#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x3f s THR 2 N 0.00 2.74 -0.09 1.12 2.01 -1.26 -4.99 115.64 115.16 2x3f s THR 2 Ca 0.00 0.67 -0.24 0.00 0.31 0.00 0.00 61.69 62.43 2x3f s THR 2 Cb 0.00 -3.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 2x3f s THR 2 CO 0.00 0.10 0.72 -0.54 -0.69 0.00 0.00 174.62 174.21 2x3f s LYS 3 N -2.17 4.40 -0.33 4.92 1.02 0.01 -4.83 119.74 122.77 2x3f s LYS 3 Ca 0.55 0.89 -0.27 0.00 0.02 0.00 0.00 55.97 57.17 2x3f s LYS 3 Cb -0.37 -3.47 0.01 0.00 -0.52 0.00 0.00 37.83 33.48 2x3f s LYS 3 CO 0.48 -0.02 0.95 -1.17 -0.92 0.00 0.00 175.35 174.67 2x3f s LEU 4 N 1.07 4.00 -0.23 3.17 2.96 -1.26 -0.75 118.68 127.65 2x3f s LEU 4 Ca 0.37 0.81 -0.05 0.00 -0.22 0.00 0.00 54.13 55.05 2x3f s LEU 4 Cb -0.17 -3.33 -0.02 0.00 0.50 0.00 0.00 46.19 43.17 2x3f s LEU 4 CO 0.17 -0.79 0.00 -0.63 -1.32 0.00 0.00 176.35 173.78 2x3f s ILE 5 N 3.39 3.81 -0.71 6.68 -1.09 0.96 -4.96 121.20 129.28 2x3f s ILE 5 Ca 0.40 -0.35 0.07 0.00 -2.23 0.00 0.00 60.65 58.54 2x3f s ILE 5 Cb -0.13 -2.75 0.16 0.00 -1.58 0.00 0.00 42.46 38.16 2x3f s ILE 5 CO 0.15 0.40 1.03 0.35 -1.23 0.00 0.00 174.94 175.64 2x3f n THR 6 N 4.72 0.69 -4.46 2.92 -2.24 -1.26 -0.43 114.28 114.23 2x3f n THR 6 Ca -0.17 -0.85 -0.22 0.00 -2.27 0.00 0.00 64.05 60.54 2x3f n THR 6 Cb 0.51 0.70 -0.14 0.00 -2.10 0.00 0.00 70.33 69.31 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 -0.88 1.36 0.20 4.28 -4.23 -1.26 -4.13 115.64 110.98 2x3f s THR 7 Ca 0.13 -1.11 -0.11 0.00 -1.18 0.00 0.00 61.69 59.42 2x3f s THR 7 Cb 0.07 -1.21 0.12 0.00 1.34 0.00 0.00 72.50 72.82 2x3f s THR 7 CO 0.10 0.07 1.81 0.58 -0.54 0.00 0.00 174.62 176.65 2x3f h VAL 8 N 4.42 1.01 -0.32 2.29 2.07 -1.95 -2.34 116.25 121.42 2x3f h VAL 8 Ca -0.40 -0.23 0.05 0.00 0.82 0.00 0.00 66.70 66.93 2x3f h VAL 8 Cb 1.17 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 2x3f h VAL 8 CO 0.44 0.12 0.06 0.50 0.02 0.00 0.00 177.57 178.71 2x3f h LYS 9 N 0.68 0.16 -0.33 1.57 3.64 -1.99 0.14 116.57 120.44 2x3f h LYS 9 Ca 0.27 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.53 2x3f h LYS 9 Cb 0.11 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 2x3f h LYS 9 CO -0.15 0.11 -0.24 1.49 -2.27 0.00 0.00 179.45 178.39 2x3f h GLU 10 N 0.17 0.66 -0.33 1.90 4.81 -1.96 -0.68 114.58 119.14 2x3f h GLU 10 Ca 0.15 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 2x3f h GLU 10 Cb 0.17 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 2x3f h GLU 10 CO -0.21 0.84 0.17 1.98 -0.73 0.00 0.00 179.01 181.06 2x3f h MET 11 N 0.57 0.46 -0.62 1.92 4.05 -0.87 -1.76 114.93 118.68 2x3f h MET 11 Ca 0.08 -0.06 0.04 0.00 -0.28 0.00 0.00 59.70 59.48 2x3f h MET 11 Cb 0.71 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.38 2x3f h MET 11 CO 0.05 0.40 0.37 1.96 0.23 0.00 0.00 176.91 179.93 2x3f h GLN 12 N 0.41 0.70 -0.30 0.39 4.20 -0.48 -2.07 115.11 117.96 2x3f h GLN 12 Ca 0.12 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.81 2x3f h GLN 12 Cb 0.08 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 2x3f h GLN 12 CO -0.02 0.46 0.14 1.25 -0.67 0.00 0.00 178.83 179.99 2x3f h HIS 13 N 0.72 0.25 -0.88 2.96 2.76 -0.89 -0.78 115.15 119.29 2x3f h HIS 13 Ca 0.26 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.42 2x3f h HIS 13 Cb 0.07 -0.07 -0.04 0.00 1.55 0.00 0.00 27.41 28.91 2x3f h HIS 13 CO -0.06 0.13 0.48 0.82 -1.30 0.00 0.00 177.93 178.00 2x3f h ILE 14 N 0.29 1.26 -0.23 6.26 2.04 -1.13 -1.98 117.51 124.02 2x3f h ILE 14 Ca 0.13 -0.64 -0.06 0.00 1.00 0.00 0.00 64.86 65.29 2x3f h ILE 14 Cb 0.06 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.20 2x3f h ILE 14 CO -0.10 0.29 -0.07 0.58 0.00 0.00 0.00 178.15 178.85 2x3f h VAL 15 N 1.23 1.29 -0.58 1.67 2.07 -1.06 -1.70 116.25 119.17 2x3f h VAL 15 Ca 0.31 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.81 2x3f h VAL 15 Cb 0.03 1.54 -0.06 0.00 -1.52 0.00 0.00 31.29 31.28 2x3f h VAL 15 CO -0.05 0.34 0.24 0.11 0.02 0.00 0.00 177.57 178.23 2x3f h LYS 16 N 0.18 0.44 -0.63 1.57 1.57 -1.04 -1.03 116.57 117.63 2x3f h LYS 16 Ca 0.06 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 2x3f h LYS 16 Cb 0.55 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 2x3f h LYS 16 CO 0.03 0.29 0.18 0.00 -0.57 0.00 0.00 179.45 179.38 2x3f h ALA 17 N 1.37 0.83 -0.51 3.86 0.00 -1.24 -2.73 119.26 120.84 2x3f h ALA 17 Ca 0.28 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2x3f h ALA 17 Cb 0.29 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2x3f h ALA 17 CO -0.25 0.51 0.32 0.00 0.00 0.00 0.00 179.25 179.83 2x3f h ALA 18 N 1.07 0.64 -0.72 0.00 0.00 -0.82 -2.15 119.26 117.28 2x3f h ALA 18 Ca 0.20 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2x3f h ALA 18 Cb 0.31 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2x3f h ALA 18 CO -0.00 0.10 0.43 0.87 0.00 0.00 0.00 179.25 180.65 2x3f h LYS 19 N 0.68 0.97 -0.24 0.00 1.79 -1.07 -0.24 116.57 118.47 2x3f h LYS 19 Ca 0.18 -0.08 -0.11 0.00 -2.18 0.00 0.00 60.65 58.46 2x3f h LYS 19 Cb -0.05 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.38 2x3f h LYS 19 CO -0.04 0.68 -0.31 -0.09 -1.08 0.00 0.00 179.45 178.61 2x3f h ARG 20 N 0.99 0.50 -0.00 3.15 9.65 -1.17 -3.01 114.38 124.49 2x3f h ARG 20 Ca 0.26 -0.21 0.00 0.00 -1.10 0.00 0.00 59.98 58.92 2x3f h ARG 20 Cb -0.03 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.53 2x3f h ARG 20 CO -0.05 0.76 -0.18 0.45 2.80 0.00 0.00 179.97 183.75 2x3f n SER 21 N -4.08 0.37 -0.70 -3.80 2.88 -0.74 -4.91 113.62 102.63 2x3f n SER 21 Ca -0.01 -0.22 -0.08 0.00 -1.33 0.00 0.00 58.87 57.24 2x3f n SER 21 Cb 0.45 -0.10 -0.02 0.00 -0.75 0.00 0.00 64.21 63.79 2x3f n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2x3f n GLY 22 N 1.39 0.58 3.67 0.46 0.00 -0.51 -5.00 105.19 105.77 2x3f n GLY 22 Ca 0.10 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.32 4.81 0.37 2.61 2.01 -0.22 -5.03 115.64 117.87 2x3f s THR 23 Ca 0.00 1.80 -0.20 0.00 0.31 0.00 0.00 61.69 63.60 2x3f s THR 23 Cb 0.00 -4.21 -0.10 0.00 0.01 0.00 0.00 72.50 68.20 2x3f s THR 23 CO 0.00 -0.04 0.87 0.42 -0.69 0.00 0.00 174.62 175.19 2x3f s THR 24 N 2.43 4.46 -0.09 -0.82 -4.23 -1.26 -4.48 115.64 111.65 2x3f s THR 24 Ca 0.41 1.37 0.03 0.00 -1.18 0.00 0.00 61.69 62.32 2x3f s THR 24 Cb -0.16 -3.68 0.01 0.00 1.34 0.00 0.00 72.50 70.00 2x3f s THR 24 CO 0.12 -0.17 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.23 2x3f s ILE 25 N -1.99 1.50 0.00 2.99 1.01 -1.26 -1.64 121.20 121.82 2x3f s ILE 25 Ca 0.57 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 60.55 2x3f s ILE 25 Cb -0.11 -1.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 2x3f s ILE 25 CO 0.16 0.44 0.02 -0.83 0.00 0.00 0.00 174.94 174.73 2x3f s GLY 26 N 0.68 1.91 -0.04 6.18 0.00 -0.42 -0.55 107.32 115.08 2x3f s GLY 26 Ca -0.13 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.65 2x3f s GLY 26 CO 0.03 -0.82 -0.01 -0.12 0.00 0.00 0.00 173.10 172.18 2x3f s PHE 27 N -1.13 0.48 -0.33 1.90 5.36 -0.02 -0.57 117.98 123.68 2x3f s PHE 27 Ca 0.21 -0.08 0.03 0.00 -0.96 0.00 0.00 56.93 56.13 2x3f s PHE 27 Cb -0.12 -0.53 0.10 0.00 -0.34 0.00 0.00 43.02 42.13 2x3f s PHE 27 CO 0.12 -0.17 0.04 0.42 -1.46 0.00 0.00 175.22 174.17 2x3f s ILE 28 N 1.09 2.04 0.05 3.12 1.09 -0.34 -0.81 121.20 127.45 2x3f s ILE 28 Ca -0.09 -2.13 -0.30 0.00 -1.10 0.00 0.00 60.65 57.04 2x3f s ILE 28 Cb -0.14 -2.48 -0.05 0.00 -1.06 0.00 0.00 42.46 38.74 2x3f s ILE 28 CO -0.01 -0.56 1.05 -2.16 -0.10 0.00 0.00 174.94 173.16 2x3f s PRO 29 N 1.04 4.54 0.18 2.79 0.04 -1.26 -1.68 135.00 140.64 2x3f s PRO 29 Ca 0.09 1.56 -0.05 0.00 0.04 0.00 0.00 61.00 62.64 2x3f s PRO 29 Cb -0.19 -3.40 -0.03 0.00 0.04 0.00 0.00 34.50 30.93 2x3f s PRO 29 CO -0.10 -0.07 0.20 0.95 0.04 0.00 0.00 177.00 178.02 2x3f s THR 30 N 0.80 0.04 -0.23 1.26 -4.23 -0.40 -4.92 115.64 107.96 2x3f s THR 30 Ca 0.53 -1.73 0.14 0.00 -1.18 0.00 0.00 61.69 59.45 2x3f s THR 30 Cb -0.25 -2.17 0.62 0.00 1.34 0.00 0.00 72.50 72.05 2x3f s THR 30 CO 0.29 -0.20 1.56 0.23 -0.54 0.00 0.00 174.62 175.96 2x3f n MET 31 N -0.23 3.32 0.00 3.99 2.81 -1.26 -1.65 117.12 124.10 2x3f n MET 31 Ca -0.03 -2.99 0.00 0.00 -1.81 0.00 0.00 57.70 52.88 2x3f n MET 31 Cb 0.64 -1.99 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 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 -0.31 -2.01 3.50 3.03 0.00 -1.26 -4.58 105.19 103.56 2x3f n GLY 32 Ca 0.27 -1.46 -0.24 0.00 0.00 0.00 0.00 46.02 44.59 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 0.24 -2.54 -1.79 4.61 0.00 -1.26 -4.93 120.51 114.84 2x3f n ALA 33 Ca 0.00 -0.09 -0.36 0.00 0.00 0.00 0.00 53.44 52.99 2x3f n ALA 33 Cb 0.00 -4.49 -0.06 0.00 0.00 0.00 0.00 19.45 14.90 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 -5.90 4.23 0.00 0.00 1.43 -1.26 -4.81 118.68 112.36 2x3f s LEU 34 Ca 0.43 1.84 0.00 0.00 -1.03 0.00 0.00 54.13 55.37 2x3f s LEU 34 Cb -0.12 -4.15 -0.00 0.00 0.03 0.00 0.00 46.19 41.95 2x3f s LEU 34 CO 0.81 -0.19 0.01 0.00 0.23 0.00 0.00 176.35 177.22 2x3f n HIS 35 N 0.22 -0.05 0.20 0.29 1.44 -1.26 -5.00 115.22 111.05 2x3f n HIS 35 Ca 0.03 -0.13 0.06 0.00 -2.01 0.00 0.00 57.72 55.68 2x3f n HIS 35 Cb 0.51 0.01 0.55 0.00 0.12 0.00 0.00 29.99 31.18 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 0.10 0.09 -0.11 4.39 3.32 -1.98 -1.59 116.42 120.63 2x3f h ASP 36 Ca -0.01 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.05 2x3f h ASP 36 Cb 0.06 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2x3f h ASP 36 CO 0.02 0.13 -0.02 1.23 -1.72 0.00 0.00 179.24 178.88 2x3f h GLY 37 N 0.29 0.09 0.95 2.75 0.00 -1.92 -0.14 103.07 105.10 2x3f h GLY 37 Ca 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2x3f h GLY 