#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1otw s ILE 3 N 0.00 3.96 -0.22 1.96 1.01 -1.26 -4.93 121.20 121.72 1otw s ILE 3 Ca 0.00 1.15 -0.16 0.00 0.00 0.00 0.00 60.65 61.64 1otw s ILE 3 Cb 0.00 -3.76 -0.11 0.00 0.01 0.00 0.00 42.46 38.60 1otw s ILE 3 CO 0.00 -0.12 -0.18 0.41 0.00 0.00 0.00 174.94 175.05 1otw n THR 4 N 5.49 1.51 -3.13 2.92 -1.04 -1.26 -4.83 114.28 113.95 1otw n THR 4 Ca 0.16 -0.09 -0.40 0.00 -2.04 0.00 0.00 64.05 61.67 1otw n THR 4 Cb 0.44 -2.10 -0.06 0.00 -1.82 0.00 0.00 70.33 66.79 1otw n THR 4 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1otw s ASP 5 N -6.74 6.71 0.06 8.00 1.01 -1.26 -4.76 116.67 119.69 1otw s ASP 5 Ca -0.31 0.86 -0.37 0.00 0.71 0.00 0.00 52.55 53.45 1otw s ASP 5 Cb 0.08 -2.35 -0.19 0.00 1.01 0.00 0.00 42.92 41.48 1otw s ASP 5 CO 0.46 -0.24 1.00 0.41 0.21 0.00 0.00 175.17 177.01 1otw n THR 6 N 4.55 0.47 -2.23 -1.27 -1.04 -1.26 -4.92 114.28 108.58 1otw n THR 6 Ca -0.02 -0.12 -0.26 0.00 -2.04 0.00 0.00 64.05 61.61 1otw n THR 6 Cb 0.50 -0.15 0.11 0.00 -1.82 0.00 0.00 70.33 68.97 1otw n THR 6 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1otw s LEU 7 N 0.68 2.83 0.22 -4.42 1.43 -1.26 -5.00 118.68 113.16 1otw s LEU 7 Ca 0.83 0.18 0.07 0.00 -1.03 0.00 0.00 54.13 54.18 1otw s LEU 7 Cb -1.14 -2.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.48 1otw s LEU 7 CO 0.55 -2.00 0.12 -0.94 0.23 0.00 0.00 176.35 174.32 1otw s SER 8 N -4.69 5.28 0.45 2.29 1.04 -1.26 -4.85 113.70 111.96 1otw s SER 8 Ca 0.66 -0.29 0.32 0.00 0.48 0.00 0.00 55.95 57.12 1otw s SER 8 Cb -0.07 -1.28 1.10 0.00 0.10 0.00 0.00 66.02 65.87 1otw s SER 8 CO 0.47 0.02 1.14 -2.65 0.98 0.00 0.00 173.24 173.19 1otw n PRO 9 N -0.75 0.00 -0.12 4.02 -0.02 -1.26 -0.64 135.00 136.23 1otw n PRO 9 Ca -0.08 0.83 -0.18 0.00 -2.02 0.00 0.00 63.50 62.05 1otw n PRO 9 Cb 0.57 -1.97 -0.12 0.00 -0.02 0.00 0.00 33.50 31.95 1otw n PRO 9 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1otw n GLN 10 N -3.23 0.66 0.19 -0.52 1.13 -1.26 -3.54 117.38 110.81 1otw n GLN 10 Ca 0.28 0.15 0.05 0.00 -1.94 0.00 0.00 57.00 55.54 1otw n GLN 10 Cb 1.43 -1.53 0.39 0.00 0.11 0.00 0.00 30.24 30.65 1otw n GLN 10 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1otw h ALA 11 N 0.07 1.23 0.01 -1.58 0.00 -1.25 -2.72 119.26 115.02 1otw h ALA 11 Ca -0.57 -0.32 -0.20 0.00 0.00 0.00 0.00 54.91 53.81 1otw h ALA 11 Cb 1.93 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.65 1otw h ALA 11 CO -0.07 0.44 -0.90 0.35 0.00 0.00 0.00 179.25 179.07 1otw h PHE 12 N 0.00 0.34 0.00 0.00 3.57 -1.39 -2.74 116.94 116.72 1otw h PHE 12 Ca -0.00 -0.19 -0.02 0.00 3.53 0.00 0.00 57.97 61.28 1otw h PHE 12 Cb 0.71 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.41 1otw h PHE 12 CO 0.00 1.01 -0.10 1.49 -2.23 0.00 0.00 178.31 178.48 1otw h GLU 13 N 0.13 0.00 0.00 1.11 4.81 -1.53 -1.61 114.58 117.48 1otw h GLU 13 Ca -0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1otw h GLU 13 Cb 1.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.91 1otw h GLU 13 CO 0.14 0.10 -0.45 0.93 -0.73 0.00 0.00 179.01 178.99 1otw h GLU 14 N 0.00 0.00 -0.07 1.92 4.39 -1.42 -2.50 114.58 116.90 1otw h GLU 14 Ca -0.00 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.54 1otw h GLU 14 Cb 0.18 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.84 1otw h GLU 14 CO 0.01 0.00 -0.57 0.00 -1.16 0.00 0.00 179.01 177.29 1otw h ALA 15 N 2.03 0.16 0.24 3.43 0.00 -1.10 -2.60 119.26 121.42 1otw h ALA 15 Ca 0.00 -0.54 -0.00 0.00 0.00 0.00 0.00 54.91 54.37 1otw h ALA 15 Cb 0.99 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1otw h ALA 15 CO 0.00 0.40 -0.34 -0.07 0.00 0.00 0.00 179.25 179.24 1otw h LEU 16 N 0.08 -0.97 -1.61 0.00 3.38 -1.36 -3.04 115.31 111.79 1otw h LEU 16 Ca -0.05 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1otw h LEU 16 Cb 1.23 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 42.30 1otw h LEU 16 CO 0.12 -0.41 0.29 0.03 0.09 0.00 0.00 178.44 178.55 1otw h ARG 17 N -0.60 0.50 -0.15 1.13 3.08 -1.57 0.38 114.38 117.14 1otw h ARG 17 Ca -0.03 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.04 1otw h ARG 17 Cb 0.55 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1otw h ARG 17 CO -0.10 0.33 0.20 0.00 -1.07 0.00 0.00 179.97 179.34 1otw h ALA 18 N 1.74 1.70 0.00 0.04 0.00 -1.35 0.14 119.26 121.53 1otw h ALA 18 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1otw h ALA 18 Cb 0.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1otw h ALA 18 CO -0.04 -0.28 0.00 1.63 0.00 0.00 0.00 179.25 180.56 1otw n LYS 19 N -3.65 0.01 0.20 0.00 4.76 0.12 -2.45 118.16 117.16 1otw n LYS 19 Ca 0.01 0.24 0.14 0.00 -2.87 0.00 0.00 58.31 55.84 1otw n LYS 19 Cb 0.31 -1.52 0.65 0.00 -1.84 0.00 0.00 35.03 32.64 1otw n LYS 19 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1otw h GLY 20 N 2.65 0.00 2.00 0.72 0.00 -0.84 -1.85 103.07 105.75 1otw h GLY 20 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1otw h GLY 20 CO 0.00 0.00 -0.01 -0.55 0.00 0.00 0.00 176.54 175.98 1otw h ASP 21 N 0.00 0.00 -0.62 0.19 3.32 -1.67 -1.94 116.42 115.69 1otw h ASP 21 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1otw h ASP 21 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1otw h ASP 21 CO 0.00 0.01 0.00 0.49 -1.72 0.00 0.00 179.24 178.02 1otw n PHE 22 N -3.60 0.89 -1.24 4.55 3.01 -0.69 -4.94 117.46 115.43 1otw n PHE 22 Ca -0.03 -0.51 -0.31 0.00 1.01 0.00 0.00 57.45 57.60 1otw n PHE 22 Cb 0.09 -0.03 0.10 0.00 -0.01 0.00 0.00 39.48 39.63 1otw n PHE 22 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 1otw s TYR 23 N -1.10 2.41 -2.00 1.38 5.04 -0.73 -4.86 117.35 117.49 1otw s TYR 23 Ca 0.43 1.60 0.12 0.00 -2.44 0.00 0.00 57.07 56.77 1otw s TYR 23 Cb 0.23 -3.13 0.74 0.00 0.35 0.00 0.00 41.96 40.15 1otw s TYR 23 CO 0.28 -1.98 1.21 -2.39 -1.34 0.00 0.00 175.55 171.33 1otw n HIS 24 N -3.45 0.00 0.23 4.97 1.44 -1.26 -2.43 115.22 114.72 1otw n HIS 24 Ca 0.10 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.92 1otw n HIS 24 Cb 0.53 0.00 0.54 0.00 0.12 0.00 0.00 29.99 31.17 1otw n HIS 24 CO 0.00 0.00 0.00 0.97 -2.81 0.00 0.00 176.34 174.50 1otw h ILE 25 N 0.00 0.53 -0.39 0.61 2.10 -1.93 -2.77 117.51 115.65 1otw h ILE 25 Ca 0.00 -0.95 0.00 0.00 1.08 0.00 0.00 64.86 64.99 1otw h ILE 25 Cb 0.00 1.65 0.00 0.00 -1.09 0.00 0.00 36.82 37.38 1otw h ILE 25 CO 0.00 0.19 0.00 1.41 -1.08 0.00 0.00 178.15 178.67 1otw n HIS 26 N -3.43 1.27 -3.62 2.19 8.25 -1.02 -4.44 115.22 114.44 1otw n HIS 26 Ca -0.00 -0.45 -0.37 0.00 -0.26 0.00 0.00 57.72 56.63 1otw n HIS 26 Cb 0.38 -0.32 -0.09 0.00 1.12 0.00 0.00 29.99 31.07 1otw n HIS 26 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1otw s HIS 27 N -2.05 3.31 0.48 4.41 5.04 -1.05 -4.97 115.29 120.47 1otw s HIS 27 Ca 0.35 0.27 0.36 0.00 -1.54 0.00 0.00 55.06 54.50 1otw s HIS 27 Cb 0.26 -2.32 1.51 0.00 0.04 0.00 0.00 32.58 32.07 1otw s HIS 27 CO 0.12 0.03 1.64 -1.35 -2.34 0.00 0.00 174.74 172.84 1otw h PRO 28 N 7.57 0.06 -0.25 2.88 0.11 -1.90 0.75 132.00 141.22 1otw h PRO 28 Ca -0.37 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.67 1otw h PRO 28 Cb 1.17 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1otw h PRO 28 CO 0.66 0.04 -0.07 -0.92 -0.21 0.00 0.00 178.00 177.50 1otw h TYR 29 N 0.06 0.55 -0.59 0.65 3.20 -1.93 -0.23 116.97 118.68 1otw h TYR 29 Ca 0.82 -0.12 -0.06 0.00 3.14 0.00 0.00 58.73 62.50 1otw h TYR 29 Cb 2.82 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 40.93 1otw h TYR 29 CO -0.00 0.72 0.12 1.25 -1.64 0.00 0.00 178.16 178.61 1otw h HIS 30 N 0.23 0.98 -0.01 -3.82 2.76 0.16 -2.93 115.15 112.52 1otw h HIS 30 Ca 0.06 -0.11 -0.08 0.00 -2.20 0.00 0.00 60.37 58.05 1otw h HIS 30 Cb 0.55 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 29.22 1otw h HIS 30 CO 0.05 0.82 -0.36 0.82 -1.30 0.00 0.00 177.93 177.97 1otw h ILE 31 N 0.89 1.26 0.00 6.26 2.04 -0.69 -1.89 117.51 125.38 1otw h ILE 31 Ca 0.19 -1.26 -0.15 0.00 1.00 0.00 0.00 64.86 64.65 1otw h ILE 31 Cb 0.35 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 1otw h ILE 31 CO 0.00 0.36 -0.70 0.00 0.00 0.00 0.00 178.15 177.82 1otw h ALA 32 N 1.62 0.69 -0.01 1.87 0.00 -1.01 -3.08 119.26 119.34 1otw h ALA 32 Ca -0.00 -0.63 -0.18 0.00 0.00 0.00 0.00 54.91 54.10 1otw h ALA 32 Cb 0.65 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1otw h ALA 32 CO 0.05 0.87 -0.80 0.52 0.00 0.00 0.00 179.25 179.88 1otw h MET 33 N 0.00 0.15 0.00 0.00 2.86 -1.21 -2.14 114.93 114.58 1otw h MET 33 Ca -0.01 -0.15 -0.06 0.00 -2.06 0.00 0.00 59.70 57.43 1otw h MET 33 Cb 1.37 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 33.06 1otw h MET 33 CO 0.09 0.87 -0.28 1.25 1.06 0.00 0.00 176.91 179.90 1otw h HIS 34 N 0.09 0.00 -0.00 -0.22 6.17 -1.34 -3.17 115.15 116.68 1otw h HIS 34 Ca -0.03 