#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dof n VAL 3 N 0.00 0.40 -3.18 0.61 0.31 -1.26 -5.01 118.33 110.20 1dof n VAL 3 Ca 0.00 -0.20 -0.39 0.00 -0.01 0.00 0.00 64.34 63.74 1dof n VAL 3 Cb 0.00 -0.81 -0.06 0.00 -0.91 0.00 0.00 33.84 32.07 1dof n VAL 3 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1dof s SER 4 N -4.18 6.98 0.60 4.52 0.15 -1.26 -4.94 113.70 115.58 1dof s SER 4 Ca -0.06 1.17 0.38 0.00 0.70 0.00 0.00 55.95 58.14 1dof s SER 4 Cb 0.02 -2.37 1.88 0.00 -1.71 0.00 0.00 66.02 63.84 1dof s SER 4 CO 0.20 0.07 2.18 1.55 1.20 0.00 0.00 173.24 178.44 1dof h PRO 5 N 5.76 0.00 0.00 5.44 0.13 -1.97 -1.57 132.00 139.80 1dof h PRO 5 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1dof h PRO 5 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1dof h PRO 5 CO 0.70 0.01 0.00 1.19 -0.23 0.00 0.00 178.00 179.68 1dof n PHE 6 N -3.14 0.00 0.47 1.56 3.01 -1.26 0.13 117.46 118.23 1dof n PHE 6 Ca -0.01 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.58 1dof n PHE 6 Cb 0.19 -0.46 0.38 0.00 -0.01 0.00 0.00 39.48 39.58 1dof n PHE 6 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1dof h ASP 7 N 0.00 0.00 0.00 4.37 3.32 -1.56 -3.44 116.42 119.12 1dof h ASP 7 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1dof h ASP 7 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1dof h ASP 7 CO 0.00 0.00 0.00 -2.67 -1.72 0.00 0.00 179.24 174.85 1dof n TRP 8 N -2.51 -0.38 0.01 4.55 4.27 -1.05 -5.03 117.44 117.30 1dof n TRP 8 Ca 0.04 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.54 1dof n TRP 8 Cb 0.42 0.08 -0.09 0.00 -1.36 0.00 0.00 31.31 30.36 1dof n TRP 8 CO 0.00 0.00 0.00 -0.09 -2.29 0.00 0.00 177.69 175.31 1dof h ARG 9 N 0.00 -0.10 -5.65 -2.67 2.43 -0.59 -3.45 114.38 104.35 1dof h ARG 9 Ca 0.00 0.01 -0.66 0.00 -0.81 0.00 0.00 59.98 58.52 1dof h ARG 9 Cb 0.00 0.02 -0.17 0.00 -0.42 0.00 0.00 29.97 29.40 1dof h ARG 9 CO 0.00 0.44 -0.62 0.71 -1.51 0.00 0.00 179.97 178.99 1dof s TYR 10 N -3.41 3.14 0.00 2.20 4.12 -0.34 -5.00 117.35 118.06 1dof s TYR 10 Ca -0.15 0.03 0.00 0.00 0.02 0.00 0.00 57.07 56.97 1dof s TYR 10 Cb 0.00 -1.89 0.00 0.00 -1.52 0.00 0.00 41.96 38.55 1dof s TYR 10 CO 0.56 0.26 0.00 0.41 0.02 0.00 0.00 175.55 176.81 1dof n GLY 11 N 2.80 2.29 3.95 0.71 0.00 -1.24 -4.46 105.19 109.24 1dof n GLY 11 Ca -0.18 -1.74 -0.24 0.00 0.00 0.00 0.00 46.02 43.86 1dof n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dof s SER 12 N 0.00 5.54 0.35 1.61 1.04 -1.26 -4.91 113.70 116.07 1dof s SER 12 Ca 0.00 0.34 0.05 0.00 0.48 0.00 0.00 55.95 56.81 1dof s SER 12 Cb 0.00 -1.37 0.66 0.00 0.10 0.00 0.00 66.02 65.41 1dof s SER 12 CO 0.00 -0.98 1.92 1.05 0.98 0.00 0.00 173.24 176.21 1dof h GLU 13 N 0.08 0.54 -1.00 4.02 9.09 -1.97 -0.39 114.58 124.94 1dof