#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ukw s ASP 33 N 0.00 -0.54 -0.06 9.51 3.68 -1.26 -5.04 116.67 122.96 1ukw s ASP 33 Ca 0.00 1.00 0.09 0.00 2.13 0.00 0.00 52.55 55.77 1ukw s ASP 33 Cb 0.00 0.97 0.14 0.00 -1.45 0.00 0.00 42.92 42.58 1ukw s ASP 33 CO 0.00 -0.18 1.07 0.49 0.13 0.00 0.00 175.17 176.68 1ukw n PHE 34 N 3.23 0.00 -2.95 -5.34 3.01 -1.26 -5.06 117.46 109.10 1ukw n PHE 34 Ca -0.16 -0.73 -0.34 0.00 1.01 0.00 0.00 57.45 57.23 1ukw n PHE 34 Cb 0.56 -0.10 -0.06 0.00 -0.01 0.00 0.00 39.48 39.87 1ukw n PHE 34 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1ukw s SER 35 N -1.90 7.01 0.27 4.37 0.15 -1.26 -5.07 113.70 117.27 1ukw s SER 35 Ca 0.16 1.57 -0.13 0.00 0.70 0.00 0.00 55.95 58.24 1ukw s SER 35 Cb 0.14 -2.48 -0.08 0.00 -1.71 0.00 0.00 66.02 61.88 1ukw s SER 35 CO 0.01 -0.18 0.65 -0.76 1.20 0.00 0.00 173.24 174.17 1ukw s LEU 36 N -2.65 4.13 0.82 3.45 1.02 -1.26 -5.08 118.68 119.11 1ukw s LEU 36 Ca 0.54 1.13 -0.11 0.00 0.02 0.00 0.00 54.13 55.71 1ukw s LEU 36 Cb -0.13 -3.87 0.11 0.00 0.02 0.00 0.00 46.19 42.32 1ukw s LEU 36 CO 0.18 -0.13 1.17 0.42 0.02 0.00 0.00 176.35 178.01 1ukw s THR 37 N -1.88 2.07 0.37 5.49 -4.23 -1.26 -4.85 115.64 111.36 1ukw s THR 37 Ca 0.50 -0.10 0.05 0.00 -1.18 0.00 0.00 61.69 60.96 1ukw s THR 37 Cb -0.11 -2.98 0.25 0.00 1.34 0.00 0.00 72.50 71.00 1ukw s THR 37 CO 0.19 0.00 2.01 -0.08 -0.54 0.00 0.00 174.62 176.20 1ukw h GLU 38 N -1.07 0.67 -0.29 3.99 4.57 -2.00 -1.94 114.58 118.50 1ukw h GLU 38 Ca -0.45 -0.05 -0.15 0.00 -1.18 0.00 0.00 59.36 57.53 1ukw h GLU 38 Cb 1.30 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 29.74 1ukw h GLU 38 CO 0.56 0.47 -0.39 0.93 -1.18 0.00 0.00 179.01 179.39 1ukw h GLU 39 N 0.68 0.78 -0.55 1.92 5.08 -1.99 -2.70 114.58 117.80 1ukw h GLU 39 Ca 0.18 -0.45 0.02 0.00 -1.00 0.00 0.00 59.36 58.11 1ukw h GLU 39 Cb -0.03 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1ukw h GLU 39 CO -0.03 1.08 0.35 1.96 -1.00 0.00 0.00 179.01 181.36 1ukw h GLN 40 N 0.54 0.67 -0.68 2.33 4.20 -1.76 0.24 115.11 120.65 1ukw h GLN 40 Ca 0.03 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1ukw h GLN 40 Cb 0.99 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.58 1ukw h GLN 40 CO 0.09 0.45 0.41 0.00 -0.67 0.00 0.00 178.83 179.11 1ukw h ARG 41 N 0.70 0.91 -0.10 1.46 3.08 -1.36 0.62 114.38 119.68 1ukw h ARG 41 Ca 0.22 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1ukw h ARG 41 Cb -0.02 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.83 1ukw h ARG 41 CO -0.08 0.63 0.02 1.96 -1.07 0.00 0.00 179.97 181.43 1ukw h GLN 42 N 0.93 0.16 -0.87 0.04 1.08 -0.87 0.23 115.11 115.81 1ukw h GLN 42 Ca 0.24 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.39 1ukw h GLN 42 Cb -0.05 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.32 1ukw h GLN 42 CO -0.05 0.36 0.51 1.25 -0.95 0.00 0.00 178.83 179.95 1ukw h LEU 43 N -0.06 1.06 -0.24 1.46 5.85 0.17 0.48 115.31 124.04 1ukw h LEU 43 Ca 0.03 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1ukw h LEU 43 Cb 0.27 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1ukw h LEU 43 CO 0.00 0.83 0.07 -0.61 -0.34 0.00 0.00 178.44 178.39 1ukw h GLN 44 N 1.21 0.37 -0.51 1.25 4.15 0.59 -0.01 115.11 122.16 1ukw h GLN 44 Ca 0.31 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 59.64 1ukw h GLN 44 Cb -0.02 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.59 1ukw h GLN 44 CO -0.06 0.45 0.29 0.00 -1.93 0.00 0.00 178.83 177.59 1ukw h ALA 45 N 0.90 0.65 0.60 3.38 0.00 -0.14 0.12 119.26 124.77 1ukw h ALA 45 Ca 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1ukw h ALA 45 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ukw h ALA 45 CO -0.00 0.16 -0.46 1.25 0.00 0.00 0.00 179.25 180.19 1ukw h LEU 46 N 0.68 -1.22 -0.39 0.00 6.46 -0.73 0.26 115.31 120.36 1ukw h LEU 46 Ca 0.18 0.08 0.08 0.00 -0.12 0.00 0.00 57.88 58.11 1ukw h LEU 46 Cb 0.03 0.38 -0.09 0.00 -0.73 0.00 0.00 40.66 40.25 1ukw h LEU 46 CO -0.03 -0.67 -0.29 0.00 -0.62 0.00 0.00 178.44 176.83 1ukw h ALA 47 N -0.85 -0.11 -0.66 1.25 0.00 -0.80 0.10 119.26 118.19 1ukw h ALA 47 Ca -0.07 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1ukw h ALA 47 Cb 0.87 0.64 -0.05 0.00 0.00 0.00 0.00 17.79 19.25 1ukw h ALA 47 CO 0.02 -0.68 0.37 -0.09 0.00 0.00 0.00 179.25 178.87 1ukw h ARG 48 N -0.22 0.68 -0.58 0.00 2.43 -0.50 -0.89 114.38 115.29 1ukw h ARG 48 Ca 0.18 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1ukw h ARG 48 Cb 0.51 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 1ukw h ARG 48 CO -0.52 0.45 0.36 -0.09 -1.51 0.00 0.00 179.97 178.66 1ukw h ARG 49 N 0.70 0.70 -0.22 0.20 2.43 0.96 -1.91 114.38 117.24 1ukw h ARG 49 Ca 0.29 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 1ukw h ARG 49 Cb 0.16 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1ukw h ARG 49 CO -0.17 0.46 0.04 0.35 -1.51 0.00 0.00 179.97 179.14 1ukw h PHE 50 N 0.72 0.38 -0.23 2.20 3.57 -0.24 -1.56 116.94 121.77 1ukw h PHE 50 Ca 0.23 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.72 1ukw h PHE 50 Cb 0.00 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 1ukw h PHE 50 CO -0.05 0.48 0.02 0.00 -2.23 0.00 0.00 178.31 176.52 1ukw h ALA 51 N 0.85 0.22 -0.33 2.41 0.00 -0.94 0.55 119.26 122.02 1ukw h ALA 51 Ca 0.07 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1ukw h ALA 51 Cb 0.30 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ukw h ALA 51 CO 0.00 -0.41 -0.11 -0.22 0.00 0.00 0.00 179.25 178.51 1ukw h LYS 52 N 0.09 0.66 0.07 0.00 3.64 -1.35 0.82 116.57 120.51 1ukw h LYS 52 Ca 0.11 -0.27 -0.28 0.00 -1.27 0.00 0.00 60.65 58.94 1ukw h LYS 52 Cb 0.13 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1ukw h LYS 52 CO -0.17 0.85 -1.39 0.93 -2.27 0.00 0.00 179.45 177.41 1ukw h GLU 53 N 0.44 0.16 0.00 1.90 5.08 -1.19 -3.39 114.58 117.57 1ukw h GLU 53 Ca 0.08 -0.27 -0.30 0.00 -1.00 0.00 0.00 59.36 57.88 1ukw h GLU 53 Cb 0.63 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.93 1ukw h GLU 53 CO 0.04 1.01 -1.98 0.28 -1.00 0.00 0.00 179.01 177.36 1ukw n VAL 54 N -3.38 0.97 0.02 3.13 0.31 0.19 -4.68 118.33 114.89 1ukw n VAL 54 Ca -0.11 -0.25 -0.08 0.00 -0.01 0.00 0.00 64.34 63.89 1ukw n VAL 54 Cb 1.02 -1.72 -0.06 0.00 -0.91 0.00 0.00 33.84 32.16 1ukw n VAL 54 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1ukw h ILE 55 N -0.61 0.67 -0.98 2.52 2.04 -1.14 -3.36 117.51 116.65 1ukw h ILE 55 Ca -0.45 -1.23 0.32 0.00 1.00 0.00 0.00 64.86 64.50 1ukw h ILE 55 Cb 1.40 1.19 -0.15 0.00 -0.74 0.00 0.00 36.82 38.51 1ukw h ILE 55 CO -0.27 0.20 0.48 0.25 0.00 0.00 0.00 178.15 178.81 1ukw h LEU 56 N -0.96 0.36 -0.88 1.44 5.85 0.45 -1.48 115.31 120.08 1ukw h LEU 56 Ca -0.02 0.20 -0.11 0.00 0.84 0.00 0.00 57.88 58.80 1ukw h LEU 56 Cb 0.46 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 1ukw h LEU 56 CO 0.03 -0.19 -0.35 -0.65 -0.34 0.00 0.00 178.44 176.95 1ukw h PRO 57 N 0.25 0.41 -0.03 5.25 0.11 -1.76 -3.27 132.00 132.97 1ukw h PRO 57 Ca 0.71 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 66.64 1ukw h PRO 57 Cb 1.62 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.72 1ukw h PRO 57 CO -0.65 0.71 -0.10 1.33 -0.21 0.00 0.00 178.00 179.08 1ukw n VAL 58 N -4.07 0.00 -0.14 3.15 0.24 -0.62 -4.60 118.33 112.29 1ukw n VAL 58 Ca -0.01 -0.45 -0.06 0.00 -2.04 0.00 0.00 64.34 61.78 1ukw n VAL 58 Cb 0.46 1.43 0.00 0.00 -1.47 0.00 0.00 33.84 34.26 1ukw n VAL 58 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ukw h ALA 59 N 4.36 -0.06 -0.73 2.33 0.00 -1.44 -1.41 119.26 122.32 1ukw h ALA 59 Ca 0.00 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1ukw h ALA 59 Cb 0.91 0.67 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 1ukw h ALA 59 CO 0.00 -0.66 0.34 1.96 0.00 0.00 0.00 179.25 180.89 1ukw h GLN 60 N -0.19 1.04 0.49 0.00 4.20 -1.82 -2.25 115.11 116.57 1ukw h GLN 60 Ca 0.20 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 1ukw h GLN 60 Cb 0.52 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1ukw h GLN 60 CO -0.57 0.80 -0.35 1.49 -0.67 0.00 0.00 178.83 179.53 1ukw h GLU 61 N 1.03 -0.80 -0.09 1.46 4.81 -1.57 -2.46 114.58 116.97 1ukw h GLU 61 Ca 0.25 0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.42 1ukw h GLU 61 Cb 0.11 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1ukw h GLU 61 CO -0.03 -0.53 -0.44 1.88 -0.73 0.00 0.00 179.01 179.16 1ukw h TYR 62 N -0.83 0.24 -0.84 0.92 -1.99 -1.38 -1.30 116.97 111.80 1ukw h TYR 62 Ca -0.05 -0.07 -0.00 0.00 2.00 0.00 0.00 58.73 60.61 1ukw h TYR 62 Cb 0.69 -0.05 -0.04 0.00 2.00 0.00 0.00 36.73 39.33 1ukw h TYR 62 CO -0.14 0.61 0.51 0.22 -0.00 0.00 0.00 178.16 179.37 1ukw h ASP 63 N 0.17 1.00 0.60 3.88 3.58 -1.35 0.63 116.42 124.91 1ukw h ASP 63 Ca 0.01 -0.05 -0.26 0.00 0.42 0.00 0.00 57.03 57.15 1ukw h ASP 63 Cb 0.85 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.65 1ukw h ASP 63 CO 0.07 0.76 -1.14 -0.33 -2.88 0.00 0.00 179.24 175.71 1ukw h GLU 64 N 1.15 0.27 0.00 0.28 5.08 -1.09 -3.28 114.58 117.00 1ukw h GLU 64 Ca 0.30 -0.41 -0.07 0.00 -1.00 0.00 0.00 59.36 58.18 1ukw h GLU 64 Cb -0.06 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1ukw h GLU 64 CO -0.06 1.17 -0.72 0.87 -1.00 0.00 0.00 179.01 179.26 1ukw h LYS 65 N 0.10 0.00 -5.76 2.33 1.57 -1.06 -3.48 116.57 110.27 1ukw h LYS 65 Ca -0.11 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.34 1ukw h LYS 65 Cb 1.85 0.00 0.15 0.00 0.08 0.00 0.00 32.23 34.31 1ukw h LYS 65 CO 0.19 0.22 -0.88 -1.91 -0.57 0.00 0.00 179.45 176.49 1ukw n GLU 66 N -2.99 -2.15 -4.07 3.15 2.13 0.22 -5.02 120.64 111.92 1ukw n GLU 66 Ca -0.01 0.71 -0.10 0.00 0.66 0.00 0.00 57.16 58.42 1ukw n GLU 66 Cb 0.67 -5.20 -0.11 0.00 0.27 0.00 0.00 31.44 27.07 1ukw n GLU 66 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1ukw s GLU 67 N -5.06 0.54 -0.12 5.31 2.02 -1.23 -4.95 118.70 115.21 1ukw s GLU 67 Ca 0.43 -0.93 -0.29 0.00 0.02 0.00 0.00 54.97 54.20 1ukw s GLU 67 Cb -0.09 -0.05 -0.01 0.00 0.10 0.00 0.00 34.13 34.07 1ukw s GLU 67 CO 0.79 -0.03 1.06 0.08 0.02 0.00 0.00 175.26 177.18 1ukw s VAL 68 N -2.39 4.66 -1.25 2.63 1.01 -1.25 -4.56 120.40 119.24 1ukw s VAL 68 Ca -0.04 1.95 -0.18 0.00 0.00 0.00 0.00 61.98 63.71 1ukw s VAL 68 Cb -0.03 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 1ukw s VAL 68 CO -0.03 -0.04 2.00 -0.81 0.00 0.00 0.00 175.10 176.22 1ukw n PRO 69 N 5.37 2.53 -0.22 2.72 -0.04 -1.26 -4.78 135.00 139.32 1ukw n PRO 69 Ca 0.10 -2.61 0.10 0.00 -0.04 0.00 0.00 63.50 61.05 1ukw n PRO 69 Cb 0.48 -3.32 0.39 0.00 -0.04 0.00 0.00 33.50 31.00 1ukw n PRO 69 CO 0.00 0.00 0.00 2.35 -0.04 0.00 0.00 175.50 177.81 1ukw h TRP 70 N 7.22 0.75 -0.19 0.54 2.91 -1.98 -0.41 115.95 124.80 1ukw h TRP 70 Ca 0.47 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.55 1ukw h TRP 70 Cb 0.74 -0.24 -0.01 0.00 -0.51 0.00 0.00 29.16 29.14 1ukw h TRP 70 CO 1.38 0.33 0.13 -1.35 -1.03 0.00 0.00 178.44 177.90 1ukw h PRO 71 N 0.68 0.07 -0.14 2.65 0.11 -1.99 0.27 132.00 133.64 1ukw h PRO 71 Ca 0.38 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.34 1ukw h PRO 71 Cb 0.55 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 31.65 1ukw h PRO 71 CO -0.15 0.04 -0.48 0.28 -0.21 0.00 0.00 178.00 177.48 1ukw h VAL 72 N 0.07 1.35 -0.36 3.15 2.07 -1.48 -1.21 116.25 119.84 1ukw h VAL 72 Ca 0.08 -1.77 0.02 0.00 0.82 0.00 0.00 66.70 65.85 1ukw h VAL 72 Cb 0.25 2.