#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wb9 n LYS 3 N 0.00 0.18 -1.52 0.11 5.02 -1.26 -4.91 118.16 115.78 2wb9 n LYS 3 Ca 0.00 0.08 -0.53 0.00 -2.02 0.00 0.00 58.31 55.84 2wb9 n LYS 3 Cb 0.00 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.45 2wb9 n LYS 3 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2wb9 n GLN 4 N -1.38 0.53 -3.60 1.97 1.13 -1.25 -4.72 117.38 110.05 2wb9 n GLN 4 Ca 0.09 0.19 -0.12 0.00 -1.94 0.00 0.00 57.00 55.21 2wb9 n GLN 4 Cb 0.22 -1.62 -0.06 0.00 0.11 0.00 0.00 30.24 28.88 2wb9 n GLN 4 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 2wb9 s HIS 5 N -0.16 -0.58 -0.07 1.08 2.46 -0.75 -4.96 115.29 112.31 2wb9 s HIS 5 Ca 0.80 1.28 0.04 0.00 0.47 0.00 0.00 55.06 57.65 2wb9 s HIS 5 Cb -1.04 0.36 -0.00 0.00 -0.13 0.00 0.00 32.58 31.77 2wb9 s HIS 5 CO 0.54 -0.36 -0.22 -0.06 -2.47 0.00 0.00 174.74 172.17 2wb9 s PHE 6 N -0.24 2.24 -0.09 3.88 0.40 -1.26 -0.03 117.98 122.87 2wb9 s PHE 6 Ca -0.01 -0.80 0.01 0.00 -0.60 0.00 0.00 56.93 55.53 2wb9 s PHE 6 Cb -0.03 -1.50 0.02 0.00 0.51 0.00 0.00 43.02 42.01 2wb9 s PHE 6 CO 0.00 -0.30 -0.11 0.21 0.70 0.00 0.00 175.22 175.73 2wb9 s LYS 7 N 0.18 1.72 -0.15 0.44 2.20 0.04 -0.97 119.74 123.19 2wb9 s LYS 7 Ca -0.11 -0.37 -0.06 0.00 -0.36 0.00 0.00 55.97 55.07 2wb9 s LYS 7 Cb -0.15 -1.57 -0.04 0.00 -1.51 0.00 0.00 37.83 34.56 2wb9 s LYS 7 CO 0.06 -0.12 0.05 -1.17 -0.36 0.00 0.00 175.35 173.81 2wb9 s LEU 8 N 1.18 3.81 -0.23 5.43 2.96 0.13 -0.75 118.68 131.20 2wb9 s LEU 8 Ca -0.05 0.13 -0.08 0.00 -0.22 0.00 0.00 54.13 53.92 2wb9 s LEU 8 Cb -0.14 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 2wb9 s LEU 8 CO -0.03 0.25 0.09 0.26 -1.32 0.00 0.00 176.35 175.60 2wb9 s TRP 9 N -0.07 3.18 0.17 5.38 0.52 0.40 -0.41 118.94 128.12 2wb9 s TRP 9 Ca 0.06 -0.11 -0.24 0.00 0.02 0.00 0.00 56.10 55.83 2wb9 s TRP 9 Cb -0.12 -2.20 0.06 0.00 -1.15 0.00 0.00 33.47 30.06 2wb9 s TRP 9 CO 0.01 -0.10 0.88 -0.47 0.02 0.00 0.00 176.95 177.28 2wb9 s TYR 10 N 1.12 -0.18 1.39 -1.98 5.04 -0.53 -2.82 117.35 119.38 2wb9 s TYR 10 Ca 0.05 -0.14 -0.21 0.00 -2.44 0.00 0.00 57.07 54.33 2wb9 s TYR 10 Cb -0.14 0.64 0.36 0.00 0.35 0.00 0.00 41.96 43.17 2wb9 s TYR 10 CO 0.04 -0.91 0.94 -0.06 -1.34 0.00 0.00 175.55 174.22 2wb9 s PHE 11 N -3.45 -0.30 -1.30 4.97 0.08 -1.26 -0.93 117.98 115.79 2wb9 s PHE 11 Ca 0.11 0.68 -0.15 0.00 0.12 0.00 0.00 56.93 57.68 2wb9 s PHE 11 Cb -0.02 -2.93 0.10 0.00 -0.57 0.00 0.00 43.02 39.60 2wb9 s PHE 11 CO 0.02 -4.83 1.73 1.04 -0.10 0.00 0.00 175.22 173.08 2wb9 n GLN 12 N -5.54 3.24 -3.55 0.44 6.02 -1.19 -4.53 117.38 112.27 2wb9 n GLN 12 Ca 0.11 -3.37 -0.10 0.00 -0.01 0.00 0.00 57.00 53.62 2wb9 n GLN 12 Cb 0.59 -3.29 -0.04 0.00 1.02 0.00 0.00 30.24 28.51 2wb9 n GLN 12 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2wb9 s PHE 13 N 3.01 -0.38 0.00 1.08 5.36 -1.26 -4.72 117.98 121.06 2wb9 s PHE 13 Ca 0.49 0.55 0.00 0.00 -0.96 0.00 0.00 56.93 57.00 2wb9 s PHE 13 Cb 0.04 0.47 0.00 0.00 -0.34 0.00 0.00 43.02 43.19 2wb9 s PHE 13 CO 0.03 -0.42 0.00 0.54 -1.46 0.00 0.00 175.22 173.91 2wb9 n ARG 14 N 0.46 0.00 0.00 10.12 1.74 -1.19 -4.81 116.66 122.98 2wb9 n ARG 14 Ca -0.10 0.22 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2wb9 n ARG 14 Cb 0.59 -0.68 0.00 0.00 -1.02 0.00 0.00 32.46 31.35 2wb9 n ARG 14 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wb9 n GLY 15 N 2.15 2.46 0.24 -0.13 0.00 0.62 -1.38 105.19 109.16 2wb9 n GLY 15 Ca 0.00 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 45.93 2wb9 n GLY 15 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wb9 h ARG 16 N 0.00 0.00 0.00 1.61 2.47 -1.91 -3.13 114.38 113.42 2wb9 h ARG 16 Ca 0.00 0.00 -0.18 0.00 -1.26 0.00 0.00 59.98 58.54 2wb9 h ARG 16 Cb 0.00 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.29 2wb9 h ARG 16 CO 0.00 0.14 -0.85 0.00 0.56 0.00 0.00 179.97 179.81 2wb9 h ALA 17 N 1.86 0.55 -0.96 0.04 0.00 -1.54 -3.39 119.26 115.83 2wb9 h ALA 17 Ca -0.00 -0.78 0.09 0.00 0.00 0.00 0.00 54.91 54.22 2wb9 h ALA 17 Cb 0.69 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 2wb9 h ALA 17 CO 0.02 1.07 0.60 1.49 0.00 0.00 0.00 179.25 182.42 2wb9 h GLU 18 N 0.00 1.00 -0.30 0.00 4.57 -1.32 -0.42 114.58 118.10 2wb9 h GLU 18 Ca -0.01 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2wb9 h GLU 18 Cb 1.55 -0.23 -0.02 0.00 -0.16 0.00 0.00 28.75 29.90 2wb9 h GLU 18 CO 0.11 0.66 0.20 -1.35 -1.18 0.00 0.00 179.01 177.45 2wb9 h PRO 19 N 1.03 0.40 -0.33 0.92 0.11 -1.82 0.30 132.00 132.62 2wb9 h PRO 19 Ca 0.44 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.36 2wb9 h PRO 19 Cb 0.30 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.32 2wb9 h PRO 19 CO -0.21 0.27 -0.43 0.97 -0.21 0.00 0.00 178.00 178.39 2wb9 h ILE 20 N 0.41 1.28 -0.65 4.15 2.10 -1.35 0.34 117.51 123.80 2wb9 h ILE 20 Ca 0.11 -1.61 0.02 0.00 1.08 0.00 0.00 64.86 64.46 2wb9 h ILE 20 Cb -0.04 1.53 -0.04 0.00 -1.09 0.00 0.00 36.82 37.18 2wb9 h ILE 20 CO -0.02 0.53 0.41 0.03 -1.08 0.00 0.00 178.15 178.01 2wb9 h ARG 21 N 0.66 0.79 -0.24 2.19 3.08 -0.80 -0.52 114.38 119.54 2wb9 h ARG 21 Ca 0.04 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 59.92 2wb9 h ARG 21 Cb 1.03 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2wb9 h ARG 21 CO 0.10 0.52 -0.35 -0.07 -1.07 0.00 0.00 179.97 179.11 2wb9 h LEU 22 N 0.82 0.55 -0.25 3.04 3.38 -0.15 -1.06 115.31 121.64 2wb9 h LEU 22 Ca 0.25 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2wb9 h LEU 22 Cb -0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2wb9 h LEU 22 CO -0.09 0.85 0.02 0.25 0.09 0.00 0.00 178.44 179.56 2wb9 h LEU 23 N 0.44 0.42 -0.92 1.67 5.85 -0.45 0.16 115.31 122.49 2wb9 h LEU 23 Ca 0.05 -0.29 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 2wb9 h LEU 23 Cb 0.81 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 2wb9 h LEU 23 CO 0.07 0.61 0.20 -0.07 -0.34 0.00 0.00 178.44 178.91 2wb9 h LEU 24 N 0.22 0.93 0.19 2.25 3.38 -1.05 0.73 115.31 121.97 2wb9 h LEU 24 Ca 0.07 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2wb9 h LEU 24 Cb 0.38 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2wb9 h LEU 24 CO 0.01 0.87 -0.09 0.74 0.09 0.00 0.00 178.44 180.06 2wb9 h THR 25 N 0.96 0.83 -0.50 0.22 2.02 -0.88 -0.59 112.91 114.98 2wb9 h THR 25 Ca 0.21 -0.10 -0.02 0.00 0.77 0.00 0.00 66.41 67.28 2wb9 h THR 25 Cb 0.28 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 2wb9 h THR 25 CO -0.01 0.02 0.23 0.00 0.37 0.00 0.00 175.52 176.13 2wb9 n ALA 27 N -2.46 2.18 -1.55 0.00 0.00 0.21 -4.90 120.51 113.99 2wb9 n ALA 27 Ca 0.04 -0.10 -0.06 0.00 0.00 0.00 0.00 53.44 53.32 2wb9 n ALA 27 Cb 0.13 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.16 2wb9 n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wb9 n GLY 28 N 0.94 0.56 3.60 0.00 0.00 -0.64 -5.00 105.19 104.65 2wb9 n GLY 28 Ca 0.08 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 45.00 2wb9 n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wb9 s VAL 29 N -2.26 5.20 0.30 1.61 1.01 -0.30 -5.03 120.40 120.92 2wb9 s VAL 29 Ca 0.00 0.46 -0.29 0.00 0.00 0.00 0.00 61.98 62.15 2wb9 s VAL 29 Cb 0.00 -3.68 -0.10 0.00 0.00 0.00 0.00 36.38 32.60 2wb9 s VAL 29 CO 0.00 0.15 1.17 -0.75 0.00 0.00 0.00 175.10 175.67 