 69.71 1wb9 n THR 755 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1wb9 s ILE 756 N -2.53 -0.07 -0.48 1.09 2.07 -1.26 -2.43 121.20 117.59 1wb9 s ILE 756 Ca 0.04 0.24 -0.15 0.00 -1.41 0.00 0.00 60.65 59.37 1wb9 s ILE 756 Cb -0.00 -0.12 0.08 0.00 0.13 0.00 0.00 42.46 42.55 1wb9 s ILE 756 CO 0.03 0.10 0.40 0.00 -1.91 0.00 0.00 174.94 173.56 1wb9 s ALA 757 N 1.25 3.56 -0.51 1.50 0.00 0.55 -4.97 121.76 123.15 1wb9 s ALA 757 Ca -0.07 -2.15 -0.28 0.00 0.00 0.00 0.00 51.96 49.46 1wb9 s ALA 757 Cb -0.13 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 19.92 1wb9 s ALA 757 CO -0.03 -1.75 1.52 -0.06 0.00 0.00 0.00 175.76 175.44 1wb9 s PHE 758 N 1.63 2.16 0.49 0.00 0.08 -1.26 -0.58 117.98 120.50 1wb9 s PHE 758 Ca 0.04 0.57 -0.18 0.00 0.12 0.00 0.00 56.93 57.48 1wb9 s PHE 758 Cb -0.25 -4.30 -0.09 0.00 -0.57 0.00 0.00 43.02 37.81 1wb9 s PHE 758 CO 0.06 -2.15 0.97 -1.64 -0.10 0.00 0.00 175.22 172.37 1wb9 s MET 759 N 5.62 4.03 -0.18 0.44 -1.94 -0.98 -4.99 119.30 121.31 1wb9 s MET 759 Ca 0.60 1.00 0.16 0.00 -1.71 0.00 0.00 55.69 55.74 1wb9 s MET 759 Cb -0.13 -2.15 0.44 0.00 2.01 0.00 0.00 34.83 35.00 1wb9 s MET 759 CO 0.27 -0.20 1.33 0.72 -0.01 0.00 0.00 175.02 177.13 1wb9 n HIS 760 N -1.29 0.61 -3.09 -0.03 -0.00 -1.26 -4.38 115.22 105.77 1wb9 n HIS 760 Ca 0.07 -1.04 -0.41 0.00 -0.00 0.00 0.00 57.72 56.34 1wb9 n HIS 760 Cb 0.54 -0.28 -0.06 0.00 -0.00 0.00 0.00 29.99 30.19 1wb9 n HIS 760 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1wb9 s SER 761 N -2.38 6.54 -0.14 0.41 0.15 -1.26 -4.91 113.70 112.11 1wb9 s SER 761 Ca 0.39 0.54 -0.26 0.00 0.70 0.00 0.00 55.95 57.32 1wb9 s SER 761 Cb 0.33 -2.34 -0.02 0.00 -1.71 0.00 0.00 66.02 62.28 1wb9 s SER 761 CO 0.05 -0.46 0.85 -0.69 1.20 0.00 0.00 173.24 174.18 1wb9 s VAL 762 N 2.62 4.89 0.06 4.45 1.01 -1.26 -4.45 120.40 127.71 1wb9 s VAL 762 Ca 0.26 1.69 0.08 0.00 0.00 0.00 0.00 61.98 64.01 1wb9 s VAL 762 Cb -0.15 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 1wb9 s VAL 762 CO 0.11 0.06 -0.22 -1.10 0.00 0.00 0.00 175.10 173.95 1wb9 s GLN 763 N 1.87 1.40 0.56 2.72 -1.52 0.00 -4.88 119.66 119.81 1wb9 s GLN 763 Ca 0.40 -1.04 -0.21 0.00 -1.95 0.00 0.00 55.36 52.56 1wb9 s GLN 763 Cb -0.17 -1.59 -0.04 0.00 -0.22 0.00 0.00 33.01 30.99 1wb9 s GLN 763 CO 0.15 0.40 1.34 -0.51 -0.25 0.00 0.00 175.29 176.41 1wb9 s ASP 764 N -1.40 5.22 0.00 5.90 1.01 -1.26 -0.62 116.67 125.52 1wb9 s ASP 764 Ca 0.08 2.72 0.00 0.00 0.71 0.00 0.00 52.55 56.06 1wb9 s ASP 764 Cb -0.09 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.21 1wb9 s ASP 764 CO 0.03 -1.60 0.00 0.61 0.21 0.00 0.00 175.17 174.42 1wb9 n GLY 765 N 0.73 0.26 3.85 0.21 0.00 -0.73 -4.73 105.19 104.78 1wb9 n GLY 765 Ca 0.11 -1.94 -0.32 0.00 0.00 0.00 0.00 46.02 43.87 1wb9 n GLY 765 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wb9 s ALA 766 N -1.45 3.10 0.42 4.61 0.00 -1.26 -2.82 121.76 124.36 1wb9 s ALA 766 Ca 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 51.96 51.86 1wb9 s ALA 766 Cb 0.00 -3.06 -0.08 0.00 0.00 0.00 0.00 23.12 19.97 1wb9 s ALA 766 CO 0.00 -0.18 1.17 0.00 0.00 0.00 0.00 175.76 