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 1ukw h VAL 72 CO -0.01 0.54 0.21 0.40 0.02 0.00 0.00 177.57 178.73 1ukw h ILE 73 N 0.20 1.03 -0.51 4.57 2.04 -1.06 0.50 117.51 124.27 1ukw h ILE 73 Ca -0.02 -0.14 0.03 0.00 1.00 0.00 0.00 64.86 65.72 1ukw h ILE 73 Cb 1.11 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 1ukw h ILE 73 CO 0.10 0.08 0.30 -0.33 0.00 0.00 0.00 178.15 178.29 1ukw h GLU 74 N 0.42 0.57 -0.79 2.37 5.08 -0.97 -0.07 114.58 121.19 1ukw h GLU 74 Ca 0.15 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 1ukw h GLU 74 Cb 0.02 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 1ukw h GLU 74 CO -0.08 0.38 0.41 0.87 -1.00 0.00 0.00 179.01 179.59 1ukw h LYS 75 N 0.59 1.10 0.22 2.33 1.79 -0.30 -1.35 116.57 120.95 1ukw h LYS 75 Ca 0.21 -0.14 -0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1ukw h LYS 75 Cb 0.05 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 30.48 1ukw h LYS 75 CO -0.11 0.82 -0.14 -0.07 -1.08 0.00 0.00 179.45 178.87 1ukw h LEU 76 N 1.11 -0.36 0.08 2.94 3.38 0.11 -1.65 115.31 120.91 1ukw h LEU 76 Ca 0.28 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.30 1ukw h LEU 76 Cb 0.06 0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1ukw h LEU 76 CO -0.04 -0.23 -0.33 -0.74 0.09 0.00 0.00 178.44 177.19 1ukw h HIS 77 N -0.36 -0.90 -0.86 1.13 2.76 -0.74 -1.58 115.15 114.59 1ukw h HIS 77 Ca -0.02 0.02 0.15 0.00 -2.20 0.00 0.00 60.37 58.33 1ukw h HIS 77 Cb 0.30 0.39 -0.10 0.00 1.55 0.00 0.00 27.41 29.56 1ukw h HIS 77 CO -0.10 -0.43 0.44 0.93 -1.30 0.00 0.00 177.93 177.48 1ukw h GLU 78 N -0.53 0.60 0.00 5.26 5.08 -1.12 0.56 114.58 124.43 1ukw h GLU 78 Ca 0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ukw h GLU 78 Cb 0.58 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1ukw h GLU 78 CO -0.22 0.40 0.00 1.55 -1.00 0.00 0.00 179.01 179.74 1ukw n VAL 79 N -4.87 0.00 -0.97 3.13 3.14 -0.63 -4.89 118.33 113.24 1ukw n VAL 79 Ca 0.18 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.56 1ukw n VAL 79 Cb 0.45 -0.37 0.00 0.00 -1.06 0.00 0.00 33.84 32.86 1ukw n VAL 79 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ukw n GLY 80 N 0.83 0.55 1.45 7.55 0.00 0.19 -4.95 105.19 110.80 1ukw n GLY 80 Ca 0.17 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.29 1ukw n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ukw n LEU 81 N 0.00 4.33 -4.70 0.99 4.77 -0.65 -4.65 117.00 117.10 1ukw n LEU 81 Ca 0.00 -2.23 -0.38 0.00 -0.03 0.00 0.00 56.01 53.38 1ukw n LEU 81 Cb 0.00 -0.53 -0.07 0.00 -2.33 0.00 0.00 43.42 40.49 1ukw n LEU 81 CO 0.00 0.90 0.07 -0.22 -1.33 0.00 0.00 177.39 176.81 1ukw s LEU 82 N -1.43 4.20 -1.63 2.23 0.20 -1.23 -4.17 118.68 116.86 1ukw s LEU 82 Ca 0.49 0.56 -0.16 0.00 0.69 0.00 0.00 54.13 55.72 1ukw s LEU 82 Cb 0.29 -2.50 0.13 0.00 -0.43 0.00 0.00 46.19 43.68 1ukw s LEU 82 CO 0.28 -0.01 0.82 0.59 -0.29 0.00 0.00 176.35 177.74 1ukw n ASN 83 N 4.06 -3.49 0.00 3.68 3.02 -1.26 -4.82 115.26 116.45 1ukw n ASN 83 Ca -0.09 -0.94 0.12 0.00 -0.03 0.00 0.00 54.58 53.63 1ukw n ASN 83 Cb 0.51 -3.11 0.69 0.00 -0.61 0.00 0.00 39.78 37.26 1ukw n ASN 83 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ukw n ALA 84 N -4.47 2.36 0.85 5.41 0.00 -1.26 -2.57 120.51 120.84 1ukw n ALA 84 Ca 0.03 -0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.46 1ukw n ALA 84 Cb 0.52 -1.38 0.40 0.00 0.00 0.00 0.00 19.45 19.00 1ukw n ALA 84 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1ukw n ILE 85 N -1.00 0.18 -1.96 0.00 -5.35 -1.26 -1.11 119.36 108.86 1ukw n ILE 85 Ca 0.17 -0.10 -0.42 0.00 -0.27 0.00 0.00 62.75 62.13 1ukw n ILE 85 Cb 0.08 -0.26 -0.03 0.00 -1.74 0.00 0.00 39.64 37.69 1ukw n ILE 85 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1ukw s ILE 86 N -3.05 2.64 0.79 7.28 1.01 -1.06 -4.24 121.20 124.57 1ukw s ILE 86 Ca 0.11 0.48 -0.15 0.00 0.00 0.00 0.00 60.65 61.10 1ukw s ILE 86 Cb 0.16 -3.31 0.01 0.00 0.01 0.00 0.00 42.46 39.34 1ukw s ILE 86 CO 0.62 0.05 0.73 -2.65 0.00 0.00 0.00 174.94 173.69 1ukw n PRO 87 N 3.54 0.18 0.31 2.79 -0.02 -1.26 0.01 135.00 140.55 1ukw n PRO 87 Ca 0.12 0.12 0.18 0.00 -2.02 0.00 0.00 63.50 61.89 1ukw n PRO 87 Cb 0.39 -2.04 1.01 0.00 -0.02 0.00 0.00 33.50 32.84 1ukw n PRO 87 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1ukw h GLU 88 N -0.72 0.00 0.00 -0.52 5.08 -1.82 -1.77 114.58 114.82 1ukw h GLU 88 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1ukw h GLU 88 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1ukw h GLU 88 CO 0.42 0.01 0.00 0.93 -1.00 0.00 0.00 179.01 179.38 1ukw h GLU 89 N 0.00 0.00 0.00 2.33 3.07 -1.89 -2.63 114.58 115.46 1ukw h GLU 89 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ukw h GLU 89 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1ukw h GLU 89 CO 0.00 0.00 -0.03 0.66 -1.40 0.00 0.00 179.01 178.24 1ukw n TYR 90 N -2.32 0.00 0.00 4.33 4.02 -0.71 -5.00 117.16 117.48 1ukw n TYR 90 Ca 0.01 -0.61 0.00 0.00 -0.01 0.00 0.00 57.90 57.29 1ukw n TYR 90 Cb 0.16 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.40 1ukw n TYR 90 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ukw n GLY 91 N -0.76 0.36 2.32 2.72 0.00 -0.99 -4.35 105.19 104.48 1ukw n GLY 91 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 1ukw n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ukw n GLY 92 N -1.58 -0.20 0.12 -0.02 0.00 -0.91 -4.90 105.19 97.70 1ukw n GLY 92 Ca 0.00 -1.87 0.13 0.00 0.00 0.00 0.00 46.02 44.28 1ukw n GLY 92 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ukw n MET 93 N -2.36 0.43 -1.77 1.61 2.81 -1.04 -3.50 117.12 113.31 1ukw n MET 93 Ca 0.10 -0.25 -0.14 0.00 -1.81 0.00 0.00 57.70 55.60 1ukw n MET 93 Cb 0.35 -1.49 -0.04 0.00 -0.71 0.00 0.00 33.22 31.33 1ukw n MET 93 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ukw n GLY 94 N 1.41 0.79 3.61 3.03 0.00 0.10 -4.65 105.19 109.48 1ukw n GLY 94 Ca 0.09 -0.32 -0.46 0.00 0.00 0.00 0.00 46.02 45.33 1ukw n GLY 94 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ukw n LEU 95 N -1.81 2.05 -4.99 0.99 4.32 -0.26 -4.88 117.00 112.41 1ukw n LEU 95 Ca -0.16 1.16 -0.20 0.00 -0.02 0.00 0.00 56.01 56.79 1ukw n LEU 95 Cb 0.54 -1.30 0.05 0.00 -1.62 0.00 0.00 43.42 41.09 1ukw n LEU 95 CO 0.21 -1.13 0.35 -0.54 -1.22 0.00 0.00 177.39 175.06 1ukw s LYS 96 N -0.90 2.39 0.31 3.23 -0.14 -1.26 -4.55 119.74 118.82 1ukw s LYS 96 Ca 0.66 -1.08 0.02 0.00 -1.36 0.00 0.00 55.97 54.21 1ukw s LYS 96 Cb -0.74 -2.54 0.56 0.00 -1.68 0.00 0.00 37.83 33.44 1ukw s LYS 96 CO 0.55 -0.79 1.90 1.98 -0.76 0.00 0.00 175.35 178.23 1ukw h MET 97 N 0.09 0.96 -0.76 1.68 4.05 -1.95 0.48 114.93 119.48 1ukw h MET 97 Ca -0.39 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 58.95 1ukw h MET 97 Cb 1.29 -0.22 -0.03 0.00 -0.80 0.00 0.00 31.60 31.83 1ukw h MET 97 CO 0.46 0.63 0.37 1.25 0.23 0.00 0.00 176.91 179.86 1ukw h LEU 98 N 0.99 0.99 -0.50 3.39 5.85 -1.94 -1.54 115.31 122.55 1ukw h LEU 98 Ca 0.41 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.97 1ukw h LEU 98 Cb 0.29 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1ukw h LEU 98 CO -0.17 0.84 0.19 0.44 -0.34 0.00 0.00 178.44 179.40 1ukw h ASP 99 N 1.07 0.70 -0.62 1.25 3.32 -1.37 -1.59 116.42 119.17 1ukw h ASP 99 Ca 0.26 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.15 1ukw h ASP 99 Cb 0.11 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 1ukw h ASP 99 CO -0.03 0.69 0.39 -0.33 -1.72 0.00 0.00 179.24 178.24 1ukw h GLU 100 N 0.67 0.76 -0.46 3.56 5.08 -0.60 0.02 114.58 123.61 1ukw h GLU 100 Ca 0.17 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1ukw h GLU 100 Cb 0.22 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1ukw h GLU 100 CO -0.01 0.50 0.28 0.28 -1.00 0.00 0.00 179.01 179.06 1ukw h VAL 101 N 0.78 1.06 0.02 3.13 2.07 -1.05 0.86 116.25 123.12 1ukw h VAL 101 Ca 0.24 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.58 1ukw h VAL 101 Cb -0.01 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1ukw h VAL 101 CO -0.09 0.10 -0.08 0.40 0.02 0.00 0.00 177.57 177.93 1ukw h ILE 102 N 0.56 0.81 -0.00 4.57 2.04 -0.58 -2.05 117.51 122.85 1ukw h ILE 102 Ca 0.18 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.04 1ukw h ILE 102 Cb -0.01 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1ukw h ILE 102 CO -0.07 0.00 -0.00 0.58 0.00 0.00 0.00 178.15 178.66 1ukw h VAL 103 N -0.14 1.31 -0.44 1.67 2.07 -0.74 -3.25 116.25 116.74 1ukw h VAL 103 Ca 0.03 -0.92 0.09 0.00 0.82 0.00 0.00 66.70 66.71 1ukw h VAL 103 Cb 0.17 1.94 -0.09 0.00 -1.52 0.00 0.00 31.29 31.79 1ukw h VAL 103 CO -0.07 0.24 -0.17 1.23 0.02 0.00 0.00 177.57 178.82 1ukw h GLY 104 N -0.39 0.19 0.84 2.17 0.00 0.81 -0.51 103.07 106.19 1ukw h GLY 104 Ca 0.00 0.22 0.08 0.00 0.00 0.00 0.00 47.33 47.63 1ukw h GLY 104 CO 0.00 -0.19 0.54 -2.09 0.00 0.00 0.00 176.54 174.80 1ukw h GLU 105 N -0.08 0.81 -0.17 4.80 4.81 -1.46 0.31 114.58 123.60 1ukw h GLU 105 Ca 0.21 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.34 1ukw h GLU 105 Cb 0.40 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 1ukw h GLU 105 CO -0.49 0.53 -0.11 0.93 -0.73 0.00 0.00 179.01 179.14 1ukw h GLU 106 N 0.83 0.38 0.61 1.92 4.39 -1.20 -2.32 114.58 119.19 1ukw h GLU 106 Ca 0.37 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.87 1ukw h GLU 106 Cb 0.36 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.01 1ukw h GLU 106 CO -0.14 0.71 -0.29 -0.07 -1.16 0.00 0.00 179.01 178.05 1ukw h LEU 107 N 0.04 -0.70 -1.93 1.33 3.38 -0.62 -3.04 115.31 113.78 1ukw h LEU 107 Ca 0.03 -0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.12 1ukw h LEU 107 Cb 0.61 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1ukw h LEU 107 CO 0.03 -0.33 0.49 0.00 0.09 0.00 0.00 178.44 178.72 1ukw h ALA 108 N -0.98 2.17 -0.76 1.53 0.00 -1.06 0.53 119.26 120.68 1ukw h ALA 108 Ca -0.08 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1ukw h ALA 108 Cb 0.67 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1ukw h ALA 108 CO 0.14 -0.72 0.51 -0.92 0.00 0.00 0.00 179.25 178.26 1ukw h TYR 109 N 0.00 0.95 0.20 0.00 5.03 -1.29 -2.46 116.97 119.40 1ukw h TYR 109 Ca 0.21 0.02 -0.32 0.00 2.58 0.00 0.00 58.73 61.23 1ukw h TYR 109 Cb 1.19 -0.32 0.02 0.00 1.55 0.00 0.00 36.73 39.17 1ukw h TYR 109 CO 0.00 0.58 -1.46 0.00 -1.32 0.00 0.00 178.16 175.96 1ukw h ALA 110 N 1.53 0.00 -0.74 1.82 0.00 -0.97 -3.44 119.26 117.46 1ukw h ALA 110 Ca 0.29 -0.94 0.19 0.00 0.00 0.00 0.00 54.91 54.45 1ukw h ALA 110 Cb -0.08 0.18 -0.23 0.00 0.00 0.00 0.00 17.79 17.66 1ukw h ALA 110 CO -0.07 0.87 0.19 0.00 0.00 0.00 0.00 179.25 180.24 1ukw h MET 112 N 7.64 0.74 -0.50 0.00 4.05 -1.80 -1.33 114.93 123.73 1ukw h MET 112 Ca -0.15 -0.29 -0.02 0.00 -0.28 0.00 0.00 59.70 58.96 1ukw h MET 112 Cb 1.14 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.88 1ukw h MET 112 CO 0.04 0.90 0.25 0.78 0.23 0.00 0.00 176.91 179.11 1ukw h GLY 113 N 0.97 0.76 1.71 1.39 0.00 -1.91 -0.10 103.07 105.89 1ukw h GLY 113 Ca 0.09 -0.37 -0.15 0.00 0.00 0.00 0.00 47.33 46.90 1ukw h GLY 113 CO 0.06 0.35 -0.62 -2.22 0.00 0.00 0.00 176.54 174.11 1ukw h ILE 114 N 0.66 1.38 -0.00 2.60 2.04 -1.88 -2.87 117.51 119.43 1ukw h ILE 114 Ca 0.17 -1.98 -0.07 0.00 1.00 0.00 0.00 64.86 63.98 1ukw h ILE 114 Cb 0.10 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 1ukw h ILE 114 CO -0.02 0.59 -0.33 0.22 0.00 0.00 0.00 178.15 178.60 1ukw h TYR 115 N 0.22 0.01 0.00 1.37 3.20 -0.84 -2.62 116.97 118.31 1ukw h TYR 115 Ca -0.01 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1ukw h TYR 115 Cb 1.13 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.40 1ukw h TYR 115 CO 0.03 0.34 -0.01 1.15 -1.64 0.00 0.00 178.16 178.03 1ukw h THR 116 N 0.01 0.44 0.73 1.81 2.02 -0.79 -2.05 112.91 115.08 1ukw h THR 116 Ca -0.00 -0.07 -0.04 0.00 0.77 0.00 0.00 66.41 67.08 1ukw h THR 116 Cb 0.60 1.04 0.01 0.00 -1.74 0.00 0.00 68.15 68.06 1ukw h THR 116 CO 0.04 0.01 -0.35 0.40 0.37 0.00 0.00 175.52 176.00 1ukw h ILE 117 N 0.00 0.00 -0.25 3.11 2.04 -1.56 0.10 117.51 120.95 1ukw h ILE 117 Ca -0.00 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.54 1ukw h ILE 117 Cb 0.04 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.11 1ukw h ILE 117 CO 0.00 0.00 -0.16 1.55 0.00 0.00 0.00 178.15 179.54 1ukw h PRO 118 N -1.23 0.43 -0.20 2.37 0.13 -1.69 -1.82 132.00 130.00 1ukw h PRO 118 Ca -0.10 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1ukw h PRO 118 Cb 0.75 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.83 1ukw h PRO 118 CO 0.16 0.59 0.13 1.98 -0.23 0.00 0.00 178.00 180.63 1ukw h MET 119 N 0.40 0.27 -0.43 0.86 4.05 -1.36 -0.57 114.93 118.15 1ukw h MET 119 Ca 0.07 -0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.41 1ukw h MET 119 Cb 0.52 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.24 1ukw h MET 119 CO 0.03 0.19 0.02 0.00 0.23 0.00 0.00 176.91 177.39 1ukw h ALA 120 N 1.06 1.23 -0.74 0.39 0.00 -0.61 -2.01 119.26 118.58 1ukw h ALA 120 Ca 0.07 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1ukw h ALA 120 Cb -0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1ukw h ALA 120 CO -0.02 0.51 0.30 1.03 0.00 0.00 0.00 179.25 181.08 1ukw h SER 121 N 0.65 1.01 0.49 0.00 0.87 -0.82 -1.15 113.55 114.60 1ukw h SER 121 Ca 0.14 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.48 1ukw h SER 121 Cb 0.38 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 1ukw h SER 121 CO 0.01 0.90 -0.33 0.44 -0.53 0.00 0.00 176.83 177.31 1ukw h ASP 122 N 1.07 0.00 -0.20 6.23 3.32 -0.56 -1.99 116.42 124.29 1ukw h ASP 122 Ca 0.25 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.27 1ukw h ASP 122 Cb 0.20 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1ukw h ASP 122 CO -0.02 0.33 0.00 0.25 -1.72 0.00 0.00 179.24 178.09 1ukw h LEU 123 N 0.00 0.33 -1.16 1.55 5.85 -0.54 -0.85 115.31 120.48 1ukw h LEU 123 Ca -0.00 -0.30 -0.08 0.00 0.84 0.00 0.00 57.88 58.33 1ukw h LEU 123 Cb 0.67 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1ukw h LEU 123 CO 0.04 0.56 -0.33 1.23 -0.34 0.00 0.00 178.44 179.60 1ukw h GLY 124 N 0.10 0.17 1.46 3.75 0.00 -1.06 -2.86 103.07 104.63 1ukw h GLY 124 Ca 0.06 -0.14 -0.16 0.00 0.00 0.00 0.00 47.33 47.09 1ukw h GLY 124 CO 0.01 0.13 -0.55 -2.22 0.00 0.00 0.00 176.54 173.91 1ukw h ILE 125 N 0.14 1.32 -0.71 2.60 2.04 -1.18 -3.33 117.51 118.39 1ukw h ILE 125 Ca 0.02 -1.79 0.16 0.00 1.00 0.00 0.00 64.86 64.24 1ukw h ILE 125 Cb 0.65 1.76 -0.11 0.00 -0.74 0.00 0.00 36.82 38.38 1ukw h ILE 125 CO 0.05 0.56 0.09 0.74 0.00 0.00 0.00 178.15 179.59 1ukw h THR 126 N 0.44 0.46 -0.84 -0.27 2.02 -0.91 -1.92 112.91 111.88 1ukw h THR 126 Ca 0.01 -0.06 0.02 0.00 0.77 0.00 0.00 66.41 67.14 1ukw h THR 126 Cb 1.09 0.26 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 1ukw h THR 126 CO 0.10 0.03 0.55 -0.65 0.37 0.00 0.00 175.52 175.93 1ukw h PRO 127 N 0.19 1.08 -0.17 6.66 0.11 -1.70 -0.79 132.00 137.37 1ukw h PRO 127 Ca 0.39 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.35 1ukw h PRO 127 Cb 0.68 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1ukw h PRO 127 CO -0.56 