#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x3f s LYS 3 N 0.00 4.25 -0.44 -2.82 2.47 -0.44 -4.86 119.74 117.91 2x3f s LYS 3 Ca 0.00 0.42 -0.24 0.00 -1.56 0.00 0.00 55.97 54.60 2x3f s LYS 3 Cb 0.00 -3.51 0.02 0.00 -1.46 0.00 0.00 37.83 32.89 2x3f s LYS 3 CO 0.00 -0.01 0.82 -1.17 0.16 0.00 0.00 175.35 175.14 2x3f s LEU 4 N 1.19 4.18 -0.27 5.43 2.96 -1.26 -0.57 118.68 130.34 2x3f s LEU 4 Ca 0.25 -0.00 -0.08 0.00 -0.22 0.00 0.00 54.13 54.07 2x3f s LEU 4 Cb -0.15 -3.02 -0.02 0.00 0.50 0.00 0.00 46.19 43.49 2x3f s LEU 4 CO 0.10 -0.92 0.09 -0.63 -1.32 0.00 0.00 176.35 173.67 2x3f s ILE 5 N 3.37 4.39 -0.46 6.68 -1.09 0.10 -4.98 121.20 129.21 2x3f s ILE 5 Ca 0.32 -0.24 0.05 0.00 -2.23 0.00 0.00 60.65 58.55 2x3f s ILE 5 Cb -0.12 -3.11 0.14 0.00 -1.58 0.00 0.00 42.46 37.80 2x3f s ILE 5 CO 0.23 0.26 1.10 0.35 -1.23 0.00 0.00 174.94 175.65 2x3f n THR 6 N 4.94 0.96 -4.33 2.92 -2.24 -1.26 -0.68 114.28 114.59 2x3f n THR 6 Ca -0.15 -0.98 -0.20 0.00 -2.27 0.00 0.00 64.05 60.45 2x3f n THR 6 Cb 0.51 0.53 -0.13 0.00 -2.10 0.00 0.00 70.33 69.13 2x3f n THR 6 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2x3f s THR 7 N -0.98 1.15 0.15 4.28 -4.23 -1.26 -4.15 115.64 110.61 2x3f s THR 7 Ca 0.11 -1.09 -0.16 0.00 -1.18 0.00 0.00 61.69 59.37 2x3f s THR 7 Cb 0.06 -1.06 0.01 0.00 1.34 0.00 0.00 72.50 72.85 2x3f s THR 7 CO 0.08 -0.03 1.81 0.58 -0.54 0.00 0.00 174.62 176.51 2x3f h VAL 8 N 4.44 1.10 -0.34 2.29 2.07 -1.93 -2.58 116.25 121.30 2x3f h VAL 8 Ca -0.39 -0.19 0.07 0.00 0.82 0.00 0.00 66.70 67.02 2x3f h VAL 8 Cb 1.18 0.52 -0.08 0.00 -1.52 0.00 0.00 31.29 31.39 2x3f h VAL 8 CO 0.43 0.10 -0.19 0.50 0.02 0.00 0.00 177.57 178.43 2x3f h LYS 9 N 0.54 -0.14 -0.38 1.57 3.64 -1.99 -0.64 116.57 119.17 2x3f h LYS 9 Ca 0.15 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 2x3f h LYS 9 Cb -0.06 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 2x3f h LYS 9 CO -0.03 -0.09 -0.12 1.49 -2.27 0.00 0.00 179.45 178.42 2x3f h GLU 10 N -0.14 0.67 -0.69 1.90 4.81 -1.98 -1.30 114.58 117.84 2x3f h GLU 10 Ca 0.17 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2x3f h GLU 10 Cb 0.41 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 2x3f h GLU 10 CO -0.43 0.77 0.38 1.98 -0.73 0.00 0.00 179.01 180.98 2x3f h MET 11 N 0.61 0.96 -0.41 1.92 4.05 -1.02 -1.36 114.93 119.68 2x3f h MET 11 Ca 0.11 -0.11 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 2x3f h MET 11 Cb 0.56 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 31.15 2x3f h MET 11 CO 0.04 0.71 0.22 1.96 0.23 0.00 0.00 176.91 180.07 2x3f h GLN 12 N 0.94 0.57 -0.45 0.39 4.20 -0.85 -1.76 115.11 118.16 2x3f h GLN 12 Ca 0.24 -0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.90 2x3f h GLN 12 Cb 0.03 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2x3f h GLN 12 CO -0.04 0.47 0.28 1.25 -0.67 0.00 0.00 178.83 180.12 2x3f h HIS 13 N 0.53 0.53 -0.56 2.96 2.76 -0.96 -0.80 115.15 119.61 2x3f h HIS 13 Ca 0.14 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.33 2x3f h HIS 13 Cb 0.06 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 28.82 2x3f h HIS 13 CO -0.02 0.32 0.34 0.82 -1.30 0.00 0.00 177.93 178.09 2x3f h ILE 14 N 0.57 1.16 -0.05 6.26 2.04 -1.01 -2.09 117.51 124.39 2x3f h ILE 14 Ca 0.17 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 2x3f h ILE 14 Cb -0.03 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2x3f h ILE 14 CO -0.06 0.17 0.02 0.58 0.00 0.00 0.00 178.15 178.86 2x3f h VAL 15 N 0.75 1.11 -0.87 1.67 2.07 -1.00 -0.52 116.25 119.47 2x3f h VAL 15 Ca 0.20 -0.33 0.08 0.00 0.82 0.00 0.00 66.70 67.46 2x3f h VAL 15 Cb -0.03 1.24 -0.07 0.00 -1.52 0.00 0.00 31.29 30.92 2x3f h VAL 15 CO -0.04 0.09 0.53 0.50 0.02 0.00 0.00 177.57 178.68 2x3f h LYS 16 N -0.05 0.91 -0.48 1.57 3.64 -1.06 -0.81 116.57 120.30 2x3f h LYS 16 Ca 0.02 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.24 2x3f h LYS 16 Cb 0.13 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2x3f h LYS 16 CO -0.00 0.60 -0.12 0.00 -2.27 0.00 0.00 179.45 177.66 2x3f h ALA 17 N 1.43 0.89 -0.29 5.00 0.00 -1.16 -2.54 119.26 122.59 2x3f h ALA 17 Ca 0.40 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2x3f h ALA 17 Cb 0.25 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2x3f h ALA 17 CO -0.20 0.64 0.15 0.00 0.00 0.00 0.00 179.25 179.84 2x3f h ALA 18 N 1.06 0.36 -0.23 0.00 0.00 -0.20 -2.67 119.26 117.58 2x3f h ALA 18 Ca 0.13 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.06 2x3f h ALA 18 Cb 0.64 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2x3f h ALA 18 CO 0.04 -0.23 0.07 0.87 0.00 0.00 0.00 179.25 180.01 2x3f h LYS 19 N 0.32 0.17 -0.63 0.00 1.79 -1.06 -0.91 116.57 116.25 2x3f h LYS 19 Ca 0.12 -0.01 0.13 0.00 -2.18 0.00 0.00 60.65 58.71 2x3f h LYS 19 Cb 0.02 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.59 2x3f h LYS 19 CO -0.07 0.11 0.43 -0.09 -1.08 0.00 0.00 179.45 178.75 2x3f h ARG 20 N 0.18 0.30 -0.05 3.15 9.65 -1.32 -1.49 114.38 124.80 2x3f h ARG 20 Ca 0.10 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 2x3f h ARG 20 Cb 0.07 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 2x3f h ARG 20 CO -0.11 0.20 0.00 -1.13 2.80 0.00 0.00 179.97 181.73 2x3f n SER 21 N -4.45 2.61 -1.22 -3.80 3.41 -0.87 -4.96 113.62 104.34 2x3f n SER 21 Ca 0.11 -1.86 -0.09 0.00 -0.26 0.00 0.00 58.87 56.77 2x3f n SER 21 Cb 0.48 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.42 2x3f n SER 21 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x3f n GLY 22 N 1.31 0.07 3.61 5.00 0.00 -0.56 -5.01 105.19 109.62 2x3f n GLY 22 Ca 0.16 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 2x3f n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x3f s THR 23 N -2.62 4.76 0.43 2.61 2.01 -0.42 -5.03 115.64 117.38 2x3f s THR 23 Ca 0.06 1.17 -0.23 0.00 0.31 0.00 0.00 61.69 63.00 2x3f s THR 23 Cb -0.03 -4.17 -0.09 0.00 0.01 0.00 0.00 72.50 68.22 2x3f s THR 23 CO 0.08 -0.30 1.03 0.42 -0.69 0.00 0.00 174.62 175.16 2x3f s THR 24 N 3.03 3.82 -0.12 -0.82 -4.23 -1.26 -4.54 115.64 111.51 2x3f s THR 24 Ca 0.33 1.29 0.01 0.00 -1.18 0.00 0.00 61.69 62.14 2x3f s THR 24 Cb -0.14 -3.61 0.02 0.00 1.34 0.00 0.00 72.50 70.11 2x3f s THR 24 CO 0.13 -0.10 -0.15 -0.63 -0.54 0.00 0.00 174.62 173.34 2x3f s ILE 25 N -1.81 1.53 0.01 2.99 1.01 -1.26 -1.08 121.20 122.60 2x3f s ILE 25 Ca 0.61 -0.64 -0.01 0.00 0.00 0.00 0.00 60.65 60.61 2x3f s ILE 25 Cb -0.19 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 40.83 2x3f s ILE 25 CO 0.24 0.45 0.16 -0.83 0.00 0.00 0.00 174.94 174.96 2x3f s GLY 26 N 1.18 2.14 -0.03 6.18 0.00 -0.36 -0.65 107.32 115.79 2x3f s GLY 26 Ca -0.02 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.89 2x3f s GLY 26 CO -0.05 -0.73 -0.00 -0.12 0.00 0.00 0.00 173.10 172.20 2x3f s PHE 27 N -1.35 0.31 -0.32 1.90 5.36 0.11 -0.98 117.98 123.01 2x3f s PHE 27 Ca 0.29 -0.01 0.03 0.00 -0.96 0.00 0.00 56.93 56.28 2x3f s PHE 27 Cb -0.13 -0.40 0.09 0.00 -0.34 0.00 0.00 43.02 42.25 2x3f s PHE 27 CO 0.20 -0.12 0.04 0.42 -1.46 0.00 0.00 175.22 174.30 2x3f s ILE 28 N 0.95 1.99 -0.03 3.12 1.09 -0.42 -0.71 121.20 127.19 2x3f s ILE 28 Ca -0.10 -2.06 -0.30 0.00 -1.10 0.00 0.00 60.65 57.09 2x3f s ILE 28 Cb -0.13 -2.43 -0.02 0.00 -1.06 0.00 0.00 42.46 38.82 2x3f s ILE 28 CO -0.02 -0.54 0.99 -2.16 -0.10 0.00 0.00 174.94 173.12 2x3f s PRO 29 N 1.07 4.51 0.16 2.79 0.04 -1.26 -1.86 135.00 140.45 2x3f s PRO 29 Ca 0.08 1.42 -0.01 0.00 0.04 0.00 0.00 61.00 62.53 2x3f s PRO 29 Cb -0.19 -3.48 -0.04 0.00 0.04 0.00 0.00 34.50 30.83 2x3f s PRO 29 CO -0.11 -0.14 0.08 0.95 0.04 0.00 0.00 177.00 177.83 2x3f s THR 30 N 1.33 0.10 -0.24 1.26 -4.23 -0.49 -4.93 115.64 108.44 2x3f s THR 30 Ca 0.51 -1.95 0.14 0.00 -1.18 0.00 0.00 61.69 59.21 2x3f s THR 30 Cb -0.20 -2.22 0.72 0.00 1.34 0.00 0.00 72.50 72.14 2x3f s THR 30 CO 0.25 -0.29 1.66 0.23 -0.54 0.00 0.00 174.62 175.93 2x3f n MET 31 N -0.17 4.10 0.00 3.99 2.81 -1.26 -2.06 117.12 124.53 2x3f n MET 31 Ca -0.03 -3.07 0.00 0.00 -1.81 0.00 0.00 57.70 52.79 2x3f n MET 31 Cb 0.65 -2.13 0.00 0.00 -0.71 0.00 0.00 33.22 31.02 2x3f n MET 31 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2x3f n GLY 32 N 0.13 -1.51 3.66 3.03 0.00 -1.26 -4.56 105.19 104.69 2x3f n GLY 32 Ca 0.28 -1.31 -0.28 0.00 0.00 0.00 0.00 46.02 44.71 2x3f n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x3f n ALA 33 N 1.53 -2.44 -1.77 4.61 0.00 -1.26 -4.87 120.51 116.32 2x3f n ALA 33 Ca 0.00 -0.19 -0.38 0.00 0.00 0.00 0.00 53.44 52.87 2x3f n ALA 33 Cb 0.00 -3.84 -0.05 0.00 0.00 0.00 0.00 19.45 15.56 2x3f n ALA 33 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2x3f s LEU 34 N -6.42 4.33 0.00 0.00 1.43 -1.26 -4.55 118.68 112.21 2x3f s LEU 34 Ca 0.38 2.08 0.06 0.00 -1.03 0.00 0.00 54.13 55.62 2x3f s LEU 34 Cb -0.12 -3.95 -0.02 0.00 0.03 0.00 0.00 46.19 42.13 2x3f s LEU 34 CO 0.85 -0.28 0.22 0.00 0.23 0.00 0.00 176.35 177.36 2x3f n HIS 35 N 0.52 -0.43 0.32 0.29 1.44 -1.26 -5.01 115.22 111.09 2x3f n HIS 35 Ca 0.02 -2.51 0.21 0.00 -2.01 0.00 0.00 57.72 53.43 2x3f n HIS 35 Cb 0.48 0.17 1.07 0.00 0.12 0.00 0.00 29.99 31.84 2x3f n HIS 35 CO 0.00 0.00 0.00 -0.44 -2.81 0.00 0.00 176.34 173.09 2x3f h ASP 36 N 1.74 0.00 -0.05 4.39 3.32 -1.98 -1.29 116.42 122.55 2x3f h ASP 36 Ca -0.24 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 2x3f h ASP 36 Cb 1.10 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 2x3f h ASP 36 CO 0.36 0.01 0.02 1.23 -1.72 0.00 0.00 179.24 179.14 2x3f h GLY 37 N 0.40 0.08 0.99 2.75 0.00 -1.93 -0.64 103.07 104.72 2x3f h GLY 37 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 47.33 47.24 2x3f h GLY 37 CO 0.00 0.04 0.18 0.45 0.00 0.00 0.00 176.54 177.22 2x3f h HIS 38 N -0.08 0.89 0.00 5.60 3.86 -1.67 -2.93 115.15 120.82 2x3f h HIS 38 Ca 0.02 -0.09 -0.06 0.00 -1.16 0.00 0.00 60.37 59.08 