176.75 1wb9 s ALA 767 N -2.57 3.10 -0.82 0.00 0.00 -1.26 -4.91 121.76 115.31 1wb9 s ALA 767 Ca 0.58 0.97 0.08 0.00 0.00 0.00 0.00 51.96 53.58 1wb9 s ALA 767 Cb -0.10 -3.38 0.13 0.00 0.00 0.00 0.00 23.12 19.77 1wb9 s ALA 767 CO 0.30 -0.58 0.94 -1.13 0.00 0.00 0.00 175.76 175.29 1wb9 n SER 768 N -0.10 2.09 -3.97 0.00 3.41 -1.26 -4.96 113.62 108.83 1wb9 n SER 768 Ca 0.05 -1.63 -0.09 0.00 -0.26 0.00 0.00 58.87 56.94 1wb9 n SER 768 Cb 0.47 -0.07 -0.11 0.00 -0.26 0.00 0.00 64.21 64.23 1wb9 n SER 768 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1wb9 s LYS 769 N -0.80 0.28 0.26 4.33 1.02 -1.26 -5.16 119.74 118.41 1wb9 s LYS 769 Ca 0.12 -0.54 0.08 0.00 0.02 0.00 0.00 55.97 55.65 1wb9 s LYS 769 Cb 0.07 0.10 -0.04 0.00 -0.52 0.00 0.00 37.83 37.44 1wb9 s LYS 769 CO 0.10 -0.05 0.08 -1.54 -0.92 0.00 0.00 175.35 173.03 1wb9 s SER 770 N -1.31 4.95 0.00 2.83 1.04 -1.26 -4.81 113.70 115.14 1wb9 s SER 770 Ca -0.14 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 55.81 1wb9 s SER 770 Cb -0.09 -1.08 0.00 0.00 0.10 0.00 0.00 66.02 64.95 1wb9 s SER 770 CO -0.01 -0.01 0.34 -1.22 0.98 0.00 0.00 173.24 173.32 1wb9 n TYR 771 N -1.01 0.00 -0.31 5.02 4.01 -1.26 -4.82 117.16 118.79 1wb9 n TYR 771 Ca -0.07 -0.06 -0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1wb9 n TYR 771 Cb 0.58 -0.01 0.13 0.00 -0.31 0.00 0.00 39.34 39.74 1wb9 n TYR 771 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1wb9 h GLY 772 N 0.00 1.27 1.94 2.72 0.00 -1.99 -1.10 103.07 105.92 1wb9 h GLY 772 Ca 0.00 -0.40 -0.17 0.00 0.00 0.00 0.00 47.33 46.76 1wb9 h GLY 772 CO 0.00 0.30 -0.78 1.41 0.00 0.00 0.00 176.54 177.47 1wb9 h LEU 773 N 1.01 0.07 -0.57 3.11 3.38 -1.99 -1.58 115.31 118.74 1wb9 h LEU 773 Ca 0.36 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.21 1wb9 h LEU 773 Cb 0.11 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1wb9 h LEU 773 CO -0.15 0.82 0.08 0.00 0.09 0.00 0.00 178.44 179.28 1wb9 h ALA 774 N 1.18 0.76 -0.40 1.53 0.00 -1.73 -1.60 119.26 118.99 1wb9 h ALA 774 Ca -0.01 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.54 1wb9 h ALA 774 Cb 1.37 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1wb9 h ALA 774 CO 0.11 0.52 -0.16 0.28 0.00 0.00 0.00 179.25 180.00 1wb9 h VAL 775 N 0.85 1.26 -0.84 0.00 2.07 -1.15 -2.42 116.25 116.01 1wb9 h VAL 775 Ca 0.17 -1.22 -0.03 0.00 0.82 0.00 0.00 66.70 66.44 1wb9 h VAL 775 Cb 0.44 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.29 1wb9 h VAL 775 CO 0.01 0.41 0.41 0.00 0.02 0.00 0.00 177.57 178.43 1wb9 h ALA 776 N 1.16 1.09 -0.24 1.67 0.00 -1.12 -1.84 119.26 119.97 1wb9 h ALA 776 Ca 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1wb9 h ALA 776 Cb 0.64 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1wb9 h ALA 776 CO 0.04 0.65 0.09 0.00 0.00 0.00 0.00 179.25 180.03 1wb9 h ALA 777 N 1.22 0.32 0.00 0.00 0.00 -1.11 -2.00 119.26 117.69 1wb9 h ALA 777 Ca 0.29 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1wb9 h ALA 777 Cb 0.11 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1wb9 h ALA 777 CO -0.04 -0.07 -0.11 -0.07 0.00 0.00 0.00 179.25 178.96 1wb9 