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.05 1otw h HIS 34 Cb 1.40 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.33 1otw h HIS 34 CO 0.02 0.28 -0.69 0.09 0.71 0.00 0.00 177.93 178.35 1otw n ASN 35 N -3.26 0.99 0.00 3.26 3.02 -1.17 -4.90 115.26 113.19 1otw n ASN 35 Ca 0.02 -0.82 0.00 0.00 -0.03 0.00 0.00 54.58 53.75 1otw n ASN 35 Cb 0.56 0.59 0.00 0.00 -0.61 0.00 0.00 39.78 40.33 1otw n ASN 35 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1otw n GLY 36 N 1.47 0.69 0.00 7.41 0.00 -1.19 -4.95 105.19 108.62 1otw n GLY 36 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 1otw n GLY 36 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1otw n ASP 37 N 0.00 0.00 -4.77 1.61 8.00 -0.83 -4.85 116.55 115.71 1otw n ASP 37 Ca 0.00 0.33 -0.38 0.00 0.71 0.00 0.00 54.79 55.44 1otw n ASP 37 Cb 0.00 -0.44 -0.06 0.00 -0.02 0.00 0.00 41.12 40.60 1otw n ASP 37 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1otw s ALA 38 N -2.88 3.30 0.81 2.24 0.00 -1.08 -4.98 121.76 119.17 1otw s ALA 38 Ca 0.17 0.52 -0.06 0.00 0.00 0.00 0.00 51.96 52.60 1otw s ALA 38 Cb 0.18 -3.15 0.16 0.00 0.00 0.00 0.00 23.12 20.31 1otw s ALA 38 CO 0.48 0.21 1.11 0.95 0.00 0.00 0.00 175.76 178.51 1otw s THR 39 N -1.38 2.07 0.04 0.00 -4.23 -1.26 -4.90 115.64 105.98 1otw s THR 39 Ca 0.44 -0.41 -0.23 0.00 -1.18 0.00 0.00 61.69 60.32 1otw s THR 39 Cb -0.22 -2.66 -0.15 0.00 1.34 0.00 0.00 72.50 70.81 1otw s THR 39 CO 0.27 0.00 1.48 -0.09 -0.54 0.00 0.00 174.62 175.74 1otw h ARG 40 N -0.91 0.15 -0.65 3.99 2.43 -1.99 -2.29 114.38 115.10 1otw h ARG 40 Ca -0.38 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.71 1otw h ARG 40 Cb 1.25 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.76 1otw h ARG 40 CO 0.38 0.40 0.30 -0.22 -1.51 0.00 0.00 179.97 179.32 1otw h LYS 41 N -0.12 0.95 -0.07 0.20 3.64 -1.98 -1.52 116.57 117.66 1otw h LYS 41 Ca 0.02 -0.15 0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1otw h LYS 41 Cb 0.33 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 1otw h LYS 41 CO 0.00 0.77 -0.16 1.96 -2.27 0.00 0.00 179.45 179.75 1otw h GLN 42 N 0.91 -0.22 -0.53 1.90 4.20 -1.85 0.22 115.11 119.74 1otw h GLN 42 Ca 0.22 0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.93 1otw h GLN 42 Cb 0.15 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 1otw h GLN 42 CO -0.02 -0.15 0.27 0.82 -0.67 0.00 0.00 178.83 179.08 1otw h ILE 43 N -0.23 1.17 0.10 2.54 2.04 -1.21 -1.71 117.51 120.21 1otw h ILE 43 Ca 0.08 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 1otw h ILE 43 Cb 0.34 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1otw h ILE 43 CO -0.21 0.19 -0.05 1.56 0.00 0.00 0.00 178.15 179.64 1otw h GLN 44 N 0.73 -0.13 -0.68 2.37 4.20 -0.91 -2.37 115.11 118.32 1otw h GLN 44 Ca 0.19 0.01 0.13 0.00 0.06 0.00 0.00 58.65 59.04 1otw h GLN 44 Cb 0.05 0.03 -0.09 0.00 0.30 0.00 0.00 27.48 27.76 1otw h GLN 44 CO -0.03 0.28 0.20 0.78 -0.67 0.00 0.00 178.83 179.39 1otw h GLY 45 N -0.59 0.95 0.96 3.46 0.00 -0.81 -0.23 103.07 106.81 1otw h GLY 45 Ca -0.01 -0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.26 1otw h GLY 45 CO 0.02 -0.12 0.65 -0.25 0.00 0.00 0.00 176.54 176.83 1otw h TRP 46 N 0.33 1.22 -0.07 5.60 7.01 -1.28 0.90 115.95 129.66 1otw h TRP 46 Ca 0.37 0.03 -0.24 0.00 2.11 0.00 0.00 58.89 61.16 1otw h TRP 46 Cb 0.57 -0.41 0.01 0.00 -2.10 0.00 0.00 29.16 27.23 1otw h TRP 46 CO -0.22 0.74 -0.89 0.28 -2.79 0.00 0.00 178.44 175.56 1otw h VAL 47 N 1.29 1.31 -0.35 2.65 2.07 -0.69 -1.25 116.25 121.28 1otw h VAL 47 Ca 0.37 -2.16 -0.17 0.00 0.82 0.00 0.00 66.70 65.56 1otw h VAL 47 Cb -0.09 2.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1otw h VAL 47 CO -0.10 0.67 -0.45 0.00 0.02 0.00 0.00 177.57 177.71 1otw h ALA 48 N 0.57 0.53 -0.37 1.67 0.00 -0.84 -2.75 119.26 118.07 1otw h ALA 48 Ca -0.08 -0.48 -0.17 0.00 0.00 0.00 0.00 54.91 54.18 1otw h ALA 48 Cb 1.53 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1otw h ALA 48 CO 0.17 0.68 -0.42 -0.91 0.00 0.00 0.00 179.25 178.77 1otw h ASN 49 N 0.73 1.00 0.39 0.00 2.35 -0.82 -2.63 115.58 116.60 1otw h ASN 49 Ca 0.04 -0.48 -0.01 0.00 -0.55 0.00 0.00 56.30 55.30 1otw h ASN 49 Cb 1.05 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 39.14 1otw h ASN 49 CO 0.11 1.28 -0.06 0.03 -1.65 0.00 0.00 177.43 177.14 1otw h ARG 50 N 0.75 0.00 0.00 0.81 2.47 -1.25 -2.19 114.38 114.97 1otw h ARG 50 Ca 0.05 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.73 1otw h ARG 50 Cb 1.02 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.33 1otw h ARG 50 CO 0.10 0.06 -0.22 0.35 0.56 0.00 0.00 179.97 180.81 1otw h PHE 51 N 0.00 0.00 -0.64 3.04 3.57 -1.15 0.28 116.94 122.03 1otw h PHE 51 Ca -0.00 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 1otw h PHE 51 Cb 0.27 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 1otw h PHE 51 CO 0.00 0.22 0.17 -0.92 -2.23 0.00 0.00 178.31 175.55 1otw h TYR 52 N 0.00 1.06 -0.16 0.41 3.20 -1.48 0.98 116.97 120.99 1otw h TYR 52 Ca -0.00 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.74 1otw h TYR 52 Cb 0.49 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 1otw h TYR 52 CO 0.00 0.88 0.06 -0.92 -1.64 0.00 0.00 178.16 176.54 1otw h TYR 53 N 0.94 0.24 0.49 -3.82 3.20 -0.87 -2.68 116.97 114.47 1otw h TYR 53 Ca 0.20 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 1otw h TYR 53 Cb 0.34 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.54 1otw h TYR 53 CO 0.03 0.31 -0.23 1.96 -1.64 0.00 0.00 178.16 178.58 1otw h GLN 54 N 0.10 -0.63 0.00 1.82 1.08 -0.31 -1.65 115.11 115.53 1otw h GLN 54 Ca 0.05 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1otw h GLN 54 Cb 0.17 0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1otw h GLN 54 CO -0.00 -0.38 0.00 0.25 -0.95 0.00 0.00 178.83 177.74 1otw n THR 55 N -5.34 0.23 -0.05 -0.54 -2.24 0.32 -2.04 114.28 104.62 1otw n THR 55 Ca -0.12 0.06 -0.13 0.00 -2.27 0.00 0.00 64.05 61.59 1otw n THR 55 Cb 0.29 -0.94 -0.14 0.00 -2.10 0.00 0.00 70.33 67.43 1otw n THR 55 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1otw n THR 56 N -1.08 1.58 -0.33 4.28 -1.04 -0.64 -4.47 114.28 112.58 1otw n THR 56 Ca 0.05 -0.74 0.23 0.00 -2.04 0.00 0.00 64.05 61.55 1otw n THR 56 Cb 0.03 -1.13 0.46 0.00 -1.82 0.00 0.00 70.33 67.87 1otw n THR 56 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1otw h ILE 57 N 0.02 0.27 -0.16 12.58 1.08 -1.12 0.22 117.51 130.40 1otw h ILE 57 Ca -0.43 -0.09 -0.15 0.00 -0.39 0.00 0.00 64.86 63.79 1otw h ILE 57 Cb 2.06 -0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 35.77 1otw h ILE 57 CO 0.04 0.05 -0.55 -0.65 -0.69 0.00 0.00 178.15 176.35 1otw h PRO 58 N 0.27 0.47 -0.35 2.37 0.11 -1.78 -1.36 132.00 131.74 1otw h PRO 58 Ca 0.72 -0.29 -0.00 0.00 0.11 0.00 0.00 66.00 66.53 1otw h PRO 58 Cb 1.64 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.77 1otw h PRO 58 CO -0.63 0.90 0.20 -0.07 -0.21 0.00 0.00 178.00 178.19 1otw h LEU 59 N 0.36 0.42 -0.46 2.35 3.38 -0.84 -1.13 115.31 119.39 1otw h LEU 59 Ca 0.01 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.75 1otw h LEU 59 Cb 1.08 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 1otw h LEU 59 CO 0.10 0.36 -0.49 0.50 0.09 0.00 0.00 178.44 179.00 1otw h LYS 60 N 0.45 0.72 -0.05 1.13 3.11 -1.02 0.13 116.57 121.04 1otw h LYS 60 Ca 0.12 -0.42 -0.20 0.00 -2.81 0.00 0.00 60.65 57.34 1otw h LYS 60 Cb 0.02 0.04 -0.00 0.00 -1.00 0.00 0.00 32.23 31.28 1otw h LYS 60 CO -0.02 1.04 -0.81 -0.44 -2.81 0.00 0.00 179.45 176.41 1otw h ASP 61 N 0.57 0.49 -0.49 4.20 3.45 -1.20 -0.98 116.42 122.46 1otw h ASP 61 Ca 0.03 -0.35 0.04 0.00 0.43 0.00 0.00 57.03 57.18 1otw h ASP 61 Cb 1.05 -0.15 -0.04 0.00 -0.56 0.00 0.00 39.33 39.63 1otw h ASP 61 CO 0.10 1.12 0.24 0.00 -1.57 0.00 0.00 179.24 179.13 1otw h ALA 62 N 0.86 0.62 -0.69 3.45 0.00 -0.73 -2.01 119.26 120.76 1otw h ALA 62 Ca -0.05 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1otw h ALA 62 Cb 1.41 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 1otw h ALA 62 CO 0.14 -0.12 0.33 0.00 0.00 0.00 0.00 179.25 179.60 1otw h ALA 63 N 1.27 0.88 -0.57 0.00 0.00 -0.58 -0.44 119.26 119.82 1otw h ALA 63 Ca 0.22 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1otw h ALA 63 Cb 0.14 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1otw h ALA 63 CO -0.16 0.45 0.32 0.82 0.00 0.00 0.00 179.25 180.68 1otw h ILE 64 N 0.95 1.02 0.00 0.00 2.04 -1.04 -2.58 117.51 117.90 1otw h ILE 64 Ca 0.24 -0.22 -0.06 0.00 1.00 0.00 0.00 64.86 65.82 1otw h ILE 64 Cb 0.12 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1otw h ILE 64 CO -0.03 0.12 -0.27 0.24 0.00 0.00 0.00 178.15 178.21 1otw h MET 65 N 0.63 0.00 0.00 2.37 2.86 -0.56 -0.69 114.93 119.54 1otw h MET 65 Ca 0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 1otw h MET 65 Cb 0.