2x3f h HIS 38 Cb 0.17 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 2x3f h HIS 38 CO -0.02 0.75 -0.27 -0.07 0.86 0.00 0.00 177.93 179.18 2x3f h LEU 39 N 0.78 0.00 -0.58 2.43 3.38 -1.27 -0.82 115.31 119.23 2x3f h LEU 39 Ca 0.18 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 2x3f h LEU 39 Cb 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2x3f h LEU 39 CO -0.01 0.27 0.14 0.74 0.09 0.00 0.00 178.44 179.67 2x3f h THR 40 N 0.00 1.25 -0.45 0.22 2.02 -0.93 0.17 112.91 115.18 2x3f h THR 40 Ca -0.00 -0.90 -0.04 0.00 0.77 0.00 0.00 66.41 66.24 2x3f h THR 40 Cb 0.53 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 2x3f h THR 40 CO 0.03 0.33 0.12 0.24 0.37 0.00 0.00 175.52 176.62 2x3f h MET 41 N 0.84 0.72 -0.73 6.66 2.86 -1.26 -2.33 114.93 121.69 2x3f h MET 41 Ca 0.18 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2x3f h MET 41 Cb 0.35 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.88 2x3f h MET 41 CO 0.00 0.71 0.44 0.28 1.06 0.00 0.00 176.91 179.40 2x3f h VAL 42 N 0.60 1.21 -0.53 -2.22 2.07 -0.89 -1.40 116.25 115.09 2x3f h VAL 42 Ca 0.14 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2x3f h VAL 42 Cb 0.31 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 2x3f h VAL 42 CO -0.00 0.22 0.33 -0.09 0.02 0.00 0.00 177.57 178.05 2x3f h ARG 43 N 1.00 0.71 -0.25 1.57 2.43 -0.55 -0.20 114.38 119.10 2x3f h ARG 43 Ca 0.26 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.35 2x3f h ARG 43 Cb -0.03 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 2x3f h ARG 43 CO -0.05 0.49 0.03 1.49 -1.51 0.00 0.00 179.97 180.43 2x3f h GLU 44 N 0.71 0.41 -0.64 0.20 4.81 -1.06 -2.17 114.58 116.84 2x3f h GLU 44 Ca 0.19 -0.12 0.09 0.00 -0.13 0.00 0.00 59.36 59.39 2x3f h GLU 44 Cb -0.04 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.22 2x3f h GLU 44 CO -0.04 0.56 0.29 1.03 -0.73 0.00 0.00 179.01 180.11 2x3f h SER 45 N 0.21 0.35 0.20 1.04 0.87 -1.02 -1.81 113.55 113.39 2x3f h SER 45 Ca 0.07 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.64 2x3f h SER 45 Cb 0.35 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 2x3f h SER 45 CO 0.01 0.21 -0.23 0.58 -0.53 0.00 0.00 176.83 176.86 2x3f h VAL 46 N 0.51 1.19 -0.30 2.23 2.07 -0.81 0.18 116.25 121.32 2x3f h VAL 46 Ca 0.32 -0.88 -0.14 0.00 0.82 0.00 0.00 66.70 66.82 2x3f h VAL 46 Cb 0.34 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 2x3f h VAL 46 CO -0.27 0.26 -0.38 -1.28 0.02 0.00 0.00 177.57 175.92 2x3f h SER 47 N 0.06 0.73 0.15 0.57 0.87 -0.81 -3.37 113.55 111.75 2x3f h SER 47 Ca 0.01 -0.32 -0.36 0.00 -1.23 0.00 0.00 61.79 59.89 2x3f h SER 47 Cb 0.45 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.17 2x3f h SER 47 CO 0.03 1.03 -2.07 0.41 -0.53 0.00 0.00 176.83 175.70 2x3f n THR 48 N -4.05 1.68 -4.30 2.23 -1.04 -0.73 -5.00 114.28 103.07 2x3f n THR 48 Ca -0.02 -0.67 -0.26 0.00 -2.04 0.00 0.00 64.05 61.06 2x3f n THR 48 Cb 0.51 -1.50 -0.09 0.00 -1.82 0.00 0.00 70.33 67.44 2x3f n THR 48 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2x3f s ASN 49 N -6.71 4.25 0.11 8.00 -0.87 0.01 -5.05 114.94 114.67 2x3f s ASN 49 Ca -0.21 -0.62 -0.16 0.00 -1.57 0.00 0.00 52.86 50.30 2x3f s ASN 49 Cb 0.07 -0.71 -0.04 0.00 -0.02 0.00 0.00 41.25 40.55 2x3f s ASN 49 CO 0.75 0.08 1.56 0.44 -2.57 0.00 0.00 177.10 177.36 2x3f h ASP 50 N 2.72 0.57 -3.96 -1.22 3.32 -1.78 -3.43 116.42 112.64 2x3f h ASP 50 Ca -0.46 -0.30 -0.51 0.00 0.02 0.00 0.00 57.03 55.79 2x3f h ASP 50 Cb 1.21 -0.15 -0.20 0.00 0.22 0.00 0.00 39.33 40.41 2x3f h ASP 50 CO 0.55 0.73 -0.79 0.27 -1.72 0.00 0.00 179.24 178.28 2x3f s ILE 51 N -5.04 1.63 -0.10 0.35 -4.36 -0.24 -4.95 121.20 108.49 2x3f s ILE 51 Ca -0.13 -1.68 0.02 0.00 -0.26 0.00 0.00 60.65 58.59 2x3f s ILE 51 Cb 0.09 -1.61 0.02 0.00 1.25 0.00 0.00 42.46 42.21 2x3f s ILE 51 CO 0.77 -0.23 -0.13 -0.89 0.24 0.00 0.00 174.94 174.70 2x3f s THR 52 N -1.66 1.34 -0.14 8.37 2.01 -1.26 -1.23 115.64 123.06 2x3f s THR 52 Ca 0.09 -0.55 0.00 0.00 0.31 0.00 0.00 61.69 61.54 2x3f s THR 52 Cb -0.08 -1.24 -0.01 0.00 0.01 0.00 0.00 72.50 71.19 2x3f s THR 52 CO 0.05 0.41 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.55 2x3f s VAL 53 N 0.98 2.84 -0.20 3.82 1.01 -0.15 -1.30 120.40 127.40 2x3f s VAL 53 Ca -0.08 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.15 2x3f s VAL 53 Cb -0.15 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 2x3f s VAL 53 CO -0.01 0.52 -0.06 -0.69 0.00 0.00 0.00 175.10 174.86 2x3f s VAL 54 N 0.62 3.31 0.09 2.92 1.01 -0.03 -1.30 120.40 127.03 2x3f s VAL 54 Ca -0.08 -0.52 -0.19 0.00 0.00 0.00 0.00 61.98 61.19 2x3f s VAL 54 Cb -0.16 -2.49 -0.07 0.00 0.00 0.00 0.00 36.38 33.67 2x3f s VAL 54 CO 0.03 0.45 0.58 -0.94 0.00 0.00 0.00 175.10 175.21 2x3f s SER 55 N 1.25 7.04 -0.27 3.32 1.04 -0.78 -0.42 113.70 124.88 2x3f s SER 55 Ca 0.03 1.25 0.01 0.00 0.48 0.00 0.00 55.95 57.72 2x3f s SER 55 Cb -0.14 -2.36 0.08 0.00 0.10 0.00 0.00 66.02 63.70 2x3f s SER 55 CO -0.02 0.24 0.01 -0.69 0.98 0.00 0.00 173.24 173.76 2x3f s VAL 56 N -1.18 1.40 -0.24 5.02 1.01 -0.04 -1.40 120.40 124.97 2x3f s VAL 56 Ca 0.31 -1.39 -0.03 0.00 0.00 0.00 0.00 61.98 60.87 2x3f s VAL 56 Cb -0.19 -1.84 0.13 0.00 0.00 0.00 0.00 36.38 34.48 2x3f s VAL 56 CO 0.19 -0.33 0.41 0.12 0.00 0.00 0.00 175.10 175.49 2x3f s PHE 57 N 1.41 -0.89 -0.55 5.22 5.36 -0.88 -4.31 117.98 123.35 2x3f s PHE 57 Ca 0.01 1.06 -0.26 0.00 -0.96 0.00 0.00 56.93 56.78 2x3f s PHE 57 Cb -0.18 0.13 0.04 0.00 -0.34 0.00 0.00 43.02 42.66 2x3f s PHE 57 CO -0.11 -0.68 1.05 0.08 -1.46 0.00 0.00 175.22 174.10 2x3f s VAL 58 N 2.59 4.24 -0.52 3.12 1.01 -1.26 -4.30 120.40 125.27 2x3f s VAL 58 Ca 0.10 0.60 -0.24 0.00 0.00 0.00 0.00 61.98 62.45 2x3f s VAL 58 Cb -0.15 -4.61 0.04 0.00 0.00 0.00 0.00 36.38 31.66 2x3f s VAL 58 CO -0.16 -1.18 0.88 0.21 0.00 0.00 0.00 175.10 174.85 2x3f s ASN 59 N 2.83 6.36 0.53 3.32 2.47 -1.26 -4.92 114.94 124.27 2x3f s ASN 59 Ca 0.37 -0.32 0.21 0.00 0.42 0.00 0.00 52.86 53.53 2x3f s ASN 59 Cb -0.10 -2.41 1.42 0.00 -1.45 0.00 0.00 41.25 38.71 2x3f s ASN 59 CO 0.23 -1.12 2.15 1.55 -3.72 0.00 0.00 177.10 176.19 2x3f h PRO 60 N 9.20 0.00 0.00 0.43 0.13 -1.95 -2.63 132.00 137.17 2x3f h PRO 60 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2x3f h PRO 60 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2x3f h PRO 60 CO 1.05 0.04 0.00 -0.07 -0.23 0.00 0.00 178.00 178.78 2x3f h LEU 61 N 0.00 0.00 -1.87 1.56 3.38 -1.91 -2.70 115.31 113.78 2x3f h LEU 61 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x3f h LEU 61 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2x3f h LEU 61 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 2x3f n GLN 62 N -2.97 2.24 -3.93 1.13 10.64 -0.99 -4.13 117.38 119.37 2x3f n GLN 62 Ca 0.00 -1.85 -0.35 0.00 -1.83 0.00 0.00 57.00 52.97 2x3f n GLN 62 Cb 0.25 -1.47 -0.09 0.00 -0.86 0.00 0.00 30.24 28.07 2x3f n GLN 62 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 2x3f s PHE 63 N -1.73 3.33 0.10 2.61 0.08 -1.02 -4.74 117.98 116.61 2x3f s PHE 63 Ca 0.35 0.21 0.01 0.00 0.12 0.00 0.00 56.93 57.62 2x3f s PHE 63 Cb 0.21 -2.07 0.01 0.00 -0.57 0.00 0.00 43.02 40.60 2x3f s PHE 63 CO 0.30 0.28 0.12 0.41 -0.10 0.00 0.00 175.22 176.23 2x3f n GLY 64 N 3.28 2.18 3.77 4.36 0.00 -1.26 -5.01 105.19 112.51 2x3f n GLY 64 Ca -0.17 -2.16 -0.41 0.00 0.00 0.00 0.00 46.02 43.29 2x3f n GLY 64 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2x3f s PRO 65 N -2.43 4.26 -2.18 1.61 0.04 -1.26 -2.66 135.00 132.38 2x3f s PRO 65 Ca 0.09 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.39 2x3f s PRO 65 Cb -0.01 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.52 2x3f s PRO 65 CO 0.06 -0.28 0.00 0.09 0.04 0.00 0.00 177.00 176.90 2x3f n ASN 66 N 0.65 -5.53 -1.43 6.66 4.13 -1.26 -4.99 115.26 113.49 2x3f n ASN 66 Ca 0.01 0.51 0.00 0.00 1.68 0.00 0.00 54.58 56.78 2x3f n ASN 66 Cb 0.42 -4.85 0.00 0.00 -1.54 0.00 0.00 39.78 33.81 2x3f n ASN 66 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2x3f n GLU 67 N -2.32 1.63 -1.84 3.52 1.02 -1.09 -5.04 120.64 116.52 2x3f n GLU 67 Ca -0.21 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.68 2x3f n GLU 67 Cb 0.69 0.00 0.04 0.00 -0.02 0.00 0.00 31.44 32.14 2x3f n GLU 67 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2x3f n ASP 68 N -1.25 5.47 -0.17 1.62 5.75 -1.26 -4.80 116.55 121.91 2x3f n ASP 68 Ca 0.00 -3.76 -0.06 0.00 -0.01 0.00 0.00 54.79 50.96 2x3f n ASP 68 Cb 0.00 -0.49 0.03 0.00 -1.03 0.00 0.00 41.12 39.63 2x3f n ASP 68 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 2x3f h PHE 69 N 2.11 0.61 -0.23 2.11 3.57 -1.96 0.49 116.94 123.63 2x3f h PHE 69 Ca 0.42 0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.78 2x3f h PHE 69 Cb 1.38 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.91 2x3f h PHE 69 CO 0.98 0.37 -0.49 -0.44 -2.23 0.00 0.00 178.31 176.50 2x3f h ASP 70 N 0.65 0.67 1.34 0.41 3.32 -2.01 -3.12 116.42 117.67 2x3f h ASP 70 Ca 0.19 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.91 2x3f h ASP 70 Cb -0.03 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.33 2x3f h ASP 70 CO -0.06 1.05 -0.10 0.00 -1.72 0.00 0.00 179.24 178.40 2x3f n ALA 71 N -2.52 2.40 -1.65 3.45 0.00 -1.04 -4.91 120.51 116.24 2x3f n ALA 71 Ca -0.03 -0.07 -0.50 0.00 0.00 0.00 0.00 53.44 52.84 2x3f n ALA 71 Cb 0.57 -1.42 -0.05 0.00 0.00 0.00 0.00 19.45 18.55 2x3f n ALA 71 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2x3f n TYR 72 N -2.18 1.97 -1.80 0.00 4.19 0.13 -4.82 117.16 114.66 2x3f n TYR 72 Ca 0.05 0.40 -0.41 0.00 3.31 0.00 0.00 57.90 61.25 2x3f n TYR 72 Cb 0.43 -2.47 -0.01 0.00 0.49 0.00 0.00 39.34 37.77 2x3f n TYR 72 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 2x3f s PRO 73 N 1.66 4.12 -0.04 2.98 0.04 -1.26 -5.00 135.00 137.50 2x3f s PRO 73 Ca 0.86 2.57 0.02 0.00 0.04 0.00 