h GLU 13 Ca -0.45 -0.09 0.09 0.00 0.05 0.00 0.00 59.36 58.96 1dof h GLU 13 Cb 1.27 -0.09 -0.08 0.00 -1.65 0.00 0.00 28.75 28.20 1dof h GLU 13 CO 0.57 0.51 0.64 1.49 0.05 0.00 0.00 179.01 182.27 1dof h GLU 14 N 0.53 1.06 0.08 1.06 4.81 -2.00 -1.06 114.58 119.06 1dof h GLU 14 Ca 0.12 -0.06 -0.24 0.00 -0.13 0.00 0.00 59.36 59.05 1dof h GLU 14 Cb 0.23 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1dof h GLU 14 CO -0.00 0.70 -1.23 0.82 -0.73 0.00 0.00 179.01 178.57 1dof h ILE 15 N 1.09 1.10 -0.87 2.32 1.08 -1.86 -3.38 117.51 116.98 1dof h ILE 15 Ca 0.46 -2.36 0.15 0.00 -0.39 0.00 0.00 64.86 62.73 1dof h ILE 15 Cb 0.32 2.71 -0.07 0.00 -3.07 0.00 0.00 36.82 36.71 1dof h ILE 15 CO -0.22 0.63 0.57 -0.09 -0.69 0.00 0.00 178.15 178.35 1dof h ARG 16 N -0.49 0.60 0.00 2.37 2.43 -0.77 -0.93 114.38 117.58 1dof h ARG 16 Ca -0.28 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1dof h ARG 16 Cb 1.60 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.02 1dof h ARG 16 CO 0.01 0.40 0.00 2.89 -1.51 0.00 0.00 179.97 181.75 1dof n ARG 17 N -4.55 0.10 0.14 0.20 1.85 -0.43 -0.64 116.66 113.33 1dof n ARG 17 Ca 0.17 0.11 0.12 0.00 -1.00 0.00 0.00 57.85 57.26 1dof n ARG 17 Cb 0.51 -1.50 0.22 0.00 -1.05 0.00 0.00 32.46 30.64 1dof n ARG 17 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 1dof h LEU 18 N 0.00 0.00 -2.88 2.89 3.38 -1.36 -3.39 115.31 113.95 1dof h LEU 18 Ca 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1dof h LEU 18 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1dof h LEU 18 CO 0.00 0.02 -0.03 0.49 0.09 0.00 0.00 178.44 179.00 1dof n PHE 19 N -2.60 0.00 -1.39 1.13 3.01 0.19 -4.55 117.46 113.25 1dof n PHE 19 Ca 0.04 -0.78 -0.29 0.00 1.01 0.00 0.00 57.45 57.42 1dof n PHE 19 Cb 0.49 -0.11 0.14 0.00 -0.01 0.00 0.00 39.48 39.98 1dof n PHE 19 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1dof s THR 20 N -2.15 2.39 0.29 4.37 -4.23 -1.13 -4.82 115.64 110.37 1dof s THR 20 Ca 0.21 0.13 -0.03 0.00 -1.18 0.00 0.00 61.69 60.82 1dof s THR 20 Cb 0.19 -2.76 0.26 0.00 1.34 0.00 0.00 72.50 71.52 1dof s THR 20 CO 0.02 -0.17 1.96 -0.55 -0.54 0.00 0.00 174.62 175.34 1dof h ASN 21 N -1.51 1.00 -0.36 3.99 -1.07 -1.96 -1.61 115.58 114.06 1dof h ASN 21 Ca -0.50 -0.02 -0.00 0.00 0.07 0.00 0.00 56.30 55.84 1dof h ASN 21 Cb 1.31 -0.25 -0.02 0.00 -2.07 0.00 0.00 38.32 37.29 1dof h ASN 21 CO 0.59 0.72 0.21 1.05 0.07 0.00 0.00 177.43 180.07 1dof h GLU 22 N 1.18 0.48 -0.84 4.14 4.11 -1.95 -1.68 114.58 120.02 1dof h GLU 22 Ca 0.32 -0.05 -0.02 0.00 0.07 0.00 0.00 59.36 59.69 1dof h GLU 22 Cb -0.12 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 28.99 1dof h GLU 22 CO -0.07 0.37 0.44 0.00 0.07 0.00 0.00 179.01 179.82 1dof h ALA 23 N 1.08 1.20 -0.26 1.06 0.00 -1.63 -0.39 119.26 120.32 1dof h ALA 23 Ca 0.13 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1dof h ALA 23 Cb 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1dof h ALA 23 CO -0.02 0.64 -0.16 0.82 0.00 0.00 0.00 179.25 180.52 1dof h ILE 24 N 1.18 1.30 -0.46 0.00 2.04 -1.09 -1.33 117.51 119.15 1dof h ILE 24 Ca 0.29 -1.28 0.04 0.00 1.00 0.00 0.00 64.86 64.92 1dof h ILE 24 Cb 0.06 1.