2wb9 s LYS 30 N 2.01 4.51 0.09 2.72 2.20 -1.26 -4.48 119.74 125.53 2wb9 s LYS 30 Ca 0.13 1.94 -0.13 0.00 -0.36 0.00 0.00 55.97 57.55 2wb9 s LYS 30 Cb -0.16 -3.12 0.02 0.00 -1.51 0.00 0.00 37.83 33.07 2wb9 s LYS 30 CO 0.10 0.05 0.32 -0.59 -0.36 0.00 0.00 175.35 174.87 2wb9 s PHE 31 N -1.17 -0.08 -0.35 4.03 -0.12 -1.26 -4.48 117.98 114.55 2wb9 s PHE 31 Ca 0.47 -0.21 -0.22 0.00 -0.05 0.00 0.00 56.93 56.92 2wb9 s PHE 31 Cb -0.34 0.12 0.01 0.00 -0.63 0.00 0.00 43.02 42.17 2wb9 s PHE 31 CO 0.45 -0.60 0.74 -2.00 -0.05 0.00 0.00 175.22 173.75 2wb9 s GLU 32 N -3.43 3.77 -0.90 1.99 2.12 -0.15 -4.99 118.70 117.12 2wb9 s GLU 32 Ca 0.01 0.29 -0.15 0.00 0.36 0.00 0.00 54.97 55.48 2wb9 s GLU 32 Cb 0.02 -3.79 0.20 0.00 0.26 0.00 0.00 34.13 30.82 2wb9 s GLU 32 CO -0.09 -0.78 0.93 0.34 -0.54 0.00 0.00 175.26 175.12 2wb9 s ASP 33 N 1.78 6.79 -0.53 -1.70 2.15 -1.26 -0.70 116.67 123.21 2wb9 s ASP 33 Ca 0.29 -2.61 -0.22 0.00 0.43 0.00 0.00 52.55 50.44 2wb9 s ASP 33 Cb -0.14 -2.27 0.05 0.00 -0.30 0.00 0.00 42.92 40.26 2wb9 s ASP 33 CO 0.15 -0.69 0.81 -0.47 -0.17 0.00 0.00 175.17 174.81 2wb9 s TYR 34 N 0.79 2.90 -0.34 -5.34 5.04 0.46 -4.98 117.35 115.87 2wb9 s TYR 34 Ca 0.24 -0.21 -0.05 0.00 -2.44 0.00 0.00 57.07 54.61 2wb9 s TYR 34 Cb -0.08 -3.85 0.05 0.00 0.35 0.00 0.00 41.96 38.43 2wb9 s TYR 34 CO -0.09 -1.22 0.10 -0.65 -1.34 0.00 0.00 175.55 172.36 2wb9 s GLN 35 N 3.42 2.54 0.36 4.97 -0.21 -1.26 -1.45 119.66 128.03 2wb9 s GLN 35 Ca 0.25 -1.26 0.02 0.00 0.02 0.00 0.00 55.36 54.38 2wb9 s GLN 35 Cb -0.15 -3.43 -0.02 0.00 1.00 0.00 0.00 33.01 30.40 2wb9 s GLN 35 CO 0.17 -0.71 0.54 -0.59 -2.12 0.00 0.00 175.29 172.58 2wb9 s PHE 36 N 1.35 3.36 0.61 0.91 -0.12 -0.11 -4.71 117.98 119.28 2wb9 s PHE 36 Ca -0.01 0.18 -0.07 0.00 -0.05 0.00 0.00 56.93 56.98 2wb9 s PHE 36 Cb -0.20 -1.97 0.00 0.00 -0.63 0.00 0.00 43.02 40.22 2wb9 s PHE 36 CO 0.01 0.02 0.94 0.95 -0.05 0.00 0.00 175.22 177.10 2wb9 s THR 37 N -2.31 3.75 0.49 -4.49 -4.23 -1.26 -3.18 115.64 104.41 2wb9 s THR 37 Ca 0.42 0.17 0.16 0.00 -1.18 0.00 0.00 61.69 61.25 2wb9 s THR 37 Cb -0.10 -3.51 0.23 0.00 1.34 0.00 0.00 72.50 70.47 2wb9 s THR 37 CO 0.35 -0.56 2.08 0.24 -0.54 0.00 0.00 174.62 176.19 2wb9 h MET 38 N -0.26 0.00 0.00 3.99 0.00 -2.00 -1.98 114.93 114.68 2wb9 h MET 38 Ca -0.45 0.00 -0.09 0.00 0.00 0.00 0.00 59.70 59.15 2wb9 h MET 38 Cb 1.25 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.84 2wb9 h MET 38 CO 0.62 0.09 -0.45 0.38 0.00 0.00 0.00 176.91 177.54 2wb9 h ASP 39 N 0.00 0.00 1.37 1.22 2.03 -2.06 -2.81 116.42 116.18 2wb9 h ASP 39 Ca -0.00 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 56.17 2wb9 h ASP 39 Cb 0.15 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.64 2wb9 h ASP 39 CO 0.01 0.45 -0.62 1.56 -1.03 0.00 0.00 179.24 179.61 2wb9 h GLN 40 N 0.00 0.00 -0.71 4.15 4.20 -1.75 -3.38 115.11 117.63 2wb9 h GLN 40 Ca -0.00 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.79 2wb9 h GLN 40 Cb 0.98 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.69 2wb9 h GLN 40 CO 0.06 0.62 0.36 2.35 -0.67 0.00 0.00 178.83 181.55 2wb9 h TRP 41 N 0.00 0.65 0.00 2.96 -0.00 -1.18 -2.00 115.95 116.38 2wb9 h TRP 41 Ca -0.01 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 58.90 2wb9 h TRP 41 Cb 1.48 -0.18 -0.00 0.00 -0.00 0.00 0.00 29.16 30.45 2wb9 h TRP 41 CO 0.00 0.25 -0.03 -1.35 -0.00 0.00 0.00 178.44 177.30 2wb9 h PRO 42 N 0.62 0.00 -0.01 2.65 0.11 -1.75 0.31 132.00 133.93 2wb9 h PRO 42 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 2wb9 h PRO 42 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 2wb9 h PRO 42 CO -0.25 0.03 -0.48 0.25 -0.21 0.00 0.00 178.00 177.34 2wb9 n THR 43 N -3.32 0.00 -0.10 -1.15 -2.24 -0.77 -4.21 114.28 102.49 2wb9 n THR 43 Ca -0.02 -0.14 -0.24 0.00 -2.27 0.00 0.00 64.05 61.39 2wb9 n THR 43 Cb 0.17 0.76 -0.12 0.00 -2.10 0.00 0.00 70.33 69.05 2wb9 n THR 43 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2wb9 n ILE 44 N -0.68 1.57 -0.32 2.28 5.41 0.10 -4.54 119.36 123.17 2wb9 n ILE 44 Ca 0.09 -0.23 0.09 0.00 1.00 0.00 0.00 62.75 63.70 2wb9 n ILE 44 Cb 0.38 -1.93 0.18 0.00 -0.71 0.00 0.00 39.64 37.57 2wb9 n ILE 44 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2wb9 n LYS 45 N -4.20 -0.08 0.00 0.38 4.81 0.86 -0.95 118.16 118.98 2wb9 n LYS 45 Ca -0.38 1.39 0.13 0.00 -0.87 0.00 0.00 58.31 58.57 2wb9 n LYS 45 Cb 0.80 -2.12 0.76 0.00 0.02 0.00 0.00 35.03 34.48 2wb9 n LYS 45 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2wb9 n PRO 46 N -5.41 0.78 -0.00 1.64 -0.02 -1.26 -2.37 135.00 128.35 2wb9 n PRO 46 Ca 0.17 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.76 2wb9 n PRO 46 Cb 0.55 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.41 2wb9 n PRO 46 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2wb9 n THR 47 N -1.02 0.00 -3.88 3.45 -2.24 -0.12 -4.99 114.28 105.48 2wb9 n THR 47 Ca 0.19 -0.08 -0.33 0.00 -2.27 0.00 0.00 64.05 61.56 2wb9 n THR 47 Cb 0.10 0.83 -0.05 0.00 -2.10 0.00 0.00 70.33 69.11 2wb9 n THR 47 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2wb9 s LEU 48 N -3.24 4.37 0.11 3.22 1.43 -1.00 -5.04 118.68 118.52 2wb9 s LEU 48 Ca 0.05 0.38 -0.31 0.00 -1.03 0.00 0.00 54.13 53.23 2wb9 s LEU 48 Cb 0.16 -2.65 -0.10 0.00 0.03 0.00 0.00 46.19 43.62 2wb9 s LEU 48 CO 0.87 0.25 1.81 -2.16 0.23 0.00 0.00 176.35 177.36 2wb9 s PRO 49 N -1.95 4.15 0.00 1.29 0.04 -1.26 -1.27 135.00 135.99 2wb9 s PRO 49 Ca 0.28 2.56 0.00 0.00 0.04 0.00 0.00 61.00 63.88 2wb9 s PRO 49 Cb -0.13 -3.64 0.00 0.00 0.04 0.00 0.00 34.50 30.77 2wb9 s PRO 49 CO 0.19 -0.84 0.00 0.41 0.04 0.00 0.00 177.00 176.80 2wb9 n GLY 50 N 4.22 2.05 2.31 0.56 0.00 -1.26 -4.20 105.19 108.87 2wb9 n GLY 50 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 2wb9 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wb9 n GLY 51 N -2.00 -0.16 3.22 -0.02 0.00 -0.39 -4.99 105.19 100.86 2wb9 n GLY 51 Ca 0.00 -0.23 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 2wb9 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wb9 s ARG 52 N -4.69 0.80 0.27 1.61 1.81 -1.26 -4.95 118.95 112.54 2wb9 s ARG 52 Ca 0.00 -0.64 0.06 0.00 -1.72 0.00 0.00 55.73 53.43 2wb9 s ARG 52 Cb 0.00 0.34 -0.06 0.00 -0.45 0.00 0.00 34.95 34.78 2wb9 s ARG 52 CO 0.00 -0.25 -0.05 0.14 -0.68 0.00 0.00 175.30 174.46 2wb9 s VAL 53 N -2.87 1.51 0.71 3.52 -7.23 -1.26 -4.64 120.40 110.14 2wb9 s VAL 53 Ca -0.03 -2.10 -0.13 0.00 -1.81 0.00 0.00 61.98 57.90 2wb9 s VAL 53 Cb 0.00 -2.42 0.03 0.00 0.56 0.00 0.00 36.38 34.55 2wb9 s VAL 53 CO -0.05 -0.31 1.12 -2.84 -0.31 0.00 0.00 175.10 172.70 2wb9 s PRO 54 N -3.75 2.46 -0.01 4.82 0.02 -1.26 -4.97 135.00 132.31 2wb9 s PRO 54 Ca 0.29 1.37 0.01 0.00 0.02 0.00 0.00 61.00 62.69 2wb9 s PRO 54 Cb 0.04 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.66 2wb9 s PRO 54 CO 0.11 -1.51 -0.03 -1.17 -0.33 0.00 0.00 177.00 174.07 2wb9 s LEU 55 N -5.31 1.80 -0.18 -5.54 2.96 -1.13 -4.05 118.68 107.24 2wb9 s LEU 55 Ca 0.66 -0.06 0.00 0.00 -0.22 0.00 0.00 54.13 54.51 2wb9 s LEU 55 Cb -0.21 -0.21 0.01 0.00 0.50 0.00 0.00 46.19 46.29 2wb9 s LEU 55 CO 0.47 0.01 -0.17 -0.22 -1.32 0.00 0.00 176.35 175.12 2wb9 s LEU 56 N 0.19 2.32 -0.26 -0.68 2.96 -0.11 -0.45 118.68 122.64 2wb9 s LEU 56 