37 CO 0.00 -0.04 0.18 0.45 0.00 0.00 0.00 176.54 177.14 2x3f h HIS 38 N 0.01 0.49 -0.15 5.60 3.86 -1.77 -3.08 115.15 120.11 2x3f h HIS 38 Ca 0.05 -0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 2x3f h HIS 38 Cb 0.08 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 2x3f h HIS 38 CO -0.15 0.40 -0.05 -0.07 0.86 0.00 0.00 177.93 178.92 2x3f h LEU 39 N 0.43 0.20 -0.45 2.43 3.38 -1.05 -1.58 115.31 118.67 2x3f h LEU 39 Ca 0.12 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2x3f h LEU 39 Cb 0.09 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2x3f h LEU 39 CO -0.02 0.29 0.29 0.74 0.09 0.00 0.00 178.44 179.84 2x3f h THR 40 N 0.21 1.12 -0.48 0.22 2.02 -0.94 0.16 112.91 115.22 2x3f h THR 40 Ca 0.05 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 2x3f h THR 40 Cb 0.24 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 2x3f h THR 40 CO 0.01 0.12 0.26 0.24 0.37 0.00 0.00 175.52 176.51 2x3f h MET 41 N 0.61 0.68 -0.48 6.66 2.86 -1.39 -0.70 114.93 123.18 2x3f h MET 41 Ca 0.16 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.73 2x3f h MET 41 Cb -0.06 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.44 2x3f h MET 41 CO -0.03 0.55 0.31 0.28 1.06 0.00 0.00 176.91 179.07 2x3f h VAL 42 N 0.64 1.10 -0.68 -2.22 2.07 -1.00 -1.28 116.25 114.87 2x3f h VAL 42 Ca 0.17 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.51 2x3f h VAL 42 Cb 0.07 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 30.22 2x3f h VAL 42 CO -0.03 0.11 0.41 0.03 0.02 0.00 0.00 177.57 178.12 2x3f h ARG 43 N 0.62 0.77 -0.54 1.57 3.08 -0.39 -0.70 114.38 118.80 2x3f h ARG 43 Ca 0.18 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.21 2x3f h ARG 43 Cb -0.04 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 29.80 2x3f h ARG 43 CO -0.06 0.51 0.32 1.49 -1.07 0.00 0.00 179.97 181.16 2x3f h GLU 44 N 0.80 0.61 -0.44 0.04 4.57 -0.74 -2.09 114.58 117.32 2x3f h GLU 44 Ca 0.28 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.35 2x3f h GLU 44 Cb 0.07 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.50 2x3f h GLU 44 CO -0.13 0.40 -0.00 1.03 -1.18 0.00 0.00 179.01 179.13 2x3f h SER 45 N 0.63 0.77 -0.79 1.04 0.87 -0.58 -2.76 113.55 112.73 2x3f h SER 45 Ca 0.22 -0.31 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 2x3f h SER 45 Cb 0.03 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 61.75 2x3f h SER 45 CO -0.10 0.89 0.47 0.58 -0.53 0.00 0.00 176.83 178.14 2x3f h VAL 46 N 0.63 1.22 -0.32 2.23 2.07 -0.93 0.46 116.25 121.60 2x3f h VAL 46 Ca 0.12 -0.50 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 2x3f h VAL 46 Cb 0.50 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2x3f h VAL 46 CO 0.02 0.24 -0.02 0.28 0.02 0.00 0.00 177.57 178.12 2x3f h SER 47 N 1.10 0.47 0.10 0.57 0.02 -1.22 -3.34 113.55 111.25 2x3f h SER 47 Ca 0.28 -0.09 -0.37 0.00 -0.84 0.00 0.00 61.79 60.78 2x3f h SER 47 Cb -0.03 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.34 2x3f h SER 47 CO -0.05 0.55 -2.21 0.41 -1.14 0.00 0.00 176.83 174.39 2x3f n THR 48 N -4.28 1.60 -4.33 -2.27 -1.04 -0.87 -5.03 114.28 98.06 2x3f n THR 48 Ca 0.01 -0.66 -0.23 0.00 -2.04 0.00 0.00 64.05 61.13 2x3f n THR 48 Cb 0.25 -1.37 -0.08 0.00 -1.82 0.00 0.00 70.33 67.31 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 -6.53 4.32 0.06 8.00 0.01 0.10 -5.06 114.94 115.84 2x3f s ASN 49 Ca -0.24 -0.75 -0.17 0.00 -0.71 0.00 0.00 52.86 50.99 2x3f s ASN 49 Cb 0.08 -0.71 -0.14 0.00 0.41 0.00 0.00 41.25 40.88 2x3f s ASN 49 CO 0.72 -0.01 1.30 0.44 -1.51 0.00 0.00 177.10 178.04 2x3f h ASP 50 N 1.96 0.64 -4.19 -1.22 3.32 -1.75 -3.44 116.42 111.75 2x3f h ASP 50 Ca -0.43 -0.57 -0.41 0.00 0.02 0.00 0.00 57.03 55.64 2x3f h ASP 50 Cb 1.25 -0.19 -0.19 0.00 0.22 0.00 0.00 39.33 40.43 2x3f h ASP 50 CO 0.61 1.09 -0.76 0.27 -1.72 0.00 0.00 179.24 178.73 2x3f s ILE 51 N -3.97 1.24 -0.09 0.35 -4.36 -0.65 -4.98 121.20 108.75 2x3f s ILE 51 Ca -0.13 -1.61 0.01 0.00 -0.26 0.00 0.00 60.65 58.66 2x3f s ILE 51 Cb 0.07 -1.41 0.02 0.00 1.25 0.00 0.00 42.46 42.39 2x3f s ILE 51 CO 0.82 -0.38 -0.09 -0.89 0.24 0.00 0.00 174.94 174.63 2x3f s THR 52 N -1.96 1.06 -0.15 8.37 2.01 -1.26 -1.30 115.64 122.42 2x3f s THR 52 Ca 0.06 -0.36 -0.02 0.00 0.31 0.00 0.00 61.69 61.68 2x3f s THR 52 Cb -0.06 -1.03 -0.02 0.00 0.01 0.00 0.00 72.50 71.40 2x3f s THR 52 CO 0.02 0.36 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.55 2x3f s VAL 53 N 1.28 3.51 -0.19 3.82 1.01 0.26 -1.20 120.40 128.89 2x3f s VAL 53 Ca -0.03 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 2x3f s VAL 53 Cb -0.14 -2.52 -0.00 0.00 0.00 0.00 0.00 36.38 33.72 2x3f s VAL 53 CO -0.04 0.50 -0.10 -0.69 0.00 0.00 0.00 175.10 174.78 2x3f s VAL 54 N 0.41 3.03 0.13 2.92 1.01 -0.08 -1.19 120.40 126.62 2x3f s VAL 54 Ca -0.07 -0.62 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 2x3f s VAL 54 Cb -0.15 -2.34 -0.07 0.00 0.00 0.00 0.00 36.38 33.82 2x3f s VAL 54 CO 0.04 0.47 0.62 -0.94 0.00 0.00 0.00 175.10 175.29 2x3f s SER 55 N 1.18 7.04 -0.28 3.32 1.04 -0.68 -0.81 113.70 124.51 2x3f s SER 55 Ca 0.02 1.29 0.02 0.00 0.48 0.00 0.00 55.95 57.75 2x3f s SER 55 Cb -0.14 -2.37 0.08 0.00 0.10 0.00 0.00 66.02 63.69 2x3f s SER 55 CO -0.03 0.18 -0.00 -0.69 0.98 0.00 0.00 173.24 173.67 2x3f s VAL 56 N -1.28 1.74 -0.23 5.02 1.01 -0.13 -1.28 120.40 125.25 2x3f s VAL 56 Ca 0.35 -1.67 -0.04 0.00 0.00 0.00 0.00 61.98 60.62 2x3f s VAL 56 Cb -0.18 -2.12 0.12 0.00 0.00 0.00 0.00 36.38 34.19 2x3f s VAL 56 CO 0.20 -0.35 0.37 0.12 0.00 0.00 0.00 175.10 175.44 2x3f s PHE 57 N 1.24 -0.76 -0.68 5.22 5.36 -0.66 -4.35 117.98 123.34 2x3f s PHE 57 Ca 0.02 0.91 -0.27 0.00 -0.96 0.00 0.00 56.93 56.62 2x3f s PHE 57 Cb -0.19 0.03 0.03 0.00 -0.34 0.00 0.00 43.02 42.56 2x3f s PHE 57 CO -0.10 -0.65 1.23 0.08 -1.46 0.00 0.00 175.22 174.32 2x3f s VAL 58 N 2.53 3.86 -0.46 3.12 1.01 -1.26 -4.34 120.40 124.85 2x3f s VAL 58 Ca 0.09 0.56 -0.26 0.00 0.00 0.00 0.00 61.98 62.37 2x3f s VAL 58 Cb -0.15 -4.84 0.03 0.00 0.00 0.00 0.00 36.38 31.42 2x3f s VAL 58 CO -0.15 -1.65 0.98 0.21 0.00 0.00 0.00 175.10 174.49 2x3f s ASN 59 N 3.44 6.54 0.51 3.32 2.47 -1.26 -4.92 114.94 125.03 2x3f s ASN 59 Ca 0.37 0.21 0.20 0.00 0.42 0.00 0.00 52.86 54.06 2x3f s ASN 59 Cb -0.08 -2.48 1.31 0.00 -1.45 0.00 0.00 41.25 38.56 2x3f s ASN 59 CO 0.19 -1.10 2.11 -0.65 -3.72 0.00 0.00 177.10 173.92 2x3f h PRO 60 N 9.10 0.00 0.00 0.43 0.11 -1.96 -2.75 132.00 136.93 2x3f h PRO 60 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2x3f h PRO 60 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2x3f h PRO 60 CO 1.05 0.08 0.00 -0.07 -0.21 0.00 0.00 178.00 178.85 2x3f h LEU 61 N 0.00 0.00 -3.13 2.35 3.38 -1.91 -2.57 115.31 113.42 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 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2x3f h LEU 61 CO 0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.54 2x3f n GLN 62 N -2.35 3.21 -4.25 1.13 10.64 -1.04 -4.16 117.38 120.56 2x3f n GLN 62 Ca 0.01 -2.62 -0.26 0.00 -1.83 0.00 0.00 57.00 52.30 2x3f n GLN 62 Cb 0.18 -1.70 -0.08 0.00 -0.86 0.00 0.00 30.24 27.78 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 -2.02 2.75 0.91 2.61 0.08 -0.97 -4.90 117.98 116.43 2x3f s PHE 63 Ca 0.39 -0.18 -0.11 0.00 0.12 0.00 0.00 56.93 57.14 2x3f s PHE 63 Cb 0.27 -1.30 0.14 0.00 -0.57 0.00 0.00 43.02 41.56 2x3f s PHE 63 CO 0.15 0.54 1.10 0.20 -0.10 0.00 0.00 175.22 177.11 2x3f s GLY 64 N -3.12 1.64 0.55 4.36 0.00 -1.26 -4.94 107.32 104.54 2x3f s GLY 64 Ca 0.28 0.14 0.29 0.00 0.00 0.00 0.00 44.72 45.43 2x3f s GLY 64 CO 0.18 0.61 2.14 -0.56 0.00 0.00 0.00 173.10 175.47 2x3f h PRO 65 N -1.67 0.00 -0.01 2.90 0.13 -2.00 -2.82 132.00 128.53 2x3f h PRO 65 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2x3f h PRO 65 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2x3f h PRO 65 CO 0.50 0.08 -0.13 0.09 -0.23 0.00 0.00 178.00 178.31 2x3f n ASN 66 N -3.65 1.58 -4.71 1.44 3.02 -1.26 -4.95 115.26 106.72 2x3f n ASN 66 Ca -0.02 -1.36 -0.42 0.00 -0.03 0.00 0.00 54.58 52.75 2x3f n ASN 66 Cb 0.19 0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.42 2x3f n ASN 66 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2x3f s GLU 67 N -2.21 4.45 0.38 3.52 0.41 -1.07 -5.04 118.70 119.15 2x3f s GLU 67 Ca 0.30 1.74 -0.04 0.00 -0.41 0.00 0.00 54.97 56.56 2x3f s GLU 67 Cb 0.20 -3.35 0.08 0.00 -1.78 0.00 0.00 34.13 29.28 2x3f s GLU 67 CO 0.41 -0.22 0.51 -0.40 -0.49 0.00 0.00 175.26 175.08 2x3f n ASP 68 N 3.79 0.27 -1.66 -0.19 5.75 -1.26 -4.96 116.55 118.30 2x3f n ASP 68 Ca 0.08 -1.33 0.00 0.00 -0.01 0.00 0.00 54.79 53.53 2x3f n ASP 68 Cb 0.47 -0.37 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 2x3f n ASP 68 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2x3f n PHE 69 N -2.47 0.00 -0.12 2.11 7.35 -1.26 -4.62 117.46 118.45 2x3f n PHE 69 Ca 0.07 -0.52 0.00 0.00 -0.76 0.00 0.00 57.45 56.25 2x3f n PHE 69 Cb 0.25 -0.37 0.28 0.00 0.35 0.00 0.00 39.48 40.00 2x3f n PHE 69 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2x3f h ALA 71 N 2.33 1.45 -1.68 3.13 0.00 -2.00 -3.44 119.26 119.05 2x3f h ALA 71 Ca 0.00 -0.10 -0.70 0.00 0.00 0.00 0.00 54.91 54.11 2x3f h ALA 71 Cb 0.54 -0.23 0.03 0.00 0.00 0.00 0.00 17.79 18.13 2x3f h ALA 71 CO 0.00 0.45 0.81 0.98 0.00 0.00 0.00 179.25 181.49 2x3f n TYR 72 N -4.38 1.97 -1.94 0.00 4.19 -1.26 -4.80 117.16 110.94 2x3f n TYR 72 Ca 0.05 0.47 -0.40 0.00 3.31 0.00 0.00 57.90 61.34 2x3f n TYR 72 Cb 0.11 -2.46 0.01 0.00 0.49 0.00 0.00 39.34 37.49 2x3f n TYR 72 CO 0.00 0.00 0.00 -2.14 0.91 0.00 0.00 176.86 175.63 2x3f s PRO 73 N 2.73 3.83 -0.13 2.98 0.02 -1.26 -5.02 135.00 138.14 2x3f s PRO 73 Ca 0.93 2.27 0.01 0.00 