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.74 1otw h MET 65 CO -0.13 0.27 0.00 0.00 1.06 0.00 0.00 176.91 178.11 1otw h ALA 66 N 1.73 1.00 -0.02 6.32 0.00 -0.72 -2.87 119.26 124.70 1otw h ALA 66 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1otw h ALA 66 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1otw h ALA 66 CO 0.03 0.00 -0.09 0.09 0.00 0.00 0.00 179.25 179.29 1otw n ASN 67 N -2.72 2.45 -4.03 0.00 3.02 -0.33 -4.90 115.26 108.75 1otw n ASN 67 Ca 0.03 -1.73 -0.32 0.00 -0.03 0.00 0.00 54.58 52.54 1otw n ASN 67 Cb 0.39 0.10 -0.15 0.00 -0.61 0.00 0.00 39.78 39.51 1otw n ASN 67 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1otw n PRO 69 N 4.45 0.43 -2.20 0.00 -0.04 -1.26 -4.73 135.00 131.65 1otw n PRO 69 Ca -0.11 -0.16 -0.38 0.00 -0.04 0.00 0.00 63.50 62.82 1otw n PRO 69 Cb 0.42 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 1otw n PRO 69 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1otw s ASP 70 N -2.68 5.54 0.34 3.54 -1.08 -1.26 -4.88 116.67 116.20 1otw s ASP 70 Ca 0.22 -0.06 0.14 0.00 -0.52 0.00 0.00 52.55 52.33 1otw s ASP 70 Cb 0.19 -2.54 1.09 0.00 -1.46 0.00 0.00 42.92 40.20 1otw s ASP 70 CO 0.53 -2.24 1.64 0.00 0.52 0.00 0.00 175.17 175.62 1otw h ALA 71 N 13.07 1.90 -0.44 3.66 0.00 -2.00 -1.85 119.26 133.60 1otw h ALA 71 Ca -0.20 0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1otw h ALA 71 Cb 1.11 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1otw h ALA 71 CO 1.24 -0.63 -0.12 0.37 0.00 0.00 0.00 179.25 180.11 1otw h GLN 72 N 0.25 0.85 -0.44 0.00 5.75 -1.98 -1.93 115.11 117.60 1otw h GLN 72 Ca 0.73 -0.33 -0.07 0.00 -0.15 0.00 0.00 58.65 58.83 1otw h GLN 72 Cb 1.71 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 30.19 1otw h GLN 72 CO -0.65 0.97 -0.01 1.15 -2.65 0.00 0.00 178.83 177.64 1otw h THR 73 N 0.68 1.23 -0.13 2.39 2.02 -1.76 -2.39 112.91 114.96 1otw h THR 73 Ca 0.11 -0.96 -0.07 0.00 0.77 0.00 0.00 66.41 66.26 1otw h THR 73 Cb 0.66 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1otw h THR 73 CO 0.05 0.34 -0.23 0.03 0.37 0.00 0.00 175.52 176.08 1otw h ARG 74 N 0.68 0.22 -0.60 6.66 3.08 -1.27 -0.99 114.38 122.16 1otw h ARG 74 Ca 0.13 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.04 1otw h ARG 74 Cb 0.43 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1otw h ARG 74 CO 0.02 0.44 0.06 0.00 -1.07 0.00 0.00 179.97 179.42 1otw h ARG 75 N 0.20 1.00 0.15 0.04 3.08 -0.82 -2.28 114.38 115.76 1otw h ARG 75 Ca 0.04 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 1otw h ARG 75 Cb 0.52 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1otw h ARG 75 CO 0.04 0.95 -0.07 0.87 -1.07 0.00 0.00 179.97 180.68 1otw h LYS 76 N 0.93 -0.20 0.00 0.04 1.57 -1.44 -3.38 116.57 114.10 1otw h LYS 76 Ca 0.18 0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.92 1otw h LYS 76 Cb 0.46 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 1otw h LYS 76 CO 0.02 0.21 -0.27 2.35 -0.57 0.00 0.00 179.45 181.19 1otw h TRP 77 N -0.68 0.00 0.00 -1.35 2.91 -1.02 0.20 115.95 116.00 1otw h TRP 77 Ca -0.02 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.00 1otw h TRP 77 Cb 0.50 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.15 1otw h TRP 77 CO 0.07 0.27 0.00 1.55 -1.03 0.00 0.00 178.44 179.30 1otw n VAL 78 N -4.01 1.08 0.20 2.65 3.14 -0.87 -2.03 118.33 118.49 1otw n VAL 78 Ca -0.02 0.27 0.08 0.00 -2.96 0.00 0.00 64.34 61.71 1otw n VAL 78 Cb 0.34 -1.06 0.27 0.00 -1.06 0.00 0.00 33.84 32.33 1otw n VAL 78 CO 0.00 0.00 0.00 -0.61 -6.46 0.00 0.00 176.83 169.76 1otw h GLN 79 N 0.00 0.00 0.00 1.45 5.75 -1.16 -1.22 115.11 119.92 1otw h GLN 79 Ca 0.00 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.45 1otw h GLN 79 Cb 0.19 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.73 1otw h GLN 79 CO 0.00 0.28 -0.25 0.00 -2.65 0.00 0.00 178.83 176.20 1otw h ARG 80 N 0.00 0.00 0.11 1.69 3.08 -1.57 -0.66 114.38 117.03 1otw h ARG 80 Ca -0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.80 1otw h ARG 80 Cb 1.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.04 1otw h ARG 80 CO 0.04 0.25 -1.22 0.82 -1.07 0.00 0.00 179.97 178.79 1otw h ILE 81 N 0.00 1.15 -0.74 2.04 2.04 -1.51 -3.03 117.51 117.45 1otw h ILE 81 Ca -0.00 -2.41 0.13 0.00 1.00 0.00 0.00 64.86 63.58 1otw h ILE 81 Cb 0.45 2.80 -0.09 0.00 -0.74 0.00 0.00 36.82 39.24 1otw h ILE 81 CO 0.03 0.67 0.30 -0.07 0.00 0.00 0.00 178.15 179.09 1otw h LEU 82 N -0.40 0.29 -0.13 1.44 3.38 -1.12 -0.68 115.31 118.09 1otw h LEU 82 Ca -0.26 0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.86 1otw h LEU 82 Cb 1.67 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 42.44 1otw h LEU 82 CO 0.05 0.12 -0.24 0.44 0.09 0.00 0.00 178.44 178.90 1otw h ASP 83 N 0.46 -0.76 0.26 -0.43 3.32 -1.16 0.41 116.42 118.52 1otw h ASP 83 Ca 0.40 0.12 -0.34 0.00 0.02 0.00 0.00 57.03 57.23 1otw h ASP 83 Cb 0.59 0.33 0.02 0.00 0.22 0.00 0.00 39.33 40.49 1otw h ASP 83 CO -0.39 -0.30 -1.63 0.45 -1.72 0.00 0.00 179.24 175.66 1otw h HIS 84 N -0.31 0.77 0.00 4.55 3.86 -1.35 -2.05 115.15 120.61 1otw h HIS 84 Ca 0.10 -0.56 -0.06 0.00 -1.16 0.00 0.00 60.37 58.69 1otw h HIS 84 Cb 0.46 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.89 1otw h HIS 84 CO -0.34 1.60 -0.28 -0.44 0.86 0.00 0.00 177.93 179.32 1otw h ASP 85 N 0.12 0.00 -3.99 2.45 3.32 -1.16 -2.55 116.42 114.61 1otw h ASP 85 Ca -0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1otw h ASP 85 Cb 2.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.66 1otw h ASP 85 CO 0.21 0.28 -0.47 0.61 -1.72 0.00 0.00 179.24 178.15 1otw n GLY 86 N 0.78 -3.65 0.37 2.75 0.00 0.14 -4.53 105.19 101.05 1otw n GLY 86 Ca 0.02 -1.00 0.01 0.00 0.00 0.00 0.00 46.02 45.05 1otw n GLY 86 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1otw h SER 87 N 0.50 1.03 0.00 1.61 0.87 -1.85 -3.44 113.55 112.27 1otw h SER 87 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1otw h SER 87 Cb 0.21 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1otw h SER 87 CO 0.00 0.71 0.00 1.41 -0.53 0.00 0.00 176.83 178.42 1otw n HIS 88 N -4.43 0.00 0.00 2.24 8.25 -1.26 -5.07 115.22 114.94 1otw n HIS 88 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 1otw n HIS 88 Cb 0.09 0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.21 1otw n HIS 88 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1otw n GLY 89 N 0.00 3.74 0.00 -1.41 0.00 -1.26 -4.89 105.19 101.37 1otw n GLY 89 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1otw n GLY 89 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1otw n GLU 90 N 0.00 2.91 -2.30 1.61 -0.00 -1.26 -5.07 120.64 116.53 1otw n GLU 90 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.16 56.91 1otw n GLU 90 Cb 0.00 -0.70 0.06 0.00 -0.00 0.00 0.00 31.44 30.80 1otw n GLU 90 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.13 177.29 1otw s ASP 91 N -1.28 4.96 0.00 -1.84 -4.77 -1.26 -4.83 116.67 107.65 1otw s ASP 91 Ca 0.00 0.39 0.00 0.00 -3.30 0.00 0.00 52.55 49.64 1otw s ASP 91 Cb 0.00 -1.11 0.00 0.00 -1.09 0.00 0.00 42.92 40.72 1otw s ASP 91 CO 0.00 -1.47 0.00 0.61 0.70 0.00 0.00 175.17 175.01 1otw n GLY 92 N -2.79 4.54 0.16 2.12 0.00 -1.26 -4.23 105.19 103.73 1otw n GLY 92 Ca 0.08 -1.31 0.13 0.00 0.00 0.00 0.00 46.02 44.92 1otw n GLY 92 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1otw h GLY 93 N 0.00 0.00 0.22 -0.02 0.00 -0.97 -2.51 103.07 99.79 1otw h GLY 93 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.96 1otw h GLY 93 CO 0.00 0.00 -2.10 1.39 0.00 0.00 0.00 176.54 175.83 1otw n ILE 94 N -2.43 1.61 -0.01 2.60 5.41 -1.02 -2.09 119.36 123.43 1otw n ILE 94 Ca 0.03 -0.48 -0.09 0.00 1.00 0.00 0.00 62.75 63.21 1otw n ILE 94 Cb 0.30 -1.72 -0.03 0.00 -0.71 0.00 0.00 39.64 37.47 1otw n ILE 94 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1otw h GLU 95 N -0.31 -0.07 0.00 0.38 4.39 -1.80 -0.39 114.58 116.78 1otw h GLU 95 Ca -0.50 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.19 1otw h GLU 95 Cb 1.80 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 30.46 1otw h GLU 95 CO -0.10 -0.05 -0.04 0.00 -1.16 0.00 0.00 179.01 177.66 1otw h ALA 96 N 1.05 1.74 0.02 3.43 0.00 -1.53 0.33 119.26 124.29 1otw h ALA 96 Ca 0.08 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1otw h ALA 96 Cb 0.19 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1otw h ALA 96 CO -0.19 0.05 -0.39 2.35 0.00 0.00 0.00 179.25 181.08 1otw h TRP 97 N 0.00 0.36 -1.05 0.00 2.91 -1.14 -1.47 115.95 115.55 1otw h TRP 97 Ca -0.00 -0.21 0.29 0.00 1.13 0.00 0.00 58.89 60.10 1otw h TRP 97 Cb 0.08 -0.04 -0.06 0.00 -0.51 0.00 0.00 29.16 28.63 1otw h TRP 97 CO 0.00 1.04 0.72 -0.07 -1.03 0.00 0.00 178.44 179.10 1otw h LEU 98 N -0.43 0.21 -0.19 0.65 3.38 0.74 1.01 115.31 120.67 1otw h