0.71 -0.30 0.28 -0.21 0.00 0.00 178.00 177.93 1ukw h VAL 128 N 1.11 1.27 -0.27 3.15 2.07 -1.56 0.28 116.25 122.30 1ukw h VAL 128 Ca 0.32 -1.29 -0.13 0.00 0.82 0.00 0.00 66.70 66.42 1ukw h VAL 128 Cb -0.09 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1ukw h VAL 128 CO -0.08 0.40 -0.36 -0.07 0.02 0.00 0.00 177.57 177.47 1ukw h LEU 129 N 0.30 0.63 0.10 2.57 3.38 -0.71 -0.11 115.31 121.47 1ukw h LEU 129 Ca 0.04 -0.27 -0.15 0.00 0.09 0.00 0.00 57.88 57.59 1ukw h LEU 129 Cb 0.68 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.26 1ukw h LEU 129 CO 0.05 0.94 -0.68 -0.07 0.09 0.00 0.00 178.44 178.76 1ukw h LEU 130 N 0.51 0.33 0.00 1.67 3.38 -0.75 -3.42 115.31 117.03 1ukw h LEU 130 Ca 0.05 -0.94 -0.13 0.00 0.09 0.00 0.00 57.88 56.95 1ukw h LEU 130 Cb 0.86 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1ukw h LEU 130 CO 0.07 1.32 -1.76 0.00 0.09 0.00 0.00 178.44 178.17 1ukw n ALA 131 N -2.71 2.06 -1.31 1.53 0.00 0.95 -5.04 120.51 115.99 1ukw n ALA 131 Ca -0.14 -0.61 -0.34 0.00 0.00 0.00 0.00 53.44 52.35 1ukw n ALA 131 Cb 0.74 -0.22 0.10 0.00 0.00 0.00 0.00 19.45 20.07 1ukw n ALA 131 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ukw s GLY 132 N -4.11 2.31 0.78 0.00 0.00 -0.05 -3.97 107.32 102.27 1ukw s GLY 132 Ca -0.06 0.87 -0.06 0.00 0.00 0.00 0.00 44.72 45.47 1ukw s GLY 132 CO 0.54 1.28 1.08 -0.51 0.00 0.00 0.00 173.10 175.49 1ukw s THR 133 N -2.02 2.15 0.22 0.90 -4.23 -1.26 -4.81 115.64 106.60 1ukw s THR 133 Ca 0.74 -0.35 -0.09 0.00 -1.18 0.00 0.00 61.69 60.81 1ukw s THR 133 Cb -0.29 -2.80 0.19 0.00 1.34 0.00 0.00 72.50 70.94 1ukw s THR 133 CO 0.46 0.00 1.88 -0.33 -0.54 0.00 0.00 174.62 176.10 1ukw h GLU 134 N -0.83 1.12 -0.07 3.99 5.08 -1.97 0.96 114.58 122.86 1ukw h GLU 134 Ca -0.41 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 57.89 1ukw h GLU 134 Cb 1.27 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 1ukw h GLU 134 CO 0.45 0.77 -0.05 1.49 -1.00 0.00 0.00 179.01 180.66 1ukw h GLU 135 N 1.14 -0.05 -0.48 2.33 4.22 -1.99 -1.08 114.58 118.67 1ukw h GLU 135 Ca 0.30 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.62 1ukw h GLU 135 Cb -0.09 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1ukw h GLU 135 CO -0.06 -0.03 -0.20 1.96 -2.18 0.00 0.00 179.01 178.49 1ukw h GLN 136 N -0.05 0.97 0.09 1.92 4.20 -1.85 -0.51 115.11 119.86 1ukw h GLN 136 Ca 0.05 -0.40 0.01 0.00 0.06 0.00 0.00 58.65 58.36 1ukw h GLN 136 Cb 0.12 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 1ukw h GLN 136 CO -0.10 1.07 -0.13 0.87 -0.67 0.00 0.00 178.83 179.87 1ukw h LYS 137 N 0.84 -0.25 -0.59 1.46 1.57 -0.58 0.30 116.57 119.31 1ukw h LYS 137 Ca 0.11 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.93 1ukw h LYS 137 Cb 0.77 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 1ukw h LYS 137 CO 0.06 -0.17 0.37 1.49 -0.57 0.00 0.00 179.45 180.63 1ukw h GLU 138 N -0.26 0.71 0.04 3.15 4.57 -1.15 0.28 114.58 121.93 1ukw h GLU 138 Ca 0.02 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1ukw h GLU 138 Cb 0.27 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1ukw h GLU 138 CO -0.06 0.47 -0.02 -0.09 -1.18 0.00 0.00 179.01 178.13 1ukw h ARG 139 N 0.74 -0.05 0.00 1.92 2.43 -0.73 -2.33 114.38 116.35 1ukw h ARG 139 Ca 0.23 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 59.21 1ukw h ARG 139 Cb -0.02 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 1ukw h ARG 139 CO -0.08 0.29 -1.04 0.74 -1.51 0.00 0.00 179.97 178.38 1ukw h PHE 140 N -0.41 0.00 0.00 2.20 0.05 -0.41 -3.38 116.94 114.99 1ukw h PHE 140 Ca -0.01 0.00 -0.27 0.00 3.82 0.00 0.00 57.97 61.51 1ukw h PHE 140 Cb 0.37 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.27 1ukw h PHE 140 CO 0.04 0.83 -1.72 1.28 -0.18 0.00 0.00 178.31 178.56 1ukw n LEU 141 N -3.22 0.77 0.01 1.54 4.32 0.98 -4.42 117.00 116.99 1ukw n LEU 141 Ca -0.03 0.36 -0.10 0.00 -0.02 0.00 0.00 56.01 56.22 1ukw n LEU 141 Cb 0.90 0.18 -0.05 0.00 -1.62 0.00 0.00 43.42 42.83 1ukw n LEU 141 CO 0.45 0.35 0.83 -0.09 -1.22 0.00 0.00 177.39 177.70 1ukw h ARG 142 N 0.00 -0.05 0.00 3.23 9.65 -1.52 -1.78 114.38 123.90 1ukw h ARG 142 Ca -0.28 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.60 1ukw h ARG 142 Cb 1.94 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 30.53 1ukw h ARG 142 CO 0.07 -0.04 0.01 -2.30 2.80 0.00 0.00 179.97 180.51 1ukw n PRO 143 N -5.18 0.14 0.00 0.20 -0.02 -1.26 -1.41 135.00 127.47 1ukw n PRO 143 Ca -0.05 0.64 0.12 0.00 -2.02 0.00 0.00 63.50 62.19 1ukw n PRO 143 Cb 0.11 -1.96 0.25 0.00 -0.02 0.00 0.00 33.50 31.87 1ukw n PRO 143 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1ukw n LEU 144 N -2.25 1.19 -0.02 2.45 4.32 -0.68 -3.86 117.00 118.16 1ukw n LEU 144 Ca -0.01 -0.36 0.05 0.00 -0.02 0.00 0.00 56.01 55.67 1ukw n LEU 144 Cb 0.04 -0.10 -0.12 0.00 -1.62 0.00 0.00 43.42 41.62 1ukw n LEU 144 CO 0.09 0.23 -0.72 0.35 -1.22 0.00 0.00 177.39 176.12 1ukw n THR 145 N -0.65 0.16 0.13 -5.08 -2.24 -0.50 -4.59 114.28 101.50 1ukw n THR 145 Ca 0.10 -0.39 0.07 0.00 -2.27 0.00 0.00 64.05 61.57 1ukw n THR 145 Cb 0.37 0.03 0.03 0.00 -2.10 0.00 0.00 70.33 68.66 1ukw n THR 145 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1ukw h GLU 146 N 0.00 0.00 -3.92 -0.78 5.08 -1.63 -3.48 114.58 109.84 1ukw h GLU 146 Ca -0.06 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.10 1ukw h GLU 146 Cb 0.88 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.06 1ukw h GLU 146 CO 0.00 0.16 -0.14 -1.59 -1.00 0.00 0.00 179.01 176.44 1ukw s LYS 147 N -3.15 1.84 -1.06 2.33 -2.85 -1.25 -5.07 119.74 110.53 1ukw s LYS 147 Ca 0.02 -1.61 -0.23 0.00 -1.00 0.00 0.00 55.97 53.15 1ukw s LYS 147 Cb 0.08 0.46 -0.01 0.00 -2.06 0.00 0.00 37.83 36.30 1ukw s LYS 147 CO 0.75 -0.77 1.76 -2.14 0.10 0.00 0.00 175.35 175.05 1ukw s PRO 148 N -3.22 3.10 0.07 1.78 0.02 -1.26 -4.77 135.00 130.71 1ukw s PRO 148 Ca 0.27 -1.00 0.07 0.00 0.02 0.00 0.00 61.00 60.36 1ukw s PRO 148 Cb -0.01 -5.27 -0.03 0.00 0.02 0.00 0.00 34.50 29.21 1ukw s PRO 148 CO 0.17 -2.96 -0.18 0.00 -0.33 0.00 0.00 177.00 173.69 1ukw s ALA 149 N 7.74 1.57 0.17 -1.55 0.00 -1.26 -4.96 121.76 123.46 1ukw s ALA 149 Ca 0.60 -1.08 0.10 0.00 0.00 0.00 0.00 51.96 51.57 1ukw s ALA 149 Cb -0.02 -0.23 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 1ukw s ALA 149 CO 0.01 0.31 -0.19 -0.51 0.00 0.00 0.00 175.76 175.38 1ukw s LEU 150 N -1.57 2.63 0.28 0.00 1.02 -1.26 -4.88 118.68 114.90 1ukw s LEU 150 Ca 0.04 -0.71 0.11 0.00 0.02 0.00 0.00 54.13 53.59 1ukw s LEU 150 Cb -0.09 -1.39 -0.05 0.00 0.02 0.00 0.00 46.19 44.68 1ukw s LEU 150 CO 0.03 0.13 -0.10 0.00 0.02 0.00 0.00 176.35 176.43 1ukw s ALA 151 N -1.51 2.95 0.12 4.21 0.00 -1.26 -0.90 121.76 125.37 1ukw s ALA 151 Ca 0.21 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.38 1ukw s ALA 151 Cb -0.09 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 1ukw s ALA 151 CO 0.11 0.26 0.00 0.00 0.00 0.00 0.00 175.76 176.13 1ukw s ALA 152 N -2.43 0.93 -0.18 0.00 0.00 -1.10 -3.68 121.76 115.30 1ukw s ALA 152 Ca 0.31 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.84 1ukw s ALA 152 Cb -0.05 0.53 0.05 0.00 0.00 0.00 0.00 23.12 23.65 1ukw s ALA 152 CO 0.17 -0.38 -0.04 0.12 0.00 0.00 0.00 175.76 175.64 1ukw s PHE 153 N -3.85 1.76 -0.54 0.00 5.36 -1.26 -1.40 117.98 118.05 1ukw s PHE 153 Ca 0.18 -1.19 -0.01 0.00 -0.96 0.00 0.00 56.93 54.95 1ukw s PHE 153 Cb 0.07 -1.33 0.14 0.00 -0.34 0.00 0.00 43.02 41.55 1ukw s PHE 153 CO -0.01 -0.65 0.33 0.00 -1.46 0.00 0.00 175.22 173.43 1ukw s ALA 154 N 1.61 3.40 -0.15 11.12 0.00 0.12 -4.73 121.76 133.13 1ukw s ALA 154 Ca -0.01 -3.07 -0.09 0.00 0.00 0.00 0.00 51.96 48.79 1ukw s ALA 154 Cb -0.16 -2.47 -0.07 0.00 0.00 0.00 0.00 23.12 20.43 1ukw s ALA 154 CO -0.07 -2.00 -0.22 -0.11 0.00 0.00 0.00 175.76 173.36 1ukw n LEU 155 N 3.68 1.29 -4.71 0.00 7.94 -1.26 -2.54 117.00 121.40 1ukw n LEU 155 Ca 0.05 0.22 -0.35 0.00 -1.11 0.00 0.00 56.01 54.81 1ukw n LEU 155 Cb 0.38 -0.52 0.10 0.00 0.53 0.00 0.00 43.42 43.90 1ukw n LEU 155 CO 0.33 0.19 0.84 -1.20 -1.11 0.00 0.00 177.39 176.43 1ukw n SER 156 N -3.83 1.59 -4.23 1.96 7.64 -1.26 -4.91 113.62 110.56 1ukw n SER 156 Ca -0.28 0.72 -0.13 0.00 1.01 0.00 0.00 58.87 60.18 1ukw n SER 156 Cb 0.65 -1.53 -0.10 0.00 -1.01 0.00 0.00 64.21 62.22 1ukw n SER 156 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1ukw s GLU 157 N -3.71 1.16 0.21 1.43 2.02 0.27 -1.06 118.70 119.02 1ukw s GLU 157 Ca 0.78 -1.58 -0.11 0.00 0.02 0.00 0.00 54.97 54.08 1ukw s GLU 157 Cb -0.34 -0.07 0.28 0.00 0.10 0.00 0.00 34.13 34.10 1ukw s GLU 157 CO 0.45 -0.24 1.68 -1.35 0.02 0.00 0.00 175.26 175.82 1ukw h PRO 158 N 2.64 0.15 -0.57 0.39 0.11 -1.88 -2.51 132.00 130.34 1ukw h PRO 158 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1ukw h PRO 158 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ukw h PRO 158 CO 0.60 0.10 0.00 0.41 -0.21 0.00 0.00 178.00 178.90 1ukw n GLY 159 N -1.34 2.91 3.22 -0.55 0.00 -1.26 -4.86 105.19 103.30 1ukw n GLY 159 Ca 0.08 -0.82 0.04 0.00 0.00 0.00 0.00 46.02 45.32 1ukw n GLY 159 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ukw s ASN 160 N -1.04 -1.03 0.00 1.61 2.47 -0.94 -5.01 114.94 111.00 1ukw s ASN 160 Ca 0.47 0.77 0.00 0.00 0.42 0.00 0.00 52.86 54.52 1ukw s ASN 160 Cb 0.31 1.91 0.00 0.00 -1.45 0.00 0.00 41.25 42.02 1ukw s ASN 160 CO 0.22 -0.19 0.05 0.61 -3.72 0.00 0.00 177.10 174.07 1ukw n GLY 161 N 5.41 0.74 0.16 1.21 0.00 -1.26 0.96 105.19 112.41 1ukw n GLY 161 Ca -0.04 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.00 1ukw n GLY 161 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ukw n SER 162 N -0.39 1.19 -3.69 1.61 7.64 -1.26 -4.78 113.62 113.93 1ukw n SER 162 Ca 0.00 -1.09 -0.30 0.00 1.01 0.00 0.00 58.87 58.49 1ukw n SER 162 Cb 0.03 0.18 -0.13 0.00 -1.01 0.00 0.00 64.21 63.27 1ukw n SER 162 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ukw s ASP 163 N -0.57 3.67 0.00 6.43 2.15 -1.26 -4.95 116.67 122.13 1ukw s ASP 163 Ca 0.05 -2.37 0.07 0.00 0.43 0.00 0.00 52.55 50.72 1ukw s ASP 163 Cb 0.04 -0.94 0.36 0.00 -0.30 0.00 0.00 42.92 42.08 1ukw s ASP 163 CO 0.08 -0.30 1.02 0.00 -0.17 0.00 0.00 175.17 175.79 1ukw n ALA 164 N 3.87 1.57 1.08 3.66 0.00 -1.26 -1.59 120.51 127.84 1ukw n ALA 164 Ca 0.07 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.59 1ukw n ALA 164 Cb 0.36 -1.11 0.18 0.00 0.00 0.00 0.00 19.45 18.88 1ukw n ALA 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ukw n ALA 165 N -1.21 3.63 -1.60 0.00 0.00 -1.26 -4.15 120.51 115.92 1ukw n ALA 165 Ca 0.04 -0.46 0.06 0.00 0.00 0.00 0.00 53.44 53.08 1ukw n ALA 165 Cb 0.05 -1.01 0.17 0.00 0.00 0.00 0.00 19.45 18.66 1ukw n ALA 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ukw n ALA 166 N -1.00 3.21 -1.76 0.00 0.00 -0.62 -4.09 120.51 116.25 1ukw n ALA 166 Ca 0.08 -3.01 -0.40 0.00 0.00 0.00 0.00 53.44 50.11 1ukw n ALA 166 Cb 0.36 -0.40 0.02 0.00 0.00 0.00 0.00 19.45 19.43 1ukw n ALA 166 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ukw n LEU 167 N -0.99 5.05 -0.06 0.00 4.77 -1.25 -4.94 117.00 119.59 1ukw n LEU 167 Ca 0.17 1.12 -0.07 0.00 -0.03 0.00 0.00 56.01 57.20 1ukw n LEU 167 Cb 0.73 -1.60 -0.15 0.00 -2.33 0.00 0.00 43.42 40.07 1ukw n LEU 167 CO -0.03 -0.18 -0.91 0.29 -1.33 0.00 0.00 177.39 175.23 1ukw n LYS 168 N -0.17 0.67 -1.67 3.23 5.02 -1.26 -4.70 118.16 119.27 1ukw n LYS 168 Ca 0.05 0.06 -0.48 0.00 -2.02 0.00 0.00 58.31 55.92 1ukw n LYS 168 Cb 0.41 -1.60 -0.05 0.00 -0.02 0.00 0.00 35.03 33.77 1ukw n LYS 168 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1ukw n THR 169 N -2.77 0.33 -4.06 -0.18 -1.04 -1.26 -4.85 114.28 100.45 1ukw n THR 169 Ca -0.25 -0.06 -0.35 0.00 -2.04 0.00 0.00 64.05 61.36 1ukw n THR 169 Cb 1.05 -1.71 -0.07 0.00 -1.82 0.00 0.00 70.33 67.78 1ukw n THR 169 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1ukw s ARG 170 N 2.71 3.21 -0.18 -2.82 0.52 0.22 -1.14 118.95 121.48 1ukw s ARG 170 Ca 0.87 -0.34 -0.01 0.00 -0.52 0.00 0.00 55.73 55.73 1ukw s ARG 170 Cb -0.70 -2.98 0.05 0.00 0.52 0.00 0.00 34.95 31.84 1ukw s ARG 170 CO 0.46 0.70 -0.04 0.00 0.02 0.00 0.00 175.30 176.44 1ukw s ALA 171 N -1.10 1.52 -0.27 2.13 0.00 -0.92 -1.10 121.76 122.02 1ukw s ALA 171 Ca 0.19 -0.91 -0.07 0.00 0.00 0.00 0.00 51.96 51.17 1ukw s ALA 171 Cb -0.12 -1.19 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 1ukw s ALA 171 CO 0.09 -0.90 0.07 0.42 0.00 0.00 0.00 175.76 175.44 1ukw s ILE 172 N 1.61 4.07 0.11 0.00 1.01 -0.89 -4.16 121.20 122.95 1ukw s ILE 172 Ca -0.01 -0.45 -0.31 0.00 0.00 0.00 0.00 60.65 59.88 1ukw s ILE 172 Cb -0.16 -2.99 -0.08 0.00 0.01 0.00 0.00 42.46 39.23 1ukw s ILE 172 CO -0.07 0.22 1.50 -0.60 0.00 0.00 0.00 174.94 175.99 1ukw s ARG 173 N 1.55 4.26 -0.43 2.79 3.52 -1.26 -0.80 118.95 128.58 1ukw s ARG 173 Ca 0.05 2.20 0.04 0.00 -0.13 0.00 0.00 55.73 57.88 1ukw s ARG 173 Cb -0.16 -3.33 0.17 0.00 -1.56 0.00 0.00 34.95 30.07 1ukw s ARG 173 CO 0.02 -0.57 0.33 -1.14 -0.81 0.00 0.00 175.30 173.14 1ukw s GLN 174 N 1.59 0.99 7.76 5.12 0.74 0.13 -4.93 119.66 131.06 1ukw s GLN 174 Ca 0.68 -2.11 0.00 0.00 0.05 0.00 0.00 55.36 53.98 1ukw s GLN 174 Cb -0.39 -1.57 0.00 0.00 1.10 0.00 0.00 33.01 32.15 1ukw s GLN 174 CO 0.30 -1.36 0.00 0.41 -0.55 0.00 