0.02 0.00 0.00 61.00 64.23 2x3f s PRO 73 Cb -0.97 -2.70 -0.00 0.00 0.02 0.00 0.00 34.50 30.85 2x3f s PRO 73 CO 0.58 -0.65 -0.17 1.03 -0.33 0.00 0.00 177.00 177.46 2x3f s ARG 74 N -2.35 3.22 -0.43 5.54 3.00 -1.26 -4.51 118.95 122.16 2x3f s ARG 74 Ca 0.59 -0.76 0.06 0.00 0.00 0.00 0.00 55.73 55.61 2x3f s ARG 74 Cb -0.40 -2.55 0.32 0.00 0.00 0.00 0.00 34.95 32.32 2x3f s ARG 74 CO 0.52 0.11 1.18 0.00 0.00 0.00 0.00 175.30 177.11 2x3f n GLN 75 N 3.78 0.81 -0.10 3.54 10.64 -1.26 -5.03 117.38 129.76 2x3f n GLN 75 Ca -0.19 -1.64 -0.01 0.00 -1.83 0.00 0.00 57.00 53.34 2x3f n GLN 75 Cb 0.52 -0.84 0.25 0.00 -0.86 0.00 0.00 30.24 29.31 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 2.41 1.20 -0.27 -0.39 6.09 -1.99 -0.85 117.51 123.71 2x3f h ILE 76 Ca -0.15 -0.66 -0.04 0.00 -1.37 0.00 0.00 64.86 62.64 2x3f h ILE 76 Cb 1.13 0.61 -0.01 0.00 0.47 0.00 0.00 36.82 39.02 2x3f h ILE 76 CO 0.10 0.26 0.03 0.44 -3.07 0.00 0.00 178.15 175.91 2x3f h ASP 77 N 0.75 0.44 -0.53 2.19 3.32 -1.99 0.10 116.42 120.70 2x3f h ASP 77 Ca 0.18 -0.28 -0.08 0.00 0.02 0.00 0.00 57.03 56.87 2x3f h ASP 77 Cb 0.19 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 2x3f h ASP 77 CO -0.01 0.60 0.03 0.50 -1.72 0.00 0.00 179.24 178.65 2x3f h LYS 78 N 0.26 0.91 -0.66 3.56 1.63 -1.89 -0.83 116.57 119.55 2x3f h LYS 78 Ca 0.08 -0.27 -0.02 0.00 -0.85 0.00 0.00 60.65 59.58 2x3f h LYS 78 Cb 0.36 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.87 2x3f h LYS 78 CO 0.01 0.92 0.32 -0.44 -3.45 0.00 0.00 179.45 176.80 2x3f h ASP 79 N 0.79 0.86 -0.52 4.20 3.32 -1.04 -0.13 116.42 123.89 2x3f h ASP 79 Ca 0.15 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 2x3f h ASP 79 Cb 0.48 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2x3f h ASP 79 CO 0.02 0.75 0.26 0.25 -1.72 0.00 0.00 179.24 178.80 2x3f h LEU 80 N 0.91 0.67 -0.71 1.55 5.85 -0.87 -1.82 115.31 120.89 2x3f h LEU 80 Ca 0.23 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2x3f h LEU 80 Cb 0.12 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2x3f h LEU 80 CO -0.03 0.59 0.44 -0.08 -0.34 0.00 0.00 178.44 179.03 2x3f h GLU 81 N 0.70 0.95 -0.48 1.25 4.81 -0.84 -1.60 114.58 119.36 2x3f h GLU 81 Ca 0.18 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 2x3f h GLU 81 Cb 0.09 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 2x3f h GLU 81 CO -0.03 0.66 0.06 -0.07 -0.73 0.00 0.00 179.01 178.90 2x3f h LEU 82 N 0.96 0.78 -0.18 1.64 3.38 -0.76 -2.66 115.31 118.47 2x3f h LEU 82 Ca 0.26 -0.27 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 2x3f h LEU 82 Cb -0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 2x3f h LEU 82 CO -0.05 0.86 -0.78 -0.37 0.09 0.00 0.00 178.44 178.18 2x3f h VAL 83 N 0.68 1.42 -0.47 1.22 -1.51 -1.31 -3.18 116.25 113.10 2x3f h VAL 83 Ca 0.14 -2.82 0.05 0.00 -1.23 0.00 0.00 66.70 62.84 2x3f h VAL 83 Cb 0.42 2.58 -0.04 0.00 -2.13 0.00 0.00 31.29 32.11 2x3f h VAL 83 CO 0.01 0.77 0.22 0.28 -1.23 0.00 0.00 177.57 177.62 2x3f h SER 84 N 0.00 0.29 -0.14 4.19 0.02 -1.26 -0.76 113.55 115.90 2x3f h SER 84 Ca -0.01 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 2x3f h SER 84 Cb 1.52 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 64.04 2x3f h SER 84 CO 0.10 0.21 0.11 -0.08 -1.14 0.00 0.00 176.83 176.03 2x3f h GLU 85 N 0.43 0.00 -0.00 3.45 4.81 -1.45 0.10 114.58 121.92 2x3f h GLU 85 Ca 0.21 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 2x3f h GLU 85 Cb 0.15 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.53 2x3f h GLU 85 CO -0.17 0.00 -0.42 0.28 -0.73 0.00 0.00 179.01 177.97 2x3f n VAL 86 N -4.33 0.00 -0.27 0.32 0.31 -1.00 -4.97 118.33 108.39 2x3f n VAL 86 Ca 0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2x3f n VAL 86 Cb 0.23 0.14 0.00 0.00 -0.91 0.00 0.00 33.84 33.30 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 1.50 0.84 3.76 2.92 0.00 0.02 -4.74 105.19 109.49 2x3f n GLY 87 Ca 0.06 -0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 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 2.77 -0.16 4.61 0.00 -0.34 -4.82 121.76 121.82 2x3f s ALA 88 Ca 0.00 1.02 -0.05 0.00 0.00 0.00 0.00 51.96 52.93 2x3f s ALA 88 Cb 0.00 -3.44 -0.23 0.00 0.00 0.00 0.00 23.12 19.45 2x3f s ALA 88 CO 0.00 -0.97 0.20 -0.25 0.00 0.00 0.00 175.76 174.74 2x3f n ASP 89 N -1.05 2.08 -3.88 0.00 8.00 -0.34 -4.18 116.55 117.18 2x3f n ASP 89 Ca 0.10 0.13 -0.16 0.00 0.71 0.00 0.00 54.79 55.57 2x3f n ASP 89 Cb 0.48 -0.76 -0.15 0.00 -0.02 0.00 0.00 41.12 40.67 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 -2.54 0.27 -0.32 0.53 1.01 -1.01 -0.81 121.20 118.34 2x3f s ILE 90 Ca -0.26 -0.05 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 2x3f s ILE 90 Cb 0.07 -0.30 0.00 0.00 0.01 0.00 0.00 42.46 42.25 2x3f s ILE 90 CO 0.72 0.13 0.14 -0.69 0.00 0.00 0.00 174.94 175.23 2x3f s VAL 91 N 0.51 4.42 -0.29 2.92 1.01 0.07 -0.90 120.40 128.14 2x3f s VAL 91 Ca -0.05 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.16 2x3f s VAL 91 Cb -0.08 -3.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 2x3f s VAL 91 CO -0.01 0.02 0.57 0.12 0.00 0.00 0.00 175.10 175.80 2x3f s PHE 92 N 1.57 3.24 -0.44 5.22 5.36 0.01 -0.03 117.98 132.91 2x3f s PHE 92 Ca 0.04 0.58 0.07 0.00 -0.96 0.00 0.00 56.93 56.66 2x3f s PHE 92 Cb -0.17 -2.86 0.25 0.00 -0.34 0.00 0.00 43.02 39.89 2x3f s PHE 92 CO 0.05 -0.39 0.55 1.58 -1.46 0.00 0.00 175.22 175.55 2x3f n HIS 93 N 5.72 0.38 -2.21 10.12 -0.00 0.43 -0.96 115.22 128.70 2x3f n HIS 93 Ca -0.03 -3.67 -0.32 0.00 -0.00 0.00 0.00 57.72 53.70 2x3f n HIS 93 Cb 0.49 -0.36 -0.01 0.00 -0.00 0.00 0.00 29.99 30.11 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 -1.36 3.60 0.43 1.57 0.04 -1.26 -4.43 135.00 133.59 2x3f s PRO 94 Ca 0.36 1.09 -0.24 0.00 0.04 0.00 0.00 61.00 62.25 2x3f s PRO 94 Cb 0.16 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 32.54 2x3f s PRO 94 CO -0.10 -0.57 1.13 0.00 0.04 0.00 0.00 177.00 177.51 2x3f s ALA 95 N -2.53 3.05 0.34 8.56 0.00 -1.26 -4.93 121.76 124.98 2x3f s ALA 95 Ca 0.61 0.87 0.06 0.00 0.00 0.00 0.00 51.96 53.51 2x3f s ALA 95 Cb -0.13 -3.35 0.72 0.00 0.00 0.00 0.00 23.12 20.36 2x3f s ALA 95 CO 0.34 -0.50 1.89 0.28 0.00 0.00 0.00 175.76 177.78 2x3f h VAL 96 N 2.07 0.92 0.00 0.00 2.07 -1.95 -1.78 116.25 117.58 2x3f h VAL 96 Ca -0.49 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 66.70 2x3f h VAL 96 Cb 1.23 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2x3f h VAL 96 CO 0.61 0.15 -0.26 -0.33 0.02 0.00 0.00 177.57 177.76 2x3f h GLU 97 N 0.80 0.00 0.23 1.57 3.07 -1.92 0.21 114.58 118.53 2x3f h GLU 97 Ca 0.41 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 58.95 2x3f h GLU 97 Cb 0.51 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 28.45 2x3f h GLU 97 CO -0.18 0.26 -1.46 0.22 -1.40 0.00 0.00 179.01 176.45 2x3f h ASP 98 N 0.00 0.76 -0.37 1.42 3.58 -1.72 -2.56 116.42 117.53 2x3f h ASP 98 Ca -0.00 -0.83 -0.16 0.00 0.42 0.00 0.00 57.03 56.46 2x3f h ASP 98 Cb 0.50 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 2x3f h ASP 98 CO 0.03 1.65 -0.38 0.24 -2.88 0.00 0.00 179.24 177.91 2x3f h MET 99 N 0.13 0.91 -2.25 0.28 2.86 -1.31 -3.39 114.93 112.17 2x3f h MET 99 Ca -0.24 -0.48 -0.59 0.00 -2.06 0.00 0.00 59.70 56.33 2x3f h MET 99 Cb 2.14 0.02 -0.41 0.00 0.06 0.00 0.00 31.60 33.41 2x3f h MET 99 CO 0.26 1.13 -0.81 0.66 1.06 0.00 0.00 176.91 179.22 2x3f n TYR 100 N -4.09 1.77 0.19 -0.22 4.01 0.73 -4.97 117.16 114.59 2x3f n TYR 100 Ca -0.03 -3.89 0.06 0.00 -0.16 0.00 0.00 57.90 53.89 2x3f n TYR 100 Cb 0.54 -0.41 0.36 0.00 -0.31 0.00 0.00 39.34 39.52 2x3f n TYR 100 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2x3f h PRO 101 N 4.40 0.00 0.00 -0.72 0.13 -1.66 -3.41 132.00 130.75 2x3f h PRO 101 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2x3f h PRO 101 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2x3f h PRO 101 CO 0.65 0.35 0.00 0.41 -0.23 0.00 0.00 178.00 179.18 2x3f n GLY 102 N 0.17 5.00 3.74 1.56 0.00 -1.26 -5.06 105.19 109.35 2x3f n GLY 102 Ca -0.00 -1.25 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 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 1.33 4.56 0.27 1.61 8.01 -1.26 -5.00 118.70 128.21 2x3f s GLU 103 Ca 0.00 1.82 -0.30 0.00 0.01 0.00 0.00 54.97 56.50 2x3f s GLU 103 Cb 0.00 -3.23 -0.10 0.00 -4.31 0.00 0.00 34.13 26.49 2x3f s GLU 103 CO 0.00 0.04 1.36 -0.51 0.01 0.00 0.00 175.26 176.16 2x3f s LEU 104 N -0.62 4.41 0.13 1.80 1.43 -1.26 -4.92 118.68 119.64 2x3f s LEU 104 Ca 0.50 2.62 0.23 0.00 -1.03 0.00 0.00 54.13 56.44 2x3f s LEU 104 Cb -0.32 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.30 2x3f s LEU 104 CO 0.38 -0.60 1.01 0.61 0.23 0.00 0.00 176.35 177.98 2x3f n GLY 105 N 1.73 -1.35 3.22 -3.19 0.00 -1.26 -4.86 105.19 99.48 2x3f n GLY 105 Ca 0.04 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 2x3f n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x3f s ILE 106 N -3.32 1.77 -0.03 -0.61 1.09 -1.26 -5.14 121.20 113.70 2x3f s ILE 106 Ca 0.01 -0.93 0.04 0.00 -1.10 0.00 0.00 60.65 58.67 2x3f s ILE 106 Cb 0.12 -1.49 -0.03 0.00 -1.06 0.00 0.00 42.46 40.00 2x3f s ILE 106 CO 0.80 0.50 -0.14 -1.81 -0.10 0.00 0.00 174.94 174.19 2x3f s ASP 107 N -0.24 4.07 -0.15 3.58 1.01 -1.26 -5.12 116.67 118.56 2x3f s ASP 107 Ca 0.01 -0.22 -0.03 0.00 0.71 0.00 0.00 52.55 53.02 2x3f s ASP 107 Cb -0.11 -0.85 -0.02 0.00 1.01 0.00 0.00 42.92 42.95 2x3f s ASP 107 CO 0.02 0.33 -0.06 -0.69 0.21 0.00 0.00 175.17 174.97 2x3f s VAL 108 N -0.79 3.65 -0.04 -1.27 1.01 -1.26 -5.11 120.40 116.60 2x3f s VAL 108 Ca 0.12 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.69 2x3f s VAL 108 Cb -0.11 -2.59 0.01 0.00 0.00 0.00 0.00 