LEU 98 Ca -0.05 0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 1otw h LEU 98 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1otw h LEU 98 CO 0.08 0.05 -0.45 0.03 0.09 0.00 0.00 178.44 178.24 1otw h ARG 99 N 0.19 0.63 0.00 1.13 3.08 -0.29 -2.40 114.38 116.71 1otw h ARG 99 Ca 0.54 -0.43 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 1otw h ARG 99 Cb 1.77 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.88 1otw h ARG 99 CO -0.13 1.05 -0.05 1.25 -1.07 0.00 0.00 179.97 181.01 1otw h LEU 100 N 0.31 0.00 0.43 3.04 5.85 0.20 -1.32 115.31 123.81 1otw h LEU 100 Ca -0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1otw h LEU 100 Cb 1.06 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.09 1otw h LEU 100 CO 0.10 0.05 -0.21 1.23 -0.34 0.00 0.00 178.44 179.27 1otw h GLY 101 N 0.79 -0.61 -0.96 3.75 0.00 -0.45 -3.14 103.07 102.45 1otw h GLY 101 Ca -0.00 0.22 0.20 0.00 0.00 0.00 0.00 47.33 47.76 1otw h GLY 101 CO 0.01 -0.22 -0.22 0.83 0.00 0.00 0.00 176.54 176.94 1otw h GLU 102 N -1.04 0.00 0.00 4.80 5.08 -0.94 -0.77 114.58 121.71 1otw h GLU 102 Ca -0.06 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1otw h GLU 102 Cb 0.54 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1otw h GLU 102 CO 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.11 1otw n ALA 103 N -3.56 1.75 -0.86 3.43 0.00 -0.54 -0.67 120.51 120.07 1otw n ALA 103 Ca 0.16 -0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.62 1otw n ALA 103 Cb 0.52 -1.24 0.19 0.00 0.00 0.00 0.00 19.45 18.92 1otw n ALA 103 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1otw n VAL 104 N -1.42 1.93 -1.93 0.00 0.24 -0.37 -1.22 118.33 115.56 1otw n VAL 104 Ca 0.05 -1.85 -0.00 0.00 -2.04 0.00 0.00 64.34 60.50 1otw n VAL 104 Cb 0.15 -0.12 -0.00 0.00 -1.47 0.00 0.00 33.84 32.41 1otw n VAL 104 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1otw n GLY 105 N -0.69 0.37 3.55 7.63 0.00 0.16 -4.88 105.19 111.32 1otw n GLY 105 Ca 0.17 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 1otw n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1otw s LEU 106 N -0.04 2.96 0.00 0.99 1.43 -0.73 -4.99 118.68 118.30 1otw s LEU 106 Ca 0.00 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 1otw s LEU 106 Cb 0.00 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 44.46 1otw s LEU 106 CO 0.00 0.20 0.00 -1.54 0.23 0.00 0.00 176.35 175.24 1otw n SER 107 N 0.96 -0.55 0.06 2.29 3.41 -1.26 -2.19 113.62 116.34 1otw n SER 107 Ca -0.14 -0.71 -0.18 0.00 -0.26 0.00 0.00 58.87 57.58 1otw n SER 107 Cb 0.52 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.33 1otw n SER 107 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1otw h ARG 108 N 0.00 0.28 -0.37 4.33 3.08 -1.97 -3.37 114.38 116.36 1otw h ARG 108 Ca 0.00 -0.47 -0.10 0.00 0.07 0.00 0.00 59.98 59.47 1otw h ARG 108 Cb 0.00 0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1otw h ARG 108 CO 0.00 1.14 -0.20 0.22 -1.07 0.00 0.00 179.97 180.06 1otw h ASP 109 N 0.08 0.71 -0.78 7.04 3.58 -1.97 0.16 116.42 125.24 1otw h ASP 109 Ca -0.29 -0.24 0.18 0.00 0.42 0.00 0.00 57.03 57.10 1otw h ASP 109 Cb 2.04 -0.19 -0.12 0.00 1.72 0.00 0.00 39.33 42.78 1otw h ASP 109 CO 0.15 0.91 0.19 0.44 -2.88 0.00 0.00 179.24 178.05 1otw h ASP 110 N 0.63 0.00 0.13 2.28 3.32 -1.94 -1.59 116.42 119.24 1otw h ASP 110 Ca 0.09 0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 1otw h ASP 110 Cb 0.68 0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.45 1otw h ASP 110 CO 0.05 -0.07 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.37 1otw h LEU 111 N 0.25 -0.15 -2.32 1.55 4.07 -1.55 -3.36 115.31 113.81 1otw h LEU 111 Ca 0.45 -0.12 0.04 0.00 0.08 0.00 0.00 57.88 58.33 1otw h LEU 111 Cb 0.81 0.04 -0.00 0.00 1.08 0.00 0.00 40.66 42.59 1otw h LEU 111 CO -0.56 0.39 0.19 -0.07 -1.08 0.00 0.00 178.44 177.31 1otw h LEU 112 N -1.02 0.00 -0.23 1.67 3.38 -0.64 0.12 115.31 118.58 1otw h LEU 112 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1otw h LEU 112 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1otw h LEU 112 CO 0.03 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.33 1otw h SER 113 N 0.00 0.00 -1.40 -0.43 4.64 -1.44 -3.47 113.55 111.45 1otw h SER 113 Ca 0.06 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.14 1otw h SER 113 Cb 0.43 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.42 1otw h SER 113 CO -0.00 0.00 -0.22 -0.62 -0.87 0.00 0.00 176.83 175.12 1otw n GLU 114 N -2.55 -1.28 0.19 4.77 1.02 0.40 -4.84 120.64 118.36 1otw n GLU 114 Ca 0.04 0.70 0.03 0.00 -0.02 0.00 0.00 57.16 57.91 1otw n GLU 114 Cb 0.42 -4.91 0.39 0.00 -0.02 0.00 0.00 31.44 27.31 1otw n GLU 114 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1otw h ARG 115 N 0.00 0.00 -0.01 3.49 2.47 -1.82 -2.82 114.38 115.69 1otw h ARG 115 Ca -0.24 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.48 1otw h ARG 115 Cb 0.78 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.10 1otw h ARG 115 CO 0.35 0.34 -0.12 0.72 0.56 0.00 0.00 179.97 181.82 1otw n HIS 116 N -4.12 0.00 -2.14 3.04 8.25 -1.26 -4.87 115.22 114.11 1otw n HIS 116 Ca -0.02 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.01 1otw n HIS 116 Cb 0.38 -0.06 -0.02 0.00 1.12 0.00 0.00 29.99 31.40 1otw n HIS 116 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1otw s VAL 117 N -2.24 3.74 0.31 1.59 1.01 -1.07 -4.70 120.40 119.05 1otw s VAL 117 Ca 0.32 0.85 -0.28 0.00 0.00 0.00 0.00 61.98 62.86 1otw s VAL 117 Cb 0.20 -3.74 -0.09 0.00 0.00 0.00 0.00 36.38 32.75 1otw s VAL 117 CO 0.42 -0.28 1.08 -0.76 0.00 0.00 0.00 175.10 175.56 1otw s LEU 118 N 4.99 4.46 0.21 3.92 1.43 -1.26 -4.85 118.68 127.57 1otw s LEU 118 Ca 0.70 2.20 -0.09 0.00 -1.03 0.00 0.00 54.13 55.91 1otw s LEU 118 Cb -0.25 -3.76 0.27 0.00 0.03 0.00 0.00 46.19 42.48 1otw s LEU 118 CO 0.28 -0.22 1.78 1.55 0.23 0.00 0.00 176.35 179.97 1otw h PRO 119 N 3.51 0.56 -0.83 1.29 0.13 -1.93 0.68 132.00 135.40 1otw h PRO 119 Ca -0.47 -0.03 0.13 0.00 -0.87 0.00 0.00 66.00 64.76 1otw h PRO 119 Cb 1.21 -0.13 -0.06 0.00 0.13 0.00 0.00 31.00 32.16 1otw h PRO 119 CO 0.66 0.37 0.54 0.78 -0.23 0.00 0.00 178.00 180.12 1otw h GLY 120 N 0.57 1.06 0.89 1.56 0.00 -1.94 0.31 103.07 105.52 1otw h GLY 120 Ca 0.31 -0.28 -0.17 0.00 0.00 0.00 0.00 47.33 47.19 1otw h GLY 120 CO -0.23 0.11 -0.61 -2.08 0.00 0.00 0.00 176.54 173.73 1otw h VAL 121 N 0.65 1.38 -0.71 4.60 2.07 -0.99 -2.85 116.25 120.40 1otw h VAL 121 Ca 0.41 -1.98 -0.03 0.00 0.82 0.00 0.00 66.70 65.91 1otw h VAL 121 Cb 0.65 2.37 -0.03 0.00 -1.52 0.00 0.00 31.29 32.76 1otw h VAL 121 CO -0.17 0.59 0.32 -0.09 0.02 0.00 0.00 177.57 178.24 1otw h ARG 122 N 0.07 1.03 -0.15 1.57 2.43 0.18 -1.78 114.38 117.74 1otw h ARG 122 Ca -0.06 -0.15 -0.12 0.00 -0.81 0.00 0.00 59.98 58.83 1otw h ARG 122 Cb 1.29 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 1otw h ARG 122 CO 0.12 0.81 -0.39 0.74 -1.51 0.00 0.00 179.97 179.74 1otw h PHE 123 N 1.02 0.68 -0.64 2.20 0.05 -0.52 -1.26 116.94 118.47 1otw h PHE 123 Ca 0.24 -0.26 0.12 0.00 3.82 0.00 0.00 57.97 61.89 1otw h PHE 123 Cb 0.14 -0.12 -0.09 0.00 2.00 0.00 0.00 35.95 37.88 1otw h PHE 123 CO 0.01 1.01 0.13 0.00 -0.18 0.00 0.00 178.31 179.29 1otw h ALA 124 N 0.54 0.76 0.01 2.45 0.00 -1.32 -2.41 119.26 119.30 1otw h ALA 124 Ca -0.01 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1otw h ALA 124 Cb 1.01 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1otw h ALA 124 CO 0.08 -0.31 -0.00 0.28 0.00 0.00 0.00 179.25 179.30 1otw h VAL 125 N 0.26 1.56 -0.76 0.00 2.07 -1.22 -2.97 116.25 115.20 1otw h VAL 125 Ca 0.34 -1.79 0.22 0.00 0.82 0.00 0.00 66.70 66.29 1otw h VAL 125 Cb 0.52 2.76 -0.03 0.00 -1.52 0.00 0.00 31.29 33.02 1otw h VAL 125 CO -0.43 0.46 0.63 0.44 0.02 0.00 0.00 177.57 178.68 1otw h ASP 126 N -0.79 0.00 0.92 0.57 3.32 -1.26 0.18 116.42 119.36 1otw h ASP 126 Ca -0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 1otw h ASP 126 Cb 0.76 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 1otw h ASP 126 CO 0.00 0.00 -0.56 0.00 -1.72 0.00 0.00 179.24 176.96 1otw h ALA 127 N 1.46 0.83 0.31 3.45 0.00 -1.27 0.30 119.26 124.34 1otw h ALA 127 Ca 0.36 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1otw h ALA 127 Cb 1.61 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1otw h ALA 127 CO -0.00 0.70 -0.15 -0.92 0.00 0.00 0.00 179.25 178.88 1otw h TYR 128 N 0.00 -0.38 -0.11 0.00 3.20 -0.60 -1.50 116.97 117.58 1otw h TYR 128 Ca -0.01 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.89 1otw h TYR 128 Cb 1.17 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 39.54 1otw h TYR 128 CO 0.00 -0.15 -0.09 1.25 -1.64 0.00 0.00 178.16 177.53 1otw h LEU 129 N -0.54 -0.29 -1.23 2.82 5.85 -1.15 -1.49 115.31 119.28 1otw h LEU 129 Ca -0.04 