h LEU 778 N 0.24 0.00 -0.23 0.00 3.38 -1.32 -1.92 115.31 115.46 1wb9 h LEU 778 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1wb9 h LEU 778 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1wb9 h LEU 778 CO -0.01 0.11 -0.20 0.00 0.09 0.00 0.00 178.44 178.44 1wb9 n ALA 779 N -2.32 2.92 0.00 1.53 0.00 -0.70 -4.94 120.51 117.00 1wb9 n ALA 779 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1wb9 n ALA 779 Cb 0.22 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1wb9 n ALA 779 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wb9 n GLY 780 N 1.35 1.01 3.72 0.00 0.00 -0.72 -5.06 105.19 105.50 1wb9 n GLY 780 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1wb9 n GLY 780 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wb9 s VAL 781 N -2.00 2.39 0.27 1.61 1.01 -0.78 -4.85 120.40 118.05 1wb9 s VAL 781 Ca 0.00 0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.96 1wb9 s VAL 781 Cb 0.00 -3.18 -0.13 0.00 0.00 0.00 0.00 36.38 33.07 1wb9 s VAL 781 CO 0.00 0.02 1.29 -2.65 0.00 0.00 0.00 175.10 173.76 1wb9 n PRO 782 N 3.87 1.88 -0.34 2.72 -0.02 -1.26 -4.71 135.00 137.15 1wb9 n PRO 782 Ca 0.14 0.67 0.20 0.00 -2.02 0.00 0.00 63.50 62.49 1wb9 n PRO 782 Cb 0.37 -2.24 0.45 0.00 -0.02 0.00 0.00 33.50 32.06 1wb9 n PRO 782 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1wb9 h LYS 783 N 3.25 0.47 -0.33 -0.52 1.57 -1.97 -0.20 116.57 118.84 1wb9 h LYS 783 Ca -0.44 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.21 1wb9 h LYS 783 Cb 1.29 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 1wb9 h LYS 783 CO 0.69 0.31 -0.20 1.05 -0.57 0.00 0.00 179.45 180.72 1wb9 h GLU 784 N 0.48 0.62 -0.21 3.15 9.09 -2.00 -0.99 114.58 124.72 1wb9 h GLU 784 Ca 0.63 -0.23 -0.03 0.00 0.05 0.00 0.00 59.36 59.78 1wb9 h GLU 784 Cb 1.39 -0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 28.45 1wb9 h GLU 784 CO -0.40 0.78 0.01 0.28 0.05 0.00 0.00 179.01 179.73 1wb9 h VAL 785 N 0.55 1.25 -0.81 -1.06 2.07 -1.40 -2.38 116.25 114.47 1wb9 h VAL 785 Ca 0.08 -0.84 0.10 0.00 0.82 0.00 0.00 66.70 66.86 1wb9 h VAL 785 Cb 0.65 1.39 -0.07 0.00 -1.52 0.00 0.00 31.29 31.74 1wb9 h VAL 785 CO 0.05 0.26 0.45 0.40 0.02 0.00 0.00 177.57 178.74 1wb9 h ILE 786 N 0.14 0.88 -0.47 4.57 1.08 -1.17 -1.27 117.51 121.27 1wb9 h ILE 786 Ca 0.06 -0.26 -0.08 0.00 -0.39 0.00 0.00 64.86 64.20 1wb9 h ILE 786 Cb 0.37 0.07 -0.02 0.00 -3.07 0.00 0.00 36.82 34.18 1wb9 h ILE 786 CO 0.01 0.14 -0.01 0.50 -0.69 0.00 0.00 178.15 178.10 1wb9 h LYS 787 N 0.74 0.84 -0.57 2.37 3.64 -1.04 -0.28 116.57 122.28 1wb9 h LYS 787 Ca 0.39 -0.27 -0.09 0.00 -1.27 0.00 0.00 60.65 59.41 1wb9 h LYS 787 Cb 0.39 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 1wb9 h LYS 787 CO -0.26 0.89 -0.01 0.00 -2.27 0.00 0.00 179.45 177.81 1wb9 h ARG 788 N 0.69 0.98 -0.54 1.90 2.47 -1.24 -2.43 114.38 116.20 1wb9 h ARG 788 Ca 0.13 -0.30 -0.04 0.00 -1.26 0.00 0.00 59.98 58.51 1wb9 h ARG 788 Cb 0.52 -0.10 -0.03 0.00 -1.65 0.00 0.00 29.97 28.72 1wb9 h ARG 788 CO 0.03 0.97 0.16 0.00 0.56 0.00 0.00 179.97 181.68 1wb9 h ALA 789 N 1.08 1.25 -0.29 0.04 0.00 -0.83 -1.97 119.26 