36.38 33.69 2x3f s VAL 108 CO 0.02 0.50 -0.10 -0.54 0.00 0.00 0.00 175.10 174.98 2x3f s LYS 109 N 0.43 1.16 0.13 2.72 1.02 -1.26 -4.78 119.74 119.17 2x3f s LYS 109 Ca -0.05 -0.33 -0.26 0.00 0.02 0.00 0.00 55.97 55.35 2x3f s LYS 109 Cb -0.15 -1.05 -0.07 0.00 -0.52 0.00 0.00 37.83 36.05 2x3f s LYS 109 CO 0.03 0.09 0.81 0.08 -0.92 0.00 0.00 175.35 175.44 2x3f s VAL 110 N 0.35 4.45 0.00 3.17 1.01 -1.26 -5.05 120.40 123.07 2x3f s VAL 110 Ca -0.06 1.75 0.00 0.00 0.00 0.00 0.00 61.98 63.67 2x3f s VAL 110 Cb -0.11 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.10 2x3f s VAL 110 CO 0.01 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.18 2x3f n GLY 111 N 1.86 0.93 0.31 4.51 0.00 -1.26 -4.71 105.19 106.84 2x3f n GLY 111 Ca -0.04 -1.13 0.20 0.00 0.00 0.00 0.00 46.02 45.05 2x3f n GLY 111 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x3f h PRO 112 N 0.00 0.00 0.00 1.61 0.13 -2.00 -1.27 132.00 130.47 2x3f h PRO 112 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2x3f h PRO 112 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2x3f h PRO 112 CO 0.00 0.00 -0.01 -0.07 -0.23 0.00 0.00 178.00 177.69 2x3f h LEU 113 N 0.00 0.00 -1.06 1.56 3.38 -1.90 -2.05 115.31 115.23 2x3f h LEU 113 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x3f h LEU 113 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2x3f h LEU 113 CO 0.00 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.55 2x3f n ALA 114 N -2.45 2.54 1.41 1.53 0.00 -0.48 -4.35 120.51 118.71 2x3f n ALA 114 Ca -0.03 -0.50 0.13 0.00 0.00 0.00 0.00 53.44 53.04 2x3f n ALA 114 Cb 0.10 -1.11 0.47 0.00 0.00 0.00 0.00 19.45 18.91 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 0.28 1.64 -4.42 0.00 8.00 -0.77 -3.01 116.55 118.27 2x3f n ASP 115 Ca 0.17 -1.57 -0.21 0.00 0.71 0.00 0.00 54.79 53.89 2x3f n ASP 115 Cb 0.34 -0.02 -0.10 0.00 -0.02 0.00 0.00 41.12 41.31 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 -1.96 1.44 0.00 2.53 -7.23 -1.26 -4.42 120.40 109.50 2x3f s VAL 116 Ca 0.37 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.46 2x3f s VAL 116 Cb 0.20 -2.52 0.00 0.00 0.56 0.00 0.00 36.38 34.63 2x3f s VAL 116 CO 0.32 -0.24 0.00 0.18 -0.31 0.00 0.00 175.10 175.06 2x3f n LEU 117 N -0.58 0.00 0.11 1.32 4.77 -1.26 -2.67 117.00 118.69 2x3f n LEU 117 Ca -0.05 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.91 2x3f n LEU 117 Cb 0.64 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.91 2x3f n LEU 117 CO 0.40 0.00 0.54 -0.33 -1.33 0.00 0.00 177.39 176.67 2x3f h GLU 118 N 0.00 0.14 -0.93 3.23 4.39 -1.97 -1.84 114.58 117.61 2x3f h GLU 118 Ca 0.00 -0.09 0.03 0.00 0.34 0.00 0.00 59.36 59.64 2x3f h GLU 118 Cb 0.00 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.61 2x3f h GLU 118 CO 0.00 0.65 0.61 0.78 -1.16 0.00 0.00 179.01 179.89 2x3f h GLY 119 N 1.50 1.33 1.42 -3.84 0.00 -1.67 0.10 103.07 101.92 2x3f h GLY 119 Ca -0.00 -0.47 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 2x3f h GLY 119 CO 0.08 0.41 -0.08 0.00 0.00 0.00 0.00 176.54 176.95 2x3f h ALA 120 N 1.45 1.11 -0.02 3.60 0.00 -1.18 -2.30 119.26 121.92 2x3f h ALA 120 Ca 0.36 -0.28 -0.26 0.00 0.00 0.00 0.00 54.91 54.73 2x3f h ALA 120 Cb -0.02 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.63 2x3f h ALA 120 CO -0.11 0.56 -1.02 0.87 0.00 0.00 0.00 179.25 179.56 2x3f h LYS 121 N 0.64 0.71 -2.84 0.00 1.57 -1.18 -3.38 116.57 112.09 2x3f h LYS 121 Ca 0.12 -0.74 -0.61 0.00 -1.87 0.00 0.00 60.65 57.54 2x3f h LYS 121 Cb 0.51 0.21 -0.41 0.00 0.08 0.00 0.00 32.23 32.62 2x3f h LYS 121 CO 0.03 1.32 -0.66 0.54 -0.57 0.00 0.00 179.45 180.11 2x3f n ARG 122 N -3.86 1.58 -1.72 3.15 1.74 0.30 -5.07 116.66 112.78 2x3f n ARG 122 Ca -0.11 -4.24 -0.43 0.00 -0.77 0.00 0.00 57.85 52.31 2x3f n ARG 122 Cb 0.87 -2.15 -0.03 0.00 -1.02 0.00 0.00 32.46 30.13 2x3f n ARG 122 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2x3f n PRO 123 N 1.99 2.68 0.00 5.56 -0.04 -0.87 -1.55 135.00 142.77 2x3f n PRO 123 Ca 0.23 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.65 2x3f n PRO 123 Cb 0.38 -2.79 0.00 0.00 -0.04 0.00 0.00 33.50 31.06 2x3f n PRO 123 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2x3f n GLY 124 N 3.55 3.30 0.39 0.55 0.00 -1.26 -4.95 105.19 106.77 2x3f n GLY 124 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.06 0.00 1.61 6.17 -1.56 -2.10 115.15 118.21 2x3f h HIS 125 Ca 0.00 0.02 -0.04 0.00 0.71 0.00 0.00 60.37 61.07 2x3f h HIS 125 Cb 0.00 0.45 -0.01 0.00 2.52 0.00 0.00 27.41 30.37 2x3f h HIS 125 CO 0.00 -0.49 -0.17 0.74 0.71 0.00 0.00 177.93 178.72 2x3f h PHE 126 N -0.62 0.00 -0.87 5.26 0.04 -1.92 -1.54 116.94 117.28 2x3f h PHE 126 Ca 0.02 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.81 2x3f h PHE 126 Cb 0.65 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.75 2x3f h PHE 126 CO -0.33 0.17 0.58 -0.44 -0.60 0.00 0.00 178.31 177.69 2x3f h ASP 127 N 0.00 0.99 -0.30 2.17 3.32 -1.82 -1.34 116.42 119.45 2x3f h ASP 127 Ca -0.00 -0.02 -0.17 0.00 0.02 0.00 0.00 57.03 56.86 2x3f h ASP 127 Cb 0.75 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 2x3f h ASP 127 CO 0.02 0.71 -0.45 1.23 -1.72 0.00 0.00 179.24 179.04 2x3f h GLY 128 N 1.17 0.94 0.93 2.75 0.00 -0.61 -1.29 103.07 106.96 2x3f h GLY 128 Ca 0.33 -1.01 -0.01 0.00 0.00 0.00 0.00 47.33 46.64 2x3f h GLY 128 CO -0.08 0.91 -0.08 -2.08 0.00 0.00 0.00 176.54 175.21 2x3f h VAL 129 N 0.69 0.88 -0.23 4.60 2.07 -1.19 -2.50 116.25 120.57 2x3f h VAL 129 Ca 0.04 -0.15 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 2x3f h VAL 129 Cb 1.03 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 2x3f h VAL 129 CO 0.10 0.04 -0.16 -0.37 0.02 0.00 0.00 177.57 177.20 2x3f h VAL 130 N -0.29 1.23 0.29 2.57 -1.51 -1.18 -0.71 116.25 116.65 2x3f h VAL 130 Ca -0.02 -1.02 -0.01 0.00 -1.23 0.00 0.00 66.70 64.42 2x3f h VAL 130 Cb 0.23 1.23 -0.00 0.00 -2.13 0.00 0.00 31.29 30.61 2x3f h VAL 130 CO 0.04 0.32 -0.18 0.74 -1.23 0.00 0.00 177.57 177.26 2x3f h THR 131 N 0.36 0.63 -0.47 7.19 2.02 -1.19 -0.90 112.91 120.55 2x3f h THR 131 Ca 0.07 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.12 2x3f h THR 131 Cb 0.50 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2x3f h THR 131 CO 0.03 0.00 -0.21 1.62 0.37 0.00 0.00 175.52 177.33 2x3f h VAL 132 N -0.45 1.27 -0.57 3.16 3.04 -1.16 -2.67 116.25 118.87 2x3f h VAL 132 Ca -0.03 -1.37 -0.09 0.00 -1.01 0.00 0.00 66.70 64.20 2x3f h VAL 132 Cb 0.37 1.13 -0.02 0.00 -2.01 0.00 0.00 31.29 30.76 2x3f h VAL 132 CO 0.03 0.47 -0.01 0.58 -1.01 0.00 0.00 177.57 177.63 2x3f h VAL 133 N 0.83 1.27 -0.28 1.51 2.07 -1.08 -0.88 116.25 119.69 2x3f h VAL 133 Ca 0.11 -1.15 0.01 0.00 0.82 0.00 0.00 66.70 66.49 2x3f h VAL 133 Cb 0.78 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 2x3f h VAL 133 CO 0.06 0.41 0.16 -1.13 0.02 0.00 0.00 177.57 177.10 2x3f h ASN 134 N 0.89 0.27 -0.25 0.57 -1.24 -1.10 -0.79 115.58 113.93 2x3f h ASN 134 Ca 0.16 0.00 0.01 0.00 0.71 0.00 0.00 56.30 57.18 2x3f h ASN 134 Cb 0.56 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.54 2x3f h ASN 134 CO 0.03 0.19 0.14 0.11 -1.29 0.00 0.00 177.43 176.62 2x3f h LYS 135 N 0.34 0.29 -0.69 6.67 1.57 -1.25 -2.32 116.57 121.18 2x3f h LYS 135 Ca 0.11 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 2x3f h LYS 135 Cb -0.00 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 2x3f h LYS 135 CO -0.05 0.19 0.35 -0.07 -0.57 0.00 0.00 179.45 179.30 2x3f h LEU 136 N 0.30 0.87 -0.93 2.94 3.38 -0.96 -1.18 115.31 119.73 2x3f h LEU 136 Ca 0.10 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 2x3f h LEU 136 Cb -0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 2x3f h LEU 136 CO -0.04 0.72 0.09 -0.26 0.09 0.00 0.00 178.44 179.04 2x3f h PHE 137 N 0.96 0.92 0.00 1.13 0.04 -0.94 0.90 116.94 119.96 2x3f h PHE 137 Ca 0.24 -0.10 -0.11 0.00 2.80 0.00 0.00 57.97 60.80 2x3f h PHE 137 Cb 0.07 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 37.94 2x3f h PHE 137 CO 0.01 0.79 -0.52 -0.91 -0.60 0.00 0.00 178.31 177.08 2x3f h ASN 138 N 0.84 0.00 0.03 2.17 2.35 -0.89 0.81 115.58 120.88 2x3f h ASN 138 Ca 0.17 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2x3f h ASN 138 Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 2x3f h ASN 138 CO 0.01 0.52 -0.01 0.40 -1.65 0.00 0.00 177.43 176.69 2x3f h ILE 139 N 0.00 1.38 0.00 2.81 2.04 -1.01 -3.39 117.51 119.34 2x3f h ILE 139 Ca -0.01 -1.78 -0.19 0.00 1.00 0.00 0.00 64.86 63.89 2x3f h ILE 139 Cb 1.11 2.49 -0.03 0.00 -0.74 0.00 0.00 36.82 39.65 2x3f h ILE 139 CO 0.07 0.42 -1.25 0.58 0.00 0.00 0.00 178.15 177.97 2x3f h VAL 140 N -0.88 0.78 -6.39 1.67 2.07 -0.87 -3.40 116.25 109.23 2x3f h VAL 140 Ca -0.00 -2.35 -0.47 0.00 0.82 0.00 0.00 66.70 64.70 2x3f h VAL 140 Cb 0.72 2.28 0.02 0.00 -1.52 0.00 0.00 31.29 32.79 2x3f h VAL 140 CO 0.01 0.44 -0.92 0.23 0.02 0.00 0.00 177.57 177.35 2x3f n MET 141 N -3.04 -2.11 -2.10 1.57 2.81 0.28 -4.90 117.12 109.63 2x3f n MET 141 Ca -0.08 0.41 -0.32 0.00 -1.81 0.00 0.00 57.70 55.90 2x3f n MET 141 Cb 0.88 -4.20 -0.00 0.00 -0.71 0.00 0.00 33.22 29.19 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 -6.33 3.51 0.07 0.03 0.04 -1.26 -4.87 135.00 126.19 2x3f s PRO 142 Ca 0.27 1.06 -0.09 0.00 0.04 0.00 0.00 61.00 62.27 2x3f s PRO 142 Cb -0.10 -2.07 -0.28 0.00 0.04 0.00 0.00 34.50 32.10 2x3f s PRO 142 CO 0.88 -0.64 1.12 -0.44 0.04 0.00 0.00 177.00 177.96 2x3f h ASP 143 N 0.41 0.62 -4.03 6.66 3.32 -1.18 -3.37 116.42 118.84 2x3f h ASP 143 Ca -0.46 -0.62 -0.37 0.00 0.02 0.00 0.00 57.03 55.60 2x3f h ASP 143 Cb 1.20 -0.20 -0.28 0.00 0.22 0.00 0.00 39.33 40.27 2x3f h ASP 143 CO 0.59 1.47 -0.77 -0.31 -1.72 0.00 0.00 179.24 178.49 