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1otw h LEU 129 Cb 0.40 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1otw h LEU 129 CO 0.07 -0.12 0.20 0.78 -0.34 0.00 0.00 178.44 179.03 1otw h ASN 130 N -0.11 0.67 -0.13 1.25 2.35 -0.41 0.30 115.58 119.50 1otw h ASN 130 Ca 0.07 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1otw h ASN 130 Cb 0.21 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1otw h ASN 130 CO -0.17 0.60 0.09 0.15 -1.65 0.00 0.00 177.43 176.45 1otw h PHE 131 N 0.73 0.17 -0.52 1.19 3.57 -0.98 -2.65 116.94 118.45 1otw h PHE 131 Ca 0.18 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.69 1otw h PHE 131 Cb 0.15 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 1otw h PHE 131 CO 0.01 0.11 0.34 0.00 -2.23 0.00 0.00 178.31 176.54 1otw h ALA 132 N 1.05 1.64 -0.20 2.41 0.00 -0.02 -0.80 119.26 123.33 1otw h ALA 132 Ca 0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1otw h ALA 132 Cb -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1otw h ALA 132 CO -0.01 0.34 -0.06 0.00 0.00 0.00 0.00 179.25 179.52 1otw h ARG 133 N 0.70 0.40 0.09 0.00 3.08 -0.77 -3.38 114.38 114.50 1otw h ARG 133 Ca 0.19 -0.16 -0.32 0.00 0.07 0.00 0.00 59.98 59.76 1otw h ARG 133 Cb -0.07 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 1otw h ARG 133 CO -0.04 0.66 -1.71 0.00 -1.07 0.00 0.00 179.97 177.81 1otw h ARG 134 N 0.11 0.19 -7.31 0.04 3.08 -1.13 -3.49 114.38 105.87 1otw h ARG 134 Ca 0.05 -0.33 -0.51 0.00 0.07 0.00 0.00 59.98 59.26 1otw h ARG 134 Cb 0.52 0.12 0.12 0.00 0.08 0.00 0.00 29.97 30.81 1otw h ARG 134 CO 0.02 0.99 0.33 0.00 -1.07 0.00 0.00 179.97 180.24 1otw s ALA 135 N -2.60 2.36 0.47 0.04 0.00 -0.34 -4.99 121.76 116.70 1otw s ALA 135 Ca -0.12 0.24 -0.24 0.00 0.00 0.00 0.00 51.96 51.84 1otw s ALA 135 Cb 0.07 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 19.87 1otw s ALA 135 CO 0.82 -1.62 1.34 0.00 0.00 0.00 0.00 175.76 176.30 1otw h TRP 137 N 2.14 0.03 0.07 0.00 5.08 -1.88 -1.99 115.95 119.39 1otw h TRP 137 Ca -0.50 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.46 1otw h TRP 137 Cb 1.27 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 27.42 1otw h TRP 137 CO 0.50 0.01 -0.03 1.96 -1.28 0.00 0.00 178.44 179.60 1otw h GLN 138 N 0.02 -0.09 -0.27 0.12 7.50 -1.94 0.13 115.11 120.59 1otw h GLN 138 Ca 0.18 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.34 1otw h GLN 138 Cb 0.69 0.02 -0.01 0.00 0.05 0.00 0.00 27.48 28.22 1otw h GLN 138 CO -0.01 0.12 0.17 0.93 -1.50 0.00 0.00 178.83 178.54 1otw h GLU 139 N -0.28 0.36 -0.57 1.46 5.08 -1.75 0.23 114.58 119.12 1otw h GLU 139 Ca -0.01 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1otw h GLU 139 Cb 0.24 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 1otw h GLU 139 CO 0.01 0.26 0.23 0.00 -1.00 0.00 0.00 179.01 178.51 1otw h ALA 140 N 1.08 1.33 -0.23 3.43 0.00 -1.44 -2.39 119.26 121.05 1otw h ALA 140 Ca 0.10 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1otw h ALA 140 Cb -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1otw h ALA 140 CO -0.02 0.50 -0.10 0.00 0.00 0.00 0.00 179.25 179.63 1otw h ALA 141 N 1.44 0.32 0.00 0.00 0.00 0.27 -2.90 119.26 118.38 1otw h ALA 141 Ca 0.19 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1otw h ALA 141 Cb 0.16 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1otw h ALA 141 CO -0.02 0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.39 1otw h SER 143 N 0.00 0.00 0.00 0.00 4.64 -1.21 -2.15 113.55 114.82 1otw h SER 143 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1otw h SER 143 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1otw h SER 143 CO 0.00 0.07 0.27 0.77 -0.87 0.00 0.00 176.83 177.07 1otw h SER 144 N 0.00 0.00 0.00 4.97 4.64 -1.55 -3.34 113.55 118.27 1otw h SER 144 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1otw h SER 144 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1otw h SER 144 CO 0.01 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.15 1otw n LEU 145 N -2.51 0.00 0.00 5.97 4.77 -0.81 -1.42 117.00 123.00 1otw n LEU 145 Ca -0.02 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.08 1otw n LEU 145 Cb 0.30 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 42.10 1otw n LEU 145 CO 0.10 0.00 0.94 0.35 -1.33 0.00 0.00 177.39 177.45 1otw n THR 146 N -0.51 0.00 0.26 -5.08 -2.24 -1.26 -2.59 114.28 102.87 1otw n THR 146 Ca 0.00 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.93 1otw n THR 146 Cb 0.00 -0.42 0.63 0.00 -2.10 0.00 0.00 70.33 68.45 1otw n THR 146 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1otw h GLU 147 N 0.00 0.00 -0.41 -0.78 5.08 -1.58 -2.99 114.58 113.90 1otw h GLU 147 Ca 0.00 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1otw h GLU 147 Cb 0.00 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.16 1otw h GLU 147 CO 0.00 0.09 -0.45 -0.07 -1.00 0.00 0.00 179.01 177.58 1otw h LEU 148 N 0.00 -1.49 -0.09 1.33 3.38 -1.76 -2.71 115.31 113.97 1otw h LEU 148 Ca -0.00 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1otw h LEU 148 Cb 0.55 0.64 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1otw h LEU 148 CO 0.01 -0.37 -0.05 0.49 0.09 0.00 0.00 178.44 178.61 1otw n PHE 149 N -5.41 0.00 -0.07 1.13 3.01 -1.14 -4.24 117.46 110.74 1otw n PHE 149 Ca -0.01 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.31 1otw n PHE 149 Cb 0.35 -0.23 -0.06 0.00 -0.01 0.00 0.00 39.48 39.53 1otw n PHE 149 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1otw h ALA 150 N 3.52 0.36 -0.57 4.37 0.00 -1.45 -3.26 119.26 122.23 1otw h ALA 150 Ca 0.00 -0.46 0.09 0.00 0.00 0.00 0.00 54.91 54.54 1otw h ALA 150 Cb 0.30 -0.06 -0.11 0.00 0.00 0.00 0.00 17.79 17.92 1otw h ALA 150 CO 0.00 0.47 -0.40 -1.35 0.00 0.00 0.00 179.25 177.97 1otw h PRO 151 N 0.39 -0.21 -0.89 0.00 0.11 -1.74 -0.52 132.00 129.15 1otw h PRO 151 Ca 0.01 0.01 0.16 0.00 0.11 0.00 0.00 66.00 66.30 1otw h PRO 151 Cb 1.01 0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.10 1otw h PRO 151 CO 0.09 -0.14 0.57 0.37 -0.21 0.00 0.00 178.00 178.69 1otw h GLN 152 N -0.21 0.59 0.00 1.05 4.15 -1.86 0.43 115.11 119.25 1otw h GLN 152 Ca 0.19 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.50 1otw h GLN 152 Cb 0.56 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 1otw h GLN 152 CO -0.68 0.39 -0.58 0.97 -1.93 0.00 0.00 178.83 177.00 1otw h ILE 153 N 0.61 0.51 -0.06 2.39 2.10 -1.39 -1.78 117.51 119.88 1otw h ILE 153 Ca 0.45 -1.76 -0.17 0.00 1.08 0.00 0.00 64.86 64.46 1otw h ILE 153 Cb 0.84 2.16 0.01 0.00 -1.09 0.00 0.00 36.82 38.74 1otw h ILE 153 CO -0.20 0.29 -0.64 0.45 -1.08 0.00 0.00 178.15 176.97 1otw h HIS 154 N 0.00 0.76 -0.50 2.19 3.86 0.59 -3.12 115.15 118.92 1otw h HIS 154 Ca -0.03 -0.37 0.02 0.00 -1.16 0.00 0.00 60.37 58.84 1otw h HIS 154 Cb 1.28 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 29.62 1otw h HIS 154 CO 0.00 1.18 0.30 1.96 0.86 0.00 0.00 177.93 182.22 1otw h GLN 155 N 0.13 0.57 -1.17 2.45 1.08 -1.18 -2.63 115.11 114.36 1otw h GLN 155 Ca -0.06 -0.03 0.33 0.00 -1.45 0.00 0.00 58.65 57.44 1otw h GLN 155 Cb 1.31 -0.13 -0.07 0.00 -0.05 0.00 0.00 27.48 28.54 1otw h GLN 155 CO 0.13 0.38 0.81 1.03 -0.95 0.00 0.00 178.83 180.23 1otw h SER 156 N 0.59 0.16 0.41 1.46 0.87 -1.26 0.11 113.55 115.88 1otw h SER 156 Ca 0.20 0.04 -0.31 0.00 -1.23 0.00 0.00 61.79 60.49 1otw h SER 156 Cb 0.03 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 61.97 1otw h SER 156 CO -0.10 0.01 -1.70 0.03 -0.53 0.00 0.00 176.83 174.55 1otw h ARG 157 N 0.13 0.15 -0.28 2.24 3.08 -1.43 -3.28 114.38 114.98 1otw h ARG 157 Ca 0.60 -0.25 -0.05 0.00 0.07 0.00 0.00 59.98 60.35 1otw h ARG 157 Cb 2.09 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 32.22 1otw h ARG 157 CO -0.13 0.90 -0.05 -0.07 -1.07 0.00 0.00 179.97 179.56 1otw h LEU 158 N 0.04 0.42 0.47 3.04 3.38 -0.59 -2.50 115.31 119.57 1otw h LEU 158 Ca -0.30 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1otw h LEU 158 Cb 2.01 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.65 1otw h LEU 158 CO 0.11 0.53 -0.23 0.44 0.09 0.00 0.00 178.44 179.38 1otw h ASP 159 N 0.43 -0.54 0.00 -0.43 3.32 -1.35 -3.42 116.42 114.43 1otw h ASP 159 Ca 0.09 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1otw h ASP 159 Cb 0.36 0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1otw h ASP 159 CO 0.02 -0.27 -1.60 -1.54 -1.72 0.00 0.00 179.24 174.13 1otw n SER 160 N -5.30 1.18 -0.02 6.45 3.41 -1.18 -4.40 113.62 113.76 1otw n SER 160 Ca -0.11 -0.13 -0.18 0.00 -0.26 0.00 0.00 58.87 58.19 1otw n SER 160 Cb 0.30 1.64 -0.08 0.00 -0.26 0.00 0.00 64.21 65.81 1otw n SER 160 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1otw h TRP 161 N 0.00 1.05 -0.05 7.33 4.06 -1.69 -1.92 115.95 124.73 1otw h TRP 161 Ca 0.00 -0.48 0.02 0.00 2.06 