Ca -0.02 -0.57 -0.11 0.00 -0.22 0.00 0.00 54.13 53.21 2wb9 s LEU 56 Cb -0.05 -1.53 -0.05 0.00 0.50 0.00 0.00 46.19 45.06 2wb9 s LEU 56 CO -0.00 0.02 0.20 -1.81 -1.32 0.00 0.00 176.35 173.44 2wb9 s ASP 57 N 1.19 6.10 -0.21 3.68 1.01 0.07 -0.21 116.67 128.30 2wb9 s ASP 57 Ca 0.02 0.09 -0.03 0.00 0.71 0.00 0.00 52.55 53.34 2wb9 s ASP 57 Cb -0.14 -2.13 -0.00 0.00 1.01 0.00 0.00 42.92 41.66 2wb9 s ASP 57 CO -0.08 -0.02 -0.08 -0.69 0.21 0.00 0.00 175.17 174.51 2wb9 s VAL 58 N 1.49 3.09 -0.37 -1.27 1.01 -0.11 -0.78 120.40 123.47 2wb9 s VAL 58 Ca 0.08 -0.59 -0.14 0.00 0.00 0.00 0.00 61.98 61.33 2wb9 s VAL 58 Cb -0.15 -2.39 -0.00 0.00 0.00 0.00 0.00 36.38 33.84 2wb9 s VAL 58 CO 0.08 0.45 0.28 -0.89 0.00 0.00 0.00 175.10 175.02 2wb9 s THR 59 N 1.39 5.26 0.28 3.92 2.01 0.95 -1.09 115.64 128.36 2wb9 s THR 59 Ca 0.05 -0.37 -0.04 0.00 0.31 0.00 0.00 61.69 61.64 2wb9 s THR 59 Cb -0.14 -3.82 0.06 0.00 0.01 0.00 0.00 72.50 68.61 2wb9 s THR 59 CO -0.05 -0.15 0.39 0.61 -0.69 0.00 0.00 174.62 174.73 2wb9 n GLY 60 N 5.12 -0.74 0.28 4.40 0.00 0.01 -1.81 105.19 112.45 2wb9 n GLY 60 Ca -0.12 -1.76 0.14 0.00 0.00 0.00 0.00 46.02 44.29 2wb9 n GLY 60 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wb9 h PRO 61 N 0.00 0.00 0.00 1.61 0.11 -1.89 -0.03 132.00 131.80 2wb9 h PRO 61 Ca -0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.98 2wb9 h PRO 61 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 2wb9 h PRO 61 CO 0.10 0.08 0.00 -0.40 -0.21 0.00 0.00 178.00 177.57 2wb9 n ASP 62 N -3.62 0.00 0.00 -2.05 3.85 -1.26 -4.46 116.55 109.01 2wb9 n ASP 62 Ca -0.02 -0.83 0.00 0.00 -0.71 0.00 0.00 54.79 53.23 2wb9 n ASP 62 Cb 0.19 -0.02 0.00 0.00 -1.35 0.00 0.00 41.12 39.94 2wb9 n ASP 62 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2wb9 n GLY 63 N 0.80 0.76 3.91 6.12 0.00 -0.02 -5.03 105.19 111.74 2wb9 n GLY 63 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2wb9 n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wb9 s LYS 64 N -0.22 3.49 -0.16 1.61 -0.14 -1.26 -4.78 119.74 118.29 2wb9 s LYS 64 Ca 0.00 -0.34 -0.05 0.00 -1.36 0.00 0.00 55.97 54.22 2wb9 s LYS 64 Cb 0.00 -2.99 -0.03 0.00 -1.68 0.00 0.00 37.83 33.12 2wb9 s LYS 64 CO 0.00 0.58 0.01 -1.17 -0.76 0.00 0.00 175.35 174.01 2wb9 s LEU 65 N -2.51 3.55 -0.05 3.17 2.96 -1.26 -0.81 118.68 123.73 2wb9 s LEU 65 Ca 0.36 0.00 0.05 0.00 -0.22 0.00 0.00 54.13 54.32 2wb9 s LEU 65 Cb -0.13 -1.87 -0.01 0.00 0.50 0.00 0.00 46.19 44.68 2wb9 s LEU 65 CO 0.27 0.19 -0.19 -0.13 -1.32 0.00 0.00 176.35 175.17 2wb9 s ARG 66 N 0.23 1.99 -0.18 1.98 0.52 -0.25 -4.98 118.95 118.27 2wb9 s ARG 66 Ca 0.01 -0.70 -0.02 0.00 -0.52 0.00 0.00 55.73 54.50 2wb9 s ARG 66 Cb -0.13 -1.72 -0.01 0.00 0.52 0.00 0.00 34.95 33.61 2wb9 s ARG 66 CO 0.02 0.29 -0.09 1.03 0.02 0.00 0.00 175.30 176.57 2wb9 s ARG 67 N -0.04 3.38 -0.09 3.54 0.52 -1.26 -0.93 118.95 124.07 2wb9 s ARG 67 Ca -0.03 -0.65 0.02 0.00 -0.52 0.00 0.00 55.73 54.54 2wb9 s ARG 67 Cb -0.12 -2.83 -0.02 0.00 0.52 0.00 0.00 34.95 32.50 2wb9 s ARG 67 CO 0.03 -0.01 -0.14 0.71 0.02 0.00 0.00 175.30 175.91 2wb9 s TYR 68 N 0.96 2.76 0.48 -0.53 1.51 0.70 -4.96 117.35 118.27 2wb9 s TYR 68 Ca -0.01 -0.42 0.04 0.00 -1.01 0.00 0.00 57.07 55.68 2wb9 s TYR 68 Cb -0.15 -1.75 -0.03 0.00 -0.11 0.00 0.00 41.96 39.93 2wb9 s TYR 68 CO -0.00 -0.03 0.11 -0.65 -1.11 0.00 0.00 175.55 173.87 2wb9 s GLN 69 N -0.15 2.16 -0.03 -0.62 1.11 -1.26 -0.94 119.66 119.93 2wb9 s GLN 69 Ca -0.01 -2.16 -0.02 0.00 0.01 0.00 0.00 55.36 53.18 2wb9 s GLN 69 Cb -0.13 -1.74 0.01 0.00 -1.01 0.00 0.00 33.01 30.13 2wb9 s GLN 69 CO 0.03 -0.29 0.05 -1.91 0.01 0.00 0.00 175.29 173.18 2wb9 n GLU 70 N -1.29 -1.17 -0.16 2.91 4.07 -1.26 -4.17 120.64 119.58 2wb9 n GLU 70 Ca -0.10 1.25 -0.02 0.00 -0.06 0.00 0.00 57.16 58.23 2wb9 n GLU 70 Cb 0.66 -1.88 0.06 0.00 -0.06 0.00 0.00 31.44 30.22 2wb9 n GLU 70 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2wb9 h SER 71 N 1.01 -0.13 0.44 4.31 4.64 -1.88 -0.79 113.55 121.15 2wb9 h SER 71 Ca -0.11 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wb9 h SER 71 Cb 0.24 0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2wb9 h SER 71 CO 0.00 -0.04 -0.30 0.23 -0.87 0.00 0.00 176.83 175.86 2wb9 n MET 72 N -5.19 0.40 -0.03 4.77 2.81 -1.26 -1.20 117.12 117.42 2wb9 n MET 72 Ca 0.05 -0.20 -0.13 0.00 -1.81 0.00 0.00 57.70 55.61 2wb9 n MET 72 Cb 0.26 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.17 2wb9 n MET 72 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2wb9 h ALA 73 N 3.33 -0.00 -0.35 3.04 0.00 -1.52 -2.09 119.26 121.67 2wb9 h ALA 73 Ca 0.00 -0.32 0.07 0.00 0.00 0.00 0.00 54.91 54.66 2wb9 h ALA 73 Cb 0.47 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.20 2wb9 h ALA 73 CO 0.00 -0.18 -0.08 0.82 0.00 0.00 0.00 179.25 179.81 2wb9 h ILE 74 N -0.64 0.65 -0.61 0.00 2.04 -1.12 -0.04 117.51 117.78 2wb9 h ILE 74 Ca -0.00 -0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 2wb9 h ILE 74 Cb 0.64 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 2wb9 h ILE 74 CO 0.00 0.00 0.23 0.00 0.00 0.00 0.00 178.15 178.38 2wb9 h ALA 75 N 1.35 0.79 -0.47 1.87 0.00 -1.26 -1.05 119.26 120.49 2wb9 h ALA 75 Ca 0.17 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2wb9 h ALA 75 Cb 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2wb9 h ALA 75 CO -0.36 0.42 -0.06 0.00 0.00 0.00 0.00 179.25 179.25 2wb9 h ARG 76 N 0.85 0.83 -0.31 0.00 3.08 -1.02 0.19 114.38 118.00 2wb9 h ARG 76 Ca 0.20 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 2wb9 h ARG 76 Cb 0.23 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 2wb9 h ARG 76 CO -0.01 0.87 0.00 1.25 -1.07 0.00 0.00 179.97 181.01 2wb9 h LEU 77 N 0.76 0.53 -0.17 3.04 5.85 -0.54 0.13 115.31 124.91 2wb9 h LEU 77 Ca 0.13 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 2wb9 h LEU 77 Cb 0.55 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2wb9 h LEU 77 CO 0.03 0.70 0.08 -0.07 -0.34 0.00 0.00 178.44 178.85 2wb9 h LEU 78 N 0.34 0.22 -0.77 2.25 3.38 -1.09 -2.37 115.31 117.27 2wb9 h LEU 78 Ca 0.09 -0.13 0.05 0.00 0.09 0.00 0.00 57.88 57.99 2wb9 h LEU 78 Cb 0.43 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 2wb9 h LEU 78 CO 0.01 0.28 0.47 0.00 0.09 0.00 0.00 178.44 179.30 2wb9 h ALA 79 N 0.94 1.04 -0.53 1.53 0.00 -0.34 0.51 119.26 122.43 2wb9 h ALA 79 Ca 0.06 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2wb9 h ALA 79 Cb 0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2wb9 h ALA 79 CO -0.01 0.20 0.29 -0.09 0.00 0.00 0.00 179.25 179.65 2wb9 h ARG 80 N 0.87 0.73 -0.27 0.00 2.43 -0.58 0.75 114.38 118.32 2wb9 h ARG 80 Ca 0.33 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2wb9 h ARG 80 Cb 0.14 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 2wb9 h ARG 80 CO -0.16 0.57 0.16 0.37 -1.51 0.00 0.00 179.97 179.40 2wb9 h GLN 81 N 0.70 0.36 -0.65 0.20 4.15 -0.65 -1.81 115.11 117.41 2wb9 h GLN 81 Ca 0.19 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.58 2wb9 h GLN 81 Cb 0.05 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.66 2wb9 h GLN 81 CO -0.03 0.25 0.00 1.19 -1.93 0.00 0.00 178.83 178.31 2wb9 n PHE 82 N -4.48 0.99 -3.73 3.99 0.99 0.03 -4.94 117.46 110.31 2wb9 n PHE 82 Ca 0.01 -0.46 -0.26 0.00 -0.00 