2x3f s TYR 144 N -2.78 0.72 -0.02 4.55 2.02 -1.02 -1.22 117.35 119.60 2x3f s TYR 144 Ca -0.06 -0.15 0.04 0.00 -0.37 0.00 0.00 57.07 56.52 2x3f s TYR 144 Cb 0.06 -0.46 -0.01 0.00 -0.40 0.00 0.00 41.96 41.16 2x3f s TYR 144 CO 0.91 -0.01 -0.14 0.00 -1.57 0.00 0.00 175.55 174.73 2x3f s ALA 145 N -0.25 1.19 -0.13 3.71 0.00 -0.65 -0.84 121.76 124.80 2x3f s ALA 145 Ca 0.03 -0.58 -0.01 0.00 0.00 0.00 0.00 51.96 51.39 2x3f s ALA 145 Cb -0.03 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 2x3f s ALA 145 CO -0.00 0.26 -0.10 0.71 0.00 0.00 0.00 175.76 176.63 2x3f s TYR 146 N -0.18 2.88 0.01 0.00 2.02 0.01 -1.01 117.35 121.09 2x3f s TYR 146 Ca 0.02 -0.46 0.02 0.00 -0.37 0.00 0.00 57.07 56.29 2x3f s TYR 146 Cb -0.07 -1.86 -0.01 0.00 -0.40 0.00 0.00 41.96 39.62 2x3f s TYR 146 CO 0.00 -0.10 -0.07 -0.06 -1.57 0.00 0.00 175.55 173.75 2x3f s PHE 147 N 0.21 0.66 0.34 2.71 0.40 -0.77 -4.29 117.98 117.24 2x3f s PHE 147 Ca -0.06 -0.23 -0.25 0.00 -0.60 0.00 0.00 56.93 55.79 2x3f s PHE 147 Cb -0.15 -0.41 -0.10 0.00 0.51 0.00 0.00 43.02 42.87 2x3f s PHE 147 CO 0.04 -0.02 0.97 0.20 0.70 0.00 0.00 175.22 177.11 2x3f s GLY 148 N -0.60 2.77 0.00 4.36 0.00 -1.26 -0.81 107.32 111.77 2x3f s GLY 148 Ca -0.01 0.55 0.26 0.00 0.00 0.00 0.00 44.72 45.53 2x3f s GLY 148 CO 0.00 0.99 1.85 0.28 0.00 0.00 0.00 173.10 176.22 2x3f n LYS 149 N 0.38 0.17 -0.32 2.90 5.02 0.15 -3.01 118.16 123.45 2x3f n LYS 149 Ca 0.03 0.05 0.10 0.00 -2.02 0.00 0.00 58.31 56.47 2x3f n LYS 149 Cb 0.50 -1.50 0.31 0.00 -0.02 0.00 0.00 35.03 34.32 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 0.81 -3.32 1.97 3.64 -1.91 -3.02 116.57 114.74 2x3f h LYS 150 Ca 0.00 -0.05 -0.75 0.00 -1.27 0.00 0.00 60.65 58.58 2x3f h LYS 150 Cb 0.35 -0.18 -0.32 0.00 -0.41 0.00 0.00 32.23 31.67 2x3f h LYS 150 CO 0.00 0.54 0.20 -0.25 -2.27 0.00 0.00 179.45 177.66 2x3f n ASP 151 N -4.61 4.95 -0.08 4.20 9.92 -1.16 -4.75 116.55 125.02 2x3f n ASP 151 Ca 0.19 -3.14 -0.11 0.00 -0.53 0.00 0.00 54.79 51.20 2x3f n ASP 151 Cb 0.43 -1.19 0.02 0.00 -0.64 0.00 0.00 41.12 39.75 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 6.10 0.67 -0.18 2.24 0.00 -1.76 -1.49 119.26 124.83 2x3f h ALA 152 Ca 0.18 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2x3f h ALA 152 Cb 0.80 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2x3f h ALA 152 CO 0.97 0.67 0.08 0.37 0.00 0.00 0.00 179.25 181.34 2x3f h GLN 153 N 0.65 0.27 -0.52 0.00 4.15 -1.90 -1.85 115.11 115.91 2x3f h GLN 153 Ca 0.05 -0.05 0.09 0.00 0.77 0.00 0.00 58.65 59.52 2x3f h GLN 153 Cb 0.97 -0.04 -0.07 0.00 0.21 0.00 0.00 27.48 28.54 2x3f h GLN 153 CO 0.09 0.33 0.10 0.37 -1.93 0.00 0.00 178.83 177.79 2x3f h GLN 154 N 0.14 0.22 -0.35 1.69 4.15 -1.91 -0.79 115.11 118.27 2x3f h GLN 154 Ca 0.06 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.47 2x3f h GLN 154 Cb 0.16 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 2x3f h GLN 154 CO -0.01 0.15 0.23 1.25 -1.93 0.00 0.00 178.83 178.52 2x3f h LEU 155 N 0.23 0.39 -0.76 -2.39 5.85 -1.03 0.14 115.31 117.74 2x3f h LEU 155 Ca 0.26 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.98 2x3f h LEU 155 Cb 0.36 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 2x3f h LEU 155 CO -0.35 0.28 0.50 0.00 -0.34 0.00 0.00 178.44 178.53 2x3f h ALA 156 N 1.13 0.97 -0.39 1.25 0.00 -0.98 -0.29 119.26 120.95 2x3f h ALA 156 Ca 0.13 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2x3f h ALA 156 Cb -0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2x3f h ALA 156 CO -0.03 0.40 -0.00 0.82 0.00 0.00 0.00 179.25 180.43 2x3f h ILE 157 N 1.04 1.26 -0.50 0.00 2.04 -0.59 -1.35 117.51 119.41 2x3f h ILE 157 Ca 0.28 -1.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.08 2x3f h ILE 157 Cb -0.10 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 2x3f h ILE 157 CO -0.06 0.34 0.12 0.58 0.00 0.00 0.00 178.15 179.14 2x3f h VAL 158 N 0.52 1.24 -0.86 1.67 2.07 -0.52 -0.45 116.25 119.92 2x3f h VAL 158 Ca 0.11 -0.84 0.03 0.00 0.82 0.00 0.00 66.70 66.82 2x3f h VAL 158 Cb 0.48 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 2x3f h VAL 158 CO 0.02 0.31 0.56 -0.33 0.02 0.00 0.00 177.57 178.14 2x3f h GLU 159 N 0.69 1.05 -0.59 1.57 5.08 -0.95 -1.70 114.58 119.73 2x3f h GLU 159 Ca 0.16 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.39 2x3f h GLU 159 Cb 0.33 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2x3f h GLU 159 CO 0.00 0.70 0.12 0.37 -1.00 0.00 0.00 179.01 179.20 2x3f h GLN 160 N 1.08 0.96 -0.70 2.33 5.75 -0.77 -2.56 115.11 121.20 2x3f h GLN 160 Ca 0.34 -0.24 -0.01 0.00 -0.15 0.00 0.00 58.65 58.59 2x3f h GLN 160 Cb 0.00 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.40 2x3f h GLN 160 CO -0.11 0.89 0.38 1.98 -2.65 0.00 0.00 178.83 179.32 2x3f h MET 161 N 0.86 0.97 -0.69 1.69 4.05 -0.78 0.75 114.93 121.78 2x3f h MET 161 Ca 0.18 -0.12 0.05 0.00 -0.28 0.00 0.00 59.70 59.54 2x3f h MET 161 Cb 0.38 -0.19 -0.05 0.00 -0.80 0.00 0.00 31.60 30.94 2x3f h MET 161 CO 0.01 0.73 0.40 0.28 0.23 0.00 0.00 176.91 178.56 2x3f h VAL 162 N 0.96 1.02 -0.01 -5.77 2.07 -1.15 0.08 116.25 113.44 2x3f h VAL 162 Ca 0.24 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 2x3f h VAL 162 Cb 0.04 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.00 2x3f h VAL 162 CO -0.04 0.14 -0.00 0.11 0.02 0.00 0.00 177.57 177.80 2x3f h LYS 163 N 0.76 0.01 -0.92 1.57 1.57 -1.04 -0.85 116.57 117.66 2x3f h LYS 163 Ca 0.30 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 59.11 2x3f h LYS 163 Cb 0.13 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 2x3f h LYS 163 CO -0.16 0.32 0.60 -0.44 -0.57 0.00 0.00 179.45 179.20 2x3f h ASP 164 N -0.30 0.99 0.14 0.86 3.32 -0.59 -3.04 116.42 117.80 2x3f h ASP 164 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2x3f h ASP 164 Cb 0.32 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.64 2x3f h ASP 164 CO 0.00 0.68 -0.42 0.49 -1.72 0.00 0.00 179.24 178.27 2x3f n PHE 165 N -4.50 0.00 -3.47 4.55 3.01 -0.01 -4.98 117.46 112.06 2x3f n PHE 165 Ca 0.12 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.33 2x3f n PHE 165 Cb 0.09 -0.07 0.05 0.00 -0.01 0.00 0.00 39.48 39.54 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 -0.53 -5.87 -4.75 4.37 4.13 -0.38 -4.97 115.26 107.25 2x3f n ASN 166 Ca 0.10 -0.50 -0.41 0.00 1.68 0.00 0.00 54.58 55.45 2x3f n ASN 166 Cb 0.39 -4.68 -0.02 0.00 -1.54 0.00 0.00 39.78 33.94 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 -3.25 3.00 -0.98 3.10 3.76 -0.89 -4.90 115.29 115.13 2x3f s HIS 167 Ca 0.51 1.15 0.18 0.00 -0.15 0.00 0.00 55.06 56.74 2x3f s HIS 167 Cb -0.23 -3.79 0.77 0.00 1.11 0.00 0.00 32.58 30.43 2x3f s HIS 167 CO 0.63 -2.46 1.58 0.00 -0.85 0.00 0.00 174.74 173.63 2x3f n ALA 168 N 1.77 1.82 -1.78 -1.40 0.00 -1.26 -4.85 120.51 114.81 2x3f n ALA 168 Ca 0.04 -0.06 -0.41 0.00 0.00 0.00 0.00 53.44 53.02 2x3f n ALA 168 Cb 0.41 -1.29 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 2x3f n ALA 168 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2x3f s VAL 169 N -3.01 2.26 -0.20 0.00 1.01 -1.26 -4.96 120.40 114.23 2x3f s VAL 169 Ca 0.08 0.26 -0.11 0.00 0.00 0.00 0.00 61.98 62.22 2x3f s VAL 169 Cb 0.12 -3.17 -0.05 0.00 0.00 0.00 0.00 36.38 33.28 2x3f s VAL 169 CO 0.33 0.06 0.18 -1.61 0.00 0.00 0.00 175.10 174.06 2x3f s GLU 170 N -2.01 4.17 -0.13 2.72 2.02 -0.36 -4.98 118.70 120.14 2x3f s GLU 170 Ca 0.52 -0.16 -0.20 0.00 0.02 0.00 0.00 54.97 55.15 2x3f s GLU 170 Cb -0.44 -3.46 -0.04 0.00 0.10 0.00 0.00 34.13 30.29 2x3f s GLU 170 CO 0.60 0.21 0.58 0.42 0.02 0.00 0.00 175.26 177.09 2x3f s ILE 171 N 0.61 5.10 -0.24 -1.63 -1.09 -1.26 -1.63 121.20 121.06 2x3f s ILE 171 Ca 0.10 1.15 -0.02 0.00 -2.23 0.00 0.00 60.65 59.65 2x3f s ILE 171 Cb -0.12 -3.91 0.02 0.00 -1.58 0.00 0.00 42.46 36.87 2x3f s ILE 171 CO 0.01 0.24 -0.07 -0.63 -1.23 0.00 0.00 174.94 173.26 2x3f s ILE 172 N 1.06 2.86 -0.14 2.92 1.01 -0.18 -4.96 121.20 123.78 2x3f s ILE 172 Ca 0.30 -0.95 -0.24 0.00 0.00 0.00 0.00 60.65 59.76 2x3f s ILE 172 Cb -0.16 -2.41 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 2x3f s ILE 172 CO 0.12 0.26 0.76 -0.83 0.00 0.00 0.00 174.94 175.25 2x3f s GLY 173 N 1.34 2.26 -0.16 6.18 0.00 -1.26 -1.84 107.32 113.85 2x3f s GLY 173 Ca 0.01 0.02 -0.05 0.00 0.00 0.00 0.00 44.72 44.70 2x3f s GLY 173 CO -0.05 1.46 0.02 -0.42 0.00 0.00 0.00 173.10 174.11 2x3f s ILE 174 N 1.68 4.41 0.59 0.90 -1.09 0.01 -4.91 121.20 122.79 2x3f s ILE 174 Ca 0.37 -0.18 -0.19 0.00 -2.23 0.00 0.00 60.65 58.41 2x3f s ILE 174 Cb -0.17 -2.95 -0.05 0.00 -1.58 0.00 0.00 42.46 37.72 2x3f s ILE 174 CO 0.14 0.50 1.08 0.47 -1.23 0.00 0.00 174.94 175.90 2x3f n ASP 175 N 3.29 1.31 -4.69 3.58 8.00 -1.26 -0.68 116.55 126.11 2x3f n ASP 175 Ca -0.17 0.85 -0.44 0.00 0.71 0.00 0.00 54.79 55.73 2x3f n ASP 175 Cb 0.53 -1.44 -0.04 0.00 -0.02 0.00 0.00 41.12 40.15 2x3f n ASP 175 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2x3f n ILE 176 N -1.58 0.24 -3.28 0.53 5.41 -1.26 -4.73 119.36 114.69 2x3f n ILE 176 Ca 0.13 -0.04 -0.38 0.00 1.00 0.00 0.00 62.75 63.46 2x3f n ILE 176 Cb 0.46 -1.89 -0.06 0.00 -0.71 0.00 0.00 39.64 37.45 2x3f n ILE 176 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2x3f s VAL 177 N 2.17 5.02 0.16 1.39 1.01 -1.26 -5.02 120.40 123.87 2x3f s VAL 177 Ca 0.82 1.10 0.08 0.00 0.00 0.00 0.00 61.98 63.98 2x3f s VAL 177 Cb -0.58 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 2x3f s VAL 177 CO 0.39 0.41 -0.18 -0.13 0.00 0.00 0.00 175.10 175.59 2x3f s ARG 178 N -0.04 1.25 0.89 2.72 0.52 -1.26 -1.06 118.95 121.97 2x3f s ARG 178 Ca 0.29 -1.40 -0.11 0.00 -0.52 0.00 0.00 55.73 53.99 2x3f s ARG 178 Cb -0.17 -1.28 0.13 0.00 0.52 0.00 0.00 34.95 34.15 2x3f s ARG 178 CO 0.14 0.26 1.10 -1.21 0.02 0.00 0.00 175.30 175.61 2x3f s GLU 179 N -2.82 1.28 0.41 3.54 0.41 0.04 -4.89 118.70 116.67 2x3f s GLU 179 Ca 0.15 1.16 0.16 0.00 -0.41 0.00 0.00 54.97 56.03 2x3f s GLU 179 Cb -0.05 -1.79 1.04 0.00 -1.78 0.00 0.00 34.13 31.55 2x3f s GLU 179 CO 0.06 -2.32 1.86 0.00 -0.49 0.00 0.00 175.26 174.37 2x3f h ALA 180 N -1.62 2.13 -0.00 5.21 0.00 -2.01 0.85 119.26 123.81 2x3f h ALA 180 Ca -0.47 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2x3f h ALA 180 Cb 1.