0.00 0.00 58.89 60.49 1otw h TRP 161 Cb 0.69 -0.16 -0.05 0.00 -1.00 0.00 0.00 29.16 28.64 1otw h TRP 161 CO 0.00 1.31 -0.48 -1.35 -3.56 0.00 0.00 178.44 174.36 1otw h PRO 162 N 0.50 -0.54 0.86 0.49 0.11 -1.80 0.40 132.00 132.01 1otw h PRO 162 Ca -0.06 0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 1otw h PRO 162 Cb 1.43 0.12 0.01 0.00 0.11 0.00 0.00 31.00 32.67 1otw h PRO 162 CO 0.16 -0.36 -0.41 0.37 -0.21 0.00 0.00 178.00 177.55 1otw h GLN 163 N -0.56 -1.11 0.00 1.05 5.75 -1.77 -2.86 115.11 115.62 1otw h GLN 163 Ca 0.02 0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.59 1otw h GLN 163 Cb 0.62 0.25 0.00 0.00 1.07 0.00 0.00 27.48 29.43 1otw h GLN 163 CO -0.35 -0.74 0.00 0.72 -2.65 0.00 0.00 178.83 175.81 1otw n HIS 164 N -5.39 0.72 -3.08 3.99 8.25 -0.72 -4.09 115.22 114.89 1otw n HIS 164 Ca -0.14 0.21 -0.20 0.00 -0.26 0.00 0.00 57.72 57.33 1otw n HIS 164 Cb 0.45 -0.85 -0.03 0.00 1.12 0.00 0.00 29.99 30.69 1otw n HIS 164 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1otw n TYR 165 N -2.09 1.33 -0.05 4.41 4.02 0.14 -4.82 117.16 120.10 1otw n TYR 165 Ca 0.06 -3.80 0.24 0.00 -0.01 0.00 0.00 57.90 54.38 1otw n TYR 165 Cb 0.40 -0.43 0.59 0.00 -0.02 0.00 0.00 39.34 39.88 1otw n TYR 165 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1otw h PRO 166 N 2.99 0.00 -0.02 -0.72 0.11 -1.59 -2.35 132.00 130.42 1otw h PRO 166 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1otw h PRO 166 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1otw h PRO 166 CO 0.59 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.71 1otw n TRP 167 N -3.44 0.03 -2.84 0.65 4.27 -1.26 -4.72 117.44 110.12 1otw n TRP 167 Ca 0.15 -0.01 -0.43 0.00 -3.89 0.00 0.00 57.50 53.32 1otw n TRP 167 Cb 1.08 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.99 1otw n TRP 167 CO 0.00 0.00 0.00 0.42 -2.29 0.00 0.00 177.69 175.82 1otw s ILE 168 N -1.97 4.37 0.36 -1.67 -1.09 -0.88 -4.88 121.20 115.43 1otw s ILE 168 Ca 0.32 0.13 -0.14 0.00 -2.23 0.00 0.00 60.65 58.74 1otw s ILE 168 Cb 0.15 -4.57 -0.11 0.00 -1.58 0.00 0.00 42.46 36.35 1otw s ILE 168 CO 0.25 -1.19 -0.07 1.17 -1.23 0.00 0.00 174.94 173.86 1otw n LYS 169 N 7.53 0.00 -0.04 2.79 3.00 -0.36 -4.86 118.16 126.22 1otw n LYS 169 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 58.31 58.23 1otw n LYS 169 Cb 0.47 -0.74 -0.03 0.00 0.00 0.00 0.00 35.03 34.73 1otw n LYS 169 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1otw h GLU 170 N 0.03 0.09 -0.31 1.64 4.57 -1.94 -3.29 114.58 115.37 1otw h GLU 170 Ca -0.30 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 1otw h GLU 170 Cb 1.07 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 1otw h GLU 170 CO 0.32 0.06 0.00 -0.85 -1.18 0.00 0.00 179.01 177.36 1otw n GLU 171 N -5.10 1.33 -0.02 1.92 0.00 -1.26 -3.19 120.64 114.32 1otw n GLU 171 Ca -0.03 -0.41 -0.07 0.00 0.00 0.00 0.00 57.16 56.65 1otw n GLU 171 Cb 0.10 -1.21 -0.13 0.00 0.00 0.00 0.00 31.44 30.19 1otw n GLU 171 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1otw n GLY 172 N 0.53 -1.03 0.33 -1.84 0.00 -1.24 -4.15 105.19 97.79 1otw n GLY 172 Ca 0.04 -0.06 0.20 0.00 0.00 0.00 0.00 46.02 46.20 1otw n GLY 172 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1otw h TYR 173 N 0.00 0.00 -0.24 1.61 -1.99 -1.79 -3.21 116.97 111.34 1otw h TYR 173 Ca -0.28 0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.47 1otw h TYR 173 Cb 1.96 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 40.66 1otw h TYR 173 CO 0.00 0.00 -0.14 0.34 -0.00 0.00 0.00 178.16 178.36 1otw n PHE 174 N -3.28 -0.11 -0.23 4.88 7.35 -1.26 -1.89 117.46 122.93 1otw n PHE 174 Ca -0.03 0.31 -0.11 0.00 -0.76 0.00 0.00 57.45 56.86 1otw n PHE 174 Cb 0.12 -0.49 -0.07 0.00 0.35 0.00 0.00 39.48 39.39 1otw n PHE 174 CO 0.00 0.00 0.00 -0.92 -0.76 0.00 0.00 176.76 175.08 1otw h TYR 175 N 0.00 -1.56 -0.99 -5.13 3.20 -1.80 1.63 116.97 112.32 1otw h TYR 175 Ca 0.04 0.09 0.21 0.00 3.14 0.00 0.00 58.73 62.22 1otw h TYR 175 Cb 0.10 0.77 -0.10 0.00 1.54 0.00 0.00 36.73 39.04 1otw h TYR 175 CO -0.88 -0.44 0.62 0.74 -1.64 0.00 0.00 178.16 176.56 1otw h PHE 176 N -0.24 0.89 0.58 -3.82 0.05 -1.74 0.22 116.94 112.89 1otw h PHE 176 Ca 0.14 0.03 -0.03 0.00 3.82 0.00 0.00 57.97 61.93 1otw h PHE 176 Cb 0.55 -0.27 0.01 0.00 2.00 0.00 0.00 35.95 38.24 1otw h PHE 176 CO -0.79 0.17 -0.28 -0.09 -0.18 0.00 0.00 178.31 177.14 1otw h ARG 177 N 0.61 -0.76 -1.09 1.51 2.43 0.26 -3.13 114.38 114.21 1otw h ARG 177 Ca 0.57 0.05 0.40 0.00 -0.81 0.00 0.00 59.98 60.19 1otw h ARG 177 Cb 1.10 0.17 -0.16 0.00 -0.42 0.00 0.00 29.97 30.66 1otw h ARG 177 CO -0.34 -0.46 0.63 0.66 -1.51 0.00 0.00 179.97 178.96 1otw h SER 178 N -1.12 0.35 1.43 -3.80 4.64 0.26 0.18 113.55 115.50 1otw h SER 178 Ca -0.08 0.21 -0.03 0.00 -0.47 0.00 0.00 61.79 61.41 1otw h SER 178 Cb 0.65 0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1otw h SER 178 CO 0.13 -0.29 -0.16 0.03 -0.87 0.00 0.00 176.83 175.67 1otw h ARG 179 N 0.11 0.00 -0.44 4.77 2.47 -1.03 -3.22 114.38 117.04 1otw h ARG 179 Ca 0.81 0.00 0.13 0.00 -1.26 0.00 0.00 59.98 59.66 1otw h ARG 179 Cb 2.18 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 30.49 1otw h ARG 179 CO -0.63 0.16 0.49 -0.07 0.56 0.00 0.00 179.97 180.48 1otw h LEU 180 N 0.00 0.00 0.00 3.04 3.38 -0.90 -2.59 115.31 118.24 1otw h LEU 180 Ca -0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 1otw h LEU 180 Cb 0.92 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 1otw h LEU 180 CO 0.02 0.00 -1.59 -1.54 0.09 0.00 0.00 178.44 175.42 1otw n SER 181 N -3.68 1.48 -0.50 -0.43 3.41 -1.24 -4.34 113.62 108.32 1otw n SER 181 Ca 0.08 0.25 0.42 0.00 -0.26 0.00 0.00 58.87 59.36 1otw n SER 181 Cb 0.67 -0.59 0.74 0.00 -0.26 0.00 0.00 64.21 64.77 1otw n SER 181 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1otw h GLN 182 N -0.70 0.04 0.00 4.33 4.20 -1.55 0.59 115.11 122.03 1otw h GLN 182 Ca -0.32 -0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.21 1otw h GLN 182 Cb 1.17 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.91 1otw h GLN 182 CO -0.19 0.03 -1.19 0.00 -0.67 0.00 0.00 178.83 176.80 1otw h ALA 183 N 1.31 0.64 -0.21 3.87 0.00 -1.72 -2.15 119.26 120.99 1otw h ALA 183 Ca 0.77 -0.87 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 1otw h ALA 183 Cb 2.89 0.17 0.00 0.00 0.00 0.00 0.00 17.79 20.85 1otw h ALA 183 CO -0.12 1.01 -0.64 -0.91 0.00 0.00 0.00 179.25 178.59 1otw h ASN 184 N 0.00 0.88 0.21 0.00 2.35 -0.07 -2.38 115.58 116.57 1otw h ASN 184 Ca -0.13 -0.51 -0.01 0.00 -0.55 0.00 0.00 56.30 55.10 1otw h ASN 184 Cb 1.64 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 39.75 1otw h ASN 184 CO 0.07 1.30 -0.10 0.08 -1.65 0.00 0.00 177.43 177.12 1otw h ARG 185 N 0.56 -0.27 -0.88 0.81 0.11 -1.21 -2.58 114.38 110.93 1otw h ARG 185 Ca -0.01 0.02 0.10 0.00 0.10 0.00 0.00 59.98 60.18 1otw h ARG 185 Cb 1.25 0.06 -0.12 0.00 1.11 0.00 0.00 29.97 32.27 1otw h ARG 185 CO 0.13 -0.09 -0.53 -0.44 0.10 0.00 0.00 179.97 179.14 1otw h ASP 186 N -0.40 -1.92 0.23 0.08 3.32 -1.44 -0.81 116.42 115.49 1otw h ASP 186 Ca -0.03 0.31 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 1otw h ASP 186 Cb 0.30 0.87 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 1otw h ASP 186 CO 0.05 -0.28 -0.11 0.58 -1.72 0.00 0.00 179.24 177.76 1otw h VAL 187 N -0.08 0.74 -0.09 -1.35 2.07 -1.34 -0.37 116.25 115.82 1otw h VAL 187 Ca 0.19 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1otw h VAL 187 Cb 0.49 1.26 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1otw h VAL 187 CO -0.88 0.11 0.03 -0.33 0.02 0.00 0.00 177.57 176.52 1otw h GLU 188 N 0.00 0.15 0.13 1.57 5.08 -0.73 0.87 114.58 121.66 1otw h GLU 188 Ca -0.00 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1otw h GLU 188 Cb 0.25 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1otw h GLU 188 CO 0.01 0.30 -0.20 1.25 -1.00 0.00 0.00 179.01 179.37 1otw h HIS 189 N -0.04 -0.53 -0.83 4.33 2.76 -1.31 -2.68 115.15 116.87 1otw h HIS 189 Ca 0.03 0.01 0.18 0.00 -2.20 0.00 0.00 60.37 58.38 1otw h HIS 189 Cb 0.21 0.22 -0.15 0.00 1.55 0.00 0.00 27.41 29.24 1otw h HIS 189 CO -0.00 -0.29 -0.15 0.78 -1.30 0.00 0.00 177.93 176.97 1otw h GLY 190 N -0.39 0.70 1.18 5.26 0.00 -0.00 -1.32 103.07 108.50 1otw h GLY 190 Ca 0.02 0.23 -0.28 0.00 0.00 0.00 0.00 47.33 47.30 1otw h GLY 190 CO -0.09 -0.33 -1.13 1.41 0.00 0.00 0.00 176.54 176.40 1otw h LEU 191 N 0.02 0.87 -0.65 3.11 3.38 0.75 -0.77 115.31 122.02 1otw h LEU 191 Ca 0.42 -0.79 0.04 0.00 0.09 0.00 0.00 57.88 57.64 1otw h LEU 191 Cb 0.68 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.11 1otw h LEU 191 CO -0.82 1.56 0.38 0.00 0.09 0.00 0.00 178.44 179.65 1otw h ALA 192 N 0.32 0.85 0.42 1.53 0.00 -0.94 0.49 119.26 121.94 1otw h ALA 192 Ca -0.16 