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 1dof h ILE 24 CO -0.04 0.40 0.22 0.40 0.00 0.00 0.00 178.15 179.13 1dof h ILE 25 N 0.29 0.95 -0.74 -0.67 1.08 -1.10 0.13 117.51 117.46 1dof h ILE 25 Ca 0.05 -0.15 -0.00 0.00 -0.39 0.00 0.00 64.86 64.37 1dof h ILE 25 Cb 0.69 0.47 -0.04 0.00 -3.07 0.00 0.00 36.82 34.87 1dof h ILE 25 CO 0.05 0.08 0.45 0.78 -0.69 0.00 0.00 178.15 178.82 1dof h ASN 26 N 0.44 0.88 -0.36 1.72 2.35 -0.84 0.09 115.58 119.87 1dof h ASN 26 Ca 0.20 -0.05 -0.16 0.00 -0.55 0.00 0.00 56.30 55.75 1dof h ASN 26 Cb 0.12 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 1dof h ASN 26 CO -0.15 0.67 -0.38 0.00 -1.65 0.00 0.00 177.43 175.92 1dof h ALA 27 N 1.48 0.60 -0.53 -0.83 0.00 -0.46 -0.85 119.26 118.67 1dof h ALA 27 Ca 0.27 -0.45 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1dof h ALA 27 Cb -0.05 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.57 1dof h ALA 27 CO -0.05 0.68 0.27 1.88 0.00 0.00 0.00 179.25 182.02 1dof h TYR 28 N 0.75 0.49 -0.69 0.00 0.99 -0.30 -2.03 116.97 116.18 1dof h TYR 28 Ca 0.06 0.02 0.03 0.00 2.00 0.00 0.00 58.73 60.84 1dof h TYR 28 Cb 0.97 -0.14 -0.04 0.00 1.00 0.00 0.00 36.73 38.52 1dof h TYR 28 CO 0.06 0.23 0.43 -0.07 -0.00 0.00 0.00 178.16 178.82 1dof h LEU 29 N 0.52 0.72 -0.82 3.88 3.38 -0.85 -0.88 115.31 121.26 1dof h LEU 29 Ca 0.24 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.30 1dof h LEU 29 Cb 0.15 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.67 1dof h LEU 29 CO -0.17 0.50 0.47 -0.33 0.09 0.00 0.00 178.44 179.00 1dof h GLU 30 N 0.86 0.76 -0.19 1.13 5.08 -0.48 -0.11 114.58 121.62 1dof h GLU 30 Ca 0.27 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.43 1dof h GLU 30 Cb -0.00 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1dof h GLU 30 CO -0.10 0.50 -0.48 0.28 -1.00 0.00 0.00 179.01 178.21 1dof h VAL 31 N 0.78 1.32 -0.60 3.13 2.07 -0.77 -2.27 116.25 119.91 1dof h VAL 31 Ca 0.40 -1.72 -0.00 0.00 0.82 0.00 0.00 66.70 66.20 1dof h VAL 31 Cb 0.38 1.89 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 1dof h VAL 31 CO -0.25 0.54 0.36 -0.33 0.02 0.00 0.00 177.57 177.90 1dof h GLU 32 N 0.36 0.82 -0.59 1.57 4.39 -0.59 -0.98 114.58 119.55 1dof h GLU 32 Ca -0.01 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 1dof h GLU 32 Cb 1.10 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.55 1dof h GLU 32 CO 0.11 