118.54 1wb9 h ALA 789 Ca 0.16 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1wb9 h ALA 789 Cb 0.53 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1wb9 h ALA 789 CO 0.03 0.53 -0.16 -0.09 0.00 0.00 0.00 179.25 179.56 1wb9 h ARG 790 N 0.80 0.52 -0.15 0.00 9.65 -0.60 -0.95 114.38 123.65 1wb9 h ARG 790 Ca 0.18 -0.16 -0.10 0.00 -1.10 0.00 0.00 59.98 58.80 1wb9 h ARG 790 Cb 0.25 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 1wb9 h ARG 790 CO -0.01 0.66 -0.30 0.37 2.80 0.00 0.00 179.97 183.49 1wb9 h GLN 791 N 0.47 0.46 -0.39 0.20 4.15 -1.13 -2.66 115.11 116.21 1wb9 h GLN 791 Ca 0.08 -0.30 -0.03 0.00 0.77 0.00 0.00 58.65 59.17 1wb9 h GLN 791 Cb 0.55 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.26 1wb9 h GLN 791 CO 0.04 0.91 0.11 -0.22 -1.93 0.00 0.00 178.83 177.73 1wb9 h LYS 792 N 0.07 0.57 -0.20 1.69 1.63 -1.18 -1.24 116.57 117.90 1wb9 h LYS 792 Ca 0.00 -0.09 -0.04 0.00 -0.85 0.00 0.00 60.65 59.67 1wb9 h LYS 792 Cb 0.89 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 32.42 1wb9 h LYS 792 CO 0.07 0.52 -0.03 1.25 -3.45 0.00 0.00 179.45 177.80 1wb9 h LEU 793 N 0.56 0.38 -0.45 5.20 5.85 -1.09 0.29 115.31 126.06 1wb9 h LEU 793 Ca 0.13 -0.35 -0.04 0.00 0.84 0.00 0.00 57.88 58.46 1wb9 h LEU 793 Cb 0.20 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1wb9 h LEU 793 CO -0.01 0.64 0.11 -0.09 -0.34 0.00 0.00 178.44 178.76 1wb9 h ARG 794 N 0.12 0.72 -0.18 1.25 2.43 -1.28 -0.26 114.38 117.17 1wb9 h ARG 794 Ca 0.05 -0.17 0.05 0.00 -0.81 0.00 0.00 59.98 59.10 1wb9 h ARG 794 Cb 0.47 -0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 29.86 1wb9 h ARG 794 CO 0.02 0.71 -0.25 1.49 -1.51 0.00 0.00 179.97 180.43 1wb9 h GLU 795 N 0.59 -0.28 -0.46 0.20 4.81 -0.97 -1.10 114.58 117.37 1wb9 h GLU 795 Ca 0.14 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.35 1wb9 h GLU 795 Cb 0.32 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1wb9 h GLU 795 CO 0.00 -0.19 0.13 -0.07 -0.73 0.00 0.00 179.01 178.16 1wb9 h LEU 796 N -0.29 0.69 -0.64 1.64 3.38 -0.75 -3.19 115.31 116.15 1wb9 h LEU 796 Ca 0.12 -0.22 -0.13 0.00 0.09 0.00 0.00 57.88 57.74 1wb9 h LEU 796 Cb 0.47 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1wb9 h LEU 796 CO -0.35 0.72 -0.61 -0.33 0.09 0.00 0.00 178.44 177.97 1wb9 h GLU 797 N 0.62 0.00 0.00 1.13 5.08 -0.86 -3.27 114.58 117.28 1wb9 h GLU 797 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1wb9 h GLU 797 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1wb9 h GLU 797 CO -0.00 0.61 0.00 -1.13 -1.00 0.00 0.00 179.01 177.48 1wb9 n SER 798 N -3.62 0.00 0.03 1.42 3.41 -0.43 -2.61 113.62 111.82 1wb9 n SER 798 Ca -0.01 0.39 0.13 0.00 -0.26 0.00 0.00 58.87 59.12 1wb9 n SER 798 Cb 0.65 -0.45 0.32 0.00 -0.26 0.00 0.00 64.21 64.47 1wb9 n SER 798 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1wb9 n ILE 799 N -1.45 0.20 0.82 -1.33 5.41 -1.24 -5.11 119.36 116.67 1wb9 n ILE 799 Ca 0.06 -0.13 0.10 0.00 1.00 0.00 0.00 62.75 63.77 1wb9 n ILE 799 Cb 0.20 -0.15 0.08 0.00 -0.71 0.00 0.00 39.64 39.07 1wb9 n ILE 799 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31