0.00 175.29 174.10 1ukw n GLY 175 N 2.93 2.25 0.87 2.59 0.00 -1.26 -3.23 105.19 109.34 1ukw n GLY 175 Ca 0.27 -0.42 0.07 0.00 0.00 0.00 0.00 46.02 45.93 1ukw n GLY 175 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ukw n ASP 176 N 9.13 2.51 -3.70 1.61 5.75 -1.26 -4.92 116.55 125.66 1ukw n ASP 176 Ca 0.00 -2.07 -0.10 0.00 -0.01 0.00 0.00 54.79 52.61 1ukw n ASP 176 Cb 0.00 -0.33 -0.04 0.00 -1.03 0.00 0.00 41.12 39.72 1ukw n ASP 176 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 1ukw s HIS 177 N -1.50 -0.14 0.01 2.11 -3.43 -1.20 -1.51 115.29 109.64 1ukw s HIS 177 Ca 0.29 -0.19 0.00 0.00 -0.80 0.00 0.00 55.06 54.36 1ukw s HIS 177 Cb 0.16 0.35 -0.04 0.00 -1.43 0.00 0.00 32.58 31.62 1ukw s HIS 177 CO 0.18 -0.85 0.08 0.71 -2.00 0.00 0.00 174.74 172.86 1ukw s TYR 178 N -3.85 3.27 -0.47 0.38 1.51 0.16 0.23 117.35 118.57 1ukw s TYR 178 Ca 0.08 0.18 -0.14 0.00 -1.01 0.00 0.00 57.07 56.18 1ukw s TYR 178 Cb -0.00 -1.72 0.08 0.00 -0.11 0.00 0.00 41.96 40.21 1ukw s TYR 178 CO -0.05 0.54 0.38 0.08 -1.11 0.00 0.00 175.55 175.39 1ukw s VAL 179 N -1.22 4.98 -0.11 0.71 1.01 0.02 -0.98 120.40 124.81 1ukw s VAL 179 Ca 0.24 -1.22 -0.20 0.00 0.00 0.00 0.00 61.98 60.80 1ukw s VAL 179 Cb -0.12 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 1ukw s VAL 179 CO 0.15 -0.61 0.54 -0.22 0.00 0.00 0.00 175.10 174.96 1ukw s LEU 180 N 1.58 4.28 -0.08 3.92 0.20 0.11 -2.08 118.68 126.60 1ukw s LEU 180 Ca 0.04 0.90 -0.04 0.00 0.69 0.00 0.00 54.13 55.72 1ukw s LEU 180 Cb -0.25 -2.80 0.04 0.00 -0.43 0.00 0.00 46.19 42.76 1ukw s LEU 180 CO 0.05 -0.04 0.18 0.20 -0.29 0.00 0.00 176.35 176.44 1ukw s ASN 181 N 0.71 0.00 0.00 3.68 0.01 -0.26 -0.95 114.94 118.13 1ukw s ASN 181 Ca 0.29 0.38 0.00 0.00 -0.71 0.00 0.00 52.86 52.82 1ukw s ASN 181 Cb -0.16 0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.79 1ukw s ASN 181 CO 0.12 -0.17 0.00 0.61 -1.51 0.00 0.00 177.10 176.15 1ukw n GLY 182 N 4.45 3.06 3.41 0.66 0.00 -0.75 -0.61 105.19 115.41 1ukw n GLY 182 Ca -0.22 -1.35 -0.33 0.00 0.00 0.00 0.00 46.02 44.12 1ukw n GLY 182 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ukw s THR 183 N -2.00 3.40 -0.02 2.61 2.01 -1.26 -1.28 115.64 119.09 1ukw s THR 183 Ca 0.00 -0.53 -0.01 0.00 0.31 0.00 0.00 61.69 61.46 1ukw s THR 183 Cb 0.00 -2.46 -0.04 0.00 0.01 0.00 0.00 72.50 70.01 1ukw s THR 183 CO 0.00 0.50 0.08 -0.54 -0.69 0.00 0.00 174.62 173.97 1ukw s LYS 184 N 0.48 3.10 0.11 4.92 -0.14 0.90 -4.29 119.74 124.82 1ukw s LYS 184 Ca -0.07 -0.45 0.09 0.00 -1.36 0.00 0.00 55.97 54.19 1ukw s LYS 184 Cb -0.15 -2.89 -0.04 0.00 -1.68 0.00 0.00 37.83 33.08 1ukw s LYS 184 CO 0.04 0.66 -0.22 1.41 -0.76 0.00 0.00 175.35 176.48 1ukw s MET 185 N -1.61 1.20 -1.19 1.68 -2.45 -0.22 -0.32 119.30 116.39 1ukw s MET 185 Ca 0.22 -1.22 -0.01 0.00 -1.25 0.00 0.00 55.69 53.42 1ukw s MET 185 Cb -0.12 -1.51 0.00 0.00 1.25 0.00 0.00 34.83 34.46 1ukw s MET 185 CO 0.12 0.35 1.00 0.91 1.05 0.00 0.00 175.02 178.45 1ukw n TRP 186 N 0.99 -2.22 -3.30 4.11 7.02 -1.09 -4.35 117.44 118.60 1ukw n TRP 186 Ca -0.19 0.92 -0.42 0.00 -1.02 0.00 0.00 57.50 56.79 1ukw n TRP 186 Cb 0.54 -4.98 -0.08 0.00 -2.42 0.00 0.00 31.31 24.36 1ukw n TRP 186 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 1ukw s ILE 187 N -3.34 5.06 0.22 -0.99 -1.09 0.20 -4.79 121.20 116.47 1ukw s ILE 187 Ca 0.08 -0.15 -0.30 0.00 -2.23 0.00 0.00 60.65 58.05 1ukw s ILE 187 Cb -0.04 -4.01 -0.10 0.00 -1.58 0.00 0.00 42.46 36.73 1ukw s ILE 187 CO 0.71 -0.37 1.47 -0.44 -1.23 0.00 0.00 174.94 175.08 1ukw s SER 188 N 1.81 6.64 -0.21 3.58 0.01 -1.26 -1.49 113.70 122.78 1ukw s SER 188 Ca 0.14 2.65 0.00 0.00 1.31 0.00 0.00 55.95 60.05 1ukw s SER 188 Cb -0.16 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.45 1ukw s SER 188 CO 0.14 -0.74 0.00 0.59 0.41 0.00 0.00 173.24 173.64 1ukw n ASN 189 N 2.80 -4.79 -0.19 2.44 5.03 0.86 -4.56 115.26 116.84 1ukw n ASN 189 Ca 0.09 0.05 0.00 0.00 0.87 0.00 0.00 54.58 55.59 1ukw n ASN 189 Cb 0.40 -2.47 0.09 0.00 -1.02 0.00 0.00 39.78 36.78 1ukw n ASN 189 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1ukw h GLY 190 N 0.00 0.61 1.25 7.41 0.00 -1.47 -1.40 103.07 109.48 1ukw h GLY 190 Ca -0.04 0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1ukw h GLY 190 CO 0.06 -0.19 -0.79 -1.33 0.00 0.00 0.00 176.54 174.30 1ukw h GLY 191 N 0.11 0.00 0.94 4.60 0.00 -1.88 -3.37 103.07 103.48 1ukw h GLY 191 Ca 0.31 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.56 1ukw h GLY 191 CO -0.51 0.00 -1.22 1.18 0.00 0.00 0.00 176.54 175.99 1ukw n GLU 192 N -2.81 0.61 -2.06 4.80 4.71 -1.07 -4.97 120.64 119.85 1ukw n GLU 192 Ca 0.00 0.15 -0.37 0.00 -0.01 0.00 0.00 57.16 56.93 1ukw n GLU 192 Cb 0.57 -1.81 0.02 0.00 -1.01 0.00 0.00 31.44 29.21 1ukw n GLU 192 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1ukw s ALA 193 N -3.19 2.76 0.23 0.62 0.00 -0.55 -4.49 121.76 117.15 1ukw s ALA 193 Ca -0.02 1.04 -0.01 0.00 0.00 0.00 0.00 51.96 52.98 1ukw s ALA 193 Cb 0.09 -3.45 0.25 0.00 0.00 0.00 0.00 23.12 20.01 1ukw s ALA 193 CO 0.80 -1.01 1.61 0.93 0.00 0.00 0.00 175.76 178.10 1ukw h GLU 194 N 1.43 0.54 -3.37 0.00 4.39 -1.37 -3.41 114.58 112.79 1ukw h GLU 194 Ca -0.50 -0.26 -0.04 0.00 0.34 0.00 0.00 59.36 58.89 1ukw h GLU 194 Cb 1.28 -0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.81 1ukw h GLU 194 CO 0.57 0.84 -0.04 1.67 -1.16 0.00 0.00 179.01 180.89 1ukw s TRP 195 N -4.28 -0.17 -0.01 4.33 1.48 -1.26 0.17 118.94 119.19 1ukw s TRP 195 Ca -0.07 -0.15 0.06 0.00 -1.06 0.00 0.00 56.10 54.88 1ukw s TRP 195 Cb 0.13 0.29 -0.01 0.00 -1.16 0.00 0.00 33.47 32.72 1ukw s TRP 195 CO 0.82 -0.76 -0.18 0.08 -4.06 0.00 0.00 176.95 172.84 1ukw s VAL 196 N -3.83 1.41 -0.45 -0.66 1.01 0.14 -2.71 120.40 115.32 1ukw s VAL 196 Ca 0.05 -0.77 -0.23 0.00 0.00 0.00 0.00 61.98 61.03 1ukw s VAL 196 Cb 0.01 -1.17 0.03 0.00 0.00 0.00 0.00 36.38 35.24 1ukw s VAL 196 CO -0.09 0.39 0.77 -0.69 0.00 0.00 0.00 175.10 175.48 1ukw s VAL 197 N -0.43 4.67 -0.22 2.92 1.01 -0.49 0.22 120.40 128.07 1ukw s VAL 197 Ca 0.07 0.40 -0.09 0.00 0.00 0.00 0.00 61.98 62.37 1ukw s VAL 197 Cb -0.07 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 1ukw s VAL 197 CO -0.01 -0.70 0.10 -0.69 0.00 0.00 0.00 175.10 173.81 1ukw s VAL 198 N 3.24 4.87 -0.24 2.92 1.01 0.34 -0.70 120.40 131.83 1ukw s VAL 198 Ca 0.29 0.01 -0.14 0.00 0.00 0.00 0.00 61.98 62.14 1ukw s VAL 198 Cb -0.12 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 1ukw s VAL 198 CO 0.22 0.38 0.33 -0.36 0.00 0.00 0.00 175.10 175.67 1ukw s PHE 199 N 1.01 3.30 0.08 5.22 0.40 -1.05 -0.84 117.98 126.10 1ukw s PHE 199 Ca 0.05 0.43 0.01 0.00 -0.60 0.00 0.00 56.93 56.83 1ukw s PHE 199 Cb -0.14 -2.49 -0.04 0.00 0.51 0.00 0.00 43.02 40.86 1ukw s PHE 199 CO 0.03 -0.09 -0.05 0.00 0.70 0.00 0.00 175.22 175.81 1ukw s ALA 200 N 1.59 0.82 -0.17 5.36 0.00 -0.38 -4.84 121.76 124.12 1ukw s ALA 200 Ca 0.15 -1.28 -0.10 0.00 0.00 0.00 0.00 51.96 50.73 1ukw s ALA 200 Cb -0.15 0.19 -0.05 0.00 0.00 0.00 0.00 23.12 23.11 1ukw s ALA 200 CO 0.08 -0.27 0.15 -0.08 0.00 0.00 0.00 175.76 175.64 1ukw s THR 201 N -3.62 5.42 -1.77 0.00 -1.32 -0.29 0.59 115.64 114.65 1ukw s THR 201 Ca 0.09 0.23 0.25 0.00 -1.21 0.00 0.00 61.69 61.05 1ukw s THR 201 Cb 0.05 -3.47 0.12 0.00 -1.51 0.00 0.00 72.50 67.69 1ukw s THR 201 CO -0.06 0.48 1.33 0.55 -2.21 0.00 0.00 174.62 174.72 1ukw n VAL 202 N 3.10 0.00 -3.15 5.08 3.14 0.20 -2.16 118.33 124.55 1ukw n VAL 202 Ca -0.17 -0.16 0.05 0.00 -2.96 0.00 0.00 64.34 61.10 1ukw n VAL 202 Cb 0.53 0.75 -0.01 0.00 -1.06 0.00 0.00 33.84 34.05 1ukw n VAL 202 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 1ukw s ASN 203 N -2.55 -0.92 0.14 6.55 3.84 -1.25 -4.93 114.94 115.82 1ukw s ASN 203 Ca 0.20 0.48 -0.19 0.00 0.21 0.00 0.00 52.86 53.56 1ukw s ASN 203 Cb 0.18 1.73 0.02 0.00 -0.55 0.00 0.00 41.25 42.64 1ukw s ASN 203 CO 0.57 -0.17 1.68 -0.65 -2.79 0.00 0.00 177.10 175.75 1ukw h PRO 204 N 7.93 -0.02 -0.12 0.43 0.11 -1.91 -2.25 132.00 136.17 1ukw h PRO 204 Ca -0.16 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.99 1ukw h PRO 204 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ukw h PRO 204 CO 0.06 -0.01 0.29 0.93 -0.21 0.00 0.00 178.00 179.06 1ukw h GLU 205 N -0.02 0.00 -0.00 1.05 3.07 -1.97 0.31 114.58 117.02 1ukw h GLU 205 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 1ukw h GLU 205 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1ukw h GLU 205 CO -0.30 0.00 -0.16 1.28 -1.40 0.00 0.00 179.01 178.44 1ukw n LEU 206 N -3.27 0.27 0.00 1.33 4.77 -0.85 -4.98 117.00 114.27 1ukw n LEU 206 Ca 0.01 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1ukw n LEU 206 Cb 0.38 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1ukw n LEU 206 CO 0.20 0.06 0.00 0.54 -1.33 0.00 0.00 177.39 176.86 1ukw n ARG 207 N -1.32 0.00 0.11 3.23 1.74 0.11 -1.26 116.66 119.28 1ukw n ARG 207 Ca 0.09 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.27 1ukw n ARG 207 Cb 0.31 0.00 0.59 0.00 -1.02 0.00 0.00 32.46 32.34 1ukw n ARG 207 CO 0.00 0.00 0.00 1.12 -1.52 0.00 0.00 177.63 177.23 1ukw h HIS 208 N 0.00 0.16 0.00 -1.55 2.07 -1.88 -0.45 115.15 113.51 1ukw h HIS 208 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1ukw h HIS 208 Cb 0.00 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 29.93 1ukw h HIS 208 CO 0.00 0.09 0.00 1.63 -3.07 0.00 0.00 177.93 176.58 1ukw n LYS 209 N -4.49 0.06 -0.02 5.12 4.76 -0.39 -3.11 118.16 120.10 1ukw n LYS 209 Ca 0.02 0.10 0.13 0.00 -2.87 0.00 0.00 58.31 55.70 1ukw n LYS 209 Cb 0.22 -1.50 0.42 0.00 -1.84 0.00 0.00 35.03 32.33 1ukw n LYS 209 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ukw n GLY 210 N 0.81 0.26 3.75 0.72 0.00 -0.18 -3.68 105.19 106.88 1ukw n GLY 210 Ca 0.06 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 1ukw n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ukw s VAL 211 N -1.95 4.58 0.02 1.61 1.01 -1.18 0.62 120.40 125.11 1ukw s VAL 211 Ca 0.36 1.71 0.05 0.00 0.00 0.00 0.00 61.98 64.10 1ukw s VAL 211 Cb 0.20 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 1ukw s VAL 211 CO 0.32 0.41 -0.16 0.54 0.00 0.00 0.00 175.10 176.21 1ukw s VAL 212 N -0.40 1.28 -0.23 2.92 0.11 0.20 -0.20 120.40 124.08 1ukw s VAL 212 Ca 0.39 -0.94 -0.10 0.00 -2.93 0.00 0.00 61.98 58.40 1ukw s VAL 212 Cb -0.22 -1.12 -0.05 0.00 -1.53 0.00 0.00 36.38 33.47 1ukw s VAL 212 CO 0.25 0.17 0.15 0.00 -3.33 0.00 0.00 175.10 172.33 1ukw s ALA 213 N -0.68 3.58 -0.03 1.54 0.00 -1.26 -1.26 121.76 123.66 1ukw s ALA 213 Ca 0.04 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.16 1ukw s ALA 213 Cb -0.07 -2.27 -0.00 0.00 0.00 0.00 0.00 23.12 20.77 1ukw s ALA 213 CO 0.01 -0.15 -0.12 -0.51 0.00 0.00 0.00 175.76 174.99 1ukw s LEU 214 N 0.98 1.86 -0.32 0.00 1.43 -0.02 -0.86 118.68 121.74 1ukw s LEU 214 Ca 0.07 -0.23 -0.18 0.00 -1.03 0.00 0.00 54.13 52.76 1ukw s LEU 214 Cb -0.13 -0.67 -0.01 0.00 0.03 0.00 0.00 46.19 45.41 1ukw s LEU 214 CO 0.04 0.10 0.52 -0.69 0.23 0.00 0.00 176.35 176.54 1ukw s VAL 215 N 0.08 5.03 -0.24 -1.59 1.01 -0.07 0.12 120.40 124.74 1ukw s VAL 215 Ca -0.02 0.51 -0.07 0.00 0.00 0.00 0.00 61.98 62.41 1ukw s VAL 215 Cb -0.09 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 1ukw s VAL 215 CO 0.01 -0.12 0.04 -0.69 0.00 0.00 0.00 175.10 174.34 1ukw s VAL 216 N 2.38 4.15 0.44 2.92 1.01 0.13 -4.87 120.40 126.56 1ukw s VAL 216 Ca 0.20 -0.23 -0.20 0.00 0.00 0.00 0.00 61.98 61.74 1ukw s VAL 216 Cb -0.15 -2.92 -0.11 0.00 0.00 0.00 0.00 36.38 33.20 1ukw s VAL 216 CO 0.12 0.37 0.96 -1.61 0.00 0.00 0.00 175.10 174.94 1ukw s GLU 217 N 1.47 4.17 0.36 2.72 2.02 -1.26 0.24 118.70 128.42 1ukw s GLU 217 Ca 0.05 1.12 0.15 0.00 0.02 0.00 0.00 54.97 56.31 1ukw s GLU 217 Cb -0.15 -2.17 1.00 0.00 0.10 0.00 0.00 34.13 32.92 1ukw s GLU 217 CO 0.02 -0.08 1.76 -0.09 0.02 0.00 0.00 175.26 176.89 1ukw h ARG 218 N 1.78 0.47 0.00 1.61 2.43 0.14 -2.68 114.38 118.13 1ukw h ARG 218 Ca -0.49 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1ukw h ARG 218 Cb 1.18 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1ukw h ARG 218 CO 0.61 0.31 -0.68 0.78 -1.51 0.00 0.00 179.97 179.48 1ukw h GLY 219 N 0.48 0.00 -6.47 2.80 0.00 -1.94 -3.48 103.07 94.46 1ukw h GLY 219 Ca 0.61 0.00 -0.76 0.00 0.00 0.00 0.00 47.33 47.18 1ukw h GLY 219 CO -0.36 0.00 0.96 2.41 0.00 0.00 0.00 176.54 179.54 1ukw n THR 220 N -2.78 0.00 -1.54 4.70 -1.04 -1.01 -4.81 114.28 107.80 1ukw n THR 220 Ca 0.01 0.00 -0.50 0.00 -2.04 0.00 0.00 64.05 61.52 1ukw n THR 220 Cb 0.54 -0.46 -0.04 0.00 -1.82 0.00 0.00 70.33 68.54 1ukw n THR 220 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1ukw n PRO 221 N 5.46 0.79 -0.84 -2.82 -0.02 -1.26 -2.44 135.00 133.88 1ukw n PRO 221 Ca 0.41 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1ukw n PRO 221 Cb -0.05 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1ukw n PRO 221 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ukw n GLY 222 N 1.89 0.53 3.04 -1.23 0.00 -1.26 -4.46 105.19 103.70 1ukw n GLY 222 Ca 0.16 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 1ukw n GLY 222 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ukw s PHE 223 N -2.00 3.47 0.27 1.61 5.36 -1.02 0.44 117.98 126.11 1ukw s PHE 223 Ca 0.00 -2.84 -0.08 