0.59 0.36 0.00 -1.16 0.00 0.00 179.01 178.91 1dof h ARG 33 N 0.81 0.80 -0.41 2.33 3.08 -1.08 0.64 114.38 120.56 1dof h ARG 33 Ca 0.22 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 60.11 1dof h ARG 33 Cb -0.02 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 1dof h ARG 33 CO -0.04 0.57 -0.11 0.00 -1.07 0.00 0.00 179.97 179.32 1dof h ALA 34 N 1.19 1.05 0.57 0.04 0.00 -0.96 -1.26 119.26 119.89 1dof h ALA 34 Ca 0.21 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1dof h ALA 34 Cb -0.03 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.60 1dof h ALA 34 CO -0.04 0.58 -0.27 1.25 0.00 0.00 0.00 179.25 180.77 1dof h LEU 35 N 0.65 -0.64 -0.96 0.00 6.46 -0.64 -0.81 115.31 119.37 1dof h LEU 35 Ca 0.11 -0.02 0.13 0.00 -0.12 0.00 0.00 57.88 57.98 1dof h LEU 35 Cb 0.56 0.17 -0.09 0.00 -0.73 0.00 0.00 40.66 40.57 1dof h LEU 35 CO 0.03 -0.39 0.59 0.58 -0.62 0.00 0.00 178.44 178.64 1dof h VAL 36 N -0.87 0.87 -0.24 1.05 2.07 -0.73 -1.84 116.25 116.56 1dof h VAL 36 Ca -0.08 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.02 1dof h VAL 36 Cb 0.62 -0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1dof h VAL 36 CO 0.13 0.16 -0.28 0.00 0.02 0.00 0.00 177.57 177.60 1dof h ALA 38 N 0.67 1.08 -0.42 0.00 0.00 -0.90 -0.10 119.26 119.58 1dof h ALA 38 Ca 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1dof h ALA 38 Cb 0.85 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1dof h ALA 38 CO 0.07 0.67 0.17 1.25 0.00 0.00 0.00 179.25 181.41 1dof h LEU 39 N 1.20 0.58 -0.63 0.00 5.85 -1.16 0.11 115.31 121.25 1dof h LEU 39 Ca 0.28 -0.17 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 1dof h LEU 39 Cb 0.17 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1dof h LEU 39 CO -0.03 0.58 0.14 -0.08 -0.34 0.00 0.00 178.44 178.71 1dof h GLU 40 N 0.53 1.02 0.00 1.25 4.81 -0.82 -0.72 114.58 120.66 1dof h GLU 40 Ca 0.14 -0.26 -0.05 0.00 -0.13 0.00 0.00 59.36 59.07 1dof h GLU 40 Cb 0.19 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1dof h GLU 40 CO -0.01 0.93 -0.22 0.93 -0.73 0.00 0.00 179.01 179.91 1dof h GLU 41 N 0.94 0.00 -0.01 1.92 5.08 -0.49 -2.49 114.58 119.52 1dof h GLU 41 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1dof h GLU 41 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1dof h GLU 41 CO 0.01 0.22 -0.09 1.28 -1.00 0.00 0.00 179.01 179.43 1dof n LEU 42 N -3.97 1.06 0.00 1.33 4.77 0.32 -4.92 117.00 115.59 1dof n LEU 42 Ca -0.02 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1dof n LEU 42 Cb 0.30 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1dof n LEU 42 CO 0.35 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1dof n GLY 43 N 1.22 0.57 0.08 -0.72 0.00 -0.94 -4.95 105.19 100.45 1dof n GLY 43 Ca 0.17 