0.00 0.00 57.45 56.74 2wb9 n PHE 82 Cb 0.08 -0.06 0.05 0.00 -1.00 0.00 0.00 39.48 38.56 2wb9 n PHE 82 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2wb9 n LYS 83 N 1.29 -6.59 -0.47 -1.08 4.76 -0.65 -4.89 118.16 110.53 2wb9 n LYS 83 Ca 0.22 0.72 0.07 0.00 -2.87 0.00 0.00 58.31 56.44 2wb9 n LYS 83 Cb 0.61 -5.66 0.19 0.00 -1.84 0.00 0.00 35.03 28.34 2wb9 n LYS 83 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2wb9 n MET 84 N -4.74 1.54 -0.02 1.97 2.81 0.17 -4.60 117.12 114.24 2wb9 n MET 84 Ca -0.03 -3.10 0.02 0.00 -1.81 0.00 0.00 57.70 52.78 2wb9 n MET 84 Cb 0.56 -1.60 0.03 0.00 -0.71 0.00 0.00 33.22 31.50 2wb9 n MET 84 CO 0.00 0.00 0.00 -0.12 1.51 0.00 0.00 175.97 177.36 2wb9 n MET 85 N -1.20 2.43 0.00 0.03 0.00 -1.24 -0.87 117.12 116.28 2wb9 n MET 85 Ca 0.19 -1.63 0.00 0.00 0.00 0.00 0.00 57.70 56.26 2wb9 n MET 85 Cb 0.70 -1.05 0.00 0.00 0.00 0.00 0.00 33.22 32.87 2wb9 n MET 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2wb9 n GLY 86 N -0.64 2.44 0.35 -5.12 0.00 -1.26 -4.21 105.19 96.76 2wb9 n GLY 86 Ca 0.03 -1.71 0.08 0.00 0.00 0.00 0.00 46.02 44.42 2wb9 n GLY 86 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wb9 n GLU 87 N 1.40 1.67 -4.20 1.61 1.02 -1.26 -4.83 120.64 116.04 2wb9 n GLU 87 Ca 0.00 -0.78 -0.12 0.00 -0.02 0.00 0.00 57.16 56.24 2wb9 n GLU 87 Cb 0.00 -1.28 -0.10 0.00 -0.02 0.00 0.00 31.44 30.04 2wb9 n GLU 87 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2wb9 s THR 88 N -1.94 0.45 0.28 2.62 -4.23 -1.26 -5.02 115.64 106.54 2wb9 s THR 88 Ca 0.13 -1.95 -0.03 0.00 -1.18 0.00 0.00 61.69 58.66 2wb9 s THR 88 Cb 0.13 -2.08 0.27 0.00 1.34 0.00 0.00 72.50 72.16 2wb9 s THR 88 CO 0.42 -0.49 1.93 0.44 -0.54 0.00 0.00 174.62 176.39 2wb9 h ASP 89 N 2.77 1.04 -0.47 3.99 5.19 -1.98 -1.39 116.42 125.56 2wb9 h ASP 89 Ca -0.36 -0.02 0.03 0.00 -0.62 0.00 0.00 57.03 56.07 2wb9 h ASP 89 Cb 1.20 -0.25 -0.04 0.00 0.18 0.00 0.00 39.33 40.43 2wb9 h ASP 89 CO 0.62 0.73 0.25 -0.08 -3.12 0.00 0.00 179.24 177.63 2wb9 h GLU 90 N 1.21 0.49 -0.75 3.56 4.81 -1.99 -0.22 114.58 121.68 2wb9 h GLU 90 Ca 0.36 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.53 2wb9 h GLU 90 Cb -0.04 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 2wb9 h GLU 90 CO -0.10 0.32 0.36 0.93 -0.73 0.00 0.00 179.01 179.79 2wb9 h GLU 91 N 0.50 1.09 -0.51 1.92 5.08 -1.83 -0.87 114.58 119.96 2wb9 h GLU 91 Ca 0.20 -0.16 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2wb9 h GLU 91 Cb 0.08 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2wb9 h GLU 91 CO -0.12 0.85 0.32 -0.92 -1.00 0.00 0.00 179.01 178.13 2wb9 h TYR 92 N 1.06 0.60 -0.42 4.33 3.20 -1.09 -0.83 116.97 123.81 2wb9 h TYR 92 Ca 0.26 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.10 2wb9 h TYR 92 Cb 0.12 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 2wb9 h TYR 92 CO 0.01 0.35 0.09 -0.92 -1.64 0.00 0.00 178.16 176.05 2wb9 h TYR 93 N 0.64 0.73 -0.95 -3.82 3.20 -0.56 0.10 116.97 116.30 2wb9 h TYR 93 Ca 0.20 -0.09 0.06 0.00 3.14 0.00 0.00 58.73 62.04 2wb9 h TYR 93 Cb -0.01 -0.20 -0.06 0.00 1.54 0.00 0.00 36.73 37.99 2wb9 h TYR 93 CO -0.06 0.69 0.61 -0.07 -1.64 0.00 0.00 178.16 177.69 2wb9 h LEU 94 N 0.55 0.98 0.19 2.82 3.38 -0.75 0.31 115.31 122.80 2wb9 h LEU 94 Ca 0.13 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2wb9 h LEU 94 Cb 0.34 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2wb9 h LEU 94 CO 0.00 0.63 -0.09 0.40 0.09 0.00 0.00 178.44 179.48 2wb9 h ILE 95 N 1.12 0.90 -0.94 1.22 2.04 -0.69 -2.23 117.51 118.93 2wb9 h ILE 95 Ca 0.41 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.90 2wb9 h ILE 95 Cb 0.14 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.32 2wb9 h ILE 95 CO -0.16 0.10 0.61 -0.33 0.00 0.00 0.00 178.15 178.37 2wb9 h GLU 96 N -0.47 1.03 -0.20 2.37 4.39 -0.18 -0.82 114.58 120.70 2wb9 h GLU 96 Ca -0.03 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 2wb9 h GLU 96 Cb 0.36 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 2wb9 h GLU 96 CO 0.04 0.68 0.12 -0.09 -1.16 0.00 0.00 179.01 178.60 2wb9 h ARG 97 N 1.06 0.27 -0.09 2.33 2.43 -0.27 -0.17 114.38 119.94 2wb9 h ARG 97 Ca 0.41 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.47 2wb9 h ARG 97 Cb 0.23 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 2wb9 h ARG 97 CO -0.17 0.23 -0.35 0.97 -1.51 0.00 0.00 179.97 179.14 2wb9 h ILE 98 N 0.24 1.27 -0.32 1.20 6.09 -1.16 -1.75 117.51 123.10 2wb9 h ILE 98 Ca 0.07 -1.32 -0.18 0.00 -1.37 0.00 0.00 64.86 62.07 2wb9 h ILE 98 Cb 0.02 1.60 -0.00 0.00 0.47 0.00 0.00 36.82 38.91 2wb9 h ILE 98 CO -0.01 0.39 -0.51 0.40 -3.07 0.00 0.00 178.15 175.35 2wb9 h ILE 99 N 0.15 1.27 -0.53 2.19 2.04 -0.92 0.23 117.51 121.94 2wb9 h ILE 99 Ca 0.02 -1.69 0.03 0.00 1.00 0.00 0.00 64.86 64.22 2wb9 h ILE 99 Cb 0.69 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 38.29 2wb9 h ILE 99 CO 0.05 0.56 0.30 1.23 0.00 0.00 0.00 178.15 180.29 2wb9 h GLY 100 N 0.71 0.76 0.88 5.37 0.00 -0.74 0.36 103.07 110.41 2wb9 h GLY 100 Ca 0.03 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.06 2wb9 h GLY 100 CO 0.12 0.17 -0.13 0.83 0.00 0.00 0.00 176.54 177.53 2wb9 h GLU 101 N 0.60 0.56 -0.02 4.80 5.08 -1.09 -2.72 114.58 121.79 2wb9 h GLU 101 Ca 0.22 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 2wb9 h GLU 101 Cb 0.07 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2wb9 h GLU 101 CO -0.12 0.81 -0.30 0.00 -1.00 0.00 0.00 179.01 178.39 2wb9 h GLU 103 N 0.03 1.05 -0.27 0.00 4.39 0.02 0.37 114.58 120.17 2wb9 h GLU 103 Ca 0.00 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 2wb9 h GLU 103 Cb 0.56 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 2wb9 h GLU 103 CO 0.04 0.69 0.14 -0.44 -1.16 0.00 0.00 179.01 178.28 2wb9 h ASP 104 N 1.08 0.35 -0.52 1.42 3.32 -1.26 -2.19 116.42 118.61 2wb9 h ASP 104 Ca 0.35 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.24 2wb9 h ASP 104 Cb 0.02 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2wb9 h ASP 104 CO -0.12 0.36 0.13 0.25 -1.72 0.00 0.00 179.24 178.14 2wb9 h LEU 105 N 0.31 0.79 -0.43 1.55 5.85 -0.78 -2.69 115.31 119.92 2wb9 h LEU 105 Ca 0.09 -0.23 0.07 0.00 0.84 0.00 0.00 57.88 58.66 2wb9 h LEU 105 Cb 0.09 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 2wb9 h LEU 105 CO -0.01 0.81 0.07 0.22 -0.34 0.00 0.00 178.44 179.19 2wb9 h TYR 106 N 0.73 0.11 -0.94 1.25 3.20 -0.15 -1.20 116.97 119.97 2wb9 h TYR 106 Ca 0.16 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.10 2wb9 h TYR 106 Cb 0.33 0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.56 2wb9 h TYR 106 CO 0.02 -0.01 0.62 0.00 -1.64 0.00 0.00 178.16 177.15 2wb9 h ARG 107 N 0.20 1.13 -0.22 1.82 2.47 -1.17 0.16 114.38 118.77 2wb9 h ARG 107 Ca 0.21 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 58.83 2wb9 h ARG 107 Cb 0.27 -0.26 -0.01 0.00 -1.65 0.00 0.00 29.97 28.32 2wb9 h ARG 107 CO -0.29 0.75 0.02 0.93 0.56 0.00 0.00 179.97 181.94 2wb9 h GLU 108 N 1.17 0.38 -0.04 0.04 4.39 -1.01 -1.51 114.58 118.01 2wb9 h GLU 108 Ca 0.38 -0.11 -0.17 0.00 0.34 0.00 0.00 59.36 59.79 2wb9 h GLU 108 Cb 0.04 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2wb9 h GLU 108 CO -0.12 0.55 -0.74 -0.39 -1.16 0.00 0.00 179.01 177.15 2wb9 h VAL 109 