0.00 -0.96 0.00 0.00 56.93 53.06 1ukw s PHE 223 Cb 0.00 -3.04 -0.06 0.00 -0.34 0.00 0.00 43.02 39.57 1ukw s PHE 223 CO 0.00 -0.87 0.57 0.15 -1.46 0.00 0.00 175.22 173.61 1ukw s LYS 224 N 0.37 3.73 -0.10 10.12 1.02 -0.14 -4.95 119.74 129.79 1ukw s LYS 224 Ca 0.14 0.18 -0.01 0.00 0.02 0.00 0.00 55.97 56.29 1ukw s LYS 224 Cb -0.22 -2.62 0.03 0.00 -0.52 0.00 0.00 37.83 34.50 1ukw s LYS 224 CO -0.04 0.24 -0.01 0.00 -0.92 0.00 0.00 175.35 174.62 1ukw s ALA 225 N -1.98 0.91 -0.17 5.17 0.00 -1.26 -1.81 121.76 122.62 1ukw s ALA 225 Ca 0.46 -0.33 -0.02 0.00 0.00 0.00 0.00 51.96 52.07 1ukw s ALA 225 Cb -0.11 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.14 1ukw s ALA 225 CO 0.26 -0.56 -0.07 0.42 0.00 0.00 0.00 175.76 175.80 1ukw s ILE 226 N 1.88 3.38 0.13 0.00 1.01 -0.12 -4.96 121.20 122.52 1ukw s ILE 226 Ca 0.04 -0.52 -0.30 0.00 0.00 0.00 0.00 60.65 59.87 1ukw s ILE 226 Cb -0.13 -2.48 -0.06 0.00 0.01 0.00 0.00 42.46 39.79 1ukw s ILE 226 CO -0.06 0.48 1.04 -0.75 0.00 0.00 0.00 174.94 175.65 1ukw s LYS 227 N 0.78 4.62 -0.03 2.79 2.20 -1.26 0.11 119.74 128.94 1ukw s LYS 227 Ca -0.03 1.59 -0.21 0.00 -0.36 0.00 0.00 55.97 56.96 1ukw s LYS 227 Cb -0.15 -3.34 -0.05 0.00 -1.51 0.00 0.00 37.83 32.79 1ukw s LYS 227 CO 0.02 0.09 0.62 0.42 -0.36 0.00 0.00 175.35 176.13 1ukw s ILE 228 N 0.09 4.98 0.37 5.43 1.01 0.12 -4.89 121.20 128.30 1ukw s ILE 228 Ca 0.50 1.28 0.06 0.00 0.00 0.00 0.00 60.65 62.49 1ukw s ILE 228 Cb -0.26 -3.96 -0.07 0.00 0.01 0.00 0.00 42.46 38.18 1ukw s ILE 228 CO 0.32 0.36 0.01 -1.38 0.00 0.00 0.00 174.94 174.24 1ukw s HIS 229 N 0.20 2.31 -0.29 3.97 -3.43 -1.26 -4.63 115.29 112.16 1ukw s HIS 229 Ca 0.33 -0.74 -0.02 0.00 -0.80 0.00 0.00 55.06 53.83 1ukw s HIS 229 Cb -0.18 -1.55 0.00 0.00 -1.43 0.00 0.00 32.58 29.42 1ukw s HIS 229 CO 0.17 0.33 0.23 0.41 -2.00 0.00 0.00 174.74 173.87 1ukw n GLY 230 N -0.84 0.61 3.87 -1.38 0.00 -1.26 -5.05 105.19 101.14 1ukw n GLY 230 Ca -0.04 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 1ukw n GLY 230 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ukw s LYS 231 N -5.19 3.80 0.30 1.61 1.02 -1.26 -4.99 119.74 115.03 1ukw s LYS 231 Ca 0.11 0.41 0.09 0.00 0.02 0.00 0.00 55.97 56.60 1ukw s LYS 231 Cb -0.05 -2.46 0.45 0.00 -0.52 0.00 0.00 37.83 35.25 1ukw s LYS 231 CO 0.14 0.07 1.68 1.98 -0.92 0.00 0.00 175.35 178.30 1ukw h MET 232 N 1.63 0.11 0.00 1.68 1.85 -1.97 -3.46 114.93 114.77 1ukw h MET 232 Ca -0.47 -0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 58.54 1ukw h MET 232 Cb 1.18 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 33.21 1ukw h MET 232 CO 0.65 0.59 0.00 0.41 -0.40 0.00 0.00 176.91 178.16 1ukw n GLY 233 N -0.04 2.53 3.30 1.39 0.00 -1.23 -4.72 105.19 106.42 1ukw n GLY 233 Ca -0.02 -1.23 -0.20 0.00 0.00 0.00 0.00 46.02 44.58 1ukw n GLY 233 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ukw n GLN 234 N -0.04 -2.59 0.18 1.61 6.02 -1.26 -4.78 117.38 116.51 1ukw n GLN 234 Ca -0.00 0.28 0.14 0.00 -0.01 0.00 0.00 57.00 57.41 1ukw n GLN 234 Cb 0.04 -4.89 0.73 0.00 1.02 0.00 0.00 30.24 27.15 1ukw n GLN 234 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ukw h ARG 235 N -0.59 0.00 0.00 -1.09 -0.00 -1.89 -1.51 114.38 109.30 1ukw h ARG 235 Ca -0.33 0.00 -0.10 0.00 -0.50 0.00 0.00 59.98 59.05 1ukw h ARG 235 Cb 1.22 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.18 1ukw h ARG 235 CO 0.45 0.00 -0.46 0.00 0.00 0.00 0.00 179.97 179.95 1ukw h ALA 236 N 1.87 1.24 -2.56 0.04 0.00 -1.80 -3.36 119.26 114.68 1ukw h ALA 236 Ca 0.09 -0.42 -0.53 0.00 0.00 0.00 0.00 54.91 54.05 1ukw h ALA 236 Cb 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1ukw h ALA 236 CO -0.00 0.58 0.50 0.45 0.00 0.00 0.00 179.25 180.78 1ukw s SER 237 N -6.90 7.19 -0.29 0.00 0.15 -0.57 -3.89 113.70 109.39 1ukw s SER 237 Ca -0.02 2.02 -0.23 0.00 0.70 0.00 0.00 55.95 58.42 1ukw s SER 237 Cb 0.14 -2.59 -0.00 0.00 -1.71 0.00 0.00 66.02 61.85 1ukw s SER 237 CO 0.74 -0.33 0.78 -0.83 1.20 0.00 0.00 173.24 174.79 1ukw s GLY 238 N 0.48 1.73 -0.13 9.45 0.00 -1.26 -4.99 107.32 112.59 1ukw s GLY 238 Ca 0.54 -0.37 -0.00 0.00 0.00 0.00 0.00 44.72 44.89 1ukw s GLY 238 CO 0.32 1.72 -0.13 -1.59 0.00 0.00 0.00 173.10 173.42 1ukw s THR 239 N 2.87 3.03 0.24 0.90 2.01 -1.26 -0.10 115.64 123.34 1ukw s THR 239 Ca 0.32 -0.67 0.07 0.00 0.31 0.00 0.00 61.69 61.72 1ukw s THR 239 Cb -0.15 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.04 1ukw s THR 239 CO 0.11 0.52 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.15 1ukw s TYR 240 N 0.42 1.82 -0.17 4.92 2.02 -0.55 0.15 117.35 125.96 1ukw s TYR 240 Ca -0.10 -0.65 -0.07 0.00 -0.37 0.00 0.00 57.07 55.88 1ukw s TYR 240 Cb -0.16 -0.95 -0.04 0.00 -0.40 0.00 0.00 41.96 40.41 1ukw s TYR 240 CO 0.05 0.30 0.08 -2.00 -1.57 0.00 0.00 175.55 172.41 1ukw s GLU 241 N -3.69 3.88 -0.13 -0.62 2.12 0.12 -0.63 118.70 119.74 1ukw s GLU 241 Ca 0.26 -0.30 -0.00 0.00 0.36 0.00 0.00 54.97 55.29 1ukw s GLU 241 Cb 0.02 -3.21 -0.01 0.00 0.26 0.00 0.00 34.13 31.18 1ukw s GLU 241 CO 0.09 0.37 -0.14 -0.51 -0.54 0.00 0.00 175.26 174.54 1ukw s LEU 242 N 0.10 2.66 -0.17 2.70 1.43 0.57 -0.94 118.68 125.02 1ukw s LEU 242 Ca 0.06 -0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1ukw s LEU 242 Cb -0.12 -1.60 -0.00 0.00 0.03 0.00 0.00 46.19 44.50 1ukw s LEU 242 CO 0.00 0.15 -0.12 -0.69 0.23 0.00 0.00 176.35 175.92 1ukw s VAL 243 N 0.45 2.84 -0.33 -1.59 1.01 -0.75 -0.07 120.40 121.97 1ukw s VAL 243 Ca -0.10 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 1ukw s VAL 243 Cb -0.16 -2.23 0.05 0.00 0.00 0.00 0.00 36.38 34.04 1ukw s VAL 243 CO 0.05 0.49 0.06 -0.36 0.00 0.00 0.00 175.10 175.35 1ukw s PHE 244 N 1.01 3.29 -0.28 5.22 0.08 -0.41 -0.97 117.98 125.91 1ukw s PHE 244 Ca -0.01 -1.71 -0.07 0.00 0.12 0.00 0.00 56.93 55.25 1ukw s PHE 244 Cb -0.15 -2.28 0.00 0.00 -0.57 0.00 0.00 43.02 40.02 1ukw s PHE 244 CO -0.02 -0.79 0.08 -1.21 -0.10 0.00 0.00 175.22 173.18 1ukw s GLU 245 N 1.31 3.22 -1.22 0.44 2.02 0.17 -1.81 118.70 122.84 1ukw s GLU 245 Ca -0.03 -0.77 -0.02 0.00 0.02 0.00 0.00 54.97 54.18 1ukw s GLU 245 Cb -0.20 -3.36 0.00 0.00 0.10 0.00 0.00 34.13 30.67 1ukw s GLU 245 CO 0.00 -0.38 0.04 -0.25 0.02 0.00 0.00 175.26 174.69 1ukw n ASP 246 N 4.88 0.47 -4.70 -0.19 8.00 -1.13 -4.44 116.55 119.44 1ukw n ASP 246 Ca -0.15 -1.02 -0.42 0.00 0.71 0.00 0.00 54.79 53.90 1ukw n ASP 246 Cb 0.49 -1.27 -0.03 0.00 -0.02 0.00 0.00 41.12 40.29 1ukw n ASP 246 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ukw s VAL 247 N -4.09 4.81 -0.38 2.53 1.01 -0.13 -4.80 120.40 119.35 1ukw s VAL 247 Ca 0.03 2.04 -0.19 0.00 0.00 0.00 0.00 61.98 63.86 1ukw s VAL 247 Cb -0.02 -4.31 0.01 0.00 0.00 0.00 0.00 36.38 32.06 1ukw s VAL 247 CO 0.80 0.10 0.54 -0.54 0.00 0.00 0.00 175.10 175.99 1ukw s LYS 248 N 1.42 3.47 -0.23 2.72 3.01 -1.26 0.09 119.74 128.97 1ukw s LYS 248 Ca 0.51 -0.28 -0.02 0.00 -1.01 0.00 0.00 55.97 55.17 1ukw s LYS 248 Cb -0.20 -3.86 0.02 0.00 -1.01 0.00 0.00 37.83 32.77 1ukw s LYS 248 CO 0.24 -0.76 -0.08 0.08 0.51 0.00 0.00 175.35 175.33 1ukw s VAL 249 N 2.47 2.84 0.55 3.17 1.01 -0.15 -4.92 120.40 125.37 1ukw s VAL 249 Ca 0.19 -0.87 -0.21 0.00 0.00 0.00 0.00 61.98 61.09 1ukw s VAL 249 Cb -0.15 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.82 1ukw s VAL 249 CO 0.15 0.33 1.28 -0.81 0.00 0.00 0.00 175.10 176.05 1ukw n PRO 250 N 4.69 1.55 0.15 2.72 -0.04 -1.26 0.38 135.00 143.19 1ukw n PRO 250 Ca -0.18 0.57 0.12 0.00 -0.04 0.00 0.00 63.50 63.97 1ukw n PRO 250 Cb 0.49 -2.49 0.55 0.00 -0.04 0.00 0.00 33.50 32.01 1ukw n PRO 250 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1ukw n VAL 251 N -1.12 0.93 1.12 0.52 0.24 -0.57 0.15 118.33 119.61 1ukw n VAL 251 Ca 0.11 0.50 0.11 0.00 -2.04 0.00 0.00 64.34 63.02 1ukw n VAL 251 Cb 0.45 -1.47 0.58 0.00 -1.47 0.00 0.00 33.84 31.92 1ukw n VAL 251 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1ukw n GLU 252 N -2.26 0.40 -0.26 7.34 0.00 -1.26 -2.30 120.64 122.29 1ukw n GLU 252 Ca 0.00 0.06 0.08 0.00 0.00 0.00 0.00 57.16 57.30 1ukw n GLU 252 Cb 0.13 -1.50 0.22 0.00 0.00 0.00 0.00 31.44 30.28 1ukw n GLU 252 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1ukw n ASN 253 N -1.22 3.35 -4.75 -1.84 4.13 0.12 -4.95 115.26 110.11 1ukw n ASN 253 Ca 0.12 -2.05 -0.38 0.00 1.68 0.00 0.00 54.58 53.94 1ukw n ASN 253 Cb 0.15 -0.34 -0.06 0.00 -1.54 0.00 0.00 39.78 37.99 1ukw n ASN 253 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 1ukw s ARG 254 N -1.10 4.26 -0.37 3.52 3.52 -0.97 -0.89 118.95 126.92 1ukw s ARG 254 Ca 0.33 0.46 -0.18 0.00 -0.13 0.00 0.00 55.73 56.21 1ukw s ARG 254 Cb 0.18 -3.39 0.00 0.00 -1.56 0.00 0.00 34.95 30.18 1ukw s ARG 254 CO 0.21 0.28 0.53 -0.51 -0.81 0.00 0.00 175.30 175.00 1ukw s LEU 255 N 0.22 4.42 0.00 -0.88 1.02 -0.04 -4.91 118.68 118.51 1ukw s LEU 255 Ca 0.26 -0.13 0.00 0.00 0.02 0.00 0.00 54.13 54.28 1ukw s LEU 255 Cb -0.16 -2.59 0.00 0.00 0.02 0.00 0.00 46.19 43.46 1ukw s LEU 255 CO 0.11 -0.54 0.00 0.61 0.02 0.00 0.00 176.35 176.56 1ukw n GLY 256 N 4.86 -0.94 3.88 -3.19 0.00 -1.25 -4.36 105.19 104.18 1ukw n GLY 256 Ca -0.04 -1.20 -0.21 0.00 0.00 0.00 0.00 46.02 44.57 1ukw n GLY 256 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ukw s GLU 257 N 0.00 2.58 0.35 1.61 0.41 -1.26 -5.00 118.70 117.38 1ukw s GLU 257 Ca 0.00 -1.48 -0.28 0.00 -0.41 0.00 0.00 54.97 52.79 1ukw s GLU 257 Cb 0.00 -2.42 -0.11 0.00 -1.78 0.00 0.00 34.13 29.83 1ukw s GLU 257 CO 0.00 -0.16 1.37 -1.21 -0.49 0.00 0.00 175.26 174.77 1ukw s GLU 258 N -4.13 4.26 0.00 1.61 2.02 -1.26 -1.91 118.70 119.29 1ukw s GLU 258 Ca 0.48 2.35 0.00 0.00 0.02 0.00 0.00 54.97 57.82 1ukw s GLU 258 Cb -0.04 -3.03 0.00 0.00 0.10 0.00 0.00 34.13 31.16 1ukw s GLU 258 CO 0.28 -0.32 0.00 0.41 0.02 0.00 0.00 175.26 175.65 1ukw n GLY 259 N 0.67 1.11 0.71 -1.39 0.00 -0.83 -4.87 105.19 100.58 1ukw n GLY 259 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1ukw n GLY 259 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ukw n GLU 260 N -2.00 1.75 -0.19 1.61 1.02 -0.80 -4.54 120.64 117.50 1ukw n GLU 260 Ca 0.00 -1.44 -0.04 0.00 -0.02 0.00 0.00 57.16 55.67 1ukw n GLU 260 Cb 0.00 -1.45 0.06 0.00 -0.02 0.00 0.00 31.44 30.04 1ukw n GLU 260 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1ukw h GLY 261 N 4.59 0.79 0.94 0.62 0.00 -0.76 -2.30 103.07 106.96 1ukw h GLY 261 Ca 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 1ukw h GLY 261 CO 0.00 0.13 -0.08 -2.75 0.00 0.00 0.00 176.54 173.83 1ukw h PHE 262 N 0.56 -0.22 -0.47 5.60 3.57 -1.75 -0.99 116.94 123.23 1ukw h PHE 262 Ca 0.25 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.77 1ukw h PHE 262 Cb 0.15 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 1ukw h PHE 262 CO -0.10 -0.13 0.31 -0.22 -2.23 0.00 0.00 178.31 175.95 1ukw h LYS 263 N -0.21 0.53 -0.07 1.11 3.64 -1.83 -0.48 116.57 119.26 1ukw h LYS 263 Ca -0.01 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1ukw h LYS 263 Cb 0.18 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1ukw h LYS 263 CO 0.00 0.35 -0.03 0.82 -2.27 0.00 0.00 179.45 178.33 1ukw h ILE 264 N 0.54 1.31 -0.79 2.00 2.04 -0.93 0.31 117.51 122.00 1ukw h ILE 264 Ca 0.19 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1ukw h ILE 264 Cb 0.08 1.