0.00 61.00 64.49 2x3f s PRO 73 Cb -0.84 -3.00 0.01 0.00 0.04 0.00 0.00 34.50 30.70 2x3f s PRO 73 CO 0.48 -0.59 -0.09 1.03 0.04 0.00 0.00 177.00 177.87 2x3f s ARG 74 N -1.11 1.18 -0.42 4.56 0.52 -1.26 -4.35 118.95 118.06 2x3f s ARG 74 Ca 0.59 -0.30 0.05 0.00 -0.52 0.00 0.00 55.73 55.54 2x3f s ARG 74 Cb -0.47 -1.06 0.30 0.00 0.52 0.00 0.00 34.95 34.24 2x3f s ARG 74 CO 0.54 0.05 1.15 0.00 0.02 0.00 0.00 175.30 177.06 2x3f n GLN 75 N 3.59 0.65 -0.30 3.54 10.64 -1.26 -5.02 117.38 129.23 2x3f n GLN 75 Ca -0.21 -1.45 -0.05 0.00 -1.83 0.00 0.00 57.00 53.45 2x3f n GLN 75 Cb 0.53 -0.83 0.07 0.00 -0.86 0.00 0.00 30.24 29.15 2x3f n GLN 75 CO 0.00 0.00 0.00 0.97 -1.83 0.00 0.00 177.06 176.20 2x3f h ILE 76 N 2.20 1.26 -0.39 -0.39 6.09 -1.98 0.15 117.51 124.45 2x3f h ILE 76 Ca -0.18 -0.77 0.00 0.00 -1.37 0.00 0.00 64.86 62.55 2x3f h ILE 76 Cb 1.12 0.26 -0.02 0.00 0.47 0.00 0.00 36.82 38.66 2x3f h ILE 76 CO 0.10 0.32 0.25 0.44 -3.07 0.00 0.00 178.15 176.20 2x3f h ASP 77 N 1.16 0.45 -0.44 2.19 3.32 -1.99 0.15 116.42 121.26 2x3f h ASP 77 Ca 0.27 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 2x3f h ASP 77 Cb 0.17 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2x3f h ASP 77 CO -0.03 0.34 0.05 0.50 -1.72 0.00 0.00 179.24 178.38 2x3f h LYS 78 N 0.52 0.74 -0.45 3.56 1.63 -1.90 -1.18 116.57 119.50 2x3f h LYS 78 Ca 0.14 -0.21 0.04 0.00 -0.85 0.00 0.00 60.65 59.77 2x3f h LYS 78 Cb -0.05 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.46 2x3f h LYS 78 CO -0.03 0.78 0.23 -0.44 -3.45 0.00 0.00 179.45 176.54 2x3f h ASP 79 N 0.60 0.33 -0.87 4.20 3.32 -0.74 0.02 116.42 123.28 2x3f h ASP 79 Ca 0.13 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 2x3f h ASP 79 Cb 0.41 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.88 2x3f h ASP 79 CO 0.01 0.24 0.51 0.25 -1.72 0.00 0.00 179.24 178.53 2x3f h LEU 80 N 0.45 1.05 -0.23 1.55 5.85 -0.52 -2.22 115.31 121.25 2x3f h LEU 80 Ca 0.19 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 2x3f h LEU 80 Cb 0.10 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2x3f h LEU 80 CO -0.13 0.81 0.09 -0.08 -0.34 0.00 0.00 178.44 178.79 2x3f h GLU 81 N 1.19 0.35 -0.28 1.25 4.81 -0.78 -1.23 114.58 119.89 2x3f h GLU 81 Ca 0.31 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.51 2x3f h GLU 81 Cb -0.03 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 2x3f h GLU 81 CO -0.06 0.41 0.07 -0.07 -0.73 0.00 0.00 179.01 178.64 2x3f h LEU 82 N 0.22 0.04 -0.43 1.64 3.38 -0.76 -1.59 115.31 117.82 2x3f h LEU 82 Ca 0.08 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 2x3f h LEU 82 Cb 0.20 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2x3f h LEU 82 CO -0.01 0.06 -0.47 -0.37 0.09 0.00 0.00 178.44 177.75 2x3f h VAL 83 N 0.18 0.90 -0.67 1.22 -1.51 -1.42 -3.07 116.25 111.88 2x3f h VAL 83 Ca 0.13 -1.96 -0.02 0.00 -1.23 0.00 0.00 66.70 63.62 2x3f h VAL 83 Cb 0.12 2.22 -0.03 0.00 -2.13 0.00 0.00 31.29 31.47 2x3f h VAL 83 CO -0.16 0.46 0.35 0.28 -1.23 0.00 0.00 177.57 177.27 2x3f h SER 84 N 0.00 0.85 -0.08 4.19 0.02 -0.74 -1.72 113.55 116.08 2x3f h SER 84 Ca -0.00 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 2x3f h SER 84 Cb 1.18 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.50 2x3f h SER 84 CO 0.06 0.72 0.03 -0.33 -1.14 0.00 0.00 176.83 176.17 2x3f h GLU 85 N 0.92 0.16 -0.07 3.45 5.08 -1.21 -1.82 114.58 121.10 2x3f h GLU 85 Ca 0.23 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2x3f h GLU 85 Cb 0.07 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2x3f h GLU 85 CO -0.03 0.16 0.00 0.28 -1.00 0.00 0.00 179.01 178.41 2x3f n VAL 86 N -4.47 0.07 -0.28 3.13 0.31 -1.10 -4.96 118.33 111.04 2x3f n VAL 86 Ca -0.01 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2x3f n VAL 86 Cb 0.12 0.65 0.00 0.00 -0.91 0.00 0.00 33.84 33.70 2x3f n VAL 86 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2x3f n GLY 87 N 1.21 0.85 3.76 2.92 0.00 -0.68 -4.76 105.19 108.49 2x3f n GLY 87 Ca 0.18 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 2x3f n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x3f s ALA 88 N -2.00 2.59 -0.22 4.61 0.00 -0.66 -4.83 121.76 121.24 2x3f s ALA 88 Ca 0.00 1.01 -0.08 0.00 0.00 0.00 0.00 51.96 52.89 2x3f s ALA 88 Cb 0.00 -3.45 -0.18 0.00 0.00 0.00 0.00 23.12 19.49 2x3f s ALA 88 CO 0.00 -1.12 -0.04 -0.25 0.00 0.00 0.00 175.76 174.35 2x3f n ASP 89 N -1.48 1.99 -4.03 0.00 8.00 -0.42 -4.64 116.55 115.97 2x3f n ASP 89 Ca 0.13 0.16 -0.21 0.00 0.71 0.00 0.00 54.79 55.58 2x3f n ASP 89 Cb 0.49 -0.72 -0.16 0.00 -0.02 0.00 0.00 41.12 40.72 2x3f n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2x3f s ILE 90 N -2.50 0.90 -0.31 0.53 1.01 -0.98 -1.33 121.20 118.52 2x3f s ILE 90 Ca -0.32 -0.43 -0.09 0.00 0.00 0.00 0.00 60.65 59.81 2x3f s ILE 90 Cb 0.09 -0.79 -0.00 0.00 0.01 0.00 0.00 42.46 41.77 2x3f s ILE 90 CO 0.61 0.27 0.14 -0.69 0.00 0.00 0.00 174.94 175.27 2x3f s VAL 91 N 0.13 4.47 -0.30 2.92 1.01 0.26 -0.85 120.40 128.04 2x3f s VAL 91 Ca -0.03 -0.46 -0.18 0.00 0.00 0.00 0.00 61.98 61.31 2x3f s VAL 91 Cb -0.09 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.00 2x3f s VAL 91 CO 0.01 0.08 0.50 0.12 0.00 0.00 0.00 175.10 175.81 2x3f s PHE 92 N 1.59 3.22 -0.44 5.22 5.36 0.43 -0.72 117.98 132.65 2x3f s PHE 92 Ca 0.04 0.41 0.06 0.00 -0.96 0.00 0.00 56.93 56.48 2x3f s PHE 92 Cb -0.17 -2.81 0.21 0.00 -0.34 0.00 0.00 43.02 39.91 2x3f s PHE 92 CO 0.05 -0.40 0.46 1.58 -1.46 0.00 0.00 175.22 175.45 2x3f n HIS 93 N 5.63 -0.09 -2.01 10.12 -0.00 0.15 -0.86 115.22 128.16 2x3f n HIS 93 Ca -0.05 -3.54 -0.32 0.00 -0.00 0.00 0.00 57.72 53.81 2x3f n HIS 93 Cb 0.49 -0.12 0.01 0.00 -0.00 0.00 0.00 29.99 30.36 2x3f n HIS 93 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 2x3f s PRO 94 N -0.78 3.50 0.46 1.57 0.04 -1.26 -4.38 135.00 134.15 2x3f s PRO 94 Ca 0.34 0.97 -0.23 0.00 0.04 0.00 0.00 61.00 62.12 2x3f s PRO 94 Cb 0.10 -2.07 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 2x3f s PRO 94 CO -0.14 -0.65 1.12 0.00 0.04 0.00 0.00 177.00 177.37 2x3f s ALA 95 N -2.81 2.96 0.29 8.56 0.00 -1.26 -4.93 121.76 124.57 2x3f s ALA 95 Ca 0.59 0.84 0.03 0.00 0.00 0.00 0.00 51.96 53.42 2x3f s ALA 95 Cb -0.13 -3.34 0.63 0.00 0.00 0.00 0.00 23.12 20.28 2x3f s ALA 95 CO 0.43 -0.53 1.79 0.28 0.00 0.00 0.00 175.76 177.73 2x3f h VAL 96 N 1.86 0.78 0.00 0.00 2.07 -1.96 -1.18 116.25 117.82 2x3f h VAL 96 Ca -0.49 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 66.69 2x3f h VAL 96 Cb 1.24 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2x3f h VAL 96 CO 0.60 0.15 -0.30 -0.33 0.02 0.00 0.00 177.57 177.71 2x3f h GLU 97 N 0.81 0.00 -0.04 1.57 3.07 -1.92 0.28 114.58 118.34 2x3f h GLU 97 Ca 0.53 0.00 -0.22 0.00 -0.50 0.00 0.00 59.36 59.17 2x3f h GLU 97 Cb 0.71 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.63 2x3f h GLU 97 CO -0.34 0.30 -0.82 0.22 -1.40 0.00 0.00 179.01 176.97 2x3f h ASP 98 N 0.00 0.80 0.00 1.42 3.58 -1.61 -2.59 116.42 118.03 2x3f h ASP 98 Ca -0.00 -0.71 -0.19 0.00 0.42 0.00 0.00 57.03 56.55 2x3f h ASP 98 Cb 0.71 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.52 2x3f h ASP 98 CO 0.04 1.40 -0.67 0.24 -2.88 0.00 0.00 179.24 177.37 2x3f h MET 99 N 0.28 0.62 -2.55 0.28 2.86 -1.10 -3.39 114.93 111.92 2x3f h MET 99 Ca -0.09 -0.46 -0.60 0.00 -2.06 0.00 0.00 59.70 56.49 2x3f h MET 99 Cb 1.49 0.08 -0.40 0.00 0.06 0.00 0.00 31.60 32.83 2x3f h MET 99 CO 0.16 1.08 -0.80 0.66 1.06 0.00 0.00 176.91 179.08 2x3f n TYR 100 N -3.92 1.28 -2.67 -0.22 4.01 0.94 -5.04 117.16 111.54 2x3f n TYR 100 Ca -0.05 -3.82 -0.42 0.00 -0.16 0.00 0.00 57.90 53.45 2x3f n TYR 100 Cb 0.68 -0.25 -0.02 0.00 -0.31 0.00 0.00 39.34 39.45 2x3f n TYR 100 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2x3f s PRO 101 N -1.01 3.79 2.14 -0.72 0.04 -0.98 -4.45 135.00 133.82 2x3f s PRO 101 Ca 0.31 -1.71 0.00 0.00 0.04 0.00 0.00 61.00 59.65 2x3f s PRO 101 Cb 0.04 -5.32 0.00 0.00 0.04 0.00 0.00 34.50 29.26 2x3f s PRO 101 CO -0.15 -2.11 0.00 0.41 0.04 0.00 0.00 177.00 175.19 2x3f n GLY 102 N 5.81 -1.26 3.77 0.56 0.00 -1.26 -4.91 105.19 107.90 2x3f n GLY 102 Ca 0.38 -1.26 -0.40 0.00 0.00 0.00 0.00 46.02 44.74 2x3f n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x3f s GLU 103 N 0.00 4.66 0.23 1.61 2.02 -1.26 -5.02 118.70 120.93 2x3f s GLU 103 Ca 0.00 1.26 -0.30 0.00 0.02 0.00 0.00 54.97 55.95 2x3f s GLU 103 Cb 0.00 -3.27 -0.09 0.00 0.10 0.00 0.00 34.13 30.86 2x3f s GLU 103 CO 0.00 0.55 1.39 -0.51 0.02 0.00 0.00 175.26 176.71 2x3f s LEU 104 N -1.13 4.40 0.21 1.80 1.43 -1.26 -4.94 118.68 119.19 2x3f s LEU 104 Ca 0.37 2.56 0.21 0.00 -1.03 0.00 0.00 54.13 56.24 2x3f s LEU 104 Cb -0.24 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.38 2x3f s LEU 104 CO 0.28 -0.63 1.10 1.23 0.23 0.00 0.00 176.35 178.55 2x3f h GLY 105 N 5.24 0.00 -4.86 -3.19 0.00 -2.00 -3.45 103.07 94.81 2x3f h GLY 105 Ca -0.45 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.19 2x3f h GLY 105 CO 0.78 0.00 -0.84 -0.42 0.00 0.00 0.00 176.54 176.06 2x3f s ILE 106 N -3.20 2.42 -0.11 2.60 1.09 -1.26 -5.13 121.20 117.61 2x3f s ILE 106 Ca 0.00 -0.95 0.00 0.00 -1.10 0.00 0.00 60.65 58.60 2x3f s ILE 106 Cb 0.09 -1.90 -0.02 0.00 -1.06 0.00 0.00 42.46 39.57 2x3f s ILE 106 CO 0.78 0.58 -0.11 -1.81 -0.10 0.00 0.00 174.94 174.28 2x3f s ASP 107 N -0.46 4.25 -0.18 3.58 1.01 -1.26 -5.11 116.67 118.50 2x3f s ASP 107 Ca 0.05 -0.21 -0.04 0.00 0.71 0.00 0.00 52.55 53.06 2x3f s ASP 107 Cb -0.12 -1.39 -0.03 0.00 1.01 0.00 0.00 42.92 42.40 2x3f s ASP 107 CO 0.01 0.24 -0.02 -0.69 0.21 0.00 0.00 175.17 174.92 2x3f s VAL 108 N -0.09 3.92 -0.01 -1.27 1.01 -1.26 -5.11 120.40 117.60 2x3f s VAL 108 Ca -0.01 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.67 2x3f s VAL 108 Cb -0.14 -2.75 -0.00 0.00 0.00 0.00 0.00 36.38 33.49 2x3f s VAL 108 CO 0.03 0.46 -0.09 -0.54 0.00 0.00 0.00 175.10 174.96 2x3f s LYS 109 N 0.70 0.82 0.12 2.72 1.02 -1.26 -4.79 119.74 119.07 2x3f s LYS 109 Ca -0.01 -0.33 -0.26 0.00 0.02 0.00 0.00 55.97 55.39 2x3f s LYS 109 Cb -0.14 -0.79 -0.07 0.00 -0.52 0.00 0.00 37.83 36.31 2x3f s LYS 109 CO 0.02 0.18 0.80 0.08 -0.92 0.00 0.00 175.35 175.51 2x3f s VAL 110 N -0.10 4.50 0.00 3.17 1.01 -1.26 -5.05 120.40 122.66 2x3f s VAL 110 Ca 0.02 1.74 0.00 0.00 0.00 0.00 0.00 61.98 63.73 2x3f s VAL 110 Cb -0.05 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.17 2x3f s VAL 110 CO -0.00 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.15 2x3f n GLY 111 N 1.94 0.62 0.50 4.51 0.00 -1.26 -4.70 105.19 106.80 2x3f n GLY 111 Ca -0.03 -1.32 0.32 0.00 0.00 0.00 0.00 46.02 44.98 2x3f n GLY 111 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2x3f h PRO 112 N 0.00 0.01 0.00 1.61 0.11 -2.00 -0.79 132.00 130.94 2x3f h PRO 112 Ca 0.00 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 2x3f h PRO 112 Cb 0.00 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 2x3f h PRO 112 CO 0.00 0.01 -0.00 -0.07 -0.21 0.00 0.00 178.00 177.72 2x3f h LEU 113 N 0.01 0.00 -2.93 2.35 3.38 -1.91 -2.19 115.31 114.02 2x3f h LEU 113 Ca 0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 2x3f h LEU 113 Cb 2.