N 0.17 1.44 -0.74 3.13 -1.51 -0.85 -2.18 116.25 115.71 2wb9 h VAL 109 Ca 0.07 -2.29 0.01 0.00 -1.23 0.00 0.00 66.70 63.25 2wb9 h VAL 109 Cb 0.36 2.22 -0.04 0.00 -2.13 0.00 0.00 31.29 31.71 2wb9 h VAL 109 CO 0.01 0.67 0.48 0.22 -1.23 0.00 0.00 177.57 177.72 2wb9 h TYR 110 N 0.15 0.94 -0.71 5.19 3.20 -0.64 -0.04 116.97 125.06 2wb9 h TYR 110 Ca -0.02 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 2wb9 h TYR 110 Cb 1.30 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 2wb9 h TYR 110 CO 0.03 0.60 0.22 1.15 -1.64 0.00 0.00 178.16 178.51 2wb9 h THR 111 N 1.01 1.26 -0.18 1.81 2.02 -1.01 -0.22 112.91 117.59 2wb9 h THR 111 Ca 0.27 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 2wb9 h THR 111 Cb -0.10 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 2wb9 h THR 111 CO -0.06 0.35 0.04 0.40 0.37 0.00 0.00 175.52 176.63 2wb9 h ILE 112 N 1.06 1.20 -0.95 3.11 2.04 -0.74 -2.60 117.51 120.63 2wb9 h ILE 112 Ca 0.23 -0.65 0.15 0.00 1.00 0.00 0.00 64.86 65.60 2wb9 h ILE 112 Cb 0.30 1.29 -0.08 0.00 -0.74 0.00 0.00 36.82 37.59 2wb9 h ILE 112 CO -0.01 0.20 0.60 0.15 0.00 0.00 0.00 178.15 179.09 2wb9 h PHE 113 N 0.10 0.92 -0.01 1.37 3.57 -0.57 -0.77 116.94 121.56 2wb9 h PHE 113 Ca 0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.58 2wb9 h PHE 113 Cb 0.26 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.72 2wb9 h PHE 113 CO 0.01 0.31 -0.02 0.54 -2.23 0.00 0.00 178.31 176.91 2wb9 n ARG 114 N -4.61 1.18 -3.06 1.11 5.12 -0.13 -4.86 116.66 111.42 2wb9 n ARG 114 Ca 0.19 -0.41 -0.40 0.00 -1.93 0.00 0.00 57.85 55.31 2wb9 n ARG 114 Cb 0.49 -1.49 -0.05 0.00 -1.16 0.00 0.00 32.46 30.25 2wb9 n ARG 114 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2wb9 s THR 115 N -2.10 4.84 0.48 0.55 2.01 -0.30 -5.02 115.64 116.11 2wb9 s THR 115 Ca 0.40 1.49 -0.21 0.00 0.31 0.00 0.00 61.69 63.68 2wb9 s THR 115 Cb 0.21 -4.05 -0.10 0.00 0.01 0.00 0.00 72.50 68.57 2wb9 s THR 115 CO 0.38 0.36 0.66 -2.65 -0.69 0.00 0.00 174.62 172.67 2wb9 n PRO 116 N 2.97 0.73 -0.23 4.92 -0.02 -1.26 -4.61 135.00 137.50 2wb9 n PRO 116 Ca -0.03 0.27 0.04 0.00 -2.02 0.00 0.00 63.50 61.75 2wb9 n PRO 116 Cb 0.51 -1.72 0.09 0.00 -0.02 0.00 0.00 33.50 32.35 2wb9 n PRO 116 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2wb9 n GLN 117 N 0.17 -0.06 0.00 -0.52 7.27 -1.26 0.18 117.38 123.16 2wb9 n GLN 117 Ca 0.11 0.98 0.00 0.00 0.07 0.00 0.00 57.00 58.17 2wb9 n GLN 117 Cb 0.43 -1.47 0.00 0.00 2.41 0.00 0.00 30.24 31.61 2wb9 n GLN 117 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2wb9 n GLY 118 N -1.40 1.62 0.00 1.69 0.00 -1.26 -4.08 105.19 101.76 2wb9 n GLY 118 Ca 0.10 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2wb9 n GLY 118 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wb9 n GLU 119 N 0.00 0.31 -0.17 1.61 1.02 0.47 -4.78 120.64 119.10 2wb9 n GLU 119 Ca 0.00 -0.53 -0.09 0.00 -0.02 0.00 0.00 57.16 56.52 2wb9 n GLU 119 Cb 0.00 -0.57 0.01 0.00 -0.02 0.00 0.00 31.44 30.86 2wb9 n GLU 119 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2wb9 h LYS 120 N 0.00 0.80 -0.32 3.49 3.64 -1.52 -3.08 116.57 119.57 2wb9 h LYS 120 Ca 0.00 -0.20 -0.08 0.00 -1.27 0.00 0.00 60.65 59.10 2wb9 h LYS 120 Cb 0.83 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 2wb9 h LYS 120 CO 0.00 0.78 -0.14 1.49 -2.27 0.00 0.00 179.45 179.31 2wb9 h GLU 121 N 0.68 0.56 -0.56 1.90 4.57 -1.86 0.68 114.58 120.54 2wb9 h GLU 121 Ca 0.15 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 2wb9 h GLU 121 Cb 0.36 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 2wb9 h GLU 121 CO 0.00 0.69 0.29 0.00 -1.18 0.00 0.00 179.01 178.82 2wb9 h ALA 122 N 1.34 0.72 -0.03 2.92 0.00 -1.93 -1.38 119.26 120.89 2wb9 h ALA 122 Ca 0.09 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2wb9 h ALA 122 Cb 0.55 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2wb9 h ALA 122 CO 0.03 0.25 -0.45 0.87 0.00 0.00 0.00 179.25 179.96 2wb9 h LYS 123 N 0.75 0.08 -0.43 0.00 1.79 -0.95 -1.65 116.57 116.16 2wb9 h LYS 123 Ca 0.19 -0.04 -0.12 0.00 -2.18 0.00 0.00 60.65 58.50 2wb9 h LYS 123 Cb 0.08 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 2wb9 h LYS 123 CO -0.03 0.51 -0.21 0.82 -1.08 0.00 0.00 179.45 179.46 2wb9 h ILE 124 N 0.06 1.28 -0.17 1.86 2.04 -0.64 -0.14 117.51 121.80 2wb9 h ILE 124 Ca 0.00 -1.36 0.01 0.00 1.00 0.00 0.00 64.86 64.51 2wb9 h ILE 124 Cb 0.82 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 2wb9 h ILE 124 CO 0.06 0.46 0.08 0.50 0.00 0.00 0.00 178.15 179.25 2wb9 h LYS 125 N 0.73 0.17 -0.13 2.37 3.64 -1.02 -0.71 116.57 121.63 2wb9 h LYS 125 Ca 0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2wb9 h LYS 125 Cb 0.78 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 2wb9 h LYS 125 CO 0.06 0.11 0.08 1.49 -2.27 0.00 0.00 179.45 178.93 2wb9 h GLU 126 N 0.17 0.17 -0.35 1.90 4.81 -1.15 -1.86 114.58 118.27 2wb9 h GLU 126 Ca 0.07 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.36 2wb9 h GLU 126 Cb 0.02 -0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.30 2wb9 h GLU 126 CO -0.05 0.13 -0.07 0.35 -0.73 0.00 0.00 179.01 178.63 2wb9 h PHE 127 N 0.16 -0.16 0.00 0.92 3.04 -0.68 0.36 116.94 120.58 2wb9 h PHE 127 Ca 0.05 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.02 2wb9 h PHE 127 Cb -0.00 0.13 -0.00 0.00 2.56 0.00 0.00 35.95 38.63 2wb9 h PHE 127 CO -0.06 -0.14 -0.04 0.87 -2.02 0.00 0.00 178.31 176.91 2wb9 h LYS 128 N 0.01 0.00 0.00 1.11 1.57 -0.85 0.66 116.57 119.08 2wb9 h LYS 128 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2wb9 h LYS 128 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2wb9 h LYS 128 CO -0.35 0.04 -1.41 0.39 -0.57 0.00 0.00 179.45 177.54 2wb9 n GLU 129 N -4.32 0.43 0.00 3.15 1.02 -0.72 -4.42 120.64 115.77 2wb9 n GLU 129 Ca -0.03 -0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 2wb9 n GLU 129 Cb 0.13 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 2wb9 n GLU 129 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2wb9 n ASN 130 N -2.09 0.00 0.21 1.62 3.02 0.07 -4.88 115.26 113.21 2wb9 n ASN 130 Ca -0.00 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.63 2wb9 n ASN 130 Cb 0.49 0.00 0.41 0.00 -0.61 0.00 0.00 39.78 40.07 2wb9 n ASN 130 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2wb9 h ASN 131 N 0.00 0.00 0.11 6.41 2.35 -1.74 -2.96 115.58 119.75 2wb9 h ASN 131 Ca 0.00 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.76 2wb9 h ASN 131 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 2wb9 h ASN 131 CO 0.00 0.26 -0.37 1.23 -1.65 0.00 0.00 177.43 176.90 2wb9 h GLY 132 N 2.16 -1.18 1.02 2.83 0.00 -1.15 0.19 103.07 106.93 2wb9 h GLY 132 Ca -0.00 0.60 0.03 0.00 0.00 0.00 0.00 47.33 47.96 2wb9 h GLY 132 CO 0.03 -0.33 0.60 -2.55 0.00 0.00 0.00 176.54 174.29 2wb9 h PRO 133 N -0.54 1.13 -0.19 4.80 0.11 -1.70 0.43 132.00 136.03 2wb9 h PRO 133 Ca -0.01 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 2wb9 h PRO 133 Cb 0.54 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 2wb9 h PRO 133 CO -0.19 0.74 0.06 1.15 -0.21 0.00 0.00 178.00 179.56 2wb9 h THR 134 N 1.16 1.18 -0.09 -1.15 2.02 -1.31 -0.29 112.91 114.43 2wb9 h THR 134 Ca 0.35 -0.56 -0.20 0.00 0.77 0.00 0.00 66.41 66.77 2wb9 h THR 134 Cb -0.02 1.20 