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.96 1ukw h ILE 264 CO -0.05 0.28 0.51 0.00 0.00 0.00 0.00 178.15 178.89 1ukw h ALA 265 N 0.64 1.42 -0.12 1.87 0.00 -0.62 -0.98 119.26 121.47 1ukw h ALA 265 Ca 0.02 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 1ukw h ALA 265 Cb 0.46 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ukw h ALA 265 CO 0.01 0.53 -0.46 0.52 0.00 0.00 0.00 179.25 179.85 1ukw h MET 266 N 1.07 0.53 -0.16 0.00 2.86 -1.02 -2.22 114.93 115.98 1ukw h MET 266 Ca 0.29 -0.40 -0.08 0.00 -2.06 0.00 0.00 59.70 57.44 1ukw h MET 266 Cb -0.10 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1ukw h MET 266 CO -0.06 1.03 -0.25 1.96 1.06 0.00 0.00 176.91 180.65 1ukw h GLN 267 N 0.14 0.30 0.27 1.72 4.20 -0.71 -1.56 115.11 119.46 1ukw h GLN 267 Ca -0.02 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 1ukw h GLN 267 Cb 1.09 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.85 1ukw h GLN 267 CO 0.10 0.53 -0.13 1.15 -0.67 0.00 0.00 178.83 179.81 1ukw h THR 268 N 0.27 0.77 -0.35 -0.54 2.02 -1.19 -3.14 112.91 110.75 1ukw h THR 268 Ca 0.04 -0.58 0.05 0.00 0.77 0.00 0.00 66.41 66.69 1ukw h THR 268 Cb 0.58 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 68.05 1ukw h THR 268 CO 0.04 0.12 0.24 -0.07 0.37 0.00 0.00 175.52 176.21 1ukw h LEU 269 N -0.68 0.23 -1.79 2.58 3.38 -1.26 0.29 115.31 118.07 1ukw h LEU 269 Ca -0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1ukw h LEU 269 Cb 0.47 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1ukw h LEU 269 CO 0.06 0.16 -0.00 0.78 0.09 0.00 0.00 178.44 179.53 1ukw h ASN 270 N 0.27 0.11 0.04 -0.43 2.35 -1.24 -2.37 115.58 114.31 1ukw h ASN 270 Ca 0.15 -0.01 -0.31 0.00 -0.55 0.00 0.00 56.30 55.59 1ukw h ASN 270 Cb 0.26 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.56 1ukw h ASN 270 CO -0.03 0.14 -1.68 0.29 -1.65 0.00 0.00 177.43 174.50 1ukw n LYS 271 N -4.46 0.63 0.31 0.81 5.02 -0.15 -4.38 118.16 115.95 1ukw n LYS 271 Ca -0.02 0.43 0.20 0.00 -2.02 0.00 0.00 58.31 56.91 1ukw n LYS 271 Cb 0.13 -1.70 0.98 0.00 -0.02 0.00 0.00 35.03 34.43 1ukw n LYS 271 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1ukw h THR 272 N -0.63 0.00 0.00 -0.18 1.35 -1.02 -1.99 112.91 110.44 1ukw h THR 272 Ca -0.42 -0.24 -0.05 0.00 -0.55 0.00 0.00 66.41 65.16 1ukw h THR 272 Cb 1.59 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 69.24 1ukw h THR 272 CO -0.14 0.00 -0.22 0.03 -0.25 0.00 0.00 175.52 174.94 1ukw h ARG 273 N 0.00 0.00 -0.52 4.72 3.08 -1.63 -2.94 114.38 117.10 1ukw h ARG 273 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1ukw h ARG 273 Cb 0.23 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1ukw h ARG 273 CO 0.00 0.22 0.26 0.82 -1.07 0.00 0.00 179.97 180.20 1ukw h ILE 274 N 0.00 1.19 -0.07 2.04 2.04 -1.59 -1.95 117.51 119.16 1ukw h ILE 274 Ca -0.00 -0.53 -0.05 0.00 1.00 0.00 0.00 64.86 65.28 1ukw h ILE 274 Cb 0.65 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1ukw h ILE 274 CO 0.03 0.21 -0.18 -0.65 0.00 0.00 0.00 178.15 177.56 1ukw h PRO 275 N 0.69 0.12 -0.30 2.37 0.11 -1.67 0.89 132.00 134.21 1ukw h PRO 275 Ca 0.18 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.17 1ukw h PRO 275 Cb 0.10 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.18 1ukw h PRO 275 CO -0.02 0.30 -0.18 0.28 -0.21 0.00 0.00 178.00 178.17 1ukw h VAL 276 N 0.11 1.25 -0.27 3.15 2.07 -1.42 0.26 116.25 121.40 1ukw h VAL 276 Ca 0.02 -1.16 -0.16 0.00 0.82 0.00 0.00 66.70 66.22 1ukw h VAL 276 Cb 0.39 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1ukw h VAL 276 CO 0.03 0.38 -0.46 0.00 0.02 0.00 0.00 177.57 177.53 1ukw h ALA 277 N 1.32 0.68 -0.39 1.67 0.00 -0.54 -1.72 119.26 120.28 1ukw h ALA 277 Ca 0.08 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 1ukw h ALA 277 Cb 0.59 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ukw h ALA 277 CO 0.04 0.67 0.05 0.00 0.00 0.00 0.00 179.25 180.01 1ukw h ALA 278 N 0.92 0.52 -0.09 0.00 0.00 -0.13 -2.20 119.26 118.28 1ukw h ALA 278 Ca 0.03 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ukw h ALA 278 Cb 1.02 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1ukw h ALA 278 CO 0.10 0.24 0.05 0.78 0.00 0.00 0.00 179.25 180.42 1ukw h GLY 279 N 0.49 0.12 -0.07 0.00 0.00 -0.44 -1.94 103.07 101.24 1ukw h GLY 279 Ca 0.12 -0.05 0.15 0.00 0.00 0.00 0.00 47.33 47.54 1ukw h GLY 279 CO 0.01 0.05 0.10 1.76 0.00 0.00 0.00 176.54 178.47 1ukw h SER 280 N 0.08 -0.10 -0.89 0.19 0.02 -1.19 0.22 113.55 111.87 1ukw h SER 280 Ca 0.03 0.15 0.03 0.00 -0.84 0.00 0.00 61.79 61.16 1ukw h SER 280 Cb 0.04 0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.76 1ukw h SER 280 CO -0.01 -0.07 0.59 0.58 -1.14 0.00 0.00 176.83 176.78 1ukw h VAL 281 N 0.21 1.18 -0.51 2.27 2.07 -1.02 -0.27 116.25 120.18 1ukw h VAL 281 Ca 0.38 -0.39 -0.10 0.00 0.82 0.00 0.00 66.70 67.40 1ukw h VAL 281 Cb 0.63 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1ukw h VAL 281 CO -0.52 0.21 -0.09 1.23 0.02 0.00 0.00 177.57 178.42 1ukw h GLY 282 N 1.15 1.01 0.92 2.17 0.00 0.14 -0.40 103.07 108.06 1ukw h GLY 282 Ca 0.35 -0.78 -0.10 0.00 0.00 0.00 0.00 47.33 46.80 1ukw h GLY 282 CO -0.09 0.71 -0.21 -2.08 0.00 0.00 0.00 176.54 174.87 1ukw h VAL 283 N 0.84 1.30 -0.81 4.60 2.07 -0.61 -1.37 116.25 122.27 1ukw h VAL 283 Ca 0.14 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 66.31 1ukw h VAL 283 Cb 0.62 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 1ukw h VAL 283 CO 0.04 0.43 0.52 0.00 0.02 0.00 0.00 177.57 178.58 1ukw h ALA 284 N 0.72 1.03 -0.71 1.67 0.00 -0.90 0.14 119.26 121.20 1ukw h ALA 284 Ca 0.05 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1ukw h ALA 284 Cb 0.76 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1ukw h ALA 284 CO 0.06 0.47 0.22 -0.09 0.00 0.00 0.00 179.25 179.90 1ukw h ARG 285 N 1.11 1.11 -0.19 0.00 2.43 -0.95 -1.10 114.38 116.79 1ukw h ARG 285 Ca 0.30 -0.24 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 1ukw h ARG 285 Cb -0.09 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.28 1ukw h ARG 285 CO -0.06 0.95 -0.13 -0.09 -1.51 0.00 0.00 179.97 179.13 1ukw h ARG 286 N 1.05 0.31 -0.33 0.20 9.65 -0.60 -1.09 114.38 123.59 1ukw h ARG 286 Ca 0.23 -0.08 -0.15 0.00 -1.10 0.00 0.00 59.98 58.88 1ukw h ARG 286 Cb 0.31 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.84 1ukw h ARG 286 CO -0.01 0.45 -0.39 0.00 2.80 0.00 0.00 179.97 182.82 1ukw h ALA 287 N 1.58 0.70 -0.45 2.80 0.00 -0.18 -2.20 119.26 121.50 1ukw h ALA 287 Ca 0.06 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 1ukw h ALA 287 Cb 0.41 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ukw h ALA 287 CO 0.02 0.67 -0.05 1.25 0.00 0.00 0.00 179.25 181.14 1ukw h LEU 288 N 0.64 0.83 -0.17 0.00 5.85 -0.64 -1.76 115.31 120.07 1ukw h LEU 288 Ca 0.05 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1ukw h LEU 288 Cb 0.95 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 1ukw h LEU 288 CO 0.09 0.97 0.07 0.44 -0.34 0.00 0.00 178.44 179.66 1ukw h ASP 289 N 0.67 0.23 0.31 1.25 3.32 -1.14 -1.05 116.42 120.02 1ukw h ASP 289 Ca 0.12 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1ukw h ASP 289 Cb 0.57 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1ukw h ASP 289 CO 0.03 0.33 -0.15 -0.33 -1.72 0.00 0.00 179.24 177.41 1ukw h GLU 290 N 0.11 -0.40 -0.56 3.56 4.39 -1.41 -2.03 114.58 118.24 1ukw h GLU 290 Ca 0.06 0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.89 1ukw h GLU 290 Cb 0.18 0.09 -0.08 0.00 -0.10 0.00 0.00 28.75 28.84 1ukw h GLU 290 CO -0.00 -0.17 0.10 0.00 -1.16 0.00 0.00 179.01 177.78 1ukw h ALA 291 N 0.08 0.64 -0.35 3.43 0.00 -1.31 -0.70 119.26 121.05 1ukw h ALA 291 Ca -0.04 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1ukw h ALA 291 Cb 0.41 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1ukw h ALA 291 CO 0.07 -0.31 -0.02 -0.09 0.00 0.00 0.00 179.25 178.90 1ukw h ARG 292 N 0.24 0.62 -0.88 0.00 2.43 -1.18 0.17 114.38 115.78 1ukw h ARG 292 Ca 0.29 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1ukw h ARG 292 Cb 0.42 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 1ukw h ARG 292 CO -0.38 0.75 0.50 -0.22 -1.51 0.00 0.00 179.97 179.12 1ukw h LYS 293 N 0.43 1.21 -0.17 0.20 3.64 -0.98 -1.25 116.57 119.65 1ukw h LYS 293 Ca 0.10 -0.13 -0.16 0.00 -1.27 0.00 0.00 60.65 59.19 1ukw h LYS 293 Cb 0.49 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1ukw h LYS 293 CO 0.02 0.87 -0.51 -0.92 -2.27 0.00 0.00 179.45 176.64 1ukw h TYR 294 N 1.22 0.83 -0.82 1.91 3.20 -0.99 -2.81 116.97 119.51 1ukw h TYR 294 Ca 0.31 -0.33 0.05 0.00 3.14 0.00 0.00 58.73 61.90 1ukw h TYR 294 Cb -0.01 -0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.07 1ukw h TYR 294 CO 0.01 1.12 0.54 0.00 -1.64 0.00 0.00 178.16 178.18 1ukw h ALA 295 N 0.55 1.54 -0.17 1.82 0.00 -0.29 0.32 119.26 123.03 1ukw h ALA 295 Ca -0.02 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.65 1ukw h ALA 295 Cb 1.13 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.66 1ukw h ALA 295 CO 0.11 0.35 -0.73 0.87 0.00 0.00 0.00 179.25 179.85 1ukw h LYS 296 N 0.96 0.77 0.17 0.00 1.57 -1.24 -1.01 116.57 117.79 1ukw h LYS 296 Ca 0.34 -0.60 -0.28 0.00 -1.87 0.00 0.00 60.65 58.25 1ukw h LYS 296 Cb 0.12 0.11 0.02 0.00 0.08 0.00 0.00 32.23 32.57 1ukw h LYS 296 CO -0.11 1.21 -1.30 0.93 -0.57 0.00 0.00 179.45 179.61 1ukw h GLU 297 N 0.54 0.36 -6.49 3.15 4.39 -1.19 -3.45 114.58 111.90 1ukw h GLU 297 Ca -0.04 -0.62 -0.53 0.00 0.34 0.00 0.00 59.36 58.51 1ukw h GLU 297 Cb 1.35 0.23 0.00 0.00 -0.10 0.00 0.00 28.75 30.23 1ukw h GLU 297 CO 0.15 1.30 0.53 0.50 -1.16 0.00 0.00 179.01 180.33 1ukw s ARG 298 N -2.51 4.46 0.20 2.33 6.06 0.11 -4.95 118.95 124.66 1ukw s ARG 298 Ca -0.15 1.73 0.10 0.00 -2.50 0.00 0.00 55.73 54.91 1ukw s ARG 298 Cb 0.03 -3.35 -0.04 0.00 0.06 0.00 0.00 34.95 31.65 1ukw s ARG 298 CO 0.85 -0.21 -0.15 -1.21 -2.50 0.00 0.00 175.30 172.09 1ukw s GLU 299 N 0.93 1.86 -0.23 5.12 2.02 -1.26 -0.87 118.70 126.27 1ukw s GLU 299 Ca 0.57 -1.42 -0.18 0.00 0.02 0.00 0.00 54.97 53.96 1ukw s GLU 299 Cb -0.28 -2.01 0.07 0.00 0.10 0.00 0.00 34.13 32.00 1ukw s GLU 299 CO 0.30 0.40 0.60 0.00 0.02 0.00 0.00 175.26 176.58 1ukw s ALA 300 N -1.85 -1.54 -1.22 5.21 0.00 -0.09 -4.87 121.76 117.40 1ukw s ALA 300 Ca 0.25 1.89 -0.08 0.00 0.00 0.00 0.00 51.96 54.02 1ukw s ALA 300 Cb -0.08 -1.11 0.01 0.00 0.00 0.00 0.00 23.12 21.94 1ukw s ALA 300 CO 0.14 -0.31 1.07 1.19 0.00 0.00 0.00 175.76 177.84 1ukw n PHE 301 N 3.43 -2.58 -3.47 0.00 3.72 -1.26 -3.22 117.46 114.07 1ukw n PHE 301 Ca -0.17 0.92 -0.18 0.00 -0.05 0.00 0.00 57.45 57.97 1ukw n PHE 301 Cb 0.57 -4.68 0.08 0.00 -0.94 0.00 0.00 39.48 34.50 1ukw n PHE 301 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ukw n GLY 302 N -1.82 -0.35 3.64 1.37 0.00 -1.26 -5.01 105.19 101.76 1ukw n GLY 302 Ca -0.01 0.10 -0.02 0.00 0.00 0.00 0.00 46.02 46.09 1ukw n GLY 302 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ukw s GLU 303 N -5.45 0.08 0.21 1.61 2.12 -1.20 -5.13 118.70 110.95 1ukw s GLU 303 Ca 0.00 0.03 -0.31 0.00 0.36 0.00 0.00 54.97 55.05 1ukw s GLU 303 Cb -0.00 0.04 -0.10 0.00 0.26 0.00 0.00 34.13 34.33 1ukw s GLU 303 CO 0.74 -0.02 1.53 -2.14 -0.54 0.00 0.00 175.26 174.82 1ukw s PRO 304 N -0.93 4.22 0.62 4.30 0.02 -1.26 -0.92 135.00 141.06 1ukw s PRO 304 Ca 0.08 2.36 0.32 0.00 0.02 0.00 0.00 61.00 63.79 1ukw s PRO 304 Cb -0.01 -3.12 1.82 0.00 0.02 0.00 0.00 34.50 33.20 1ukw s PRO 304 CO -0.08 -0.54 2.12 -0.84 -0.33 0.00 0.00 177.00 177.32 1ukw h ILE 305 N 3.78 0.27 0.00 2.83 3.07 -0.79 0.26 117.51 126.94 1ukw h ILE 305 Ca -0.44 0.00 -0.00 0.00 1.55 0.00 0.00 64.86 65.96 1ukw h ILE 305 Cb 1.21 0.84 -0.00 0.00 -0.27 0.00 0.00 36.82 38.60 1ukw h ILE 305 CO 0.85 0.00 -0.02 0.00 -1.05 0.00 0.00 178.15 177.94 1ukw h ALA 306 N 1.73 1.28 0.00 0.16 0.00 -1.44 -0.03 119.26 120.95 1ukw h ALA 306 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ukw h ALA 306 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ukw h ALA 306 CO -0.00 0.02 0.00 -0.91 0.00 0.00 0.00 179.25 178.36 1ukw h ASN 307 N 0.00 0.00 -3.38 0.00 4.21 -0.75 -3.41 115.58 112.25 1ukw h ASN 307 Ca -0.00 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.96 1ukw h ASN 307 Cb 0.07 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.23 1ukw h ASN 307 CO 0.00 0.00 0.20 -0.36 -1.29 0.00 0.00 177.43 175.98 1ukw s PHE 308 N -3.28 3.61 0.39 1.19 2.99 -0.03 -4.96 117.98 117.90 1ukw s PHE 308 Ca 0.06 1.43 0.08 0.00 0.00 0.00 0.00 56.93 58.49 1ukw s PHE 308 Cb 0.10 -2.92 0.83 0.00 0.00 0.00 0.00 43.02 41.03 1ukw s PHE 308 CO 0.48 0.06 2.00 0.37 -0.00 0.00 0.00 175.22 178.13 1ukw h GLN 309 N 6.73 0.61 -0.67 0.44 4.15 -1.86 -0.82 115.11 123.70 1ukw h GLN 309 Ca -0.41 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 58.93 1ukw h GLN 309 Cb 1.21 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.73 1ukw h GLN 309 CO 0.75 0.40 0.24 0.00 -1.93 0.00 0.00 178.83 178.29 1ukw h ALA 310 N 1.67 1.16 0.00 3.38 0.00 -1.93 -0.93 119.26 122.62 1ukw h ALA 310 Ca 0.25 -0.19 -0.22 0.00 0.00 0.00 0.00 54.91 54.75 1ukw h ALA 310 Cb 0.19 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1ukw h ALA 310 CO -0.07 0.59 -0.94 0.82 0.00 0.00 0.00 179.25 179.66 1ukw h ILE 311 N 0.97 1.43 -0.48 0.00 1.08 -1.63 -2.93 117.51 115.95 1ukw h ILE 311 Ca 0.22 -2.50 -0.04 0.00 -0.39 0.00 0.00 64.86 62.15 1ukw h ILE 311 Cb 0.23 2.44 -0.02 0.00 -3.07 0.00 0.00 36.82 36.41 1ukw h ILE 311 CO -0.01 0.74 0.16 1.56 -0.69 0.00 0.00 178.15 179.91 1ukw h GLN 312 N 0.20 0.74 -0.16 2.37 4.20 -0.82 -2.40 115.11 119.23 1ukw h GLN 312 Ca -0.07 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.43 1ukw h GLN 312 Cb 1.57 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 29.23 1ukw h GLN 312 CO 0.16 0.69 -0.14 0.74 -0.67 0.00 0.00 178.83 179.61 1ukw h PHE 313 N 0.64 0.27 -0.32 2.96 -1.00 -1.21 0.97 116.94 119.25 1ukw h PHE 313 Ca 0.16 -0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.86 1ukw h PHE 313 Cb 0.25 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 39.72 1ukw h PHE 313 CO 0.01 0.40 0.03 0.87 -1.61 0.00 0.00 178.31 178.01 1ukw h LYS 314 N 0.25 0.55 -0.67 1.51 1.57 -1.30 -0.49 116.57 117.98 1ukw h LYS 314 Ca 0.05 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.62 1ukw h LYS 314 Cb 0.40 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 1ukw h LYS 314 CO 0.02 0.66 0.21 -0.07 -0.57 0.00 0.00 179.45 179.70 1ukw h LEU 315 N 0.36 0.95 -0.47 2.94 3.38 -0.91 -2.03 115.31 119.53 1ukw h LEU 315 Ca 0.09 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1ukw h LEU 315 Cb 0.39 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1ukw h LEU 315 CO 0.01 0.89 0.12 0.58 0.09 0.00 0.00 178.44 180.13 1ukw h VAL 316 N 0.98 1.23 -0.26 1.22 2.07 -0.59 -2.39 116.25 118.52 1ukw h VAL 316 Ca 0.22 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.89 1ukw h VAL 316 Cb 0.28 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1ukw h VAL 316 CO -0.01 0.29 -0.03 0.44 0.02 0.00 0.00 177.57 178.28 1ukw h ASP 317 N 0.63 0.37 0.37 0.57 3.32 -0.73 -1.18 116.42 119.76 1ukw h ASP 317 Ca 0.15 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1ukw h ASP 317 