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2x3f h ALA 180 CO 0.49 -0.41 -0.12 -0.40 0.00 0.00 0.00 179.25 178.82 2x3f n ASP 181 N -4.52 0.23 0.00 0.00 5.68 -1.26 -4.92 116.55 111.75 2x3f n ASP 181 Ca 0.19 -0.08 0.00 0.00 -0.50 0.00 0.00 54.79 54.40 2x3f n ASP 181 Cb 0.65 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 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 1.39 1.82 3.67 6.12 0.00 0.29 -4.97 105.19 113.52 2x3f n GLY 182 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2x3f n GLY 182 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2x3f n LEU 183 N 0.00 4.12 -4.75 0.99 7.94 -1.26 -4.65 117.00 119.40 2x3f n LEU 183 Ca 0.00 0.93 -0.42 0.00 -1.11 0.00 0.00 56.01 55.41 2x3f n LEU 183 Cb 0.00 -1.53 -0.01 0.00 0.53 0.00 0.00 43.42 42.41 2x3f n LEU 183 CO 0.00 0.19 1.17 0.00 -1.11 0.00 0.00 177.39 177.64 2x3f n ALA 184 N 6.91 2.30 -1.77 1.96 0.00 -1.26 -0.78 120.51 127.88 2x3f n ALA 184 Ca 0.19 0.36 -0.39 0.00 0.00 0.00 0.00 53.44 53.61 2x3f n ALA 184 Cb 0.39 -2.42 -0.03 0.00 0.00 0.00 0.00 19.45 17.39 2x3f n ALA 184 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2x3f s LYS 185 N -1.09 4.24 -0.23 0.00 1.02 -0.23 -4.85 119.74 118.61 2x3f s LYS 185 Ca 0.60 1.81 -0.28 0.00 0.02 0.00 0.00 55.97 58.13 2x3f s LYS 185 Cb -0.51 -2.81 0.14 0.00 -0.52 0.00 0.00 37.83 34.13 2x3f s LYS 185 CO 0.54 -0.15 1.12 0.45 -0.92 0.00 0.00 175.35 176.39 2x3f s SER 186 N -1.08 -0.30 0.55 2.83 0.15 -1.26 -4.94 113.70 109.63 2x3f s SER 186 Ca 0.53 0.44 0.25 0.00 0.70 0.00 0.00 55.95 57.87 2x3f s SER 186 Cb -0.30 0.40 1.44 0.00 -1.71 0.00 0.00 66.02 65.85 2x3f s SER 186 CO 0.39 -0.20 2.05 0.28 1.20 0.00 0.00 173.24 176.96 2x3f h SER 187 N 3.03 0.00 1.69 5.45 0.02 -1.95 -2.93 113.55 118.86 2x3f h SER 187 Ca -0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2x3f h SER 187 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2x3f h SER 187 CO 0.22 0.00 0.00 0.03 -1.14 0.00 0.00 176.83 175.94 2x3f h ARG 188 N 0.00 0.00 -0.77 3.45 3.08 -1.95 -3.29 114.38 114.90 2x3f h ARG 188 Ca 0.16 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.30 2x3f h ARG 188 Cb 0.69 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.68 2x3f h ARG 188 CO -0.00 0.00 0.50 -0.91 -1.07 0.00 0.00 179.97 178.49 2x3f h ASN 189 N 0.00 0.62 -0.64 7.04 2.35 -1.90 -0.21 115.58 122.84 2x3f h ASN 189 Ca 0.00 0.02 0.09 0.00 -0.55 0.00 0.00 56.30 55.85 2x3f h ASN 189 Cb 0.84 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 39.06 2x3f h ASN 189 CO 0.00 0.37 0.43 1.62 -1.65 0.00 0.00 177.43 178.20 2x3f h VAL 190 N 0.69 0.93 0.00 2.81 3.04 -1.81 -1.41 116.25 120.50 2x3f h VAL 190 Ca 0.35 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.86 2x3f h VAL 190 Cb 0.46 0.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.10 2x3f h VAL 190 CO -0.13 0.09 0.00 1.88 -1.01 0.00 0.00 177.57 178.40 2x3f h TYR 191 N 0.52 0.00 -3.45 3.17 0.99 -1.27 -3.43 116.97 113.50 2x3f h TYR 191 Ca 0.29 0.00 -0.52 0.00 2.00 0.00 0.00 58.73 60.50 2x3f h TYR 191 Cb 0.45 0.00 0.03 0.00 1.00 0.00 0.00 36.73 38.22 2x3f h TYR 191 CO -0.00 0.00 0.64 -0.51 -0.00 0.00 0.00 178.16 178.29 2x3f s LEU 192 N -4.78 4.42 1.02 3.88 1.43 -0.53 -4.60 118.68 119.52 2x3f s LEU 192 Ca 0.01 2.41 -0.12 0.00 -1.03 0.00 0.00 54.13 55.40 2x3f s LEU 192 Cb 0.08 -3.61 0.20 0.00 0.03 0.00 0.00 46.19 42.89 2x3f s LEU 192 CO 0.35 -0.50 1.08 0.42 0.23 0.00 0.00 176.35 177.92 2x3f s THR 193 N -0.04 2.23 0.14 5.49 -4.23 -1.26 -4.64 115.64 113.32 2x3f s THR 193 Ca 0.55 0.08 -0.19 0.00 -1.18 0.00 0.00 61.69 60.94 2x3f s THR 193 Cb -0.36 -2.35 -0.00 0.00 1.34 0.00 0.00 72.50 71.12 2x3f s THR 193 CO 0.39 -0.10 1.70 -0.33 -0.54 0.00 0.00 174.62 175.74 2x3f h GLU 194 N -2.06 -0.00 -0.14 3.99 3.07 -1.96 0.32 114.58 117.79 2x3f h GLU 194 Ca -0.54 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.20 2x3f h GLU 194 Cb 1.31 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.21 2x3f h GLU 194 CO 0.52 -0.00 -0.42 1.96 -1.40 0.00 0.00 179.01 179.67 2x3f h GLN 195 N -0.00 0.33 -0.41 2.33 4.20 -2.01 -3.13 115.11 116.43 2x3f h GLN 195 Ca 0.11 -0.16 -0.11 0.00 0.06 0.00 0.00 58.65 58.55 2x3f h GLN 195 Cb 0.18 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 2x3f h GLN 195 CO -0.25 0.69 -0.21 0.93 -0.67 0.00 0.00 178.83 179.33 2x3f h GLU 196 N 0.27 0.80 -0.52 1.46 5.08 -1.70 -1.84 114.58 118.13 2x3f h GLU 196 Ca 0.02 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2x3f h GLU 196 Cb 0.85 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.04 2x3f h GLU 196 CO 0.07 0.94 0.26 -0.09 -1.00 0.00 0.00 179.01 179.19 2x3f h ARG 197 N 0.70 0.71 -0.12 2.33 9.65 -0.35 0.26 114.38 127.57 2x3f h ARG 197 Ca 0.10 -0.08 -0.21 0.00 -1.10 0.00 0.00 59.98 58.69 2x3f h ARG 197 Cb 0.73 -0.14 0.01 0.00 -1.39 0.00 0.00 29.97 29.17 2x3f h ARG 197 CO 0.06 0.54 -0.78 1.96 2.80 0.00 0.00 179.97 184.54 2x3f h GLN 198 N 0.72 0.65 -0.74 0.20 7.50 -1.47 -3.18 115.11 118.79 2x3f h GLN 198 Ca 0.18 -0.55 -0.06 0.00 0.50 0.00 0.00 58.65 58.73 2x3f h GLN 198 Cb 0.05 0.12 -0.03 0.00 0.05 0.00 0.00 27.48 27.67 2x3f h GLN 198 CO -0.03 1.16 0.23 0.93 -1.50 0.00 0.00 178.83 179.63 2x3f h GLU 199 N 0.44 1.15 0.00 1.46 5.08 -0.68 -3.18 114.58 118.85 2x3f h GLU 199 Ca -0.05 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2x3f h GLU 199 Cb 1.40 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 2x3f h GLU 199 CO 0.15 0.98 -0.00 0.00 -1.00 0.00 0.00 179.01 179.14 2x3f h ALA 200 N 1.14 1.02 0.00 3.43 0.00 -0.47 -0.23 119.26 124.15 2x3f h ALA 200 Ca 0.24 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2x3f h ALA 200 Cb 0.31 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2x3f h ALA 200 CO -0.01 0.00 -0.10 0.28 0.00 0.00 0.00 179.25 179.42 2x3f h VAL 201 N 0.00 0.60 0.00 0.00 2.07 -1.64 -2.76 116.25 114.52 2x3f h VAL 201 Ca -0.00 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2x3f h VAL 201 Cb 0.04 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2x3f h VAL 201 CO 0.00 0.10 0.00 1.41 0.02 0.00 0.00 177.57 179.10 2x3f n HIS 202 N -3.74 0.06 0.32 1.57 -0.00 -0.10 -2.29 115.22 111.05 2x3f n HIS 202 Ca -0.02 0.02 -0.17 0.00 -0.00 0.00 0.00 57.72 57.55 2x3f n HIS 202 Cb 0.21 -0.54 -0.09 0.00 -0.00 0.00 0.00 29.99 29.57 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 -0.67 -0.88 2.41 4.07 -1.69 0.12 115.31 118.67 2x3f h LEU 203 Ca 0.00 0.03 -0.04 0.00 0.08 0.00 0.00 57.88 57.95 2x3f h LEU 203 Cb 0.32 0.18 -0.04 0.00 1.08 0.00 0.00 40.66 42.21 2x3f h LEU 203 CO 0.00 -0.47 0.33 0.77 -1.08 0.00 0.00 178.44 177.99 2x3f h SER 204 N -0.78 1.06 -0.43 -0.43 4.64 -1.66 -2.46 113.55 113.48 2x3f h SER 204 Ca -0.08 -0.15 -0.09 0.00 -0.47 0.00 0.00 61.79 61.00 2x3f h SER 204 Cb 0.60 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2x3f h SER 204 CO 0.12 0.92 -0.05 0.11 -0.87 0.00 0.00 176.83 177.06 2x3f h LYS 205 N 1.13 0.86 -0.20 4.77 1.79 -1.41 -1.90 116.57 121.61 2x3f h LYS 205 Ca 0.26 -0.27 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2x3f h LYS 205 Cb 0.18 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.74 2x3f h LYS 205 CO -0.03 0.90 0.05 0.66 -1.08 0.00 0.00 179.45 179.95 2x3f h SER 206 N 0.79 0.25 0.00 0.86 4.64 -0.60 0.11 113.55 119.60 2x3f h SER 206 Ca 0.14 -0.02 -0.20 0.00 -0.47 0.00 0.00 61.79 61.24 2x3f h SER 206 Cb 0.55 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2x3f h SER 206 CO 0.03 0.26 -0.72 -0.07 -0.87 0.00 0.00 176.83 175.46 2x3f h LEU 207 N 0.28 0.75 -1.17 5.97 3.38 -0.96 -0.84 115.31 122.72 2x3f h LEU 207 Ca 0.07 -0.48 -0.06 0.00 0.09 0.00 0.00 57.88 57.50 2x3f h LEU 207 Cb 0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2x3f h LEU 207 CO -0.00 1.25 -0.09 -0.07 0.09 0.00 0.00 178.44 179.62 2x3f h LEU 208 N 0.45 0.45 -0.22 1.67 3.38 -0.73 -1.06 115.31 119.25 2x3f h LEU 208 Ca -0.03 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2x3f h LEU 208 Cb 1.33 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2x3f h LEU 208 CO 0.14 0.58 0.08 0.25 0.09 0.00 0.00 178.44 179.59 2x3f h LEU 209 N 0.44 0.31 -0.74 1.67 5.85 -0.58 -1.58 115.31 120.68 2x3f h LEU 209 Ca 0.09 -0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.70 2x3f h LEU 209 Cb 0.43 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.32 2x3f h LEU 209 CO 0.02 0.40 0.43 0.00 -0.34 0.00 0.00 178.44 178.95 2x3f h ALA 210 N 0.92 1.00 -0.66 1.25 0.00 -0.65 -1.08 119.26 120.04 2x3f h ALA 210 Ca 0.07 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2x3f h ALA 210 Cb 0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2x3f h ALA 210 CO -0.01 0.13 0.19 0.37 0.00 0.00 0.00 179.25 179.94 2x3f h GLN 211 N 0.79 1.04 -0.49 0.00 4.15 -1.11 -1.70 115.11 117.79 2x3f h GLN 211 Ca 0.33 -0.23 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 2x3f h GLN 211 Cb 0.18 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 2x3f h GLN 211 CO -0.18 0.91 0.28 0.00 -1.93 0.00 0.00 178.83 177.91 2x3f h ALA 212 N 1.08 0.63 -0.47 3.38 0.00 -0.57 0.63 119.26 123.94 2x3f h ALA 212 Ca 0.21 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2x3f h ALA 212 Cb 0.32 