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 1dof n GLY 43 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1dof h VAL 44 N 0.00 1.61 -4.04 1.61 2.07 -1.39 -3.47 116.25 112.64 1dof h VAL 44 Ca 0.00 -2.36 -0.49 0.00 0.82 0.00 0.00 66.70 64.67 1dof h VAL 44 Cb 0.00 3.19 0.02 0.00 -1.52 0.00 0.00 31.29 32.98 1dof h VAL 44 CO 0.00 0.60 0.29 0.00 0.02 0.00 0.00 177.57 178.48 1dof s ALA 45 N -2.29 3.18 0.24 1.67 0.00 -0.76 -4.93 121.76 118.87 1dof s ALA 45 Ca -0.19 -0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.44 1dof s ALA 45 Cb -0.01 -2.96 -0.11 0.00 0.00 0.00 0.00 23.12 20.05 1dof s ALA 45 CO 0.71 -0.25 1.54 -2.00 0.00 0.00 0.00 175.76 175.75 1dof s GLU 46 N -4.23 4.20 0.12 0.00 2.12 -1.26 -4.48 118.70 115.16 1dof s GLU 46 Ca 0.55 2.43 -0.35 0.00 0.36 0.00 0.00 54.97 57.96 1dof s GLU 46 Cb -0.10 -3.09 -0.16 0.00 0.26 0.00 0.00 34.13 31.05 1dof s GLU 46 CO 0.36 -0.56 1.43 2.89 -0.54 0.00 0.00 175.26 178.84 1dof n ARG 47 N 2.75 1.54 0.00 4.30 1.85 -1.26 -0.26 116.66 125.58 1dof n ARG 47 Ca 0.09 0.55 0.00 0.00 -1.00 0.00 0.00 57.85 57.50 1dof n ARG 47 Cb 0.38 -2.24 0.00 0.00 -1.05 0.00 0.00 32.46 29.55 1dof n ARG 47 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1dof n GLY 48 N 2.84 2.11 0.12 2.89 0.00 -1.26 -4.95 105.19 106.94 1dof n GLY 48 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 1dof n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dof h GLU 51 N -0.55 0.56 -0.33 0.00 -0.00 -1.96 0.10 114.58 112.39 1dof h GLU 51 Ca 0.02 -0.04 -0.04 0.00 -0.00 0.00 0.00 59.36 59.30 1dof h GLU 51 Cb 0.62 -0.12 -0.01 0.00 -0.00 0.00 0.00 28.75 29.24 1dof h GLU 51 CO -0.35 0.40 0.07 1.57 -0.00 0.00 0.00 179.01 180.70 1dof h LYS 52 N 0.57 0.54 -0.20 1.06 2.10 -1.10 0.76 116.57 120.30 1dof h LYS 52 Ca 0.15 -0.14 -0.19 0.00 -2.00 0.00 0.00 60.65 58.47 1dof h LYS 52 Cb -0.01 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.26 1dof h LYS 52 CO -0.03 0.61 -0.64 -0.39 -2.00 0.00 0.00 179.45 177.01 1dof h VAL 53 N 0.39 1.29 -0.55 0.07 -1.51 -0.18 -1.69 116.25 114.08 1dof h VAL 53 Ca 0.10 -1.86 -0.01 0.00 -1.23 0.00 0.00 66.70 63.70 1dof h VAL 53 Cb 0.32 1.82 -0.03 0.00 -2.13 0.00 0.00 31.29 31.27 1dof h VAL 53 CO 0.00 0.59 0.29 0.78 -1.23 0.00 0.00 177.57 178.00 1dof h ASN 54 N 0.54 0.70 1.02 4.19 2.35 -0.89 -2.55 115.58 120.94 1dof h ASN 54 Ca -0.01 -0.11 -0.07 0.00 -0.55 0.00 0.00 56.30 55.56 1dof h ASN 54 Cb 1.24 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.42 1dof h ASN 54 CO 0.13 0.61 -0.31 0.11 -1.65 0.00 0.00 177.43 176.32 1dof h LYS 55 N 0.74 0.00 -7.07 0.81 6.56 -0.82 -3.45 116.57 113.35 1dof h LYS 55 Ca 0.19 0.00 -0.48 0.00 -1.06 0.00 0.00 60.65 59.31 1dof h LYS 55 Cb 0.08 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 31.77 1dof h LYS 55 CO -0.03 0.31 