Cb 0.31 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1ukw h ASP 317 CO -0.00 0.45 -0.18 0.24 -1.72 0.00 0.00 179.24 178.04 1ukw h MET 318 N 0.38 -0.47 -0.31 3.56 2.86 -1.04 -2.63 114.93 117.28 1ukw h MET 318 Ca 0.08 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1ukw h MET 318 Cb 0.30 0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 1ukw h MET 318 CO 0.01 -0.28 0.20 1.25 1.06 0.00 0.00 176.91 179.15 1ukw h LEU 319 N -0.55 0.36 -0.19 1.22 5.85 -1.04 -0.42 115.31 120.53 1ukw h LEU 319 Ca -0.05 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1ukw h LEU 319 Cb 0.41 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1ukw h LEU 319 CO 0.08 0.27 0.07 0.40 -0.34 0.00 0.00 178.44 178.92 1ukw h ILE 320 N 0.43 1.18 -0.14 4.05 2.04 -1.06 -0.76 117.51 123.25 1ukw h ILE 320 Ca 0.11 -0.56 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 1ukw h ILE 320 Cb -0.04 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1ukw h ILE 320 CO -0.02 0.18 0.02 1.23 0.00 0.00 0.00 178.15 179.56 1ukw h GLY 321 N 0.14 0.24 0.26 5.37 0.00 -1.07 -2.14 103.07 105.88 1ukw h GLY 321 Ca 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1ukw h GLY 321 CO -0.00 0.15 -0.52 -2.22 0.00 0.00 0.00 176.54 173.95 1ukw h ILE 322 N 0.01 0.01 -0.55 2.60 2.04 -1.02 0.30 117.51 120.90 1ukw h ILE 322 Ca 0.04 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.95 1ukw h ILE 322 Cb 0.29 0.01 -0.05 0.00 -0.74 0.00 0.00 36.82 36.34 1ukw h ILE 322 CO 0.00 0.00 0.28 -0.33 0.00 0.00 0.00 178.15 178.10 1ukw h GLU 323 N -0.84 0.53 -0.14 2.37 4.39 -1.18 0.98 114.58 120.68 1ukw h GLU 323 Ca -0.02 -0.03 -0.17 0.00 0.34 0.00 0.00 59.36 59.47 1ukw h GLU 323 Cb 0.80 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1ukw h GLU 323 CO -0.21 0.35 -0.63 1.79 -1.16 0.00 0.00 179.01 179.15 1ukw h THR 324 N 0.54 1.34 -0.20 1.13 1.35 -1.28 -2.64 112.91 113.15 1ukw h THR 324 Ca 0.24 -1.92 -0.17 0.00 -0.55 0.00 0.00 66.41 64.01 1ukw h THR 324 Cb 0.15 1.90 -0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1ukw h THR 324 CO -0.17 0.59 -0.59 0.00 -0.25 0.00 0.00 175.52 175.11 1ukw h ALA 325 N 0.93 0.60 -0.23 6.62 0.00 -0.01 -2.38 119.26 124.80 1ukw h ALA 325 Ca -0.01 -0.53 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 1ukw h ALA 325 Cb 1.18 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1ukw h ALA 325 CO 0.11 0.69 -0.08 -0.09 0.00 0.00 0.00 179.25 179.89 1ukw h ARG 326 N 0.48 0.45 -0.80 0.00 2.43 -0.82 -0.78 114.38 115.34 1ukw h ARG 326 Ca 0.00 -0.18 -0.03 0.00 -0.81 0.00 0.00 59.98 58.95 1ukw h ARG 326 Cb 1.16 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.65 1ukw h ARG 326 CO 0.12 0.71 0.38 0.52 -1.51 0.00 0.00 179.97 180.18 1ukw h MET 327 N 0.17 1.15 0.00 0.20 2.86 -1.49 0.13 114.93 117.96 1ukw h MET 327 Ca 0.05 -0.17 -0.09 0.00 -2.06 0.00 0.00 59.70 57.43 1ukw h MET 327 Cb 0.56 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 1ukw h MET 327 CO 0.03 0.89 -0.45 -0.92 1.06 0.00 0.00 176.91 177.52 1ukw h TYR 328 N 1.14 0.00 -0.21 -0.22 3.20 -1.37 -1.74 116.97 117.77 1ukw h TYR 328 Ca 0.27 0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.97 1ukw h TYR 328 Cb 0.13 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 1ukw h TYR 328 CO 0.01 0.45 -0.58 1.15 -1.64 0.00 0.00 178.16 177.55 1ukw h THR 329 N 0.00 1.31 -0.60 1.81 2.02 0.02 -1.67 112.91 115.79 1ukw h THR 329 Ca -0.00 -1.82 -0.09 0.00 0.77 0.00 0.00 66.41 65.27 1ukw h THR 329 Cb 0.96 1.77 -0.02 0.00 -1.74 0.00 0.00 68.15 69.12 1ukw h THR 329 CO 0.06 0.57 0.03 1.88 0.37 0.00 0.00 175.52 178.44 1ukw h TYR 330 N 0.50 1.13 -0.72 3.16 0.05 -0.52 -1.45 116.97 119.12 1ukw h TYR 330 Ca 0.00 -0.18 -0.01 0.00 0.05 0.00 0.00 58.73 58.59 1ukw h TYR 330 Cb 1.16 -0.30 -0.03 0.00 1.01 0.00 0.00 36.73 38.57 1ukw h TYR 330 CO 0.06 0.99 0.41 -0.92 -1.05 0.00 0.00 178.16 177.64 1ukw h TYR 331 N 0.94 0.97 -0.44 4.88 5.03 -1.19 0.14 116.97 127.31 1ukw h TYR 331 Ca 0.18 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.44 1ukw h TYR 331 Cb 0.51 -0.31 -0.02 0.00 1.55 0.00 0.00 36.73 38.46 1ukw h TYR 331 CO 0.04 0.68 0.18 0.00 -1.32 0.00 0.00 178.16 177.73 1ukw h ALA 332 N 1.21 0.57 -0.50 1.82 0.00 -1.05 -1.19 119.26 120.12 1ukw h ALA 332 Ca 0.26 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1ukw h ALA 332 Cb 0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1ukw h ALA 332 CO -0.04 0.17 0.06 0.00 0.00 0.00 0.00 179.25 179.44 1ukw h ALA 333 N 1.02 1.17 0.09 0.00 0.00 -0.85 -2.19 119.26 118.50 1ukw h ALA 333 Ca 0.15 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1ukw h ALA 333 Cb 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ukw h ALA 333 CO -0.01 0.55 -0.04 2.35 0.00 0.00 0.00 179.25 182.10 1ukw h TRP 334 N 0.76 -0.11 -0.40 0.00 7.01 -0.36 -0.36 115.95 122.49 1ukw h TRP 334 Ca 0.16 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.22 1ukw h TRP 334 Cb 0.37 0.04 -0.06 0.00 -2.10 0.00 0.00 29.16 27.41 1ukw h TRP 334 CO 0.02 -0.03 0.03 -0.07 -2.79 0.00 0.00 178.44 175.61 1ukw h LEU 335 N -0.17 -0.09 -0.46 0.65 3.38 -0.98 -0.52 115.31 117.12 1ukw h LEU 335 Ca -0.01 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1ukw h LEU 335 Cb 0.14 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1ukw h LEU 335 CO 0.02 -0.01 0.27 0.00 0.09 0.00 0.00 178.44 178.81 1ukw h ALA 336 N 1.33 0.58 0.00 1.53 0.00 -1.25 0.65 119.26 122.10 1ukw h ALA 336 Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ukw h ALA 336 Cb 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ukw h ALA 336 CO -0.29 0.08 0.00 -0.44 0.00 0.00 0.00 179.25 178.60 1ukw h ASP 337 N 0.61 0.00 0.07 0.00 3.32 -0.36 -1.91 116.42 118.15 1ukw h ASP 337 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1ukw h ASP 337 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1ukw h ASP 337 CO -0.03 0.00 -0.42 0.00 -1.72 0.00 0.00 179.24 177.07 1ukw n GLN 338 N -2.51 1.05 -1.11 3.56 1.13 -0.27 -4.94 117.38 114.28 1ukw n GLN 338 Ca 0.01 -0.80 -0.01 0.00 -1.94 0.00 0.00 57.00 54.25 1ukw n GLN 338 Cb 0.20 -1.48 -0.01 0.00 0.11 0.00 0.00 30.24 29.06 1ukw n GLN 338 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ukw n GLY 339 N 1.40 0.47 3.94 1.08 0.00 -0.72 -5.04 105.19 106.32 1ukw n GLY 339 Ca 0.10 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 44.87 1ukw n GLY 339 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ukw s LEU 340 N -0.30 4.02 0.29 0.99 1.43 0.15 -5.02 118.68 120.25 1ukw s LEU 340 Ca 0.00 0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 53.21 1ukw s LEU 340 Cb 0.00 -3.27 -0.12 0.00 0.03 0.00 0.00 46.19 42.84 1ukw s LEU 340 CO 0.00 -0.29 1.59 -2.65 0.23 0.00 0.00 176.35 175.23 1ukw n PRO 341 N -1.77 2.69 -0.12 1.29 -0.02 -1.26 -4.32 135.00 131.50 1ukw n PRO 341 Ca -0.05 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 1ukw n PRO 341 Cb 0.56 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1ukw n PRO 341 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 1ukw n HIS 342 N 2.11 0.00 -0.15 6.00 1.44 -1.26 -4.86 115.22 118.50 1ukw n HIS 342 Ca 0.08 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.71 1ukw n HIS 342 Cb 0.37 0.05 0.01 0.00 0.12 0.00 0.00 29.99 30.53 1ukw n HIS 342 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ukw h ALA 343 N 0.00 0.57 -0.41 1.59 0.00 -1.90 -1.67 119.26 117.44 1ukw h ALA 343 Ca 0.00 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1ukw h ALA 343 Cb 1.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1ukw h ALA 343 CO 0.00 0.08 -0.27 1.12 0.00 0.00 0.00 179.25 180.18 1ukw h HIS 344 N 0.58 1.06 -0.41 0.00 2.07 -1.90 -2.79 115.15 113.76 1ukw h HIS 344 Ca 0.16 -0.28 -0.05 0.00 -2.85 0.00 0.00 60.37 57.34 1ukw h HIS 344 Cb 0.03 -0.24 -0.02 0.00 2.57 0.00 0.00 27.41 29.76 1ukw h HIS 344 CO -0.02 1.09 0.06 0.00 -3.07 0.00 0.00 177.93 175.98 1ukw h ALA 345 N 0.80 0.54 0.00 6.11 0.00 -1.87 -1.79 119.26 123.07 1ukw h ALA 345 Ca 0.08 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1ukw h ALA 345 Cb 0.85 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1ukw h ALA 345 CO 0.07 0.27 -0.47 0.66 0.00 0.00 0.00 179.25 179.78 1ukw h SER 346 N 0.53 0.00 -0.40 0.00 4.64 -1.36 -0.16 113.55 116.80 1ukw h SER 346 Ca 0.12 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.31 1ukw h SER 346 Cb 0.39 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 1ukw h SER 346 CO 0.01 0.47 -0.27 0.00 -0.87 0.00 0.00 176.83 176.17 1ukw h ALA 347 N 1.53 0.58 -0.27 5.18 0.00 -1.34 -0.46 119.26 124.47 1ukw h ALA 347 Ca -0.00 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 1ukw h ALA 347 Cb 0.93 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1ukw h ALA 347 CO 0.06 0.59 -0.06 0.82 0.00 0.00 0.00 179.25 180.67 1ukw h ILE 348 N 0.71 1.28 -0.22 0.00 2.04 -1.05 -1.86 117.51 118.41 1ukw h ILE 348 Ca 0.08 -1.07 -0.00 0.00 1.00 0.00 0.00 64.86 64.87 1ukw h ILE 348 Cb 0.85 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 1ukw h ILE 348 CO 0.07 0.34 0.12 0.00 0.00 0.00 0.00 178.15 178.69 1ukw h ALA 349 N 0.78 0.28 0.21 1.87 0.00 -0.93 0.66 119.26 122.12 1ukw h ALA 349 Ca 0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ukw h ALA 349 Cb 0.53 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ukw h ALA 349 CO 0.03 -0.20 -0.10 -0.22 0.00 0.00 0.00 179.25 178.76 1ukw h LYS 350 N 0.25 -0.27 -0.12 0.00 3.11 -1.07 -0.45 116.57 118.02 1ukw h LYS 350 Ca 0.08 0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 57.93 1ukw h LYS 350 Cb 0.05 0.06 -0.00 0.00 -1.00 0.00 0.00 32.23 31.34 1ukw h LYS 350 CO -0.01 -0.15 0.03 0.00 -2.81 0.00 0.00 179.45 176.51 1ukw h ALA 351 N 0.47 0.15 0.76 5.00 0.00 -1.31 -2.30 119.26 122.05 1ukw h ALA 351 Ca -0.03 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1ukw h ALA 351 Cb 0.24 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1ukw h ALA 351 CO 0.05 -0.23 -0.37 -0.92 0.00 0.00 0.00 179.25 177.78 1ukw h TYR 352 N 0.00 -0.95 -0.24 0.00 3.20 -0.85 -2.33 116.97 115.80 1ukw h TYR 352 Ca 0.04 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.94 1ukw h TYR 352 Cb 0.23 0.31 -0.06 0.00 1.54 0.00 0.00 36.73 38.75 1ukw h TYR 352 CO 0.00 -0.57 -0.16 0.00 -1.64 0.00 0.00 178.16 175.79 1ukw h ALA 353 N -1.00 0.02 0.00 1.82 0.00 -1.16 -0.64 119.26 118.30 1ukw h ALA 353 Ca -0.10 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ukw h ALA 353 Cb 0.80 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ukw h ALA 353 CO 0.17 -0.57 -0.04 0.66 0.00 0.00 0.00 179.25 179.47 1ukw h SER 354 N -0.15 0.00 0.06 0.00 4.64 -1.46 0.24 113.55 116.89 1ukw h SER 354 Ca 0.13 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.25 1ukw h SER 354 Cb 0.35 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.46 1ukw h SER 354 CO -0.33 0.04 -0.83 -0.33 -0.87 0.00 0.00 176.83 174.50 1ukw h GLU 355 N 0.00 0.45 0.00 4.77 5.08 -0.66 -2.46 114.58 121.76 1ukw h GLU 355 Ca -0.00 -0.57 -0.10 0.00 -1.00 0.00 0.00 59.36 57.69 1ukw h GLU 355 Cb 0.07 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1ukw h GLU 355 CO 0.00 1.22 -0.46 -0.84 -1.00 0.00 0.00 179.01 177.93 1ukw h ILE 356 N -0.05 1.06 -0.16 3.13 -0.00 -0.64 -2.40 117.51 118.45 1ukw h ILE 356 Ca -0.12 -1.77 -0.14 0.00 -0.00 0.00 0.00 64.86 62.83 1ukw h ILE 356 Cb 1.56 2.03 -0.01 0.00 -0.00 0.00 0.00 36.82 40.40 1ukw h ILE 356 CO 0.16 0.46 -0.50 0.00 -0.00 0.00 0.00 178.15 178.26 1ukw h ALA 357 N 1.54 0.83 -0.10 0.16 0.00 -0.57 -0.77 119.26 120.34 1ukw h ALA 357 Ca -0.00 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 1ukw h ALA 357 Cb 1.