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1otw h ALA 192 Cb 1.80 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 1otw h ALA 192 CO 0.22 0.10 -0.36 -0.07 0.00 0.00 0.00 179.25 179.14 1otw h LEU 193 N 0.73 -0.94 0.53 0.00 3.38 -1.20 -0.72 115.31 117.08 1otw h LEU 193 Ca 0.27 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.29 1otw h LEU 193 Cb 0.09 0.31 0.01 0.00 0.09 0.00 0.00 40.66 41.16 1otw h LEU 193 CO -0.14 -0.51 -0.25 0.00 0.09 0.00 0.00 178.44 177.62 1otw h ALA 194 N -0.35 -0.71 -0.80 1.53 0.00 -0.63 0.30 119.26 118.61 1otw h ALA 194 Ca -0.04 -0.16 0.19 0.00 0.00 0.00 0.00 54.91 54.90 1otw h ALA 194 Cb 0.68 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 18.62 1otw h ALA 194 CO -0.03 -0.89 0.23 0.87 0.00 0.00 0.00 179.25 179.43 1otw h LYS 195 N -0.73 0.27 0.25 0.00 1.57 -0.09 -0.84 116.57 117.01 1otw h LYS 195 Ca -0.07 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1otw h LYS 195 Cb 0.55 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1otw h LYS 195 CO 0.12 0.18 -0.12 0.00 -0.57 0.00 0.00 179.45 179.06 1otw h ALA 196 N 1.67 -0.50 -0.90 3.86 0.00 -0.71 -3.38 119.26 119.31 1otw h ALA 196 Ca 0.47 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 1otw h ALA 196 Cb 0.86 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 1otw h ALA 196 CO -0.55 -0.47 0.53 -0.92 0.00 0.00 0.00 179.25 177.84 1otw h TYR 197 N -0.70 1.20 -0.81 0.00 3.20 -0.37 -3.36 116.97 116.13 1otw h TYR 197 Ca -0.03 -0.01 -0.70 0.00 3.14 0.00 0.00 58.73 61.13 1otw h TYR 197 Cb 0.26 -0.39 -0.09 0.00 1.54 0.00 0.00 36.73 38.05 1otw h TYR 197 CO 0.04 0.80 2.36 0.00 -1.64 0.00 0.00 178.16 179.72 1otw n ASP 199 N 7.09 3.44 -3.45 0.00 5.75 -1.26 -4.71 116.55 123.41 1otw n ASP 199 Ca 0.48 -2.34 -0.17 0.00 -0.01 0.00 0.00 54.79 52.75 1otw n ASP 199 Cb 0.43 -0.37 -0.07 0.00 -1.03 0.00 0.00 41.12 40.08 1otw n ASP 199 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1otw s SER 200 N -1.26 1.22 0.01 -1.12 1.04 -1.26 -5.04 113.70 107.29 1otw s SER 200 Ca 0.33 -1.62 -0.23 0.00 0.48 0.00 0.00 55.95 54.91 1otw s SER 200 Cb 0.21 0.56 -0.18 0.00 0.10 0.00 0.00 66.02 66.72 1otw s SER 200 CO 0.15 -1.10 1.28 0.00 0.98 0.00 0.00 173.24 174.55 1otw h ALA 201 N 2.20 0.12 -0.40 5.32 0.00 -1.90 -2.23 119.26 122.36 1otw h ALA 201 Ca -0.27 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.37 1otw h ALA 201 Cb 1.24 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.93 1otw h ALA 201 CO 0.39 -0.02 -0.45 0.93 0.00 0.00 0.00 179.25 180.09 1otw h GLU 202 N -0.24 -0.26 0.00 0.00 4.39 -1.92 -1.50 114.58 115.05 1otw h GLU 202 Ca 0.01 0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 1otw h GLU 202 Cb 0.65 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1otw h GLU 202 CO 0.03 -0.17 -0.12 0.87 -1.16 0.00 0.00 179.01 178.45 1otw h LYS 203 N -0.27 0.00 0.14 2.33 1.57 -1.94 -2.49 116.57 115.91 1otw h LYS 203 Ca 0.07 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1otw h LYS 203 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1otw h LYS 203 CO -0.52 0.12 -0.07 1.96 -0.57 0.00 0.00 179.45 180.37 1otw h GLN 204 N 0.00 -0.18 -0.24 3.15 4.20 -0.67 -1.66 115.11 119.71 1otw h GLN 204 Ca -0.00 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.77 1otw h GLN 204 Cb 0.30 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.07 1otw h GLN 204 CO 0.02 0.27 -0.09 -0.91 -0.67 0.00 0.00 178.83 177.44 1otw h ASN 205 N -0.73 -0.32 -0.35 1.46 2.35 -1.11 -1.09 115.58 115.80 1otw h ASN 205 Ca -0.02 0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1otw h ASN 205 Cb 0.53 0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.07 1otw h ASN 205 CO 0.03 -0.12 0.21 -0.09 -1.65 0.00 0.00 177.43 175.82 1otw h ARG 206 N -0.05 0.47 -0.16 0.81 2.43 -1.54 -1.44 114.38 114.91 1otw h ARG 206 Ca 0.13 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 1otw h ARG 206 Cb 0.24 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1otw h ARG 206 CO -0.28 0.35 -0.07 1.98 -1.51 0.00 0.00 179.97 180.44 1otw h MET 207 N 0.46 0.23 -0.40 0.20 4.05 -1.00 0.23 114.93 118.70 1otw h MET 207 Ca 0.13 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.48 1otw h MET 207 Cb -0.00 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.74 1otw h MET 207 CO -0.02 0.32 0.15 -0.07 0.23 0.00 0.00 176.91 177.51 1otw h LEU 208 N 0.23 0.55 -0.92 3.39 3.38 -0.61 -0.76 115.31 120.57 1otw h LEU 208 Ca 0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1otw h LEU 208 Cb 0.27 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1otw h LEU 208 CO 0.01 0.58 0.52 -0.08 0.09 0.00 0.00 178.44 179.56 1otw h GLU 209 N 0.50 1.27 -0.50 1.13 4.57 -0.56 0.65 114.58 121.63 1otw h GLU 209 Ca 0.13 -0.14 0.09 0.00 -1.18 0.00 0.00 59.36 58.26 1otw h GLU 209 Cb 0.21 -0.25 -0.07 0.00 -0.16 0.00 0.00 28.75 28.47 1otw h GLU 209 CO -0.01 0.91 0.10 0.82 -1.18 0.00 0.00 179.01 179.65 1otw h ILE 210 N 1.28 0.71 -0.57 2.32 2.04 -0.20 -1.12 117.51 121.98 1otw h ILE 210 Ca 0.32 -0.08 -0.09 0.00 1.00 0.00 0.00 64.86 66.02 1otw h ILE 210 Cb 0.00 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1otw h ILE 210 CO -0.06 0.04 0.01 0.25 0.00 0.00 0.00 178.15 178.40 1otw h LEU 211 N 0.23 0.94 -0.26 1.44 5.85 0.44 -1.25 115.31 122.70 1otw h LEU 211 Ca 0.25 -0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.77 1otw h LEU 211 Cb 0.34 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 1otw h LEU 211 CO -0.33 0.99 0.03 -0.61 -0.34 0.00 0.00 178.44 178.18 1otw h GLN 212 N 0.89 0.12 -0.47 1.25 5.75 -0.32 0.12 115.11 122.46 1otw h GLN 212 Ca 0.17 -0.01 0.09 0.00 -0.15 0.00 0.00 58.65 58.75 1otw h GLN 212 Cb 0.50 -0.03 -0.08 0.00 1.07 0.00 0.00 27.48 28.94 1otw h GLN 212 CO 0.02 0.08 -0.05 0.35 -2.65 0.00 0.00 178.83 176.58 1otw h PHE 213 N 0.13 -0.13 -0.94 3.99 3.57 -0.41 0.56 116.94 123.71 1otw h PHE 213 Ca 0.12 0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.72 1otw h PHE 213 Cb 0.14 0.13 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 1otw h PHE 213 CO -0.18 -0.15 0.61 -0.22 -2.23 0.00 0.00 178.31 176.15 1otw h LYS 214 N 0.06 1.07 -0.25 1.11 1.63 -0.42 -1.35 116.57 118.42 1otw h LYS 214 Ca 0.23 -0.06 -0.14 0.00 -0.85 0.00 0.00 60.65 59.83 1otw h LYS 214 Cb 0.35 -0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 31.73 1otw h LYS 214 CO -0.43 0.71 -0.41 -0.07 -3.45 0.00 0.00 179.45 175.80 1otw h LEU 215 N 1.11 0.63 -1.26 5.20 3.38 0.13 -2.81 115.31 121.69 1otw h LEU 215 Ca 0.40 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1otw h LEU 215 Cb 0.15 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1otw h LEU 215 CO -0.15 0.97 0.31 0.44 0.09 0.00 0.00 178.44 180.10 1otw h ASP 216 N 0.49 0.73 -0.11 -0.43 3.32 0.73 -1.14 116.42 120.01 1otw h ASP 216 Ca 0.04 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1otw h ASP 216 Cb 0.92 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.28 1otw h ASP 216 CO 0.08 0.60 0.02 0.40 -1.72 0.00 0.00 179.24 178.63 1otw h ILE 217 N 0.82 1.21 -0.56 0.35 2.04 -1.11 -0.50 117.51 119.76 1otw h ILE 217 Ca 0.21 -0.64 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 1otw h ILE 217 Cb 0.05 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 1otw h ILE 217 CO -0.03 0.18 0.23 -0.07 0.00 0.00 0.00 178.15 178.46 1otw h LEU 218 N -0.04 0.77 -0.93 1.44 3.38 -1.21 -1.67 115.31 117.05 1otw h LEU 218 Ca 0.03 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1otw h LEU 218 Cb 0.27 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1otw h LEU 218 CO 0.00 0.73 0.36 -0.25 0.09 0.00 0.00 178.44 179.37 1otw h TRP 219 N 0.77 1.13 -0.01 1.13 2.91 -1.07 -2.76 115.95 118.06 1otw h TRP 219 Ca 0.19 -0.06 -0.14 0.00 1.13 0.00 0.00 58.89 60.01 1otw h TRP 219 Cb 0.19 -0.35 -0.02 0.00 -0.51 0.00 0.00 29.16 28.48 1otw h TRP 219 CO 0.01 0.83 -0.66 0.77 -1.03 0.00 0.00 178.44 178.36 1otw h SER 220 N 1.12 0.03 -0.58 2.65 0.02 -0.63 -0.73 113.55 115.43 1otw h SER 220 Ca 0.27 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.23 1otw h SER 220 Cb 0.13 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 62.63 1otw h SER 220 CO -0.03 0.68 0.35 0.24 -1.14 0.00 0.00 176.83 176.92 1otw h MET 221 N 0.02 0.66 -0.18 3.45 2.86 -1.04 -2.05 114.93 118.64 1otw h MET 221 Ca -0.01 -0.04 -0.19 0.00 -2.06 0.00 0.00 59.70 57.40 1otw h MET 221 Cb 1.16 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1otw h MET 221 CO 0.09 0.44 -0.66 -0.07 1.06 0.00 0.00 176.91 177.77 1otw h LEU 222 N 0.68 0.78 -0.73 1.22 3.38 -1.22 -2.76 115.31 116.66 1otw h LEU 222 Ca 0.24 -0.47 0.12 0.00 0.09 0.00 0.00 57.88 57.86 1otw h LEU 222 Cb 0.05 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 40.49 1otw h LEU 222 CO -0.11 1.24 0.33 0.44 0.09 0.00 0.00 178.44 180.42 1otw h ASP 223 N 0.49 0.38 0.07 -0.43 3.32 -0.88 0.69 116.42 120.07 1otw h