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.76 2x3f h LEU 113 CO -0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.52 2x3f n ALA 114 N -2.09 2.52 1.27 1.53 0.00 -0.30 -4.41 120.51 119.03 2x3f n ALA 114 Ca -0.02 -1.40 0.13 0.00 0.00 0.00 0.00 53.44 52.15 2x3f n ALA 114 Cb 0.16 -0.75 0.36 0.00 0.00 0.00 0.00 19.45 19.22 2x3f n ALA 114 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2x3f n ASP 115 N 0.93 1.41 -4.31 0.00 8.00 -0.82 -3.80 116.55 117.96 2x3f n ASP 115 Ca 0.20 -1.21 -0.17 0.00 0.71 0.00 0.00 54.79 54.32 2x3f n ASP 115 Cb 0.64 0.13 -0.10 0.00 -0.02 0.00 0.00 41.12 41.76 2x3f n ASP 115 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2x3f s VAL 116 N -2.32 1.25 0.00 2.53 -7.23 -1.26 -4.46 120.40 108.91 2x3f s VAL 116 Ca 0.28 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.37 2x3f s VAL 116 Cb 0.20 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 35.00 2x3f s VAL 116 CO 0.46 -0.51 0.00 0.18 -0.31 0.00 0.00 175.10 174.92 2x3f n LEU 117 N -0.35 0.00 0.24 1.32 4.77 -1.26 -1.77 117.00 119.95 2x3f n LEU 117 Ca -0.07 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.03 2x3f n LEU 117 Cb 0.62 0.00 0.57 0.00 -2.33 0.00 0.00 43.42 42.28 2x3f n LEU 117 CO 0.35 0.00 0.87 -0.33 -1.33 0.00 0.00 177.39 176.96 2x3f h GLU 118 N 0.00 0.00 -0.06 3.23 4.39 -1.94 -0.26 114.58 119.94 2x3f h GLU 118 Ca 0.00 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.59 2x3f h GLU 118 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2x3f h GLU 118 CO 0.00 0.17 -0.45 0.78 -1.16 0.00 0.00 179.01 178.35 2x3f h GLY 119 N 1.76 0.15 1.32 -3.84 0.00 -1.53 0.28 103.07 101.20 2x3f h GLY 119 Ca -0.00 -0.14 -0.32 0.00 0.00 0.00 0.00 47.33 46.87 2x3f h GLY 119 CO 0.02 0.13 -1.46 0.00 0.00 0.00 0.00 176.54 175.23 2x3f h ALA 120 N 1.43 -0.01 -0.06 3.60 0.00 -1.35 -3.28 119.26 119.59 2x3f h ALA 120 Ca 0.01 -0.93 -0.10 0.00 0.00 0.00 0.00 54.91 53.89 2x3f h ALA 120 Cb 0.84 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2x3f h ALA 120 CO 0.06 0.86 -0.43 0.87 0.00 0.00 0.00 179.25 180.61 2x3f h LYS 121 N 0.12 0.13 -2.72 0.00 1.79 -0.97 -3.37 116.57 111.55 2x3f h LYS 121 Ca -0.23 -0.06 -0.61 0.00 -2.18 0.00 0.00 60.65 57.57 2x3f h LYS 121 Cb 2.10 -0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 32.34 2x3f h LYS 121 CO 0.23 0.55 -0.76 0.54 -1.08 0.00 0.00 179.45 178.93 2x3f n ARG 122 N -4.01 1.08 -1.68 3.15 1.74 0.98 -5.07 116.66 112.85 2x3f n ARG 122 Ca -0.02 -3.88 -0.45 0.00 -0.77 0.00 0.00 57.85 52.74 2x3f n ARG 122 Cb 0.48 -1.99 -0.04 0.00 -1.02 0.00 0.00 32.46 29.89 2x3f n ARG 122 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2x3f n PRO 123 N 2.33 2.50 -0.13 5.56 -0.02 -1.24 -1.44 135.00 142.55 2x3f n PRO 123 Ca 0.25 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.63 2x3f n PRO 123 Cb 0.41 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.13 2x3f n PRO 123 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x3f n GLY 124 N 4.06 1.56 0.09 -1.23 0.00 -1.26 -4.91 105.19 103.50 2x3f n GLY 124 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 2x3f n GLY 124 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2x3f h HIS 125 N 0.00 -0.13 0.00 1.61 6.17 -1.53 -1.89 115.15 119.39 2x3f h HIS 125 Ca 0.00 -0.00 -0.07 0.00 0.71 0.00 0.00 60.37 61.01 2x3f h HIS 125 Cb 0.00 0.04 -0.01 0.00 2.52 0.00 0.00 27.41 29.96 2x3f h HIS 125 CO 0.00 0.00 -0.32 0.74 0.71 0.00 0.00 177.93 179.06 2x3f h PHE 126 N -0.23 0.00 -0.71 5.26 0.04 -1.92 -1.74 116.94 117.65 2x3f h PHE 126 Ca -0.01 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.77 2x3f h PHE 126 Cb 0.18 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.29 2x3f h PHE 126 CO -0.04 0.32 0.46 -0.44 -0.60 0.00 0.00 178.31 178.01 2x3f h ASP 127 N 0.00 0.78 -0.69 2.17 3.32 -1.80 -1.14 116.42 119.05 2x3f h ASP 127 Ca -0.00 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 2x3f h ASP 127 Cb 0.85 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.19 2x3f h ASP 127 CO 0.04 0.55 0.26 1.23 -1.72 0.00 0.00 179.24 179.60 2x3f h GLY 128 N 0.92 1.13 0.78 2.75 0.00 -0.52 -2.06 103.07 106.06 2x3f h GLY 128 Ca 0.27 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 2x3f h GLY 128 CO -0.08 0.59 -0.07 -2.08 0.00 0.00 0.00 176.54 174.90 2x3f h VAL 129 N 1.00 0.96 -0.45 4.60 2.07 -1.04 -2.29 116.25 121.09 2x3f h VAL 129 Ca 0.23 -0.47 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 2x3f h VAL 129 Cb 0.24 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 2x3f h VAL 129 CO -0.02 0.11 0.12 -0.37 0.02 0.00 0.00 177.57 177.44 2x3f h VAL 130 N -0.42 1.19 0.33 2.57 -1.51 -1.24 -0.03 116.25 117.14 2x3f h VAL 130 Ca -0.02 -0.67 -0.00 0.00 -1.23 0.00 0.00 66.70 64.77 2x3f h VAL 130 Cb 0.33 0.72 -0.01 0.00 -2.13 0.00 0.00 31.29 30.20 2x3f h VAL 130 CO 0.03 0.25 -0.26 0.74 -1.23 0.00 0.00 177.57 177.10 2x3f h THR 131 N 0.65 0.45 -0.27 7.19 2.02 -1.26 0.44 112.91 122.13 2x3f h THR 131 Ca 0.15 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.18 2x3f h THR 131 Cb 0.22 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2x3f h THR 131 CO -0.01 0.00 -0.44 1.62 0.37 0.00 0.00 175.52 177.06 2x3f h VAL 132 N -0.59 1.29 -0.48 3.16 3.04 -1.22 -2.75 116.25 118.70 2x3f h VAL 132 Ca -0.02 -1.63 -0.11 0.00 -1.01 0.00 0.00 66.70 63.92 2x3f h VAL 132 Cb 0.52 1.56 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 2x3f h VAL 132 CO -0.01 0.52 -0.15 0.58 -1.01 0.00 0.00 177.57 177.51 2x3f h VAL 133 N 0.56 1.27 -0.39 1.51 2.07 -0.87 -0.84 116.25 119.56 2x3f h VAL 133 Ca 0.04 -1.29 0.06 0.00 0.82 0.00 0.00 66.70 66.33 2x3f h VAL 133 Cb 0.99 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 31.80 2x3f h VAL 133 CO 0.09 0.45 0.06 -1.13 0.02 0.00 0.00 177.57 177.06 2x3f h ASN 134 N 0.80 -0.02 -0.12 0.57 -1.24 -0.87 -0.20 115.58 114.50 2x3f h ASN 134 Ca 0.12 0.07 -0.01 0.00 0.71 0.00 0.00 56.30 57.19 2x3f h ASN 134 Cb 0.71 0.10 -0.01 0.00 0.73 0.00 0.00 38.32 39.86 2x3f h ASN 134 CO 0.05 0.02 0.05 0.11 -1.29 0.00 0.00 177.43 176.38 2x3f h LYS 135 N 0.19 0.18 -0.78 6.67 1.57 -1.25 -2.16 116.57 120.98 2x3f h LYS 135 Ca 0.19 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2x3f h LYS 135 Cb 0.24 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 2x3f h LYS 135 CO -0.26 0.28 0.51 -0.07 -0.57 0.00 0.00 179.45 179.34 2x3f h LEU 136 N 0.04 0.87 -0.95 2.94 3.38 -0.99 -0.24 115.31 120.36 2x3f h LEU 136 Ca 0.04 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 2x3f h LEU 136 Cb 0.17 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2x3f h LEU 136 CO -0.00 0.62 -0.10 -0.26 0.09 0.00 0.00 178.44 178.79 2x3f h PHE 137 N 1.03 0.72 0.00 1.13 0.04 -0.85 -0.22 116.94 118.78 2x3f h PHE 137 Ca 0.29 -0.12 -0.10 0.00 2.80 0.00 0.00 57.97 60.85 2x3f h PHE 137 Cb -0.08 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 37.87 2x3f h PHE 137 CO -0.00 0.73 -0.47 -0.91 -0.60 0.00 0.00 178.31 177.06 2x3f h ASN 138 N 0.61 0.00 0.00 2.17 2.35 -0.65 -1.11 115.58 118.95 2x3f h ASN 138 Ca 0.11 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2x3f h ASN 138 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 2x3f h ASN 138 CO 0.03 0.47 -0.00 0.40 -1.65 0.00 0.00 177.43 176.68 2x3f h ILE 139 N 0.00 1.64 0.00 2.81 2.04 -0.82 -3.39 117.51 119.80 2x3f h ILE 139 Ca -0.00 -2.04 -0.07 0.00 1.00 0.00 0.00 64.86 63.74 2x3f h ILE 139 Cb 1.08 3.01 -0.01 0.00 -0.74 0.00 0.00 36.82 40.15 2x3f h ILE 139 CO 0.06 0.52 -1.14 0.58 0.00 0.00 0.00 178.15 178.17 2x3f h VAL 140 N -0.90 0.21 -6.74 1.67 2.07 -1.11 -3.40 116.25 108.05 2x3f h VAL 140 Ca -0.00 -1.41 -0.55 0.00 0.82 0.00 0.00 66.70 65.56 2x3f h VAL 140 Cb 0.86 1.73 -0.05 0.00 -1.52 0.00 0.00 31.29 32.32 2x3f h VAL 140 CO 0.00 0.12 -0.97 0.23 0.02 0.00 0.00 177.57 176.98 2x3f n MET 141 N -2.78 -1.18 -2.24 1.57 2.81 -0.42 -4.90 117.12 109.97 2x3f n MET 141 Ca -0.04 0.22 -0.32 0.00 -1.81 0.00 0.00 57.70 55.75 2x3f n MET 141 Cb 0.67 -3.47 -0.02 0.00 -0.71 0.00 0.00 33.22 29.69 2x3f n MET 141 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2x3f s PRO 142 N -6.96 3.70 0.06 0.03 0.04 -1.26 -4.89 135.00 125.71 2x3f s PRO 142 Ca 0.29 1.03 -0.16 0.00 0.04 0.00 0.00 61.00 62.20 2x3f s PRO 142 Cb -0.14 -2.09 -0.19 0.00 0.04 0.00 0.00 34.50 32.11 2x3f s PRO 142 CO 0.94 -0.48 1.22 -0.44 0.04 0.00 0.00 177.00 178.27 2x3f h ASP 143 N 0.68 0.76 -4.18 6.66 3.32 -1.23 -3.38 116.42 119.05 2x3f h ASP 143 Ca -0.47 -0.68 -0.48 0.00 0.02 0.00 0.00 57.03 55.43 2x3f h ASP 143 Cb 1.20 -0.23 -0.29 0.00 0.22 