0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2wb9 h THR 134 CO -0.10 0.18 -0.74 -0.07 0.37 0.00 0.00 175.52 175.16 2wb9 h LEU 135 N 0.14 0.80 -1.34 2.58 3.38 -0.19 -2.78 115.31 117.90 2wb9 h LEU 135 Ca 0.06 -0.67 -0.06 0.00 0.09 0.00 0.00 57.88 57.30 2wb9 h LEU 135 Cb 0.21 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2wb9 h LEU 135 CO -0.00 1.35 -0.23 -0.07 0.09 0.00 0.00 178.44 179.57 2wb9 h LEU 136 N 0.32 0.14 -0.48 1.67 3.38 -0.18 -0.65 115.31 119.51 2wb9 h LEU 136 Ca -0.07 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 2wb9 h LEU 136 Cb 1.39 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 42.08 2wb9 h LEU 136 CO 0.15 0.38 0.15 0.50 0.09 0.00 0.00 178.44 179.71 2wb9 h LYS 137 N 0.13 0.76 0.18 1.13 3.64 -0.99 0.14 116.57 121.56 2wb9 h LYS 137 Ca 0.02 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2wb9 h LYS 137 Cb 0.49 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2wb9 h LYS 137 CO 0.03 0.72 -0.11 -0.07 -2.27 0.00 0.00 179.45 177.75 2wb9 h LEU 138 N 0.65 -0.28 -0.63 5.20 3.38 -1.14 0.14 115.31 122.63 2wb9 h LEU 138 Ca 0.16 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2wb9 h LEU 138 Cb 0.28 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2wb9 h LEU 138 CO -0.00 -0.18 0.41 0.58 0.09 0.00 0.00 178.44 179.33 2wb9 h VAL 139 N -0.28 1.17 -0.72 1.22 2.07 -0.99 0.10 116.25 118.82 2wb9 h VAL 139 Ca -0.02 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2wb9 h VAL 139 Cb 0.24 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 2wb9 h VAL 139 CO 0.01 0.17 0.46 0.77 0.02 0.00 0.00 177.57 179.00 2wb9 h SER 140 N 0.86 0.85 -0.80 0.57 4.64 -0.43 -1.51 113.55 117.72 2wb9 h SER 140 Ca 0.23 -0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.47 2wb9 h SER 140 Cb -0.08 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 61.76 2wb9 h SER 140 CO -0.05 0.64 0.35 -0.33 -0.87 0.00 0.00 176.83 176.57 2wb9 h GLU 141 N 0.98 1.18 0.29 4.77 5.08 -0.64 0.79 114.58 127.03 2wb9 h GLU 141 Ca 0.26 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2wb9 h GLU 141 Cb -0.07 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 28.98 2wb9 h GLU 141 CO -0.05 0.93 -0.14 0.77 -1.00 0.00 0.00 179.01 179.52 2wb9 h SER 142 N 1.16 -0.33 -0.45 1.42 0.02 -0.72 -0.19 113.55 114.45 2wb9 h SER 142 Ca 0.27 -0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.18 2wb9 h SER 142 Cb 0.17 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 2wb9 h SER 142 CO -0.03 -0.22 0.15 0.25 -1.14 0.00 0.00 176.83 175.85 2wb9 h LEU 143 N -0.41 0.70 -0.53 5.07 5.85 -1.01 -2.86 115.31 122.12 2wb9 h LEU 143 Ca -0.04 -0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.51 2wb9 h LEU 143 Cb 0.31 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 2wb9 h LEU 143 CO 0.07 0.67 0.09 -0.08 -0.34 0.00 0.00 178.44 178.84 2wb9 h GLU 144 N 0.74 0.88 -0.12 1.25 4.81 -0.47 -0.63 114.58 121.03 2wb9 h GLU 144 Ca 0.17 -0.23 0.04 0.00 -0.13 0.00 0.00 59.36 59.20 2wb9 h GLU 144 Cb 0.22 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.50 2wb9 h GLU 144 CO -0.01 0.86 0.12 0.66 -0.73 0.00 0.00 179.01 179.91 2wb9 h SER 145 N 0.77 0.00 -0.50 1.04 4.64 -0.81 0.58 113.55 119.26 2wb9 h SER 145 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2wb9 h SER 145 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2wb9 h SER 145 CO 0.01 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.43 2wb9 n SER 146 N -3.99 3.55 0.00 4.97 3.41 -0.86 -4.96 113.62 115.75 2wb9 n SER 146 Ca 0.00 -2.12 0.00 0.00 -0.26 0.00 0.00 58.87 56.49 2wb9 n SER 146 Cb 0.23 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 2wb9 n SER 146 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wb9 n GLY 147 N 0.89 0.69 1.69 5.00 0.00 0.19 -4.60 105.19 109.05 2wb9 n GLY 147 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2wb9 n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wb9 n GLY 148 N -1.23 3.29 0.10 -0.02 0.00 -0.30 -4.76 105.19 102.26 2wb9 n GLY 148 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2wb9 n GLY 148 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wb9 n LYS 149 N -1.99 0.77 -4.03 1.61 4.76 -1.26 -4.67 118.16 113.35 2wb9 n LYS 149 Ca 0.00 0.08 -0.13 0.00 -2.87 0.00 0.00 58.31 55.39 2wb9 n LYS 149 Cb 0.00 -1.43 -0.13 0.00 -1.84 0.00 0.00 35.03 31.63 2wb9 n LYS 149 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2wb9 s HIS 150 N -2.42 0.35 0.11 2.13 3.76 -1.26 -4.90 115.29 113.05 2wb9 s HIS 150 Ca -0.22 -0.21 0.25 0.00 -0.15 0.00 0.00 55.06 54.73 2wb9 s HIS 150 Cb 0.07 -0.22 0.92 0.00 1.11 0.00 0.00 32.58 34.46 2wb9 s HIS 150 CO 0.55 -0.05 1.82 -0.39 -0.85 0.00 0.00 174.74 175.83 2wb9 h VAL 151 N 4.90 0.49 -2.31 -0.90 -1.51 -1.89 -3.42 116.25 111.62 2wb9 h VAL 151 Ca -0.29 -1.09 -0.07 0.00 -1.23 0.00 0.00 66.70 64.02 2wb9 h VAL 151 Cb 1.20 1.77 -0.22 0.00 -2.13 0.00 0.00 31.29 31.91 2wb9 h VAL 151 CO 0.47 0.20 -0.01 0.00 -1.23 0.00 0.00 177.57 177.00 2wb9 s ALA 152 N -3.62 -1.46 0.00 5.19 0.00 -1.26 -4.71 121.76 115.90 2wb9 s ALA 152 Ca 0.01 1.58 0.00 0.00 0.00 0.00 0.00 51.96 53.55 2wb9 s ALA 152 Cb 0.10 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.39 2wb9 s ALA 152 CO 0.63 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.51 2wb9 n GLY 153 N 2.52 0.74 1.70 0.00 0.00 -1.26 -4.08 105.19 104.82 2wb9 n GLY 153 Ca -0.15 -0.86 -0.05 0.00 0.00 0.00 0.00 46.02 44.96 2wb9 n GLY 153 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wb9 n ASN 154 N -2.74 2.55 -4.07 1.61 3.02 -1.26 -4.77 115.26 109.61 2wb9 n ASN 154 Ca 0.00 -3.08 -0.10 0.00 -0.03 0.00 0.00 54.58 51.36 2wb9 n ASN 154 Cb 0.00 -0.42 -0.07 0.00 -0.61 0.00 0.00 39.78 38.68 2wb9 n ASN 154 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wb9 s ARG 155 N -2.86 1.33 0.26 3.52 1.70 -1.26 -5.04 118.95 116.61 2wb9 s ARG 155 Ca 0.39 -1.38 -0.31 0.00 -0.47 0.00 0.00 55.73 53.96 2wb9 s ARG 155 Cb 0.38 0.38 -0.12 0.00 -0.57 0.00 0.00 34.95 35.01 2wb9 s ARG 155 CO -0.05 -0.50 1.64 -0.89 -1.08 0.00 0.00 175.30 174.42 2wb9 n ILE 156 N -0.30 0.63 -4.41 4.99 5.41 -1.26 -4.78 119.36 119.64 2wb9 n ILE 156 Ca -0.01 -0.16 -0.20 0.00 1.00 0.00 0.00 62.75 63.38 2wb9 n ILE 156 Cb 0.64 -1.96 -0.10 0.00 -0.71 0.00 0.00 39.64 37.51 2wb9 n ILE 156 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2wb9 s THR 157 N 0.44 0.97 0.46 1.39 -4.23 -1.26 -4.82 115.64 108.58 2wb9 s THR 157 Ca 0.68 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.36 2wb9 s THR 157 Cb -0.51 -2.73 0.35 0.00 1.34 0.00 0.00 72.50 70.95 2wb9 s THR 157 CO 0.42 0.00 1.98 0.25 -0.54 0.00 0.00 174.62 176.74 2wb9 h LEU 158 N 2.19 0.27 -0.50 4.79 5.85 -1.40 -1.93 115.31 124.59 2wb9 h LEU 158 Ca -0.40 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.34 2wb9 h LEU 158 Cb 1.25 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 2wb9 h LEU 158 CO 0.66 0.16 0.33 1.23 -0.34 0.00 0.00 178.44 180.48 2wb9 h GLY 159 N 0.30 0.70 1.00 3.75 0.00 -1.85 0.11 103.07 107.09 2wb9 h GLY 159 Ca 0.27 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 2wb9 h GLY 159 CO -0.06 0.25 0.41 -0.55 0.00 0.00 0.00 176.54 176.59 2wb9 h ASP 160 N 0.67 0.85 -0.29 0.19 3.32 -1.81 -0.93 116.42 118.41 2wb9 h ASP 160 Ca 0.18 -0.07 -0.16 0.00 0.02 0.00 