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1ukw h ALA 357 CO 0.06 0.67 -0.13 0.35 0.00 0.00 0.00 179.25 180.20 1ukw h PHE 358 N 0.35 0.33 -0.90 0.00 3.57 -1.24 -2.14 116.94 116.89 1ukw h PHE 358 Ca 0.01 -0.10 0.04 0.00 3.53 0.00 0.00 57.97 61.45 1ukw h PHE 358 Cb 1.01 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 39.63 1ukw h PHE 358 CO 0.03 0.71 0.58 0.93 -2.23 0.00 0.00 178.31 178.34 1ukw h GLU 359 N -0.15 1.10 -0.56 1.11 5.08 -1.37 -1.41 114.58 118.38 1ukw h GLU 359 Ca 0.01 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1ukw h GLU 359 Cb 0.67 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1ukw h GLU 359 CO 0.03 0.73 0.34 0.00 -1.00 0.00 0.00 179.01 179.11 1ukw h ALA 360 N 1.38 0.71 -0.38 3.43 0.00 -1.06 -1.27 119.26 122.07 1ukw h ALA 360 Ca 0.36 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.08 1ukw h ALA 360 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1ukw h ALA 360 CO -0.12 0.18 -0.27 0.00 0.00 0.00 0.00 179.25 179.04 1ukw h ALA 361 N 1.17 0.81 0.09 0.00 0.00 -1.07 0.10 119.26 120.37 1ukw h ALA 361 Ca 0.20 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1ukw h ALA 361 Cb -0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1ukw h ALA 361 CO -0.04 0.65 -0.05 -0.97 0.00 0.00 0.00 179.25 178.84 1ukw h ASN 362 N 0.69 -0.12 0.11 0.00 -1.24 -0.95 -1.10 115.58 112.97 1ukw h ASN 362 Ca 0.09 0.01 -0.08 0.00 0.71 0.00 0.00 56.30 57.02 1ukw h ASN 362 Cb 0.80 0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.87 1ukw h ASN 362 CO 0.07 -0.08 -0.27 1.56 -1.29 0.00 0.00 177.43 177.41 1ukw h GLN 363 N -0.13 0.26 -0.60 6.67 1.08 -1.14 -1.73 115.11 119.52 1ukw h GLN 363 Ca -0.01 -0.09 -0.07 0.00 -1.45 0.00 0.00 58.65 57.03 1ukw h GLN 363 Cb 0.11 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.49 1ukw h GLN 363 CO 0.02 0.52 0.10 0.00 -0.95 0.00 0.00 178.83 178.52 1ukw h ALA 364 N 1.49 1.06 0.28 3.87 0.00 -0.55 0.10 119.26 125.51 1ukw h ALA 364 Ca 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1ukw h ALA 364 Cb 0.61 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ukw h ALA 364 CO 0.04 0.61 -0.13 0.82 0.00 0.00 0.00 179.25 180.59 1ukw h ILE 365 N 0.90 0.76 -0.73 0.00 2.04 -0.83 -2.94 117.51 116.71 1ukw h ILE 365 Ca 0.19 -0.47 0.17 0.00 1.00 0.00 0.00 64.86 65.74 1ukw h ILE 365 Cb 0.39 1.02 -0.12 0.00 -0.74 0.00 0.00 36.82 37.36 1ukw h ILE 365 CO 0.01 0.10 0.08 -0.61 0.00 0.00 0.00 178.15 177.72 1ukw h GLN 366 N -0.63 0.16 0.00 2.37 5.75 -0.93 0.16 115.11 121.98 1ukw h GLN 366 Ca -0.04 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.44 1ukw h GLN 366 Cb 0.45 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 28.96 1ukw h GLN 366 CO 0.06 0.11 -0.06 0.82 -2.65 0.00 0.00 178.83 177.11 1ukw h ILE 367 N 0.16 0.44 0.00 2.39 2.04 -0.73 -1.79 117.51 120.03 1ukw h ILE 367 Ca 0.41 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1ukw h ILE 367 Cb 0.72 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1ukw h ILE 367 CO -0.59 0.06 -0.25 1.41 0.00 0.00 0.00 178.15 178.77 1ukw n HIS 368 N -3.59 0.42 -4.55 1.37 8.25 0.53 -4.86 115.22 112.78 1ukw n HIS 368 Ca -0.02 0.12 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1ukw n HIS 368 Cb 0.17 -0.62 0.00 0.00 1.12 0.00 0.00 29.99 30.66 1ukw n HIS 368 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ukw n GLY 369 N 1.40 1.13 0.34 -1.41 0.00 -0.67 -2.96 105.19 103.02 1ukw n GLY 369 Ca 0.05 -0.72 0.10 0.00 0.00 0.00 0.00 46.02 45.45 1ukw n GLY 369 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ukw h GLY 370 N 0.00 0.63 2.00 -0.02 0.00 -1.90 0.39 103.07 104.18 1ukw h GLY 370 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 1ukw h GLY 370 CO 0.00 0.14 -0.08 -0.97 0.00 0.00 0.00 176.54 175.63 1ukw h TYR 371 N 0.49 0.00 0.00 5.60 -1.99 -1.90 -2.06 116.97 117.10 1ukw h TYR 371 Ca 0.26 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.99 1ukw h TYR 371 Cb 0.39 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.12 1ukw h TYR 371 CO -0.00 0.08 0.00 0.78 -0.00 0.00 0.00 178.16 179.02 1ukw h GLY 372 N 1.25 0.00 0.70 3.88 0.00 -0.92 -3.21 103.07 104.76 1ukw h GLY 372 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ukw h GLY 372 CO 0.01 0.00 -0.15 2.98 0.00 0.00 0.00 176.54 179.38 1ukw n TYR 373 N -2.47 0.00 -4.53 5.60 9.36 -0.77 -3.72 117.16 120.63 1ukw n TYR 373 Ca 0.04 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 60.97 1ukw n TYR 373 Cb 0.37 -0.16 -0.13 0.00 -0.63 0.00 0.00 39.34 38.78 1ukw n TYR 373 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1ukw s VAL 374 N -2.47 2.19 -1.62 2.97 -7.23 -1.21 -5.00 120.40 108.02 1ukw s VAL 374 Ca 0.28 -1.64 0.05 0.00 -1.81 0.00 0.00 61.98 58.85 1ukw s VAL 374 Cb 0.20 -1.93 0.10 0.00 0.56 0.00 0.00 36.38 35.31 1ukw s VAL 374 CO 0.48 0.16 0.91 0.54 -0.31 0.00 0.00 175.10 176.88 1ukw n ARG 375 N 1.16 0.10 0.25 4.82 1.74 -1.26 -1.23 116.66 122.24 1ukw n ARG 375 Ca -0.18 0.16 0.17 0.00 -0.77 0.00 0.00 57.85 57.23 1ukw n ARG 375 Cb 0.53 -1.50 0.72 0.00 -1.02 0.00 0.00 32.46 31.19 1ukw n ARG 375 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 1ukw h GLU 376 N 0.00 0.00 -6.34 5.56 4.57 -1.95 -3.41 114.58 113.01 1ukw h GLU 376 Ca 0.00 0.00 -0.62 0.00 -1.18 0.00 0.00 59.36 57.56 1ukw h GLU 376 Cb 0.03 0.00 -0.15 0.00 -0.16 0.00 0.00 28.75 28.47 1ukw h GLU 376 CO 0.00 0.00 -0.76 -0.06 -1.18 0.00 0.00 179.01 177.01 1ukw s PHE 377 N -3.66 2.37 -0.63 0.92 0.40 -0.37 -5.08 117.98 111.93 1ukw s PHE 377 Ca 0.01 -0.32 0.25 0.00 -0.60 0.00 0.00 56.93 56.27 1ukw s PHE 377 Cb 0.09 -1.08 0.51 0.00 0.51 0.00 0.00 43.02 43.05 1ukw s PHE 377 CO 0.48 0.63 1.52 -1.00 0.70 0.00 0.00 175.22 177.55 1ukw h PRO 378 N 2.54 0.00 -0.78 0.24 0.13 -1.83 -3.39 132.00 128.91 1ukw h PRO 378 Ca -0.43 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.68 1ukw h PRO 378 Cb 1.24 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 1ukw h PRO 378 CO 0.56 0.00 0.41 -0.39 -0.23 0.00 0.00 178.00 178.35 1ukw h VAL 379 N 0.00 1.24 -0.32 1.56 -1.51 -1.90 -3.06 116.25 112.26 1ukw h VAL 379 Ca 0.00 -0.63 0.07 0.00 -1.23 0.00 0.00 66.70 64.91 1ukw h VAL 379 Cb 0.79 0.20 -0.06 0.00 -2.13 0.00 0.00 31.29 30.09 1ukw h VAL 379 CO 0.00 0.27 -0.10 -0.08 -1.23 0.00 0.00 177.57 176.44 1ukw h GLU 380 N 1.10 -0.02 -0.06 5.19 4.22 -1.75 -2.12 114.58 121.13 1ukw h GLU 380 Ca 0.27 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.67 1ukw h GLU 380 Cb 0.06 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1ukw h GLU 380 CO -0.04 -0.02 -0.16 -0.22 -2.18 0.00 0.00 179.01 176.40 1ukw h LYS 381 N -0.02 0.10 -0.54 1.92 3.64 -1.80 -2.82 116.57 117.05 1ukw h LYS 381 Ca 0.16 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 1ukw h LYS 381 Cb 0.26 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 1ukw h LYS 381 CO -0.34 0.26 0.30 -0.07 -2.27 0.00 0.00 179.45 177.33 1ukw h LEU 382 N 0.10 0.46 -0.08 5.20 4.07 -1.33 -0.28 115.31 123.45 1ukw h LEU 382 Ca 0.02 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.99 1ukw h LEU 382 Cb 0.34 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 42.00 1ukw h LEU 382 CO 0.02 0.32 0.04 0.25 -1.08 0.00 0.00 178.44 177.99 1ukw h LEU 383 N 0.59 0.11 -1.58 1.67 5.85 -1.43 0.07 115.31 120.59 1ukw h LEU 383 Ca 0.23 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1ukw h LEU 383 Cb 0.09 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1ukw h LEU 383 CO -0.13 0.18 0.09 0.03 -0.34 0.00 0.00 178.44 178.27 1ukw h ARG 384 N 0.03 0.37 0.09 1.25 3.08 -1.43 -2.53 114.38 115.23 1ukw h ARG 384 Ca 0.03 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1ukw h ARG 384 Cb 0.10 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1ukw h ARG 384 CO -0.00 0.32 -0.04 -0.44 -1.07 0.00 0.00 179.97 178.73 1ukw h ASP 385 N 0.37 -0.11 0.13 7.04 3.45 -0.76 -3.27 116.42 123.27 1ukw h ASP 385 Ca 0.09 -0.41 -0.01 0.00 0.43 0.00 0.00 57.03 57.14 1ukw h ASP 385 Cb 0.10 0.03 -0.00 0.00 -0.56 0.00 0.00 39.33 38.89 1ukw h ASP 385 CO -0.01 0.54 -0.05 1.62 -1.57 0.00 0.00 179.24 179.77 1ukw h VAL 386 N -0.94 0.58 -0.93 -1.35 3.04 -0.94 -2.65 116.25 113.06 1ukw h VAL 386 Ca -0.01 -0.20 0.06 0.00 -1.01 0.00 0.00 66.70 65.54 1ukw h VAL 386 Cb 0.51 1.13 -0.06 0.00 -2.01 0.00 0.00 31.29 30.85 1ukw h VAL 386 CO 0.02 0.05 0.61 0.50 -1.01 0.00 0.00 177.57 177.73 1ukw h LYS 387 N 0.00 1.04 -0.49 4.17 1.63 -1.60 -1.33 116.57 119.99 1ukw h LYS 387 Ca -0.00 -0.06 0.05 0.00 -0.85 0.00 0.00 60.65 59.79 1ukw h LYS 387 Cb 0.13 -0.23 -0.03 0.00 -0.60 0.00 0.00 32.23 31.49 1ukw h LYS 387 CO 0.01 0.69 0.33 1.25 -3.45 0.00 0.00 179.45 178.27 1ukw h LEU 388 N 1.07 0.41 -1.96 5.20 6.46 -1.67 -1.46 115.31 123.35 1ukw h LEU 388 Ca 0.40 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.16 1ukw h LEU 388 Cb 0.19 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.03 1ukw h LEU 388 CO -0.15 0.27 0.00 0.78 -0.62 0.00 0.00 178.44 178.72 1ukw h ASN 389 N 0.47 0.00 0.48 1.25 -0.26 -1.39 0.26 115.58 116.39 1ukw h ASN 389 Ca 0.21 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.95 1ukw h ASN 389 Cb 0.24 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.50 1ukw h ASN 389 CO -0.05 0.00 -0.40 0.00 -1.06 0.00 0.00 177.43 175.91 1ukw n GLN 390 N -2.60 0.18 -0.05 0.81 6.02 -0.55 -4.51 117.38 116.68 1ukw n GLN 390 Ca -0.02 -0.10 -0.10 0.00 -0.01 0.00 0.00 57.00 56.77 1ukw n GLN 390 Cb 0.07 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.80 1ukw n GLN 390 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1ukw n ILE 391 N -1.32 0.65 -1.69 5.09 5.41 0.81 -2.02 119.36 126.28 1ukw n ILE 391 Ca 0.07 -0.09 -0.30 0.00 1.00 0.00 0.00 62.75 63.43 1ukw n ILE 391 Cb 0.34 -1.67 0.07 0.00 -0.71 0.00 0.00 39.64 37.67 1ukw n ILE 391 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1ukw s TYR 392 N -2.20 3.05 -1.46 1.39 1.13 -0.50 -2.55 117.35 116.20 1ukw s TYR 392 Ca -0.14 1.12 -0.08 0.00 -1.41 0.00 0.00 57.07 56.57 1ukw s TYR 392 Cb 0.05 -3.09 0.03 0.00 -1.10 0.00 0.00 41.96 37.85 1ukw s TYR 392 CO 0.18 -1.50 0.82 0.39 -2.51 0.00 0.00 175.55 172.93 1ukw n GLU 393 N -3.24 -5.71 -0.05 -3.49 1.02 -1.26 -4.59 120.64 103.32 1ukw n GLU 393 Ca 0.07 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 57.99 1ukw n GLU 393 Cb 0.56 -5.69 0.00 0.00 -0.02 0.00 0.00 31.44 26.30 1ukw n GLU 393 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ukw n GLY 394 N -1.65 0.14 3.76 0.62 0.00 -1.23 -4.94 105.19 101.89 1ukw n GLY 394 Ca -0.04 -1.21 -0.31 0.00 0.00 0.00 0.00 46.02 44.47 1ukw n GLY 394 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ukw s THR 395 N -0.19 3.28 0.01 2.61 -4.23 -1.06 -4.59 115.64 111.47 1ukw s THR 395 Ca 0.00 0.42 0.30 0.00 -1.18 0.00 0.00 61.69 61.22 1ukw s THR 395 Cb 0.00 -2.88 0.31 0.00 1.34 0.00 0.00 72.50 71.26 1ukw s THR 395 CO 0.00 -0.54 1.90 0.78 -0.54 0.00 0.00 174.62 176.22 1ukw h ASN 396 N -1.16 0.00 -0.03 3.99 2.35 -1.71 -0.34 115.58 118.69 1ukw h ASN 396 Ca -0.43 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.19 1ukw h ASN 396 Cb 1.23 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.61 1ukw h ASN 396 CO 0.51 0.00 -0.48 -0.33 -1.65 0.00 0.00 177.43 175.47 1ukw h GLU 397 N 0.00 0.37 0.00 0.81 3.07 -1.90 -1.07 114.58 115.86 1ukw h GLU 397 Ca 0.00 -0.37 -0.08 0.00 -0.50 0.00 0.00 59.36 58.41 1ukw h GLU 397 Cb 0.14 0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1ukw h GLU 397 CO 0.00 1.04 -0.39 -0.84 -1.40 0.00 0.00 179.01 177.41 1ukw h ILE 398 N -0.15 0.87 -0.19 3.13 -0.00 -1.76 0.20 117.51 119.60 1ukw h ILE 398 Ca -0.05 -1.63 -0.01 0.00 -0.00 0.00 0.00 64.86 63.18 1ukw h ILE 398 Cb 1.19 2.00 -0.01 0.00 -0.00 0.00 0.00 36.82 40.00 1ukw h ILE 398 CO 0.10 0.38 0.10 1.56 -0.00 0.00 0.00 178.15 180.29 1ukw h GLN 399 N 0.00 0.27 -0.58 0.16 1.08 -1.02 0.32 115.11 115.35 1ukw h GLN 399 Ca -0.00 -0.04 -0.05 0.00 -1.45 0.00 0.00 58.65 57.11 1ukw h GLN 399 Cb 0.97 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.33 1ukw h GLN 399 CO 0.05 0.28 0.15 0.00 -0.95 0.00 0.00 178.83 178.37 1ukw h ARG 400 N 0.19 0.88 -0.64 1.46 3.08 -0.51 -1.12 114.38 117.72 1ukw h ARG 400 Ca 0.07 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1ukw h ARG 400 Cb 0.10 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 1ukw h ARG 400 CO -0.01 0.78 0.36 -0.07 -1.07 0.00 0.00 179.97 179.96 1ukw h LEU 401 N 0.85 0.77 -0.38 3.04 3.38 0.22 0.28 115.31 123.47 1ukw h LEU 401 Ca 0.19 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1ukw h LEU 401 Cb 0.29 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1ukw h LEU 401 CO -0.00 0.61 0.09 0.40 0.09 0.00 0.00 178.44 179.63 1ukw h ILE 402 N 0.88 1.23 -0.38 1.22 1.08 0.68 -2.33 117.51 119.89 1ukw h ILE 402 Ca 0.23 -0.78 -0.06 0.00 -0.39 0.00 0.00 64.86 63.85 1ukw h ILE 402 Cb -0.00 1.01 -0.01 0.00 -3.07 0.00 0.00 36.82 34.74 1ukw h ILE 402 CO -0.04 0.27 -0.02 0.40 -0.69 0.00 0.00 178.15 178.07 1ukw h ILE 403 N 0.47 1.26 -0.75 -0.67 2.04 -0.63 -2.68 117.51 116.56 1ukw h ILE 403 Ca 0.12 -1.02 0.11 0.00 1.00 0.00 0.00 64.86 65.06 1ukw h ILE 403 Cb 0.31 1.18 -0.08 0.00 -0.74 0.00 0.00 36.82 37.50 1ukw h ILE 403 CO 0.00 0.34 0.37 0.00 0.00 0.00 0.00 178.15 178.86 1ukw h ALA 404 N 0.87 1.05 -0.19 1.87 0.00 -0.35 0.28 119.26 122.79 1ukw h ALA 404 Ca 0.10 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ukw h ALA 404 Cb 0.49 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1ukw h ALA 404 CO 0.02 -0.07 0.12 0.00 0.00 0.00 0.00 179.25 179.33 1ukw h ARG 405 N 0.60 0.26 -0.97 0.00 3.08 -1.27 0.36 114.38 116.44 1ukw h ARG 405 Ca 0.38 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.48 1ukw h ARG 405 Cb 0.45 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.38 1ukw h ARG 405 CO -0.30 0.19 0.63 1.25 -1.07 0.00 0.00 179.97 180.67 1ukw h HIS 406 N 0.25 1.15 -0.02 3.04 2.76 -0.99 0.87 115.15 122.21 1ukw h HIS 406 Ca 0.07 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 1ukw h HIS 406 Cb -0.01 -0.38 0.00 0.00 1.55 0.00 0.00 27.41 28.58 1ukw h HIS 406 CO -0.06 0.60 -0.03 0.82 -1.30 0.00 0.00 177.93 177.96 1ukw h ILE 407 N 1.13 1.45 0.00 6.26 2.04 -0.09 -3.29 117.51 125.01 1ukw h ILE 407 Ca 0.42 -1.37 0.00 0.00 1.00 0.00 0.00 64.86 64.91 1ukw h ILE 407 Cb 0.18 2.34 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 1ukw h ILE 407 CO -0.16 0.36 0.00 -0.07 0.00 0.00 0.00 178.15 178.28 1ukw h LEU 408 N -0.51 0.00 -9.58 1.44 -0.00 -0.16 -3.46 115.31 103.04 1ukw h LEU 408 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 57.88 57.36 1ukw h LEU 408 Cb 0.61 0.00 0.23 0.00 -0.00 0.00 0.00 40.66 41.49 1ukw h LEU 408 CO 0.01 0.00 -1.00 0.00 -0.00 0.00 0.00 178.44 177.44 1ukw n ALA 409 N -1.85 -3.56 0.35 1.53 0.00 0.28 -5.07 120.51 112.19 1ukw n ALA 409 Ca 0.05 -0.78 0.04 0.00 0.00 0.00 0.00 53.44 52.75 1ukw n ALA 409 Cb 0.41 -1.58 0.03 0.00 0.00 0.00 0.00 19.45 18.31 1ukw n ALA 409 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50