0.00 0.00 39.33 40.23 2x3f h ASP 143 CO 0.60 1.33 -0.81 -0.31 -1.72 0.00 0.00 179.24 178.33 2x3f s TYR 144 N -3.54 1.23 -0.05 4.55 2.02 -1.06 -1.08 117.35 119.42 2x3f s TYR 144 Ca -0.12 -0.24 0.04 0.00 -0.37 0.00 0.00 57.07 56.39 2x3f s TYR 144 Cb 0.06 -0.79 -0.00 0.00 -0.40 0.00 0.00 41.96 40.82 2x3f s TYR 144 CO 0.87 -0.03 -0.18 0.00 -1.57 0.00 0.00 175.55 174.64 2x3f s ALA 145 N -0.30 1.64 -0.15 3.71 0.00 -0.35 -0.71 121.76 125.59 2x3f s ALA 145 Ca 0.05 -0.74 -0.04 0.00 0.00 0.00 0.00 51.96 51.24 2x3f s ALA 145 Cb -0.05 -0.55 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 2x3f s ALA 145 CO -0.00 0.29 -0.04 0.71 0.00 0.00 0.00 175.76 176.71 2x3f s TYR 146 N 0.07 3.03 0.11 0.00 2.02 0.12 -1.03 117.35 121.66 2x3f s TYR 146 Ca -0.05 -0.27 0.03 0.00 -0.37 0.00 0.00 57.07 56.40 2x3f s TYR 146 Cb -0.12 -1.95 -0.04 0.00 -0.40 0.00 0.00 41.96 39.45 2x3f s TYR 146 CO 0.03 -0.01 -0.08 -0.06 -1.57 0.00 0.00 175.55 173.85 2x3f s PHE 147 N 0.30 1.03 -0.15 2.71 0.40 -0.20 -4.31 117.98 117.76 2x3f s PHE 147 Ca -0.03 -0.81 -0.07 0.00 -0.60 0.00 0.00 56.93 55.42 2x3f s PHE 147 Cb -0.14 -0.56 -0.04 0.00 0.51 0.00 0.00 43.02 42.79 2x3f s PHE 147 CO 0.03 -0.05 0.09 0.20 0.70 0.00 0.00 175.22 176.19 2x3f s GLY 148 N -2.94 2.00 0.00 4.36 0.00 -1.26 -0.25 107.32 109.24 2x3f s GLY 148 Ca 0.12 -0.71 0.17 0.00 0.00 0.00 0.00 44.72 44.29 2x3f s GLY 148 CO -0.02 -0.19 1.48 0.28 0.00 0.00 0.00 173.10 174.65 2x3f n LYS 149 N 2.75 0.23 -0.11 2.90 5.02 -0.01 -2.26 118.16 126.68 2x3f n LYS 149 Ca -0.18 0.13 -0.00 0.00 -2.02 0.00 0.00 58.31 56.24 2x3f n LYS 149 Cb 0.53 -1.50 0.26 0.00 -0.02 0.00 0.00 35.03 34.30 2x3f n LYS 149 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2x3f h LYS 150 N 0.00 0.77 -2.88 1.97 3.64 -1.90 -2.91 116.57 115.26 2x3f h LYS 150 Ca 0.00 -0.11 -0.80 0.00 -1.27 0.00 0.00 60.65 58.47 2x3f h LYS 150 Cb 0.16 -0.14 -0.29 0.00 -0.41 0.00 0.00 32.23 31.55 2x3f h LYS 150 CO 0.00 0.63 0.71 -0.25 -2.27 0.00 0.00 179.45 178.27 2x3f n ASP 151 N -4.35 6.29 -0.25 4.20 9.92 -0.96 -4.68 116.55 126.73 2x3f n ASP 151 Ca 0.04 -3.42 -0.05 0.00 -0.53 0.00 0.00 54.79 50.84 2x3f n ASP 151 Cb 0.15 -1.24 0.09 0.00 -0.64 0.00 0.00 41.12 39.48 2x3f n ASP 151 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2x3f h ALA 152 N 5.37 1.06 -0.39 2.24 0.00 -1.71 -0.14 119.26 125.70 2x3f h ALA 152 Ca 0.20 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2x3f h ALA 152 Cb 0.62 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2x3f h ALA 152 CO 1.31 0.64 -0.14 0.37 0.00 0.00 0.00 179.25 181.43 2x3f h GLN 153 N 1.06 0.78 -0.65 0.00 4.15 -1.89 -2.06 115.11 116.50 2x3f h GLN 153 Ca 0.24 -0.32 0.03 0.00 0.77 0.00 0.00 58.65 59.36 2x3f h GLN 153 Cb 0.28 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.89 2x3f h GLN 153 CO -0.01 0.94 0.40 0.37 -1.93 0.00 0.00 178.83 178.59 2x3f h GLN 154 N 0.58 0.76 -0.34 1.69 4.15 -1.83 -1.97 115.11 118.16 2x3f h GLN 154 Ca 0.09 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.48 2x3f h GLN 154 Cb 0.68 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.17 2x3f h GLN 154 CO 0.05 0.50 0.18 1.25 -1.93 0.00 0.00 178.83 178.89 2x3f h LEU 155 N 0.79 0.29 -1.06 -2.39 5.85 -0.76 0.50 115.31 118.52 2x3f h LEU 155 Ca 0.26 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 2x3f h LEU 155 Cb 0.02 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 2x3f h LEU 155 CO -0.10 0.21 0.38 0.00 -0.34 0.00 0.00 178.44 178.59 2x3f h ALA 156 N 1.16 1.27 -0.28 1.25 0.00 -1.19 -1.08 119.26 120.39 2x3f h ALA 156 Ca 0.14 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 2x3f h ALA 156 Cb 0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2x3f h ALA 156 CO -0.08 0.57 -0.21 0.82 0.00 0.00 0.00 179.25 180.35 2x3f h ILE 157 N 1.04 1.30 -0.51 0.00 2.04 -0.75 -1.83 117.51 118.80 2x3f h ILE 157 Ca 0.26 -1.35 -0.04 0.00 1.00 0.00 0.00 64.86 64.73 2x3f h ILE 157 Cb 0.07 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2x3f h ILE 157 CO -0.04 0.43 0.17 0.58 0.00 0.00 0.00 178.15 179.29 2x3f h VAL 158 N 0.37 1.23 -0.98 1.67 2.07 -0.68 -0.06 116.25 119.88 2x3f h VAL 158 Ca 0.05 -0.75 0.04 0.00 0.82 0.00 0.00 66.70 66.86 2x3f h VAL 158 Cb 0.76 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 2x3f h VAL 158 CO 0.06 0.28 0.64 -0.33 0.02 0.00 0.00 177.57 178.23 2x3f h GLU 159 N 0.69 1.20 -0.52 1.57 5.08 -1.16 -0.41 114.58 121.02 2x3f h GLU 159 Ca 0.16 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.33 2x3f h GLU 159 Cb 0.26 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2x3f h GLU 159 CO -0.01 0.79 -0.16 0.37 -1.00 0.00 0.00 179.01 179.01 2x3f h GLN 160 N 1.23 1.02 -0.71 2.33 5.75 -0.74 -2.48 115.11 121.52 2x3f h GLN 160 Ca 0.39 -0.41 -0.02 0.00 -0.15 0.00 0.00 58.65 58.46 2x3f h GLN 160 Cb 0.00 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.47 2x3f h GLN 160 CO -0.12 1.10 0.37 1.98 -2.65 0.00 0.00 178.83 179.50 2x3f h MET 161 N 0.89 1.00 -0.68 1.69 4.05 -0.33 0.14 114.93 121.69 2x3f h MET 161 Ca 0.13 -0.13 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 2x3f h MET 161 Cb 0.74 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 31.32 2x3f h MET 161 CO 0.06 0.77 0.40 0.28 0.23 0.00 0.00 176.91 178.64 2x3f h VAL 162 N 0.98 1.20 0.31 -5.77 2.07 -0.97 -0.22 116.25 113.85 2x3f h VAL 162 Ca 0.25 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2x3f h VAL 162 Cb 0.08 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2x3f h VAL 162 CO -0.04 0.21 -0.15 0.11 0.02 0.00 0.00 177.57 177.73 2x3f h LYS 163 N 0.92 -0.40 -0.88 1.57 1.57 -0.96 -1.35 116.57 117.05 2x3f h LYS 163 Ca 0.24 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 59.12 2x3f h LYS 163 Cb -0.01 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.34 2x3f h LYS 163 CO -0.04 -0.17 0.57 -0.44 -0.57 0.00 0.00 179.45 178.80 2x3f h ASP 164 N -0.57 0.87 0.04 0.86 3.32 -0.53 -2.82 116.42 117.59 2x3f h ASP 164 Ca -0.04 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2x3f h ASP 164 Cb 0.41 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2x3f h ASP 164 CO 0.07 0.55 -0.26 0.49 -1.72 0.00 0.00 179.24 178.37 2x3f n PHE 165 N -4.49 0.00 -3.81 4.55 3.01 -0.11 -4.98 117.46 111.62 2x3f n PHE 165 Ca 0.13 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.31 2x3f n PHE 165 Cb 0.21 -0.03 0.04 0.00 -0.01 0.00 0.00 39.48 39.69 2x3f n PHE 165 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2x3f n ASN 166 N 0.18 -5.31 -4.72 4.37 4.13 -0.57 -4.96 115.26 108.38 2x3f n ASN 166 Ca 0.12 -0.70 -0.42 0.00 1.68 0.00 0.00 54.58 55.26 2x3f n ASN 166 Cb 0.46 -4.22 -0.03 0.00 -1.54 0.00 0.00 39.78 34.45 2x3f n ASN 166 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 2x3f s HIS 167 N -3.30 3.12 -0.31 3.10 3.76 -0.86 -4.90 115.29 115.90 2x3f s HIS 167 Ca 0.64 0.80 0.25 0.00 -0.15 0.00 0.00 55.06 56.61 2x3f s HIS 167 Cb -0.31 -3.83 1.12 0.00 1.11 0.00 0.00 32.58 30.66 2x3f s HIS 167 CO 0.79 -2.96 1.77 0.00 -0.85 0.00 0.00 174.74 173.49 2x3f h ALA 168 N 6.49 1.00 -2.95 -1.40 0.00 -1.92 -3.46 119.26 117.02 2x3f h ALA 168 Ca -0.43 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 53.94 2x3f h ALA 168 Cb 1.21 0.00 0.11 0.00 0.00 0.00 0.00 17.79 19.10 2x3f h ALA 168 CO 0.87 0.00 0.74 0.08 0.00 0.00 0.00 179.25 180.94 2x3f s VAL 169 N -3.43 2.14 -0.22 0.00 1.01 -1.26 -4.99 120.40 113.65 2x3f s VAL 169 Ca 0.02 0.14 -0.12 0.00 0.00 0.00 0.00 61.98 62.02 2x3f s VAL 169 Cb 0.09 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 2x3f s VAL 169 CO 0.38 0.03 0.21 -0.70 0.00 0.00 0.00 175.10 175.02 2x3f s GLU 170 N -2.17 4.13 -0.08 2.72 2.12 -0.24 -4.96 118.70 120.21 2x3f s GLU 170 Ca 0.55 -0.15 -0.22 0.00 0.36 0.00 0.00 54.97 55.51 2x3f s GLU 170 Cb -0.45 -3.51 -0.04 0.00 0.26 0.00 0.00 34.13 30.40 2x3f s GLU 170 CO 0.60 0.10 0.65 0.42 -0.54 0.00 0.00 175.26 176.49 2x3f s ILE 171 N 0.92 5.08 -0.16 -3.70 -1.09 -1.26 -1.21 121.20 119.78 2x3f s ILE 171 Ca 0.10 1.32 0.00 0.00 -2.23 0.00 0.00 60.65 59.85 2x3f s ILE 171 Cb -0.13 -3.99 0.00 0.00 -1.58 0.00 0.00 42.46 36.77 2x3f s ILE 171 CO 0.04 0.26 -0.16 -0.63 -1.23 0.00 0.00 174.94 173.22 2x3f s ILE 172 N 0.82 2.56 -0.17 2.92 -1.09 -0.20 -4.96 121.20 121.08 2x3f s ILE 172 Ca 0.34 -0.79 -0.08 0.00 -2.23 0.00 0.00 60.65 57.89 2x3f s ILE 172 Cb -0.17 -2.09 -0.04 0.00 -1.58 0.00 0.00 42.46 38.58 2x3f s ILE 172 CO 0.16 0.51 0.10 -0.83 -1.23 0.00 0.00 174.94 173.65 2x3f s GLY 173 N 0.97 1.99 -0.08 6.18 0.00 -1.26 -1.04 107.32 114.08 2x3f s GLY 173 Ca -0.03 -0.71 -0.02 0.00 0.00 0.00 0.00 44.72 43.97 2x3f s GLY 173 CO -0.03 -0.01 0.01 -0.42 0.00 0.00 0.00 173.10 172.65 2x3f s ILE 174 N 0.09 4.38 0.67 0.90 -1.09 0.66 -4.88 121.20 121.92 2x3f s ILE 174 Ca 0.07 -0.25 -0.17 0.00 -2.23 0.00 0.00 60.65 58.08 2x3f s ILE 174 Cb -0.12 -2.85 -0.03 0.00 -1.58 0.00 0.00 42.46 37.88 2x3f s ILE 174 CO -0.00 0.59 0.83 0.47 -1.23 0.00 0.00 174.94 175.60 2x3f n ASP 175 N 2.06 0.07 -4.71 3.58 8.00 -1.26 -0.83 116.55 123.47 2x3f n ASP 175 Ca -0.18 0.70 -0.42 0.00 0.71 0.00 0.00 54.79 55.60 2x3f n ASP 175 Cb 0.54 -1.34 -0.03 0.00 -0.02 0.00 0.00 41.12 40.27 2x3f n ASP 175 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2x3f s ILE 176 N -1.73 2.47 -0.13 0.53 1.01 -1.26 -4.71 121.20 117.38 2x3f s ILE 176 Ca 0.72 0.20 -0.15 0.00 0.00 0.00 0.00 60.65 61.42 2x3f s ILE 176 Cb -0.38 -3.