0.00 57.03 57.01 2wb9 h ASP 160 Cb -0.07 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 2wb9 h ASP 160 CO -0.05 0.67 -0.42 -0.07 -1.72 0.00 0.00 179.24 177.65 2wb9 h LEU 161 N 0.95 0.91 -0.59 1.55 3.38 -0.80 0.94 115.31 121.65 2wb9 h LEU 161 Ca 0.25 -0.43 -0.15 0.00 0.09 0.00 0.00 57.88 57.64 2wb9 h LEU 161 Cb -0.02 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 2wb9 h LEU 161 CO -0.05 1.21 -0.54 0.15 0.09 0.00 0.00 178.44 179.30 2wb9 h PHE 162 N 0.69 0.58 -0.39 1.13 3.57 -0.92 -1.14 116.94 120.46 2wb9 h PHE 162 Ca 0.05 -0.20 0.02 0.00 3.53 0.00 0.00 57.97 61.37 2wb9 h PHE 162 Cb 1.00 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.60 2wb9 h PHE 162 CO 0.06 0.90 0.23 1.25 -2.23 0.00 0.00 178.31 178.51 2wb9 h LEU 163 N 0.36 0.37 -0.11 0.59 5.85 -0.98 -1.56 115.31 119.82 2wb9 h LEU 163 Ca 0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2wb9 h LEU 163 Cb 1.06 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 2wb9 h LEU 163 CO 0.10 0.26 0.07 0.15 -0.34 0.00 0.00 178.44 178.68 2wb9 h PHE 164 N 0.46 0.14 -0.21 1.25 3.04 -0.39 0.68 116.94 121.91 2wb9 h PHE 164 Ca 0.16 0.00 -0.09 0.00 3.98 0.00 0.00 57.97 62.02 2wb9 h PHE 164 Cb 0.01 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 38.46 2wb9 h PHE 164 CO -0.07 0.09 -0.24 1.79 -2.02 0.00 0.00 178.31 177.86 2wb9 h THR 165 N 0.15 1.25 -0.17 4.41 1.35 -1.14 -0.30 112.91 118.45 2wb9 h THR 165 Ca 0.04 -1.19 -0.16 0.00 -0.55 0.00 0.00 66.41 64.55 2wb9 h THR 165 Cb -0.02 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 2wb9 h THR 165 CO -0.01 0.37 -0.53 0.74 -0.25 0.00 0.00 175.52 175.84 2wb9 h THR 166 N 0.35 1.32 -0.47 6.82 2.02 -0.92 -2.20 112.91 119.83 2wb9 h THR 166 Ca 0.06 -1.78 -0.04 0.00 0.77 0.00 0.00 66.41 65.42 2wb9 h THR 166 Cb 0.61 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 68.96 2wb9 h THR 166 CO 0.04 0.55 0.14 -0.07 0.37 0.00 0.00 175.52 176.56 2wb9 h LEU 167 N 0.35 0.64 -0.73 2.58 3.38 -0.53 -1.30 115.31 119.70 2wb9 h LEU 167 Ca -0.02 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 57.92 2wb9 h LEU 167 Cb 1.16 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 2wb9 h LEU 167 CO 0.11 0.62 0.42 0.74 0.09 0.00 0.00 178.44 180.43 2wb9 h THR 168 N 0.69 0.98 -0.61 0.22 2.02 -0.72 0.73 112.91 116.22 2wb9 h THR 168 Ca 0.16 -0.26 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 2wb9 h THR 168 Cb 0.22 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 66.75 2wb9 h THR 168 CO -0.01 0.14 0.18 0.45 0.37 0.00 0.00 175.52 176.65 2wb9 h HIS 169 N 0.77 0.99 -0.48 3.16 3.86 -0.68 -0.08 115.15 122.69 2wb9 h HIS 169 Ca 0.33 -0.10 -0.02 0.00 -1.16 0.00 0.00 60.37 59.41 2wb9 h HIS 169 Cb 0.20 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 2wb9 h HIS 169 CO -0.06 0.82 0.21 0.28 0.86 0.00 0.00 177.93 180.04 2wb9 h VAL 170 N 0.87 1.20 -0.82 2.45 2.07 -0.66 0.49 116.25 121.85 2wb9 h VAL 170 Ca 0.19 -0.59 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 2wb9 h VAL 170 Cb 0.30 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2wb9 h VAL 170 CO -0.00 0.23 0.50 0.24 0.02 0.00 0.00 177.57 178.56 2wb9 h MET 171 N 0.63 1.11 -0.01 1.57 2.86 -0.41 0.02 114.93 120.70 2wb9 h MET 171 Ca 0.16 -0.09 -0.21 0.00 -2.06 0.00 0.00 59.70 57.50 2wb9 h MET 171 Cb 0.16 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.58 2wb9 h MET 171 CO -0.02 0.77 -0.89 0.93 1.06 0.00 0.00 176.91 178.77 2wb9 h GLU 172 N 1.13 0.36 0.05 1.72 5.08 -0.91 -3.31 114.58 118.70 2wb9 h GLU 172 Ca 0.30 -0.37 -0.27 0.00 -1.00 0.00 0.00 59.36 58.01 2wb9 h GLU 172 Cb -0.06 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2wb9 h GLU 172 CO -0.06 1.04 -1.42 1.15 -1.00 0.00 0.00 179.01 178.72 2wb9 h THR 173 N 0.21 1.24 -2.12 1.13 2.02 -0.73 -3.40 112.91 111.25 2wb9 h THR 173 Ca -0.06 -2.95 -0.58 0.00 0.77 0.00 0.00 66.41 63.59 2wb9 h THR 173 Cb 1.51 2.70 -0.41 0.00 -1.74 0.00 0.00 68.15 70.21 2wb9 h THR 173 CO 0.15 0.78 -0.81 0.52 0.37 0.00 0.00 175.52 176.53 2wb9 n VAL 174 N -3.32 1.21 -1.73 3.16 0.31 -0.02 -5.01 118.33 112.93 2wb9 n VAL 174 Ca -0.12 -4.79 -0.42 0.00 -0.01 0.00 0.00 64.34 59.00 2wb9 n VAL 174 Cb 1.01 -1.90 -0.01 0.00 -0.91 0.00 0.00 33.84 32.04 2wb9 n VAL 174 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2wb9 n PRO 175 N 0.93 2.40 0.00 5.55 -0.02 -1.25 -2.18 135.00 140.44 2wb9 n PRO 175 Ca 0.27 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.59 2wb9 n PRO 175 Cb 0.46 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 2wb9 n PRO 175 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wb9 n GLY 176 N 0.95 2.92 0.06 -1.23 0.00 -1.26 -4.86 105.19 101.77 2wb9 n GLY 176 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 2wb9 n GLY 176 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2wb9 h PHE 177 N 0.00 0.04 -0.80 1.61 3.57 -1.78 0.07 116.94 119.65 2wb9 h PHE 177 Ca 0.00 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.51 2wb9 h PHE 177 Cb 0.00 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 2wb9 h PHE 177 CO 0.00 0.35 0.53 1.25 -2.23 0.00 0.00 178.31 178.21 2wb9 h LEU 178 N -0.28 0.89 -0.64 0.59 5.85 -1.89 -0.14 115.31 119.69 2wb9 h LEU 178 Ca 0.01 -0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 2wb9 h LEU 178 Cb 0.33 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2wb9 h LEU 178 CO 0.00 0.63 -0.24 -0.33 -0.34 0.00 0.00 178.44 178.16 2wb9 h GLU 179 N 1.04 0.81 0.06 1.25 3.07 -1.74 -0.33 114.58 118.74 2wb9 h GLU 179 Ca 0.31 -0.34 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2wb9 h GLU 179 Cb -0.04 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.84 2wb9 h GLU 179 CO -0.08 0.97 -0.03 1.96 -1.40 0.00 0.00 179.01 180.43 2wb9 h GLN 180 N 0.70 -0.08 0.00 2.33 4.20 -0.84 -3.39 115.11 118.04 2wb9 h GLN 180 Ca 0.09 0.01 -0.14 0.00 0.06 0.00 0.00 58.65 58.66 2wb9 h GLN 180 Cb 0.77 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.54 2wb9 h GLN 180 CO 0.06 0.15 -0.87 0.87 -0.67 0.00 0.00 178.83 178.37 2wb9 h LYS 181 N -1.01 0.00 -2.07 1.46 6.56 -1.06 -3.40 116.57 117.06 2wb9 h LYS 181 Ca -0.01 0.00 -0.54 0.00 -1.06 0.00 0.00 60.65 59.04 2wb9 h LYS 181 Cb 0.26 0.00 -0.40 0.00 -0.57 0.00 0.00 32.23 31.52 2wb9 h LYS 181 CO 0.01 0.51 -1.01 1.19 -2.06 0.00 0.00 179.45 178.09 2wb9 n PHE 182 N -3.14 1.01 -0.11 -1.35 3.01 -0.13 -4.96 117.46 111.79 2wb9 n PHE 182 Ca -0.02 -3.80 0.15 0.00 1.01 0.00 0.00 57.45 54.78 2wb9 n PHE 182 Cb 0.80 -0.42 0.53 0.00 -0.01 0.00 0.00 39.48 40.38 2wb9 n PHE 182 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2wb9 h PRO 183 N 3.47 0.34 -0.29 -1.08 0.13 -1.75 -1.85 132.00 130.98 2wb9 h PRO 183 Ca 0.11 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.17 2wb9 h PRO 183 Cb 0.83 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 31.87 2wb9 h PRO 183 CO 0.58 0.22 -0.01 0.87 -0.23 0.00 0.00 178.00 179.44 2wb9 h LYS 184 N 0.35 0.44 -0.23 0.86 1.57 -1.92 0.12 116.57 117.77 2wb9 h LYS 184 Ca 0.32 -0.09 -0.19 0.00 -1.87 0.00 0.00 60.65 58.82 2wb9 h LYS 184 Cb 0.75 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.00 2wb9 h LYS 184 CO -0.08 0.48 -0.59 -0.07 -0.57 0.00 0.00 179.45 178.62 2wb9 h LEU 185 N 0.43 0.91 -1.14 2.94 3.38 -1.71 -1.34 115.31 118.79 2wb9 h LEU 185 Ca 0.09 -0.57 