ASP 223 Ca -0.02 0.08 -0.11 0.00 0.02 0.00 0.00 57.03 57.00 1otw h ASP 223 Cb 1.25 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.82 1otw h ASP 223 CO 0.13 0.19 -0.37 0.00 -1.72 0.00 0.00 179.24 177.47 1otw h ALA 224 N 1.49 1.02 0.02 3.45 0.00 -1.37 -1.56 119.26 122.29 1otw h ALA 224 Ca 0.38 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1otw h ALA 224 Cb 0.49 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1otw h ALA 224 CO -0.33 0.60 -0.01 0.52 0.00 0.00 0.00 179.25 180.03 1otw h MET 225 N 0.35 -0.02 -0.50 0.00 2.86 -0.76 -2.39 114.93 114.47 1otw h MET 225 Ca 0.04 0.00 0.10 0.00 -2.06 0.00 0.00 59.70 57.78 1otw h MET 225 Cb 0.81 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.37 1otw h MET 225 CO 0.06 0.31 -0.22 1.15 1.06 0.00 0.00 176.91 179.27 1otw h THR 226 N -0.35 0.34 -0.41 2.22 2.02 0.41 -1.37 112.91 115.76 1otw h THR 226 Ca -0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1otw h THR 226 Cb 0.34 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 1otw h THR 226 CO 0.00 0.00 0.13 0.24 0.37 0.00 0.00 175.52 176.27 1otw h MET 227 N -0.11 0.59 0.00 6.66 2.86 -1.15 -1.64 114.93 122.15 1otw h MET 227 Ca 0.23 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 1otw h MET 227 Cb 0.47 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.03 1otw h MET 227 CO -0.57 0.51 -0.04 0.00 1.06 0.00 0.00 176.91 177.87 1otw h ALA 228 N 1.57 0.00 0.00 6.32 0.00 -0.91 -0.03 119.26 126.21 1otw h ALA 228 Ca 0.14 -0.52 -0.26 0.00 0.00 0.00 0.00 54.91 54.27 1otw h ALA 228 Cb 0.17 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1otw h ALA 228 CO -0.01 0.02 -1.99 0.66 0.00 0.00 0.00 179.25 177.93 1otw n TYR 229 N -4.59 0.00 -0.01 0.00 0.53 -0.56 -3.62 117.16 108.91 1otw n TYR 229 Ca -0.10 0.00 -0.04 0.00 -1.02 0.00 0.00 57.90 56.73 1otw n TYR 229 Cb 0.49 -0.71 -0.12 0.00 -1.03 0.00 0.00 39.34 37.98 1otw n TYR 229 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1otw n ALA 230 N -2.53 1.74 0.19 -0.72 0.00 -0.69 -4.63 120.51 113.86 1otw n ALA 230 Ca -0.23 -0.72 0.02 0.00 0.00 0.00 0.00 53.44 52.51 1otw n ALA 230 Cb 0.97 -0.82 0.02 0.00 0.00 0.00 0.00 19.45 19.61 1otw n ALA 230 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1otw n LEU 231 N -2.91 1.36 -2.68 0.00 4.77 -0.75 -5.00 117.00 111.79 1otw n LEU 231 Ca -0.15 -0.99 -0.13 0.00 -0.03 0.00 0.00 56.01 54.70 1otw n LEU 231 Cb 0.95 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 42.10 1otw n LEU 231 CO 0.44 0.29 0.10 0.00 -1.33 0.00 0.00 177.39 176.90 1otw n GLN 232 N 0.24 -4.88 -2.75 3.23 1.13 -1.21 -4.95 117.38 108.18 1otw n GLN 232 Ca 0.03 0.59 -0.04 0.00 -1.94 0.00 0.00 57.00 55.64 1otw n GLN 232 Cb 0.11 -4.85 0.06 0.00 0.11 0.00 0.00 30.24 25.67 1otw n GLN 232 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1otw n ARG 233 N -3.31 1.45 -1.06 -1.09 1.74 -0.03 -5.01 116.66 109.37 1otw n ARG 233 Ca -0.14 -2.93 -0.31 0.00 -0.77 0.00 0.00 57.85 53.70 1otw n ARG 233 Cb 0.60 -1.05 0.13 0.00 -1.02 0.00 0.00 32.46 31.12 1otw n ARG 233 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1otw s PRO 234 N -2.64 1.61 -0.01 5.56 0.04 -1.24 -4.25 135.00 134.06 1otw s PRO 234 Ca 0.24 1.21 -0.38 0.00 0.04 0.00 0.00 61.00 62.11 1otw s PRO 234 Cb 0.39 -1.82 -0.17 0.00 0.04 0.00 0.00 34.50 32.94 1otw s PRO 234 CO -0.03 -2.11 1.40 -2.30 0.04 0.00 0.00 177.00 173.99 1otw n PRO 235 N -3.85 0.99 -1.34 0.56 -0.02 -1.26 -1.93 135.00 128.15 1otw n PRO 235 Ca 0.09 0.36 -0.06 0.00 -2.02 0.00 0.00 63.50 61.87 1otw n PRO 235 Cb 0.53 -1.99 -0.02 0.00 -0.02 0.00 0.00 33.50 32.00 1otw n PRO 235 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1otw n TYR 236 N 3.03 -0.05 0.14 6.00 4.02 -1.26 -4.74 117.16 124.30 1otw n TYR 236 Ca 0.21 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 58.14 1otw n TYR 236 Cb 0.16 -1.49 0.46 0.00 -0.02 0.00 0.00 39.34 38.44 1otw n TYR 236 CO 0.00 0.00 0.00 1.12 -1.01 0.00 0.00 176.86 176.97 1otw h HIS 237 N 0.00 0.21 0.00 -0.72 2.07 -1.51 0.70 115.15 115.90 1otw h HIS 237 Ca -0.13 -0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.37 1otw h HIS 237 Cb 0.53 -0.06 0.00 0.00 2.57 0.00 0.00 27.41 30.45 1otw h HIS 237 CO 0.18 0.27 0.00 1.79 -3.07 0.00 0.00 177.93 177.10 1otw h THR 238 N 0.20 0.00 0.00 6.12 1.35 -1.91 -3.33 112.91 115.34 1otw h THR 238 Ca 0.05 -0.39 -0.14 0.00 -0.55 0.00 0.00 66.41 65.37 1otw h THR 238 Cb 0.23 1.31 -0.03 0.00 -1.73 0.00 0.00 68.15 67.94 1otw h THR 238 CO 0.01 0.00 -1.78 0.52 -0.25 0.00 0.00 175.52 174.02 1otw n VAL 239 N -2.85 0.53 -3.60 6.82 0.31 0.07 -5.07 118.33 114.55 1otw n VAL 239 Ca 0.01 -0.45 -0.05 0.00 -0.01 0.00 0.00 64.34 63.83 1otw n VAL 239 Cb 0.27 -0.33 -0.02 0.00 -0.91 0.00 0.00 33.84 32.85 1otw n VAL 239 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1otw s THR 240 N -2.56 0.00 -0.88 2.52 2.01 -0.25 -5.05 115.64 111.43 1otw s THR 240 Ca -0.06 -0.21 0.07 0.00 0.31 0.00 0.00 61.69 61.80 1otw s THR 240 Cb 0.06 -1.39 0.06 0.00 0.01 0.00 0.00 72.50 71.24 1otw s THR 240 CO 0.54 0.00 0.75 -0.90 -0.69 0.00 0.00 174.62 174.32 1otw n ASP 241 N -0.31 1.65 -4.80 3.53 5.68 -1.26 -3.96 116.55 117.07 1otw n ASP 241 Ca -0.07 -1.34 -0.33 0.00 -0.50 0.00 0.00 54.79 52.55 1otw n ASP 241 Cb 0.61 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.58 1otw n ASP 241 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1otw s LYS 242 N -0.62 3.40 -0.02 0.11 1.02 -1.26 -5.02 119.74 117.35 1otw s LYS 242 Ca 0.09 1.25 -0.30 0.00 0.02 0.00 0.00 55.97 57.03 1otw s LYS 242 Cb 0.06 -2.04 -0.06 0.00 -0.52 0.00 0.00 37.83 35.27 1otw s LYS 242 CO 0.09 -0.75 1.68 0.00 -0.92 0.00 0.00 175.35 175.45 1otw s ALA 243 N -2.34 3.62 0.00 5.17 0.00 -1.26 -4.90 121.76 122.05 1otw s ALA 243 Ca 0.65 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.63 1otw s ALA 243 Cb -0.16 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.21 1otw s ALA 243 CO 0.33 -1.35 0.22 0.00 0.00 0.00 0.00 175.76 174.96 1otw n ALA 244 N 6.88 1.93 -1.29 0.00 0.00 -1.26 -5.06 120.51 121.70 1otw n ALA 244 Ca 0.17 -0.22 -0.31 0.00 0.00 0.00 0.00 53.44 53.08 1otw n ALA 244 Cb 0.42 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.96 1otw n ALA 244 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 1otw s TRP 245 N -0.42 2.55 0.48 0.00 -2.14 -1.26 -5.01 118.94 113.14 1otw s TRP 245 Ca 0.00 1.56 -0.24 0.00 2.66 0.00 0.00 56.10 60.09 1otw s TRP 245 Cb 0.00 -3.08 -0.07 0.00 -3.10 0.00 0.00 33.47 27.22 1otw s TRP 245 CO 0.00 -1.81 1.31 -3.38 -2.66 0.00 0.00 176.95 170.41 1otw s HIS 246 N -2.77 2.58 0.00 1.66 -3.43 -1.26 -4.97 115.29 107.10 1otw s HIS 246 Ca 0.63 1.40 0.00 0.00 -0.80 0.00 0.00 55.06 56.28 1otw s HIS 246 Cb -0.18 -3.70 0.00 0.00 -1.43 0.00 0.00 32.58 27.27 1otw s HIS 246 CO 0.53 -2.40 0.71 0.25 -2.00 0.00 0.00 174.74 171.83 1otw n THR 247 N -0.47 0.44 -4.77 -5.38 -2.24 -1.26 -4.84 114.28 95.76 1otw n THR 247 Ca 0.07 -0.45 -0.26 0.00 -2.27 0.00 0.00 64.05 61.14 1otw n THR 247 Cb 0.45 0.80 -0.16 0.00 -2.10 0.00 0.00 70.33 69.32 1otw n THR 247 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1otw s THR 248 N -0.44 1.36 -1.01 4.28 -1.32 -1.26 -4.71 115.64 112.55 1otw s THR 248 Ca 0.00 -0.65 -0.26 0.00 -1.21 0.00 0.00 61.69 59.58 1otw s THR 248 Cb 0.00 -1.20 -0.16 0.00 -1.51 0.00 0.00 72.50 69.63 1otw s THR 248 CO 0.00 0.40 2.14 -0.13 -2.21 0.00 0.00 174.62 174.82 1otw s ARG 249 N 0.31 1.65 0.24 7.08 0.52 -1.26 -4.83 118.95 122.65 1otw s ARG 249 Ca -0.09 -0.32 -0.06 0.00 -0.52 0.00 0.00 55.73 54.74 1otw s ARG 249 Cb -0.14 -4.99 0.41 0.00 0.52 0.00 0.00 34.95 30.76 1otw s ARG 249 CO 0.03 -4.77 1.72 -0.07 0.02 0.00 0.00 175.30 172.24 1otw h LEU 250 N 21.16 0.20 -0.48 2.53 3.38 -1.97 -2.23 115.31 137.90 1otw h LEU 250 Ca 0.05 0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.97 1otw h LEU 250 Cb 0.99 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 1otw h LEU 250 CO 1.07 0.08 -0.76 -0.37 0.09 0.00 0.00 178.44 178.55 1otw h VAL 251 N 0.39 1.51 0.00 1.22 -1.51 -2.04 -3.30 116.25 112.52 1otw h VAL 251 Ca 0.39 -2.49 0.00 0.00 -1.23 0.00 0.00 66.70 63.37 1otw h VAL 251 Cb 0.59 2.35 0.00 0.00 -2.13 0.00 0.00 31.29 32.09 1otw h VAL 251 CO -0.41 0.72 -0.40 -0.07 -1.23 0.00 0.00 177.57 176.18 1otw h LEU 252 N 0.04 0.00 -7.29 4.19 3.38 -1.83 -3.47 115.31 110.33 1otw h LEU 252 Ca -0.02 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 1otw h LEU 252 Cb 1.33 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.86 1otw h LEU 252 CO 0.10 0.01 -0.15 -1.83 0.09 0.00 0.00 178.44 176.66 1otw s GLU 253 N -3.25 0.64 0.00 1.13 -1.05 -0.89 -5.10 118.70 110.17 1otw s GLU 253 Ca 0.05 0.38 0.30 0.00 -0.15 0.00 0.00 54.97 55.55 1otw s GLU 253 Cb 0.08 0.30 1.51 0.00 -0.44 0.00 0.00 34.13 35.58 1otw s GLU 253 CO 0.71 -0.13 2.01 1.58 0.95 0.00 0.00 175.26 180.38