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2x3f h ALA 212 CO -0.00 0.15 0.17 -0.07 0.00 0.00 0.00 179.25 179.49 2x3f h LEU 213 N 0.66 0.67 -0.35 0.00 3.38 -1.05 -0.37 115.31 118.25 2x3f h LEU 213 Ca 0.17 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.97 2x3f h LEU 213 Cb 0.04 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2x3f h LEU 213 CO -0.03 0.67 0.20 0.22 0.09 0.00 0.00 178.44 179.59 2x3f h TYR 214 N 0.62 0.37 -0.35 1.13 5.03 -1.13 -1.33 116.97 121.31 2x3f h TYR 214 Ca 0.15 0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.42 2x3f h TYR 214 Cb 0.23 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 38.37 2x3f h TYR 214 CO 0.01 0.22 -0.04 1.96 -1.32 0.00 0.00 178.16 178.99 2x3f h GLN 215 N 0.41 0.56 0.00 1.82 1.08 -0.52 -0.45 115.11 118.00 2x3f h GLN 215 Ca 0.14 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2x3f h GLN 215 Cb 0.01 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 2x3f h GLN 215 CO -0.07 0.61 0.00 -0.25 -0.95 0.00 0.00 178.83 178.18 2x3f n ASP 216 N -4.24 0.00 0.00 1.46 8.00 -0.18 -4.88 116.55 116.71 2x3f n ASP 216 Ca 0.01 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.49 2x3f n ASP 216 Cb 0.28 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.12 2x3f n ASP 216 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x3f n GLY 217 N 0.21 1.20 3.71 0.44 0.00 -0.18 -5.07 105.19 105.51 2x3f n GLY 217 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.50 4.33 0.00 1.61 2.56 -0.54 -4.91 118.70 121.25 2x3f s GLU 218 Ca 0.00 2.02 0.00 0.00 0.00 0.00 0.00 54.97 56.99 2x3f s GLU 218 Cb 0.00 -3.28 0.00 0.00 2.00 0.00 0.00 34.13 32.85 2x3f s GLU 218 CO 0.00 -0.42 0.31 0.54 -0.56 0.00 0.00 175.26 175.13 2x3f n ARG 219 N 4.04 -0.50 -3.23 4.30 5.12 -1.26 -4.45 116.66 120.69 2x3f n ARG 219 Ca 0.11 -0.31 -0.40 0.00 -1.93 0.00 0.00 57.85 55.33 2x3f n ARG 219 Cb 0.43 -0.80 -0.08 0.00 -1.16 0.00 0.00 32.46 30.85 2x3f n ARG 219 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 2x3f s GLN 220 N -0.02 4.03 0.27 5.56 -2.07 -1.26 0.24 119.66 126.42 2x3f s GLN 220 Ca 0.00 0.29 0.00 0.00 -1.82 0.00 0.00 55.36 53.83 2x3f s GLN 220 Cb 0.00 -3.67 0.54 0.00 -1.09 0.00 0.00 33.01 28.79 2x3f s GLN 220 CO 0.00 -0.38 1.81 0.77 -1.32 0.00 0.00 175.29 176.16 2x3f h SER 221 N 8.06 0.78 -0.70 12.60 0.02 -1.47 -2.40 113.55 130.43 2x3f h SER 221 Ca -0.29 0.06 0.07 0.00 -0.84 0.00 0.00 61.79 60.80 2x3f h SER 221 Cb 1.14 -0.08 -0.06 0.00 0.14 0.00 0.00 62.40 63.53 2x3f h SER 221 CO 0.72 0.39 0.38 0.11 -1.14 0.00 0.00 176.83 177.29 2x3f h LYS 222 N 0.85 0.66 -0.44 3.45 1.57 -1.90 -0.66 116.57 120.10 2x3f h LYS 222 Ca 0.48 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 59.15 2x3f h LYS 222 Cb 0.55 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 2x3f h LYS 222 CO -0.30 0.44 -0.02 0.28 -0.57 0.00 0.00 179.45 179.27 2x3f h VAL 223 N 0.68 1.26 -0.04 0.50 2.07 -1.83 0.49 116.25 119.39 2x3f h VAL 223 Ca 0.33 -1.08 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 2x3f h VAL 223 Cb 0.26 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2x3f h VAL 223 CO -0.21 0.37 0.02 0.40 0.02 0.00 0.00 177.57 178.16 2x3f h ILE 224 N 0.62 1.07 -0.33 4.57 2.04 -1.35 0.93 117.51 125.06 2x3f h ILE 224 Ca 0.12 -0.20 0.06 0.00 1.00 0.00 0.00 64.86 65.83 2x3f h ILE 224 Cb 0.53 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.70 2x3f h ILE 224 CO 0.03 0.06 0.00 0.40 0.00 0.00 0.00 178.15 178.64 2x3f h ILE 225 N -0.03 0.76 -0.35 -0.67 2.04 -0.99 -0.26 117.51 118.01 2x3f h ILE 225 Ca 0.01 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.80 2x3f h ILE 225 Cb 0.08 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 2x3f h ILE 225 CO -0.00 0.02 0.05 0.44 0.00 0.00 0.00 178.15 178.66 2x3f h ASP 226 N 0.10 0.56 -0.42 1.72 3.32 -0.70 0.02 116.42 121.01 2x3f h ASP 226 Ca 0.16 -0.26 -0.13 0.00 0.02 0.00 0.00 57.03 56.82 2x3f h ASP 226 Cb 0.21 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2x3f h ASP 226 CO -0.26 0.68 -0.23 0.11 -1.72 0.00 0.00 179.24 177.82 2x3f h LYS 227 N 0.42 0.93 -0.28 3.56 1.57 -0.59 0.00 116.57 122.19 2x3f h LYS 227 Ca 0.11 -0.40 -0.03 0.00 -1.87 0.00 0.00 60.65 58.46 2x3f h LYS 227 Cb 0.36 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 2x3f h LYS 227 CO 0.01 1.06 0.05 0.28 -0.57 0.00 0.00 179.45 180.28 2x3f h VAL 228 N 0.81 1.23 -0.60 0.50 2.07 -1.01 -2.00 116.25 117.24 2x3f h VAL 228 Ca 0.10 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.86 2x3f h VAL 228 Cb 0.79 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 2x3f h VAL 228 CO 0.07 0.25 0.37 0.74 0.02 0.00 0.00 177.57 179.01 2x3f h THR 229 N 0.28 1.18 -0.49 2.57 2.02 -0.72 -1.28 112.91 116.45 2x3f h THR 229 Ca 0.09 -0.39 -0.09 0.00 0.77 0.00 0.00 66.41 66.79 2x3f h THR 229 Cb 0.32 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 2x3f h THR 229 CO 0.00 0.18 -0.03 1.56 0.37 0.00 0.00 175.52 177.60 2x3f h GLN 230 N 0.81 0.89 0.21 6.66 4.20 -0.96 -1.61 115.11 125.30 2x3f h GLN 230 Ca 0.22 -0.30 0.01 0.00 0.06 0.00 0.00 58.65 58.63 2x3f h GLN 230 Cb -0.03 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2x3f h GLN 230 CO -0.04 0.94 -0.22 -0.92 -0.67 0.00 0.00 178.83 177.91 2x3f h TYR 231 N 0.74 -0.59 -0.24 2.96 5.03 -1.20 -2.74 116.97 120.93 2x3f h TYR 231 Ca 0.14 0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.50 2x3f h TYR 231 Cb 0.56 0.23 -0.05 0.00 1.55 0.00 0.00 36.73 39.02 2x3f h TYR 231 CO 0.04 -0.33 -0.10 -0.07 -1.32 0.00 0.00 178.16 176.38 2x3f h LEU 232 N -0.47 -0.35 -1.60 2.82 3.38 -1.17 -2.79 115.31 115.12 2x3f h LEU 232 Ca 0.00 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2x3f h LEU 232 Cb 0.45 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 2x3f h LEU 232 CO -0.06 -0.14 0.13 -0.33 0.09 0.00 0.00 178.44 178.13 2x3f h GLU 233 N -0.07 0.40 -0.00 1.13 5.08 -1.24 -1.14 114.58 118.73 2x3f h GLU 233 Ca 0.13 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2x3f h GLU 233 Cb 0.26 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2x3f h GLU 233 CO -0.28 0.32 -0.08 -1.13 -1.00 0.00 0.00 179.01 176.83 2x3f n SER 234 N -4.43 0.32 -0.00 1.42 3.41 -1.04 -3.91 113.62 109.39 2x3f n SER 234 Ca 0.01 -0.44 0.02 0.00 -0.26 0.00 0.00 58.87 58.21 2x3f n SER 234 Cb 0.12 -0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 63.91 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 -1.07 0.00 -4.38 7.33 8.25 -0.53 -5.05 115.22 119.76 2x3f n HIS 235 Ca 0.14 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.37 2x3f n HIS 235 Cb 0.27 -0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.26 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 -1.42 2.06 -1.78 1.59 -4.36 -0.60 -4.73 121.20 111.95 2x3f s ILE 236 Ca 0.01 -2.06 0.22 0.00 -0.26 0.00 0.00 60.65 58.56 2x3f s ILE 236 Cb 0.03 -2.01 -0.06 0.00 1.25 0.00 0.00 42.46 41.67 2x3f s ILE 236 CO 0.17 -0.31 1.03 -1.54 0.24 0.00 0.00 174.94 174.53 2x3f n SER 237 N 0.06 1.79 -4.30 4.36 3.41 -1.26 -4.84 113.62 112.83 2x3f n SER 237 Ca -0.11 -1.40 -0.29 0.00 -0.26 0.00 0.00 58.87 56.82 2x3f n SER 237 Cb 0.58 0.59 0.16 0.00 -0.26 0.00 0.00 64.21 65.28 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 -2.56 1.76 -0.13 5.00 0.00 -1.26 -4.98 107.32 105.15 2x3f s GLY 238 Ca 0.16 -1.21 -0.04 0.00 0.00 0.00 0.00 44.72 43.63 2x3f s GLY 238 CO 0.63 -0.51 0.01 0.50 0.00 0.00 0.00 173.10 173.73 2x3f s ARG 239 N -5.74 3.40 -0.12 2.90 0.52 0.84 -4.91 118.95 115.85 2x3f s ARG 239 Ca 0.71 -0.41 -0.30 0.00 -0.52 0.00 0.00 55.73 55.22 2x3f s ARG 239 Cb -0.05 -2.93 -0.01 0.00 0.52 0.00 0.00 34.95 32.47 2x3f s ARG 239 CO 0.51 0.49 1.09 0.42 0.02 0.00 0.00 175.30 177.83 2x3f s ILE 240 N -0.28 4.57 -0.17 1.52 -1.09 -1.26 -0.21 121.20 124.27 2x3f s ILE 240 Ca 0.06 1.86 0.04 0.00 -2.23 0.00 0.00 60.65 60.39 2x3f s ILE 240 Cb -0.12 -4.20 -0.22 0.00 -1.58 0.00 0.00 42.46 36.34 2x3f s ILE 240 CO 0.02 -0.04 0.15 -0.62 -1.23 0.00 0.00 174.94 173.22 2x3f n GLU 241 N 5.42 0.69 -3.62 2.79 1.02 0.10 -4.94 120.64 122.10 2x3f n GLU 241 Ca 0.10 0.18 -0.15 0.00 -0.02 0.00 0.00 57.16 57.27 2x3f n GLU 241 Cb 0.47 -1.62 -0.07 0.00 -0.02 0.00 0.00 31.44 30.20 2x3f n GLU 241 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2x3f s GLU 242 N -2.54 0.85 -0.12 3.49 2.12 -0.78 -4.93 118.70 116.78 2x3f s GLU 242 Ca -0.21 0.56 -0.02 0.00 0.36 0.00 0.00 54.97 55.66 2x3f s GLU 242 Cb 0.08 0.40 0.04 0.00 0.26 0.00 0.00 34.13 34.91 2x3f s GLU 242 CO 0.73 -0.18 0.02 0.08 -0.54 0.00 0.00 175.26 175.37 2x3f s VAL 243 N -0.36 0.41 0.03 3.70 1.01 -1.26 -1.17 120.40 122.76 2x3f s VAL 243 Ca -0.05 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.79 2x3f s VAL 243 Cb -0.03 -0.72 -0.02 0.00 0.00 0.00 0.00 36.38 35.61 2x3f s VAL 243 CO 0.04 0.06 -0.05 0.00 0.00 0.00 0.00 175.10 175.15 2x3f s ALA 244 N 1.94 0.35 -0.16 5.51 0.00 -0.27 -4.95 121.76 124.18 2x3f s ALA 244 Ca 0.03 -0.72 -0.00 0.00 0.00 0.00 0.00 51.96 51.27 2x3f s ALA 244 Cb -0.14 0.11 0.04 0.00 0.00 0.00 0.00 23.12 23.13 2x3f s ALA 244 CO -0.06 -0.12 -0.08 0.08 0.00 0.00 0.00 175.76 175.58 2x3f s VAL 245 N -1.63 1.23 0.06 0.00 1.01 -1.26 -1.23 120.40 118.57 2x3f s VAL 245 Ca -0.11 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.27 2x3f s VAL 245 Cb -0.09 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 2x3f s VAL 245 CO -0.01 0.22 -0.07 -0.31 0.00 0.00 0.00 175.10 174.93 2x3f s TYR 246 N 1.60 0.69 0.64 5.22 1.51 -0.88 -4.74 117.35 121.39 2x3f s TYR 246 Ca 0.02 -0.65 -0.18 0.00 -1.01 0.00 0.00 57.07 55.25 2x3f s TYR 246 Cb -0.15 -0.42 -0.02 0.00 -0.11 0.00 0.00 41.96 41.27 2x3f s TYR 246 CO -0.08 -0.13 1.16 -1.13 -1.11 0.00 0.00 175.55 174.26 2x3f n SER 247 N 0.97 1.50 -3.96 2.29 3.41 -0.34 -0.45 113.62 117.04 2x3f n SER 247 Ca -0.19 0.80 -0.21 0.00 -0.26 0.00 0.00 58.87 59.01 2x3f n SER 247 Cb 0.57 -1.49 -0.16 0.00 -0.26 0.00 0.00 64.21 62.87 2x3f n SER 247 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2x3f s TYR 248 N -1.47 0.92 -1.74 7.33 5.04 -0.21 -0.55 117.35 126.67 2x3f s TYR 248 Ca 0.80 -0.26 0.13 0.00 -2.44 0.00 0.00 57.07 55.30 2x3f s TYR 248 Cb -0.39 -0.71 0.41 0.00 0.35 0.00 0.00 41.96 41.62 2x3f s TYR 248 CO 0.43 -0.15 1.31 -0.35 -1.34 0.00 0.00 175.55 175.45 2x3f n PRO 249 N 3.61 2.26 0.20 4.97 -0.04 -1.26 -4.58 135.00 140.16 2x3f n PRO 249 Ca -0.21 -1.64 0.08 0.00 -0.04 0.00 0.00 63.50 61.69 2x3f n PRO 249 Cb 0.53 -1.45 0.32 0.00 -0.04 0.00 0.00 33.50 32.86 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 2.54 0.00 -5.91 0.54 7.50 -1.94 -3.48 115.11 114.37 2x3f h GLN 250 Ca 0.00 0.00 -0.39 0.00 0.50 0.00 0.00 58.65 58.76 2x3f h GLN 250 Cb 0.73 0.00 0.10 0.00 0.05 0.00 0.00 27.48 28.36 2x3f h GLN 250 CO 0.05 0.27 -0.79 1.28 -1.50 0.00 0.00 178.83 178.14 2x3f n LEU 251 N -3.31 -3.46 -4.33 1.46 4.32 0.28 -4.86 117.00 107.11 2x3f n LEU 251 Ca 0.01 -0.71 -0.31 0.00 -0.02 0.00 0.00 56.01 54.98 2x3f n LEU 251 Cb 0.52 -2.88 -0.16 0.00 -1.62 0.00 0.00 43.42 39.28 2x3f n LEU 251 CO 0.35 0.43 -0.55 -0.69 -1.22 0.00 0.00 177.39 175.70 2x3f s VAL 252 N -3.48 2.19 0.22 4.08 1.01 -1.26 -4.85 120.40 118.31 2x3f s VAL 252 Ca 0.11 -1.