0.01 0.00 0.09 0.00 0.00 57.88 57.51 2wb9 h LEU 185 Cb 0.29 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2wb9 h LEU 185 CO 0.01 1.32 0.58 -0.74 0.09 0.00 0.00 178.44 179.70 2wb9 h HIS 186 N 0.54 1.10 -0.54 1.13 2.76 -0.86 -0.67 115.15 118.62 2wb9 h HIS 186 Ca -0.01 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.13 2wb9 h HIS 186 Cb 1.20 -0.37 -0.02 0.00 1.55 0.00 0.00 27.41 29.77 2wb9 h HIS 186 CO 0.08 0.69 0.11 0.93 -1.30 0.00 0.00 177.93 178.44 2wb9 h GLU 187 N 1.19 0.84 -0.46 5.26 5.08 -0.68 -0.39 114.58 125.42 2wb9 h GLU 187 Ca 0.33 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.44 2wb9 h GLU 187 Cb -0.12 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 2wb9 h GLU 187 CO -0.07 0.77 0.05 0.35 -1.00 0.00 0.00 179.01 179.10 2wb9 h PHE 188 N 0.81 0.83 -0.87 4.33 3.57 -0.40 0.14 116.94 125.35 2wb9 h PHE 188 Ca 0.17 -0.13 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2wb9 h PHE 188 Cb 0.33 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 2wb9 h PHE 188 CO 0.02 0.79 0.46 1.25 -2.23 0.00 0.00 178.31 178.60 2wb9 h HIS 189 N 0.63 1.22 -0.25 0.41 2.76 -0.17 0.26 115.15 120.02 2wb9 h HIS 189 Ca 0.14 -0.04 -0.14 0.00 -2.20 0.00 0.00 60.37 58.12 2wb9 h HIS 189 Cb 0.43 -0.39 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 2wb9 h HIS 189 CO 0.03 0.86 -0.43 0.87 -1.30 0.00 0.00 177.93 177.96 2wb9 h LYS 190 N 1.23 0.61 0.00 5.26 1.57 -0.73 -3.32 116.57 121.20 2wb9 h LYS 190 Ca 0.31 -0.33 -0.18 0.00 -1.87 0.00 0.00 60.65 58.58 2wb9 h LYS 190 Cb 0.06 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 2wb9 h LYS 190 CO -0.05 0.92 -1.29 1.03 -0.57 0.00 0.00 179.45 179.50 2wb9 h SER 191 N 0.50 0.00 -0.64 0.86 0.87 -0.48 -3.39 113.55 111.26 2wb9 h SER 191 Ca 0.04 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.63 2wb9 h SER 191 Cb 0.95 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.86 2wb9 h SER 191 CO 0.09 0.66 0.39 0.25 -0.53 0.00 0.00 176.83 177.69 2wb9 h LEU 192 N 0.00 0.63 -2.07 2.23 5.85 -1.06 -0.92 115.31 119.96 2wb9 h LEU 192 Ca -0.15 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 2wb9 h LEU 192 Cb 1.64 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.54 2wb9 h LEU 192 CO 0.06 0.44 -0.03 -0.65 -0.34 0.00 0.00 178.44 177.92 2wb9 h PRO 193 N 0.76 0.00 0.00 5.25 0.11 -1.79 0.37 132.00 136.71 2wb9 h PRO 193 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 2wb9 h PRO 193 Cb 0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.16 2wb9 h PRO 193 CO -0.12 0.03 0.00 0.25 -0.21 0.00 0.00 178.00 177.95 2wb9 n THR 194 N -4.28 1.11 0.73 -1.15 -2.24 -0.35 -2.11 114.28 105.99 2wb9 n THR 194 Ca -0.03 0.28 0.12 0.00 -2.27 0.00 0.00 64.05 62.15 2wb9 n THR 194 Cb 0.12 -1.12 0.23 0.00 -2.10 0.00 0.00 70.33 67.46 2wb9 n THR 194 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2wb9 n SER 195 N -1.41 2.93 -3.15 3.42 2.88 0.13 -4.68 113.62 113.74 2wb9 n SER 195 Ca 0.03 -1.92 0.04 0.00 -1.33 0.00 0.00 58.87 55.70 2wb9 n SER 195 Cb 0.10 -0.14 -0.01 0.00 -0.75 0.00 0.00 64.21 63.41 2wb9 n SER 195 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wb9 h SER 197 N 7.95 0.00 0.18 0.00 4.64 -1.84 -0.90 113.55 123.58 2wb9 h SER 197 Ca -0.16 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.05 2wb9 h SER 197 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2wb9 h SER 197 CO 0.14 0.14 -0.39 0.03 -0.87 0.00 0.00 176.83 175.88 2wb9 h ARG 198 N 0.00 0.29 -0.17 4.77 3.08 -1.90 -1.94 114.38 118.50 2wb9 h ARG 198 Ca -0.00 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 59.91 2wb9 h ARG 198 Cb 0.47 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 2wb9 h ARG 198 CO 0.02 0.64 0.10 1.25 -1.07 0.00 0.00 179.97 180.90 2wb9 h LEU 199 N 0.24 0.21 -0.29 3.04 5.85 -1.48 -1.65 115.31 121.23 2wb9 h LEU 199 Ca 0.02 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2wb9 h LEU 199 Cb 0.80 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 2wb9 h LEU 199 CO 0.06 0.22 0.12 -1.28 -0.34 0.00 0.00 178.44 177.21 2wb9 h SER 200 N 0.19 0.41 -0.67 1.25 0.87 -1.17 -0.76 113.55 113.66 2wb9 h SER 200 Ca 0.06 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 2wb9 h SER 200 Cb 0.05 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 2wb9 h SER 200 CO -0.01 0.46 0.42 -0.33 -0.53 0.00 0.00 176.83 176.85 2wb9 h GLU 201 N 0.32 0.89 -0.71 2.24 4.39 -1.35 -0.81 114.58 119.55 2wb9 h GLU 201 Ca 0.10 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.76 2wb9 h GLU 201 Cb 0.19 -0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 28.60 2wb9 h GLU 201 CO -0.01 0.61 0.45 -0.92 -1.16 0.00 0.00 179.01 177.99 2wb9 h TYR 202 N 0.90 0.85 -0.30 4.33 3.20 -0.87 -2.54 116.97 122.54 2wb9 h TYR 202 Ca 0.24 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 62.00 2wb9 h TYR 202 Cb -0.07 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 37.91 2wb9 h TYR 202 CO -0.02 0.49 -0.35 -0.07 -1.64 0.00 0.00 178.16 176.56 2wb9 h LEU 203 N 0.89 0.71 -1.39 2.82 3.38 -0.71 -1.26 115.31 119.73 2wb9 h LEU 203 Ca 0.28 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 2wb9 h LEU 203 Cb 0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2wb9 h LEU 203 CO -0.10 0.99 -0.30 0.11 0.09 0.00 0.00 178.44 179.23 2wb9 h LYS 204 N 0.56 0.00 -0.01 1.13 1.57 -0.76 -3.16 116.57 115.90 2wb9 h LYS 204 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2wb9 h LYS 204 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.18 2wb9 h LYS 204 CO 0.08 0.30 -0.54 1.63 -0.57 0.00 0.00 179.45 180.34 2wb9 n LYS 205 N -4.01 1.00 -2.12 3.15 4.76 -0.98 -4.99 118.16 114.98 2wb9 n LYS 205 Ca -0.02 -0.82 -0.40 0.00 -2.87 0.00 0.00 58.31 54.21 2wb9 n LYS 205 Cb 0.36 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 32.06 2wb9 n LYS 205 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2wb9 s ARG 206 N -2.56 4.11 0.70 1.97 3.52 -0.51 -4.99 118.95 121.19 2wb9 s ARG 206 Ca 0.17 2.12 -0.16 0.00 -0.13 0.00 0.00 55.73 57.73 2wb9 s ARG 206 Cb 0.18 -2.85 0.01 0.00 -1.56 0.00 0.00 34.95 30.73 2wb9 s ARG 206 CO 0.62 -0.36 1.13 0.00 -0.81 0.00 0.00 175.30 175.87 2wb9 n ALA 207 N 0.35 0.35 -2.38 6.12 0.00 -1.26 -4.99 120.51 118.69 2wb9 n ALA 207 Ca 0.03 -0.13 -0.39 0.00 0.00 0.00 0.00 53.44 52.95 2wb9 n ALA 207 Cb 0.43 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.61 2wb9 n ALA 207 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wb9 s LYS 208 N -3.43 4.25 0.16 0.00 1.02 -1.26 -5.06 119.74 115.42 2wb9 s LYS 208 Ca 0.77 0.72 0.02 0.00 0.02 0.00 0.00 55.97 57.51 2wb9 s LYS 208 Cb -0.36 -3.29 -0.05 0.00 -0.52 0.00 0.00 37.83 33.62 2wb9 s LYS 208 CO 0.46 0.51 -0.02 0.95 -0.92 0.00 0.00 175.35 176.33 2wb9 s THR 209 N -0.65 0.77 -0.63 2.17 -4.23 -1.26 -5.04 115.64 106.76 2wb9 s THR 209 Ca 0.30 -1.99 0.25 0.00 -1.18 0.00 0.00 61.69 59.07 2wb9 s THR 209 Cb -0.19 -2.02 0.27 0.00 1.34 0.00 0.00 72.50 71.90 2wb9 s THR 209 CO 0.18 -0.57 1.75 -0.81 -0.54 0.00 0.00 174.62 174.63 2wb9 n PRO 210 N -0.21 0.23 0.00 3.99 -0.04 -1.26 -4.97 135.00 132.73 2wb9 n PRO 210 Ca -0.08 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 2wb9 n PRO 210 Cb 0.62 -1.83 0.00 0.00 -0.04 0.00 0.00 33.50 32.26 2wb9 n PRO 210 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80