0.39 0.00 -2.06 0.00 0.00 179.45 178.07 1dof s ALA 56 N -3.51 2.86 -0.04 3.86 0.00 -0.64 -5.05 121.76 119.24 1dof s ALA 56 Ca 0.01 0.65 0.04 0.00 0.00 0.00 0.00 51.96 52.66 1dof s ALA 56 Cb 0.10 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 19.95 1dof s ALA 56 CO 0.67 -0.37 -0.16 0.45 0.00 0.00 0.00 175.76 176.34 1dof s SER 57 N -1.92 2.08 0.04 0.00 0.15 -1.26 -4.97 113.70 107.82 1dof s SER 57 Ca 0.68 -0.34 0.05 0.00 0.70 0.00 0.00 55.95 57.03 1dof s SER 57 Cb -0.18 -0.61 -0.02 0.00 -1.71 0.00 0.00 66.02 63.50 1dof s SER 57 CO 0.21 0.14 -0.15 -0.69 1.20 0.00 0.00 173.24 173.96 1dof s VAL 58 N 0.10 1.15 0.16 4.45 1.01 -1.26 -5.02 120.40 120.99 1dof s VAL 58 Ca -0.05 -1.05 0.09 0.00 0.00 0.00 0.00 61.98 60.97 1dof s VAL 58 Cb -0.12 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1dof s VAL 58 CO 0.02 -0.01 -0.18 -0.94 0.00 0.00 0.00 175.10 173.99 1dof s SER 59 N -1.21 2.68 0.48 3.32 1.04 -1.26 -4.96 113.70 113.80 1dof s SER 59 Ca 0.02 -0.85 0.13 0.00 0.48 0.00 0.00 55.95 55.73 1dof s SER 59 Cb -0.08 -0.16 1.13 0.00 0.10 0.00 0.00 66.02 67.01 1dof s SER 59 CO 0.01 -0.03 2.11 0.00 0.98 0.00 0.00 173.24 176.32 1dof h ALA 60 N 3.30 1.92 0.43 5.32 0.00 -1.90 0.36 119.26 128.69 1dof h ALA 60 Ca -0.42 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1dof h ALA 60 Cb 1.20 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1dof h ALA 60 CO 0.50 0.06 -0.20 0.38 0.00 0.00 0.00 179.25 179.99 1dof h ASP 61 N 0.20 -0.48 0.23 0.00 2.03 -1.97 -3.11 116.42 113.31 1dof h ASP 61 Ca 0.07 -0.04 0.01 0.00 -0.73 0.00 0.00 57.03 56.33 1dof h ASP 61 Cb 0.03 0.13 -0.03 0.00 -0.83 0.00 0.00 39.33 38.62 1dof h ASP 61 CO -0.01 -0.26 -0.33 -0.33 -1.03 0.00 0.00 179.24 177.27 1dof h GLU 62 N -0.68 -0.60 -7.23 4.15 5.08 -1.63 -3.55 114.58 110.11 1dof h GLU 62 Ca -0.06 0.04 -0.46 0.00 -1.00 0.00 0.00 59.36 57.89 1dof h GLU 62 Cb 0.50 0.14 0.19 0.00 0.50 0.00 0.00 28.75 30.07 1dof h GLU 62 CO 0.10 -0.40 0.11 0.08 -1.00 0.00 0.00 179.01 177.89 1dof s VAL 63 N -6.01 2.13 0.00 3.13 1.01 0.11 -5.02 120.40 115.75 1dof s VAL 63 Ca -0.16 0.04 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1dof s VAL 63 Cb 0.07 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.21 1dof s VAL 63 CO 0.64 -0.06 0.00 1.41 0.00 0.00 0.00 175.10 177.09 1dof n HIS 72 N -4.55 0.00 -0.03 5.22 -0.00 -1.26 -4.95 115.22 109.66 1dof n HIS 72 Ca 0.05 0.00 -0.16 0.00 -0.00 0.00 0.00 57.72 57.61 1dof n HIS 72 Cb 0.55 0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 30.45 1dof n HIS 72 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.34 175.90 1dof h ASP 73 N 0.50 0.56 -0.41 0.41 3.32 -2.05 -2.62 116.42 116.12 1dof h ASP 73 Ca 0.00 -0.65 -0.06 0.00 0.02 0.00 0.00 57.03 56.34 1dof h ASP 73 Cb 0.00 