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 2x3f s ILE 176 CO 0.51 0.01 0.36 -0.69 0.00 0.00 0.00 174.94 175.13 2x3f s VAL 177 N 1.85 5.24 0.17 2.92 1.01 -1.26 -5.04 120.40 125.30 2x3f s VAL 177 Ca 0.75 0.71 0.10 0.00 0.00 0.00 0.00 61.98 63.53 2x3f s VAL 177 Cb -0.46 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2x3f s VAL 177 CO 0.33 0.39 -0.20 -0.13 0.00 0.00 0.00 175.10 175.49 2x3f s ARG 178 N 0.33 1.36 0.93 2.72 0.52 -1.26 -1.22 118.95 122.33 2x3f s ARG 178 Ca 0.20 -1.44 -0.11 0.00 -0.52 0.00 0.00 55.73 53.87 2x3f s ARG 178 Cb -0.14 -1.52 0.15 0.00 0.52 0.00 0.00 34.95 33.96 2x3f s ARG 178 CO 0.07 0.32 1.12 -1.21 0.02 0.00 0.00 175.30 175.62 2x3f s GLU 179 N -2.72 0.90 0.42 3.54 0.41 0.41 -4.87 118.70 116.79 2x3f s GLU 179 Ca 0.17 1.35 0.14 0.00 -0.41 0.00 0.00 54.97 56.22 2x3f s GLU 179 Cb -0.07 -1.73 1.00 0.00 -1.78 0.00 0.00 34.13 31.56 2x3f s GLU 179 CO 0.08 -2.65 1.94 0.00 -0.49 0.00 0.00 175.26 174.13 2x3f h ALA 180 N -1.87 2.03 -0.00 5.21 0.00 -2.01 0.30 119.26 122.92 2x3f h ALA 180 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2x3f h ALA 180 Cb 1.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2x3f h ALA 180 CO 0.45 -0.20 -0.01 -0.40 0.00 0.00 0.00 179.25 179.08 2x3f n ASP 181 N -4.48 0.22 0.00 0.00 5.68 -1.26 -4.90 116.55 111.82 2x3f n ASP 181 Ca 0.13 -0.89 0.00 0.00 -0.50 0.00 0.00 54.79 53.53 2x3f n ASP 181 Cb 0.45 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 2x3f n ASP 181 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x3f n GLY 182 N 1.09 1.23 3.70 6.12 0.00 0.10 -4.94 105.19 112.49 2x3f n GLY 182 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2x3f n GLY 182 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2x3f s LEU 183 N 0.00 4.38 0.22 0.99 2.96 -1.26 -4.62 118.68 121.35 2x3f s LEU 183 Ca 0.00 2.68 -0.31 0.00 -0.22 0.00 0.00 54.13 56.28 2x3f s LEU 183 Cb 0.00 -3.58 -0.11 0.00 0.50 0.00 0.00 46.19 43.01 2x3f s LEU 183 CO 0.00 -0.93 1.59 0.00 -1.32 0.00 0.00 176.35 175.69 2x3f s ALA 184 N 2.14 3.79 0.33 5.97 0.00 -1.26 -0.45 121.76 132.28 2x3f s ALA 184 Ca 0.76 1.46 -0.29 0.00 0.00 0.00 0.00 51.96 53.89 2x3f s ALA 184 Cb -0.44 -3.64 -0.11 0.00 0.00 0.00 0.00 23.12 18.93 2x3f s ALA 184 CO 0.33 -0.85 1.43 0.15 0.00 0.00 0.00 175.76 176.82 2x3f s LYS 185 N 0.53 4.22 -0.27 0.00 -0.14 -0.36 -4.85 119.74 118.87 2x3f s LYS 185 Ca 0.68 2.41 -0.25 0.00 -1.36 0.00 0.00 55.97 57.45 2x3f s LYS 185 Cb -0.46 -3.03 0.08 0.00 -1.68 0.00 0.00 37.83 32.75 2x3f s LYS 185 CO 0.37 -0.41 0.80 0.45 -0.76 0.00 0.00 175.35 175.80 2x3f s SER 186 N -0.12 -0.68 0.59 2.83 0.15 -1.26 -4.96 113.70 110.25 2x3f s SER 186 Ca 0.53 1.30 0.32 0.00 0.70 0.00 0.00 55.95 58.81 2x3f s SER 186 Cb -0.44 1.32 1.86 0.00 -1.71 0.00 0.00 66.02 67.05 2x3f s SER 186 CO 0.55 -0.23 2.24 0.28 1.20 0.00 0.00 173.24 177.28 2x3f h SER 187 N 4.79 0.00 0.84 5.45 0.02 -1.92 -1.79 113.55 120.94 2x3f h SER 187 Ca -0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2x3f h SER 187 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2x3f h SER 187 CO 0.07 0.02 -0.00 0.54 -1.14 0.00 0.00 176.83 176.32 2x3f n ARG 188 N -3.65 0.16 0.30 3.45 1.74 -1.26 -3.61 116.66 113.79 2x3f n ARG 188 Ca -0.03 -0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.21 2x3f n ARG 188 Cb 0.11 -1.50 0.92 0.00 -1.02 0.00 0.00 32.46 30.97 2x3f n ARG 188 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2x3f h ASN 189 N 0.00 0.00 0.50 0.55 2.35 -1.70 -2.15 115.58 115.13 2x3f h ASN 189 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2x3f h ASN 189 Cb 0.42 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 2x3f h ASN 189 CO 0.00 0.01 -0.05 1.62 -1.65 0.00 0.00 177.43 177.37 2x3f h VAL 190 N 0.00 0.21 0.00 2.81 3.04 -1.78 -1.92 116.25 118.60 2x3f h VAL 190 Ca -0.00 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.30 2x3f h VAL 190 Cb 0.04 1.32 0.00 0.00 -2.01 0.00 0.00 31.29 30.63 2x3f h VAL 190 CO 0.00 0.05 0.00 1.88 -1.01 0.00 0.00 177.57 178.49 2x3f h TYR 191 N 0.00 0.00 -3.51 3.17 0.05 -1.66 -3.45 116.97 111.57 2x3f h TYR 191 Ca -0.00 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.26 2x3f h TYR 191 Cb 0.31 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.07 2x3f h TYR 191 CO 0.00 0.00 0.54 -0.51 -1.05 0.00 0.00 178.16 177.14 2x3f s LEU 192 N -5.03 4.46 0.88 3.88 1.43 -0.72 -4.48 118.68 119.08 2x3f s LEU 192 Ca 0.05 2.21 -0.12 0.00 -1.03 0.00 0.00 54.13 55.25 2x3f s LEU 192 Cb 0.09 -3.61 0.12 0.00 0.03 0.00 0.00 46.19 42.82 2x3f s LEU 192 CO 0.50 -0.34 1.10 0.42 0.23 0.00 0.00 176.35 178.26 2x3f s THR 193 N -0.13 2.65 0.19 5.49 -4.23 -1.26 -4.76 115.64 113.57 2x3f s THR 193 Ca 0.52 0.21 -0.18 0.00 -1.18 0.00 0.00 61.69 61.06 2x3f s THR 193 Cb -0.32 -2.82 0.14 0.00 1.34 0.00 0.00 72.50 70.85 2x3f s THR 193 CO 0.37 -0.27 1.62 -0.33 -0.54 0.00 0.00 174.62 175.46 2x3f h GLU 194 N -1.43 -0.10 -0.43 3.99 5.08 -1.99 -0.09 114.58 119.61 2x3f h GLU 194 Ca -0.49 0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 57.75 2x3f h GLU 194 Cb 1.29 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.55 2x3f h GLU 194 CO 0.57 -0.07 -0.21 0.37 -1.00 0.00 0.00 179.01 178.67 2x3f h GLN 195 N -0.11 0.90 -0.87 2.33 4.15 -2.00 -2.89 115.11 116.62 2x3f h GLN 195 Ca 0.23 -0.40 -0.03 0.00 0.77 0.00 0.00 58.65 59.23 2x3f h GLN 195 Cb 0.47 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.10 2x3f h GLN 195 CO -0.58 1.05 0.44 0.93 -1.93 0.00 0.00 178.83 178.74 2x3f h GLU 196 N 0.73 1.24 -0.88 1.69 5.08 -1.81 -1.43 114.58 119.20 2x3f h GLU 196 Ca 0.09 -0.17 0.09 0.00 -1.00 0.00 0.00 59.36 58.37 2x3f h GLU 196 Cb 0.78 -0.23 -0.07 0.00 0.50 0.00 0.00 28.75 29.73 2x3f h GLU 196 CO 0.06 0.94 0.53 -0.09 -1.00 0.00 0.00 179.01 179.45 2x3f h ARG 197 N 1.24 0.87 -0.41 2.33 9.65 -0.88 0.92 114.38 128.11 2x3f h ARG 197 Ca 0.30 -0.05 -0.14 0.00 -1.10 0.00 0.00 59.98 58.99 2x3f h ARG 197 Cb 0.09 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 28.46 2x3f h ARG 197 CO -0.04 0.58 -0.30 1.96 2.80 0.00 0.00 179.97 184.97 2x3f h GLN 198 N 0.90 0.89 -0.42 0.20 1.08 -1.27 -3.01 115.11 113.47 2x3f h GLN 198 Ca 0.41 -0.41 -0.13 0.00 -1.45 0.00 0.00 58.65 57.08 2x3f h GLN 198 Cb 0.33 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 2x3f h GLN 198 CO -0.23 1.06 -0.24 0.93 -0.95 0.00 0.00 178.83 179.41 2x3f h GLU 199 N 0.75 0.87 0.00 1.46 5.08 -0.34 -3.28 114.58 119.11 2x3f h GLU 199 Ca 0.08 -0.37 -0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2x3f h GLU 199 Cb 0.86 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.08 2x3f h GLU 199 CO 0.08 1.01 -0.00 0.00 -1.00 0.00 0.00 179.01 179.10 2x3f h ALA 200 N 0.97 1.29 -0.00 3.43 0.00 0.99 -0.42 119.26 125.52 2x3f h ALA 200 Ca 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2x3f h ALA 200 Cb 0.78 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2x3f h ALA 200 CO 0.06 0.00 0.00 0.28 0.00 0.00 0.00 179.25 179.60 2x3f h VAL 201 N 0.00 0.21 0.00 0.00 2.07 -1.62 -2.22 116.25 114.69 2x3f h VAL 201 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2x3f h VAL 201 Cb 0.01 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2x3f h VAL 201 CO 0.00 0.00 0.00 1.41 0.02 0.00 0.00 177.57 179.00 2x3f n HIS 202 N -3.39 0.51 0.32 1.57 -0.00 -0.17 -2.55 115.22 111.52 2x3f n HIS 202 Ca -0.03 0.17 -0.17 0.00 -0.00 0.00 0.00 57.72 57.69 2x3f n HIS 202 Cb 0.08 -0.78 -0.09 0.00 -0.00 0.00 0.00 29.99 29.21 2x3f n HIS 202 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2x3f h LEU 203 N 0.00 -0.66 -0.68 2.41 4.07 -1.59 -0.96 115.31 117.89 2x3f h LEU 203 Ca 0.00 -0.01 0.02 0.00 0.08 0.00 0.00 57.88 57.98 2x3f h LEU 203 Cb 0.51 0.17 -0.04 0.00 1.08 0.00 0.00 40.66 42.38 2x3f h LEU 203 CO 0.00 -0.42 0.43 0.77 -1.08 0.00 0.00 178.44 178.14 2x3f h SER 204 N -0.86 0.72 -0.72 -0.43 4.64 -1.71 -2.38 113.55 112.81 2x3f h SER 204 Ca -0.08 -0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.27 2x3f h SER 204 Cb 0.63 -0.16 -0.04 0.00 -0.31 0.00 0.00 62.40 62.52 2x3f h SER 204 CO 0.13 0.50 0.47 0.11 -0.87 0.00 0.00 176.83 177.18 2x3f h LYS 205 N 0.85 0.83 -0.04 4.77 1.57 -1.46 -2.07 116.57 121.02 2x3f h LYS 205 Ca 0.27 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.90 2x3f h LYS 205 Cb -0.01 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 2x3f h LYS 205 CO -0.09 0.55 -0.41 0.66 -0.57 0.00 0.00 179.45 179.58 2x3f h SER 206 N 0.85 0.08 0.34 0.86 4.64 -0.67 -1.13 113.55 118.53 2x3f h SER 206 Ca 0.29 -0.03 -0.15 0.00 -0.47 0.00 0.00 61.79 61.43 2x3f h SER 206 Cb 0.08 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 2x3f h SER 206 CO -0.08 0.49 -0.62 -0.07 -0.87 0.00 0.00 176.83 175.68 2x3f h LEU 207 N 0.07 0.31 -0.81 5.97 3.38 -1.04 -0.44 115.31 122.74 2x3f h LEU 207 Ca 0.00 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.67 2x3f h LEU 207 Cb 0.76 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2x3f h LEU 207 CO 0.06 0.85 -0.42 -0.07 0.09 0.00 0.00 178.44 178.94 2x3f h LEU 208 N 0.20 0.39 -0.24 1.67 3.38 -0.90 -0.45 115.31 119.36 2x3f h LEU 208 Ca -0.01 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2x3f h LEU 208 Cb 1.13 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 2x3f h LEU 208 CO 0.10 0.77 0.12 0.25 0.09 0.00 0.00 178.44 179.77 2x3f h LEU 209 N 0.30 0.31 -0.81 1.67 5.85 -0.99 -0.58 115.31 121.07 2x3f h LEU 209 Ca 0.03 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 2x3f h LEU 209 Cb 0.87 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 2x3f h LEU 209 CO 0.07 0.33 0.45 0.00 -0.34 0.00 0.00 178.44 178.95 2x3f h ALA 210 N 0.99 1.03 -0.62 1.25 0.00 -0.86 -1.22 119.26 119.84 2x3f h ALA 210 Ca 0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2x3f h ALA 210 Cb 0.10 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2x3f h ALA 210 CO -0.01 0.54 0.26 0.37 0.00 0.00 0.00 179.25 180.41 2x3f h GLN 211 N 1.12 0.91 -0.44 0.00 4.15 -0.91 -1.42 115.11 118.52 2x3f h GLN 211 Ca 0.28 -0.15 -0.05 0.00 0.77 0.00 0.00 58.65 59.50 2x3f h GLN 211 Cb 0.02 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.54 2x3f h GLN 211 CO -0.05 0.76 0.07 0.00 -1.93 0.00 0.00 178.83 177.68 2x3f h ALA 212 N 1.11 0.59 -0.49 3.38 0.00 -0.77 0.42 119.26 123.50 2x3f h ALA 212 Ca 0.21 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 