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.03 2x3f s VAL 252 Cb -0.05 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 2x3f s VAL 252 CO 0.77 0.58 0.41 -1.83 0.00 0.00 0.00 175.10 175.03 2x3f s GLU 253 N -0.60 3.52 -0.14 2.72 -1.05 -1.26 -1.20 118.70 120.69 2x3f s GLU 253 Ca 0.09 -0.35 -0.18 0.00 -0.15 0.00 0.00 54.97 54.39 2x3f s GLU 253 Cb -0.10 -2.82 0.05 0.00 -0.44 0.00 0.00 34.13 30.82 2x3f s GLU 253 CO -0.01 0.37 0.48 1.14 0.95 0.00 0.00 175.26 178.19 2x3f s GLN 254 N -3.45 0.63 0.12 -4.83 -2.07 -1.26 -5.00 119.66 103.79 2x3f s GLN 254 Ca 0.39 0.51 -0.22 0.00 -1.82 0.00 0.00 55.36 54.21 2x3f s GLN 254 Cb -0.11 0.30 -0.06 0.00 -1.09 0.00 0.00 33.01 32.05 2x3f s GLN 254 CO 0.30 -0.11 1.69 0.45 -1.32 0.00 0.00 175.29 176.30 2x3f h HIS 255 N 4.92 -0.23 -3.75 9.60 3.86 -1.99 -3.41 115.15 124.16 2x3f h HIS 255 Ca -0.28 0.01 -0.64 0.00 -1.16 0.00 0.00 60.37 58.31 2x3f h HIS 255 Cb 1.17 0.11 -0.19 0.00 1.06 0.00 0.00 27.41 29.57 2x3f h HIS 255 CO 0.41 -0.14 -0.56 -1.21 0.86 0.00 0.00 177.93 177.29 2x3f s GLU 256 N -6.17 3.86 0.08 2.45 2.02 -1.26 -1.46 118.70 118.22 2x3f s GLU 256 Ca -0.14 -0.37 -0.31 0.00 0.02 0.00 0.00 54.97 54.17 2x3f s GLU 256 Cb 0.09 -3.51 -0.08 0.00 0.10 0.00 0.00 34.13 30.73 2x3f s GLU 256 CO 0.67 -0.14 1.52 0.42 0.02 0.00 0.00 175.26 177.75 2x3f s ILE 257 N 1.57 3.16 0.11 -1.63 1.01 0.67 -4.95 121.20 121.14 2x3f s ILE 257 Ca 0.07 0.72 0.03 0.00 0.00 0.00 0.00 60.65 61.47 2x3f s ILE 257 Cb -0.15 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 2x3f s ILE 257 CO 0.07 0.02 -0.09 0.42 0.00 0.00 0.00 174.94 175.36 2x3f s THR 258 N 1.93 0.95 0.00 2.92 -4.23 -1.26 -4.91 115.64 111.04 2x3f s THR 258 Ca 0.69 -1.81 0.00 0.00 -1.18 0.00 0.00 61.69 59.39 2x3f s THR 258 Cb -0.38 -1.55 0.00 0.00 1.34 0.00 0.00 72.50 71.91 2x3f s THR 258 CO 0.30 -0.67 0.00 0.61 -0.54 0.00 0.00 174.62 174.32 2x3f n GLY 259 N 0.24 -0.24 3.72 3.99 0.00 -1.26 -4.73 105.19 106.91 2x3f n GLY 259 Ca -0.14 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 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 4.58 0.30 1.61 3.52 -1.25 -4.03 118.95 123.68 2x3f s ARG 260 Ca 0.00 1.56 0.04 0.00 -0.13 0.00 0.00 55.73 57.20 2x3f s ARG 260 Cb 0.00 -3.38 -0.06 0.00 -1.56 0.00 0.00 34.95 29.95 2x3f s ARG 260 CO 0.00 0.01 0.03 0.96 -0.81 0.00 0.00 175.30 175.49 2x3f s ILE 261 N 0.47 1.23 0.01 4.11 -4.36 0.25 -1.05 121.20 121.86 2x3f s ILE 261 Ca 0.51 -2.02 0.03 0.00 -0.26 0.00 0.00 60.65 58.90 2x3f s ILE 261 Cb -0.25 -2.67 -0.01 0.00 1.25 0.00 0.00 42.46 40.78 2x3f s ILE 261 CO 0.30 -0.10 -0.08 0.72 0.24 0.00 0.00 174.94 176.02 2x3f s PHE 262 N -3.28 0.73 -0.21 1.37 -0.71 0.41 -0.85 117.98 115.45 2x3f s PHE 262 Ca 0.34 -0.25 -0.06 0.00 -1.04 0.00 0.00 56.93 55.92 2x3f s PHE 262 Cb 0.07 -0.45 -0.03 0.00 -1.21 0.00 0.00 43.02 41.40 2x3f s PHE 262 CO 0.14 -0.02 0.03 0.42 -1.34 0.00 0.00 175.22 174.44 2x3f s ILE 263 N -0.59 4.14 0.09 -4.49 1.09 -0.42 -2.07 121.20 118.95 2x3f s ILE 263 Ca -0.01 -0.24 0.08 0.00 -1.10 0.00 0.00 60.65 59.38 2x3f s ILE 263 Cb -0.05 -2.89 -0.03 0.00 -1.06 0.00 0.00 42.46 38.42 2x3f s ILE 263 CO 0.00 0.41 -0.21 -0.94 -0.10 0.00 0.00 174.94 174.10 2x3f s SER 264 N 1.08 2.53 0.06 3.58 1.04 -0.37 -1.52 113.70 120.10 2x3f s SER 264 Ca 0.03 -0.65 0.05 0.00 0.48 0.00 0.00 55.95 55.86 2x3f s SER 264 Cb -0.14 -0.15 -0.03 0.00 0.10 0.00 0.00 66.02 65.80 2x3f s SER 264 CO 0.02 0.08 -0.14 -0.76 0.98 0.00 0.00 173.24 173.42 2x3f s LEU 265 N -1.76 2.23 -0.08 2.42 1.43 -0.27 -1.11 118.68 121.54 2x3f s LEU 265 Ca 0.07 -0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 52.59 2x3f s LEU 265 Cb -0.10 -0.56 0.05 0.00 0.03 0.00 0.00 46.19 45.61 2x3f s LEU 265 CO 0.04 -0.02 0.17 0.00 0.23 0.00 0.00 176.35 176.77 2x3f s ALA 266 N -1.07 -0.28 -0.03 4.21 0.00 -0.32 -2.57 121.76 121.69 2x3f s ALA 266 Ca -0.00 0.69 0.03 0.00 0.00 0.00 0.00 51.96 52.68 2x3f s ALA 266 Cb -0.09 -0.67 -0.00 0.00 0.00 0.00 0.00 23.12 22.36 2x3f s ALA 266 CO 0.02 -0.37 -0.13 0.08 0.00 0.00 0.00 175.76 175.36 2x3f s VAL 267 N 1.74 1.08 -0.38 0.00 1.01 -0.25 0.01 120.40 123.61 2x3f s VAL 267 Ca -0.03 -0.53 -0.07 0.00 0.00 0.00 0.00 61.98 61.35 2x3f s VAL 267 Cb -0.12 -0.94 0.06 0.00 0.00 0.00 0.00 36.38 35.39 2x3f s VAL 267 CO -0.06 0.32 0.17 -0.75 0.00 0.00 0.00 175.10 174.78 2x3f s LYS 268 N 0.10 2.54 0.07 2.72 2.47 0.71 -0.84 119.74 127.50 2x3f s LYS 268 Ca -0.03 -1.37 -0.01 0.00 -1.56 0.00 0.00 55.97 53.01 2x3f s LYS 268 Cb -0.10 -3.59 0.01 0.00 -1.46 0.00 0.00 37.83 32.70 2x3f s LYS 268 CO 0.01 -0.83 0.09 1.19 0.16 0.00 0.00 175.35 175.98 2x3f n PHE 269 N 4.82 -3.79 -0.02 4.03 3.72 0.05 -0.11 117.46 126.16 2x3f n PHE 269 Ca -0.10 -0.10 -0.01 0.00 -0.05 0.00 0.00 57.45 57.19 2x3f n PHE 269 Cb 0.44 -0.07 -0.01 0.00 -0.94 0.00 0.00 39.48 38.90 2x3f n PHE 269 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2x3f h SER 270 N -0.10 -0.12 -0.00 4.37 0.02 -1.93 -3.34 113.55 112.44 2x3f h SER 270 Ca -0.03 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2x3f h SER 270 Cb 0.09 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2x3f h SER 270 CO 0.02 -0.02 -0.20 0.29 -1.14 0.00 0.00 176.83 175.78 2x3f n LYS 271 N -2.99 3.06 -4.88 3.45 5.02 -1.26 -5.02 118.16 115.54 2x3f n LYS 271 Ca -0.00 -0.35 -0.33 0.00 -2.02 0.00 0.00 58.31 55.62 2x3f n LYS 271 Cb 0.02 -0.94 -0.15 0.00 -0.02 0.00 0.00 35.03 33.94 2x3f n LYS 271 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2x3f s ALA 272 N -1.26 2.52 -0.34 7.82 0.00 -1.25 -5.03 121.76 124.21 2x3f s ALA 272 Ca 0.05 -0.91 -0.13 0.00 0.00 0.00 0.00 51.96 50.97 2x3f s ALA 272 Cb 0.05 -1.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.04 2x3f s ALA 272 CO 0.21 0.26 0.24 0.50 0.00 0.00 0.00 175.76 176.97 2x3f s ARG 273 N 0.34 3.52 -0.01 0.00 3.52 -1.26 -0.77 118.95 124.29 2x3f s ARG 273 Ca -0.13 -0.63 0.03 0.00 -0.13 0.00 0.00 55.73 54.88 2x3f s ARG 273 Cb -0.16 -3.80 -0.03 0.00 -1.56 0.00 0.00 34.95 29.39 2x3f s ARG 273 CO 0.06 -0.43 -0.08 -0.51 -0.81 0.00 0.00 175.30 173.53 2x3f s LEU 274 N 1.73 3.08 0.16 -0.88 1.43 -0.02 -4.96 118.68 119.21 2x3f s LEU 274 Ca 0.06 -0.15 0.09 0.00 -1.03 0.00 0.00 54.13 53.10 2x3f s LEU 274 Cb -0.17 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 2x3f s LEU 274 CO 0.11 0.30 -0.20 0.27 0.23 0.00 0.00 176.35 177.05 2x3f s ILE 275 N -0.93 1.95 0.17 -0.59 -4.36 -1.26 -1.09 121.20 115.10 2x3f s ILE 275 Ca 0.15 -1.88 -0.17 0.00 -0.26 0.00 0.00 60.65 58.49 2x3f s ILE 275 Cb -0.11 -1.88 0.03 0.00 1.25 0.00 0.00 42.46 41.75 2x3f s ILE 275 CO 0.05 -0.21 0.48 -0.62 0.24 0.00 0.00 174.94 174.88 2x3f s ASP 276 N -2.53 -0.24 0.22 4.36 -1.08 -1.06 -4.91 116.67 111.42 2x3f s ASP 276 Ca 0.15 -0.45 -0.22 0.00 -0.52 0.00 0.00 52.55 51.52 2x3f s ASP 276 Cb -0.07 0.54 0.04 0.00 -1.46 0.00 0.00 42.92 41.97 2x3f s ASP 276 CO 0.07 -0.99 0.67 0.54 0.52 0.00 0.00 175.17 175.99 2x3f s ASN 277 N -2.86 -0.40 -0.00 -0.34 2.20 -1.26 -1.11 114.94 111.18 2x3f s ASN 277 Ca 0.08 -0.33 0.00 0.00 -0.94 0.00 0.00 52.86 51.67 2x3f s ASN 277 Cb 0.00 0.67 0.00 0.00 -2.00 0.00 0.00 41.25 39.92 2x3f s ASN 277 CO -0.05 -1.17 -0.00 -0.51 -2.94 0.00 0.00 177.10 172.43 2x3f s ILE 278 N -3.83 0.01 -0.22 0.54 2.07 -0.58 -4.99 121.20 114.20 2x3f s ILE 278 Ca 0.07 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.25 2x3f s ILE 278 Cb -0.04 -0.02 -0.02 0.00 0.13 0.00 0.00 42.46 42.50 2x3f s ILE 278 CO -0.02 0.01 0.02 -0.63 -1.91 0.00 0.00 174.94 172.41 2x3f s ILE 279 N 0.04 4.02 0.16 2.00 1.01 -1.26 -1.30 121.20 125.86 2x3f s ILE 279 Ca -0.00 -0.28 0.02 0.00 0.00 0.00 0.00 60.65 60.39 2x3f s ILE 279 Cb -0.01 -2.85 -0.05 0.00 0.01 0.00 0.00 42.46 39.57 2x3f s ILE 279 CO -0.00 0.39 -0.02 -0.63 0.00 0.00 0.00 174.94 174.68 2x3f s ILE 280 N 1.33 0.72 0.00 2.92 -1.09 -0.02 -4.99 121.20 120.06 2x3f s ILE 280 Ca 0.04 -1.98 0.00 0.00 -2.23 0.00 0.00 60.65 56.48 2x3f s ILE 280 Cb -0.15 -2.04 0.00 0.00 -1.58 0.00 0.00 42.46 38.70 2x3f s ILE 280 CO 0.02 -0.55 0.00 0.61 -1.23 0.00 0.00 174.94 173.78 2x3f n GLY 281 N -0.21 -0.74 0.28 6.18 0.00 -1.26 -0.59 105.19 108.85 2x3f n GLY 281 Ca -0.08 -1.68 0.04 0.00 0.00 0.00 0.00 46.02 44.30 2x3f n GLY 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32