54.95 2x3f h ALA 212 Cb 0.18 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2x3f h ALA 212 CO -0.02 0.31 0.20 -0.07 0.00 0.00 0.00 179.25 179.67 2x3f h LEU 213 N 0.59 0.24 -0.30 0.00 3.38 -1.09 0.40 115.31 118.52 2x3f h LEU 213 Ca 0.13 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 2x3f h LEU 213 Cb 0.39 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2x3f h LEU 213 CO 0.01 0.17 0.13 0.22 0.09 0.00 0.00 178.44 179.06 2x3f h TYR 214 N 0.39 0.45 -0.75 1.13 5.03 -1.01 -0.32 116.97 121.89 2x3f h TYR 214 Ca 0.23 -0.03 0.10 0.00 2.58 0.00 0.00 58.73 61.61 2x3f h TYR 214 Cb 0.21 -0.14 -0.07 0.00 1.55 0.00 0.00 36.73 38.27 2x3f h TYR 214 CO -0.14 0.42 0.39 0.37 -1.32 0.00 0.00 178.16 177.88 2x3f h GLN 215 N 0.35 0.63 0.00 1.82 5.75 0.86 -1.65 115.11 122.87 2x3f h GLN 215 Ca 0.10 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 2x3f h GLN 215 Cb 0.15 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.56 2x3f h GLN 215 CO -0.01 0.42 0.00 -3.47 -2.65 0.00 0.00 178.83 173.12 2x3f n ASP 216 N -4.83 0.00 0.00 -0.69 2.03 0.13 -4.87 116.55 108.31 2x3f n ASP 216 Ca 0.12 -0.67 0.00 0.00 0.52 0.00 0.00 54.79 54.76 2x3f n ASP 216 Cb 0.29 -0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.58 2x3f n ASP 216 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2x3f n GLY 217 N 1.07 1.22 3.72 0.27 0.00 -0.62 -5.07 105.19 105.78 2x3f n GLY 217 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2x3f n GLY 217 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x3f s GLU 218 N -0.21 4.38 0.00 1.61 2.56 -0.17 -4.90 118.70 121.98 2x3f s GLU 218 Ca 0.00 1.98 0.00 0.00 0.00 0.00 0.00 54.97 56.95 2x3f s GLU 218 Cb 0.00 -3.26 0.00 0.00 2.00 0.00 0.00 34.13 32.87 2x3f s GLU 218 CO 0.00 -0.31 0.19 0.54 -0.56 0.00 0.00 175.26 175.12 2x3f n ARG 219 N 3.47 1.14 -2.71 4.30 5.12 -1.26 -4.34 116.66 122.38 2x3f n ARG 219 Ca 0.09 -0.19 -0.43 0.00 -1.93 0.00 0.00 57.85 55.39 2x3f n ARG 219 Cb 0.44 -0.62 -0.03 0.00 -1.16 0.00 0.00 32.46 31.09 2x3f n ARG 219 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 2x3f s GLN 220 N -0.22 3.91 0.26 5.56 0.74 -1.26 -0.00 119.66 128.64 2x3f s GLN 220 Ca 0.00 0.76 -0.03 0.00 0.05 0.00 0.00 55.36 56.14 2x3f s GLN 220 Cb 0.00 -3.80 0.38 0.00 1.10 0.00 0.00 33.01 30.69 2x3f s GLN 220 CO 0.00 -1.01 1.88 0.77 -0.55 0.00 0.00 175.29 176.38 2x3f h SER 221 N 8.46 1.02 -0.91 6.67 0.02 -1.13 -2.11 113.55 125.58 2x3f h SER 221 Ca -0.22 0.01 0.12 0.00 -0.84 0.00 0.00 61.79 60.86 2x3f h SER 221 Cb 1.07 -0.21 -0.08 0.00 0.14 0.00 0.00 62.40 63.31 2x3f h SER 221 CO 1.03 0.66 0.53 0.50 -1.14 0.00 0.00 176.83 178.41 2x3f h LYS 222 N 1.17 0.81 -0.27 3.45 3.64 -1.90 0.50 116.57 123.96 2x3f h LYS 222 Ca 0.42 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.66 2x3f h LYS 222 Cb 0.13 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2x3f h LYS 222 CO -0.16 0.53 -0.17 0.28 -2.27 0.00 0.00 179.45 177.66 2x3f h VAL 223 N 0.83 1.30 0.07 2.00 2.07 -1.78 -1.25 116.25 119.50 2x3f h VAL 223 Ca 0.46 -1.29 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 2x3f h VAL 223 Cb 0.50 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 2x3f h VAL 223 CO -0.28 0.41 -0.04 0.40 0.02 0.00 0.00 177.57 178.08 2x3f h ILE 224 N 0.33 0.94 -0.76 4.57 2.04 -1.12 -1.16 117.51 122.35 2x3f h ILE 224 Ca 0.06 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.90 2x3f h ILE 224 Cb 0.70 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 2x3f h ILE 224 CO 0.05 0.01 0.48 0.40 0.00 0.00 0.00 178.15 179.09 2x3f h ILE 225 N -0.12 1.10 -0.25 -0.67 2.04 -0.87 0.16 117.51 118.90 2x3f h ILE 225 Ca -0.01 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 2x3f h ILE 225 Cb 0.10 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.25 2x3f h ILE 225 CO 0.02 0.17 0.06 0.44 0.00 0.00 0.00 178.15 178.84 2x3f h ASP 226 N 0.94 0.38 -0.50 1.72 3.32 -1.11 0.48 116.42 121.65 2x3f h ASP 226 Ca 0.31 -0.23 -0.09 0.00 0.02 0.00 0.00 57.03 57.04 2x3f h ASP 226 Cb 0.03 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2x3f h ASP 226 CO -0.12 0.52 -0.03 0.11 -1.72 0.00 0.00 179.24 178.00 2x3f h LYS 227 N 0.23 0.90 -0.25 3.56 1.57 -0.79 0.21 116.57 121.99 2x3f h LYS 227 Ca 0.08 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.54 2x3f h LYS 227 Cb 0.29 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2x3f h LYS 227 CO 0.00 0.94 0.10 0.28 -0.57 0.00 0.00 179.45 180.20 2x3f h VAL 228 N 0.75 1.18 -0.11 0.50 2.07 -1.00 -1.68 116.25 117.97 2x3f h VAL 228 Ca 0.14 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 2x3f h VAL 228 Cb 0.56 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 2x3f h VAL 228 CO 0.03 0.18 0.05 0.74 0.02 0.00 0.00 177.57 178.60 2x3f h THR 229 N 0.26 1.12 -0.83 2.57 2.02 -0.51 -0.73 112.91 116.80 2x3f h THR 229 Ca 0.08 -0.35 0.03 0.00 0.77 0.00 0.00 66.41 66.95 2x3f h THR 229 Cb 0.20 1.15 -0.05 0.00 -1.74 0.00 0.00 68.15 67.71 2x3f h THR 229 CO -0.01 0.11 0.54 1.56 0.37 0.00 0.00 175.52 178.09 2x3f h GLN 230 N 0.05 1.02 -0.30 6.66 4.20 -0.62 -0.58 115.11 125.53 2x3f h GLN 230 Ca 0.04 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.70 2x3f h GLN 230 Cb 0.12 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 2x3f h GLN 230 CO -0.00 0.67 0.16 -0.92 -0.67 0.00 0.00 178.83 178.07 2x3f h TYR 231 N 1.05 0.29 -0.46 2.96 5.03 -1.03 -2.43 116.97 122.38 2x3f h TYR 231 Ca 0.33 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.64 2x3f h TYR 231 Cb -0.00 -0.09 -0.02 0.00 1.55 0.00 0.00 36.73 38.16 2x3f h TYR 231 CO -0.02 0.17 0.26 -0.07 -1.32 0.00 0.00 178.16 177.17 2x3f h LEU 232 N 0.33 0.57 -1.17 2.82 3.38 -0.67 -3.02 115.31 117.56 2x3f h LEU 232 Ca 0.12 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.04 2x3f h LEU 232 Cb 0.02 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 2x3f h LEU 232 CO -0.07 0.49 0.57 -0.33 0.09 0.00 0.00 178.44 179.19 2x3f h GLU 233 N 0.61 1.04 -0.00 1.13 5.08 -0.93 -0.06 114.58 121.45 2x3f h GLU 233 Ca 0.16 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2x3f h GLU 233 Cb 0.05 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.06 2x3f h GLU 233 CO -0.03 0.69 -0.02 -1.13 -1.00 0.00 0.00 179.01 177.52 2x3f n SER 234 N -4.45 0.06 0.00 1.42 3.41 -0.93 -4.15 113.62 108.98 2x3f n SER 234 Ca 0.12 -0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 2x3f n SER 234 Cb 0.12 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2x3f n SER 234 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2x3f n HIS 235 N -1.24 0.00 -4.22 7.33 8.25 -0.52 -5.08 115.22 119.74 2x3f n HIS 235 Ca 0.14 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.41 2x3f n HIS 235 Cb 0.24 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.24 2x3f n HIS 235 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2x3f s ILE 236 N -1.73 1.31 -1.20 1.59 -4.36 -0.15 -4.78 121.20 111.88 2x3f s ILE 236 Ca 0.00 -1.54 0.26 0.00 -0.26 0.00 0.00 60.65 59.11 2x3f s ILE 236 Cb 0.00 -1.36 0.09 0.00 1.25 0.00 0.00 42.46 42.44 2x3f s ILE 236 CO 0.00 -0.29 1.48 -1.54 0.24 0.00 0.00 174.94 174.83 2x3f n SER 237 N 0.89 0.60 -4.82 4.36 3.41 -1.26 -4.78 113.62 112.03 2x3f n SER 237 Ca -0.18 -0.38 -0.32 0.00 -0.26 0.00 0.00 58.87 57.73 2x3f n SER 237 Cb 0.55 0.19 0.01 0.00 -0.26 0.00 0.00 64.21 64.70 2x3f n SER 237 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2x3f s GLY 238 N -2.87 1.98 -0.17 5.00 0.00 -1.26 -5.00 107.32 105.00 2x3f s GLY 238 Ca 0.15 0.25 -0.29 0.00 0.00 0.00 0.00 44.72 44.83 2x3f s GLY 238 CO 0.65 0.56 1.02 -1.60 0.00 0.00 0.00 173.10 173.72 2x3f s ARG 239 N -4.37 4.34 -0.72 2.90 3.52 0.01 -4.86 118.95 119.76 2x3f s ARG 239 Ca 0.61 1.37 -0.26 0.00 -0.13 0.00 0.00 55.73 57.33 2x3f s ARG 239 Cb -0.14 -3.59 0.04 0.00 -1.56 0.00 0.00 34.95 29.70 2x3f s ARG 239 CO 0.41 -0.48 1.19 0.42 -0.81 0.00 0.00 175.30 176.03 2x3f s ILE 240 N 2.64 3.91 0.06 4.11 1.01 -1.26 -0.22 121.20 131.45 2x3f s ILE 240 Ca 0.46 0.14 -0.06 0.00 0.00 0.00 0.00 60.65 61.18 2x3f s ILE 240 Cb -0.17 -4.85 -0.30 0.00 0.01 0.00 0.00 42.46 37.16 2x3f s ILE 240 CO 0.12 -1.74 1.08 -0.33 0.00 0.00 0.00 174.94 174.06 2x3f h GLU 241 N 9.88 0.32 -2.97 2.79 5.08 -1.16 -3.47 114.58 125.05 2x3f h GLU 241 Ca -0.27 -0.55 -0.15 0.00 -1.00 0.00 0.00 59.36 57.40 2x3f h GLU 241 Cb 1.05 0.20 -0.25 0.00 0.50 0.00 0.00 28.75 30.26 2x3f h GLU 241 CO 1.25 1.25 -0.35 -1.21 -1.00 0.00 0.00 179.01 178.95 2x3f s GLU 242 N -2.64 0.37 -0.15 2.33 0.41 -0.81 -4.92 118.70 113.28 2x3f s GLU 242 Ca -0.06 0.44 -0.04 0.00 -0.41 0.00 0.00 54.97 54.90 2x3f s GLU 242 Cb 0.06 0.18 0.06 0.00 -1.78 0.00 0.00 34.13 32.65 2x3f s GLU 242 CO 0.89 -0.04 0.10 0.08 -0.49 0.00 0.00 175.26 175.79 2x3f s VAL 243 N 0.18 -0.11 0.03 2.63 1.01 -1.26 -1.61 120.40 121.27 2x3f s VAL 243 Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.93 2x3f s VAL 243 Cb -0.02 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.83 2x3f s VAL 243 CO 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 175.10 174.88 2x3f s ALA 244 N 2.16 0.26 -0.22 5.51 0.00 -0.43 -4.95 121.76 124.09 2x3f s ALA 244 Ca 0.03 -0.78 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 2x3f s ALA 244 Cb -0.15 0.18 0.06 0.00 0.00 0.00 0.00 23.12 23.21 2x3f s ALA 244 CO -0.08 -0.21 -0.03 0.08 0.00 0.00 0.00 175.76 175.51 2x3f s VAL 245 N -2.16 1.27 0.07 0.00 1.01 -1.26 -1.16 120.40 118.17 2x3f s VAL 245 Ca -0.09 -1.03 0.05 0.00 0.00 0.00 0.00 61.98 60.91 2x3f s VAL 245 Cb -0.05 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 2x3f s VAL 245 CO -0.03 -0.12 -0.14 -0.31 0.00 0.00 0.00 175.10 174.50 2x3f s TYR 246 N 1.52 1.18 0.69 5.22 1.51 -0.85 -1.54 117.35 125.07 2x3f s TYR 246 Ca -0.04 -0.47 -0.16 0.00 -1.01 0.00 0.00 57.07 55.38 2x3f s TYR 246 Cb -0.18 -0.66 0.02 0.00 -0.11 0.00 0.00 41.96 41.02 2x3f s TYR 246 CO -0.07 0.05 1.23 -1.54 -1.11 0.00 0.00 175.55 174.11 2x3f s SER 247 N -1.77 4.44 -0.03 2.29 1.04 -0.18 -0.30 113.70 119.19 2x3f s SER 247 Ca -0.02 2.44 0.01 0.00 0.48 0.00 0.00 55.95 58.86 2x3f s SER 247 Cb -0.10 -2.60 0.02 0.00 0.10 0.00 0.00 66.02 63.44 2x3f s SER 247 CO 0.02 -2.11 -0.03 -0.47 0.98 0.00 0.00 173.24 171.64 2x3f s TYR 248 N -1.76 0.47 -1.98 5.02 5.04 -0.53 -1.05 117.35 122.56 2x3f s TYR 248 Ca 0.77 -0.08 0.13 0.00 -2.44 0.00 0.00 57.07 55.45 2x3f s TYR 248 Cb -0.32 -0.44 0.37 0.00 0.35 0.00 0.00 41.96 41.93 2x3f s TYR 248 CO 0.42 -0.11 1.31 -0.35 -1.34 0.00 0.00 175.55 175.48 2x3f n PRO 249 N 3.76 1.99 0.22 4.97 -0.04 -1.26 -4.58 135.00 140.06 2x3f n PRO 249 Ca -0.23 -1.51 0.11 0.00 -0.04 0.00 0.00 63.50 61.83 2x3f n PRO 249 Cb 0.53 -1.33 0.35 0.00 -0.04 0.00 0.00 33.50 33.00 2x3f n PRO 249 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2x3f h GLN 250 N 2.45 0.00 -5.62 0.54 7.50 -1.94 -3.48 115.11 114.56 2x3f h GLN 250 Ca 0.00 0.00 -0.31 0.00 0.50 0.00 0.00 58.65 58.84 2x3f h GLN 250 Cb 0.57 0.00 0.17 0.00 0.05 0.00 0.00 27.48 28.28 2x3f h GLN 250 CO 0.00 0.14 -0.80 1.28 -1.50 0.00 0.00 178.83 177.96 2x3f n LEU 251 N -3.19 -4.43 -4.31 1.46 4.32 -0.22 -4.93 117.00 105.71 2x3f n LEU 251 Ca 0.02 -0.65 -0.33 0.00 -0.02 0.00 0.00 56.01 55.03 2x3f n LEU 251 Cb 0.48 -3.13 -0.15 0.00 -1.62 0.00 0.00 43.42 39.00 2x3f n LEU 251 CO 0.33 0.31 -0.49 -0.69 -1.22 0.00 0.00 177.39 175.63 2x3f s VAL 252 N -3.38 2.63 0.27 4.08 1.01 -1.25 -4.87 120.40 118.90 2x3f s VAL 252 Ca 0.12 -0.81 -0.30 0.00 0.00 0.00 0.00 61.98 60.99 2x3f s VAL 252 Cb -0.02 -2.07 -0.13 0.00 0.00 0.00 0.00 36.38 34.17 2x3f s VAL 252 CO 0.74 0.54 1.49 1.21 0.00 0.00 0.00 175.10 179.07 2x3f n GLU 253 N 3.53 2.34 -4.32 2.72 2.13 -1.26 -1.01 120.64 124.77 2x3f n GLU 253 Ca -0.19 0.83 -0.33 0.00 0.66 0.00 0.00 57.16 58.13 2x3f n GLU 253 Cb 0.53 -2.54 -0.09 0.00 0.27 0.00 0.00 31.44 29.61 2x3f n GLU 253 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2x3f s GLN 254 N -0.54 2.85 -0.08 5.31 -1.52 -0.59 -4.85 119.66 120.24 2x3f s GLN 254 Ca 0.66 -0.55 -0.08 0.00 -1.95 0.00 0.00 55.36 53.44 2x3f s GLN 254 Cb -0.58 -2.70 -0.04 0.00 -0.22 0.00 0.00 33.01 29.47 2x3f s GLN 254 CO 0.50 0.65 -0.17 0.72 -0.25 0.00 0.00 175.29 176.74 2x3f n HIS 255 N 1.64 0.00 -4.02 0.91 8.25 -1.26 -4.75 115.22 115.99 2x3f n HIS 255 Ca -0.16 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 56.95 2x3f n HIS 255 Cb 0.53 -0.35 -0.13 0.00 1.12 0.00 0.00 29.99 31.16 2x3f n HIS 255 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2x3f s GLU 256 N -2.34 3.61 -0.07 -0.41 0.41 -1.26 -0.56 118.70 118.08 2x3f s GLU 256 Ca -0.16 -0.52 -0.29 0.00 -0.41 0.00 0.00 54.97 53.58 2x3f s GLU 256 Cb 0.04 -3.10 -0.02 0.00 -1.78 0.00 0.00 34.13 29.27 2x3f s GLU 256 CO 0.22 -0.02 0.98 0.42 -0.49 0.00 0.00 175.26 176.37 2x3f s ILE 257 N 1.10 4.83 0.03 -1.63 1.01 1.00 -4.97 121.20 122.56 2x3f s ILE 257 Ca 0.02 2.02 -0.03 0.00 0.00 0.00 0.00 60.65 62.66 2x3f s ILE 257 Cb -0.14 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.01 2x3f s ILE 257 CO 0.02 0.07 0.04 0.42 0.00 0.00 0.00 174.94 175.49 2x3f s THR 258 N 1.61 0.13 0.00 2.92 -4.23 -1.26 -4.93 115.64 109.88 2x3f s THR 258 Ca 0.49 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 2x3f s THR 258 Cb -0.19 -0.75 0.00 0.00 1.34 0.00 0.00 72.50 72.89 2x3f s THR 258 CO 0.21 -0.61 0.00 0.61 -0.54 0.00 0.00 174.62 174.29 2x3f n GLY 259 N 0.99 -1.12 3.68 3.99 0.00 -1.26 -4.74 105.19 106.73 2x3f n GLY 259 Ca -0.20 -1.23 -0.41 0.00 0.00 0.00 0.00 46.02 44.18 2x3f n GLY 259 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2x3f s ARG 260 N 0.00 4.34 0.25 1.61 3.52 -1.13 -4.20 118.95 123.34 2x3f s ARG 260 Ca 0.00 1.01 0.05 0.00 -0.13 0.00 0.00 55.73 56.66 2x3f s ARG 260 Cb 0.00 -3.54 -0.05 0.00 -1.56 0.00 0.00 34.95 29.80 2x3f s ARG 260 CO 0.00 -0.23 -0.03 0.96 -0.81 0.00 0.00 175.30 175.20 2x3f s ILE 261 N 1.79 1.27 -0.03 4.11 -4.36 -0.09 -1.45 121.20 122.45 2x3f s ILE 261 Ca 0.39 -2.07 0.04 0.00 -0.26 0.00 0.00 60.65 58.75 2x3f s ILE 261 Cb -0.17 -2.38 -0.00 0.00 1.25 0.00 0.00 42.46 41.16 2x3f s ILE 261 CO 0.15 -0.32 -0.13 0.72 0.24 0.00 0.00 174.94 175.59 2x3f s PHE 262 N -3.26 1.30 -0.28 1.37 -0.71 0.59 -0.94 117.98 116.05 2x3f s PHE 262 Ca 0.29 -0.31 -0.10 0.00 -1.04 0.00 0.00 56.93 55.77 2x3f s PHE 262 Cb 0.05 -0.87 -0.04 0.00 -1.21 0.00 0.00 43.02 40.95 2x3f s PHE 262 CO 0.10 -0.09 0.15 0.42 -1.34 0.00 0.00 175.22 174.45 2x3f s ILE 263 N -0.05 4.88 0.13 -4.49 1.01 0.17 -2.01 121.20 120.84 2x3f s ILE 263 Ca -0.00 -0.03 0.09 0.00 0.00 0.00 0.00 60.65 60.70 2x3f s ILE 263 Cb -0.08 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.01 2x3f s ILE 263 CO 0.01 0.25 -0.21 -0.94 0.00 0.00 0.00 174.94 174.04 2x3f s SER 264 N 1.69 2.73 0.03 3.58 1.04 -0.31 -1.51 113.70 120.95 2x3f s SER 264 Ca 0.06 -0.75 0.04 0.00 0.48 0.00 0.00 55.95 55.79 2x3f s SER 264 Cb -0.16 -0.16 -0.02 0.00 0.10 0.00 0.00 66.02 65.78 2x3f s SER 264 CO 0.08 0.06 -0.11 -0.76 0.98 0.00 0.00 173.24 173.48 2x3f s LEU 265 N -2.14 2.15 -0.04 2.42 1.43 -0.08 -1.32 118.68 121.10 2x3f s LEU 265 Ca 0.10 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 2x3f s LEU 265 Cb -0.09 -0.45 0.02 0.00 0.03 0.00 0.00 46.19 45.70 2x3f s LEU 265 CO 0.05 -0.01 -0.02 0.00 0.23 0.00 0.00 176.35 176.61 2x3f s ALA 266 N -0.81 0.51 -0.05 4.21 0.00 -0.63 -2.44 121.76 122.56 2x3f s ALA 266 Ca -0.01 0.03 0.02 0.00 0.00 0.00 0.00 51.96 52.01 2x3f s ALA 266 Cb -0.07 -0.43 0.02 0.00 0.00 0.00 0.00 23.12 22.64 2x3f s ALA 266 CO 0.01 -0.11 -0.09 0.08 0.00 0.00 0.00 175.76 175.65 2x3f s VAL 267 N 1.13 0.85 -0.45 0.00 1.01 -0.31 -0.49 120.40 122.14 2x3f s VAL 267 Ca -0.08 -0.32 -0.13 0.00 0.00 0.00 0.00 61.98 61.45 2x3f s VAL 267 Cb -0.14 -0.81 0.07 0.00 0.00 0.00 0.00 36.38 35.51 2x3f s VAL 267 CO -0.01 0.29 0.34 -0.75 0.00 0.00 0.00 175.10 174.96 2x3f s LYS 268 N 0.72 2.86 0.30 2.72 2.47 0.70 -0.93 119.74 128.58 2x3f s LYS 268 Ca -0.13 -1.35 -0.04 0.00 -1.56 0.00 0.00 55.97 52.90 2x3f s LYS 268 Cb -0.15 -3.99 0.07 0.00 -1.46 0.00 0.00 37.83 32.29 2x3f s LYS 268 CO 0.02 -0.97 0.41 1.19 0.16 0.00 0.00 175.35 176.16 2x3f n PHE 269 N 5.10 -3.76 -0.23 4.03 3.72 0.67 -0.81 117.46 126.18 2x3f n PHE 269 Ca -0.12 -0.45 -0.06 0.00 -0.05 0.00 0.00 57.45 56.78 2x3f n PHE 269 Cb 0.44 -0.31 -0.00 0.00 -0.94 0.00 0.00 39.48 38.66 2x3f n PHE 269 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2x3f h SER 270 N -0.46 -1.32 0.00 4.37 0.87 -1.94 -3.35 113.55 111.72 2x3f h SER 270 Ca -0.13 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2x3f h SER 270 Cb 0.40 0.64 0.00 0.00 -0.44 0.00 0.00 62.40 63.00 2x3f h SER 270 CO 0.11 -0.31 -1.00 1.17 -0.53 0.00 0.00 176.83 176.27 2x3f n LYS 271 N -5.43 1.63 -2.41 2.24 4.81 -1.26 -5.04 118.16 112.70 2x3f n LYS 271 Ca 0.04 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.06 2x3f n LYS 271 Cb 0.36 -1.00 -0.03 0.00 0.02 0.00 0.00 35.03 34.38 2x3f n LYS 271 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2x3f s ALA 272 N -2.00 3.53 -0.35 3.14 0.00 -1.26 -5.01 121.76 119.81 2x3f s ALA 272 Ca 0.00 0.66 -0.10 0.00 0.00 0.00 0.00 51.96 52.52 2x3f s ALA 272 Cb 0.00 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.60 2x3f s ALA 272 CO 0.00 -0.83 0.18 0.50 0.00 0.00 0.00 175.76 175.61 2x3f s ARG 273 N 2.37 2.95 0.05 0.00 3.52 -1.26 -0.24 118.95 126.35 2x3f s ARG 273 Ca 0.57 -0.99 0.03 0.00 -0.13 0.00 0.00 55.73 55.21 2x3f s ARG 273 Cb -0.26 -3.66 -0.04 0.00 -1.56 0.00 0.00 34.95 29.43 2x3f s ARG 273 CO 0.22 -0.62 0.03 -0.51 -0.81 0.00 0.00 175.30 173.62 2x3f s LEU 274 N 1.56 3.63 0.24 -0.88 1.43 -0.10 -4.96 118.68 119.60 2x3f s LEU 274 Ca 0.02 -0.04 0.05 0.00 -1.03 0.00 0.00 54.13 53.13 2x3f s LEU 274 Cb -0.19 -2.26 -0.05 0.00 0.03 0.00 0.00 46.19 43.73 2x3f s LEU 274 CO 0.06 0.21 -0.05 0.27 0.23 0.00 0.00 176.35 177.08 2x3f s ILE 275 N -1.27 1.35 0.06 -0.59 -4.36 -1.26 -1.16 121.20 113.96 2x3f s ILE 275 Ca 0.25 -2.09 -0.27 0.00 -0.26 0.00 0.00 60.65 58.29 2x3f s ILE 275 Cb -0.12 -2.32 0.09 0.00 1.25 0.00 0.00 42.46 41.36 2x3f s ILE 275 CO 0.17 -0.37 0.82 -0.62 0.24 0.00 0.00 174.94 175.18 2x3f s ASP 276 N -3.35 -0.39 0.22 4.36 -1.08 -1.02 -4.91 116.67 110.51 2x3f s ASP 276 Ca 0.27 -0.06 -0.21 0.00 -0.52 0.00 0.00 52.55 52.03 2x3f s ASP 276 Cb 0.04 0.46 0.04 0.00 -1.46 0.00 0.00 42.92 41.99 2x3f s ASP 276 CO 0.09 -0.75 0.64 0.54 0.52 0.00 0.00 175.17 176.20 2x3f s ASN 277 N -2.61 -0.36 -0.02 -0.34 2.20 -1.26 -0.90 114.94 111.66 2x3f s ASN 277 Ca 0.05 -0.38 0.02 0.00 -0.94 0.00 0.00 52.86 51.61 2x3f s ASN 277 Cb -0.01 0.65 -0.00 0.00 -2.00 0.00 0.00 41.25 39.89 2x3f s ASN 277 CO -0.08 -1.16 -0.08 -0.51 -2.94 0.00 0.00 177.10 172.32 2x3f s ILE 278 N -3.85 0.70 -0.19 0.54 2.07 -0.57 -4.99 121.20 114.91 2x3f s ILE 278 Ca 0.07 -0.35 -0.08 0.00 -1.41 0.00 0.00 60.65 58.89 2x3f s ILE 278 Cb -0.03 -0.61 -0.04 0.00 0.13 0.00 0.00 42.46 41.91 2x3f s ILE 278 CO -0.02 0.21 0.07 -0.63 -1.91 0.00 0.00 174.94 172.66 2x3f s ILE 279 N 0.00 4.82 0.04 2.00 1.01 -1.26 -0.65 121.20 127.16 2x3f s ILE 279 Ca 0.00 -0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.65 2x3f s ILE 279 Cb -0.06 -3.18 -0.02 0.00 0.01 0.00 0.00 42.46 39.21 2x3f s ILE 279 CO -0.00 0.45 -0.07 -0.63 0.00 0.00 0.00 174.94 174.68 2x3f s ILE 280 N 0.46 0.52 0.00 2.92 1.01 -0.12 -5.00 121.20 120.99 2x3f s ILE 280 Ca 0.04 -1.12 0.00 0.00 0.00 0.00 0.00 60.65 59.57 2x3f s ILE 280 Cb -0.12 -0.65 0.00 0.00 0.01 0.00 0.00 42.46 41.69 2x3f s ILE 280 CO 0.00 -0.42 0.00 0.61 0.00 0.00 0.00 174.94 175.14 2x3f n GLY 281 N 1.38 0.35 0.87 6.18 0.00 -1.26 -0.91 105.19 111.80 2x3f n GLY 281 Ca -0.22 -1.85 0.11 0.00 0.00 0.00 0.00 46.02 44.06 2x3f n GLY 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32