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1dof h ASP 73 CO 0.00 1.12 0.03 0.40 -1.72 0.00 0.00 179.24 179.07 1dof h ILE 74 N 0.03 1.25 -0.84 0.35 1.08 -1.98 -1.70 117.51 115.71 1dof h ILE 74 Ca -0.03 -0.96 0.02 0.00 -0.39 0.00 0.00 64.86 63.50 1dof h ILE 74 Cb 1.12 1.07 -0.04 0.00 -3.07 0.00 0.00 36.82 35.89 1dof h ILE 74 CO 0.10 0.33 0.55 0.25 -0.69 0.00 0.00 178.15 178.68 1dof h LEU 75 N 0.54 0.93 -0.61 1.44 5.85 -2.00 0.17 115.31 121.64 1dof h LEU 75 Ca 0.12 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1dof h LEU 75 Cb 0.43 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1dof h LEU 75 CO 0.02 0.66 0.21 0.28 -0.34 0.00 0.00 178.44 179.27 1dof h SER 76 N 1.10 0.88 -0.43 1.25 0.02 -1.34 -1.92 113.55 113.11 1dof h SER 76 Ca 0.32 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1dof h SER 76 Cb -0.08 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 1dof h SER 76 CO -0.09 0.83 0.25 0.25 -1.14 0.00 0.00 176.83 176.94 1dof h LEU 77 N 0.87 0.52 -0.68 5.07 7.12 -0.32 -1.33 115.31 126.56 1dof h LEU 77 Ca 0.20 -0.06 -0.12 0.00 0.13 0.00 0.00 57.88 58.03 1dof h LEU 77 Cb 0.26 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.24 1dof h LEU 77 CO -0.01 0.43 -0.22 0.58 -0.13 0.00 0.00 178.44 179.09 1dof h VAL 78 N 0.56 1.27 -0.06 1.05 2.07 -0.53 -0.74 116.25 119.87 1dof h VAL 78 Ca 0.15 -1.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 1dof h VAL 78 Cb 0.01 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1dof h VAL 78 CO -0.03 0.45 0.04 -0.07 0.02 0.00 0.00 177.57 177.98 1dof h LEU 79 N 0.69 0.08 -0.11 2.57 3.38 -1.16 -1.20 115.31 119.56 1dof h LEU 79 Ca 0.10 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1dof h LEU 79 Cb 0.74 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1dof h LEU 79 CO 0.06 0.11 0.05 -0.07 0.09 0.00 0.00 178.44 178.67 1dof h LEU 80 N 0.04 0.15 -1.24 1.67 3.38 -1.03 -1.87 115.31 116.40 1dof h LEU 80 Ca 0.02 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1dof h LEU 80 Cb 0.05 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1dof h LEU 80 CO -0.00 0.26 0.13 0.25 0.09 0.00 0.00 178.44 179.17 1dof h LEU 81 N 0.02 0.60 0.31 1.67 5.85 -1.13 -0.29 115.31 122.34 1dof h LEU 81 Ca 0.04 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1dof h LEU 81 Cb 0.16 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1dof h LEU 81 CO -0.00 0.58 -0.15 -0.08 -0.34 0.00 0.00 178.44 178.45 1dof h GLU 82 N 0.64 -0.40 0.03 1.25 4.81 -0.90 -1.57 114.58 118.45 1dof h GLU 82 Ca 0.15 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.44 1dof h GLU 82 Cb 0.21 0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.63 1dof h GLU 82 CO -0.01 -0.14 -0.35 1.96 -0.73 0.00 0.00 179.01 179.75 1dof h GLN 83 N -0.62 -0.50 -0.68 1.92 4.20 -1.23 0.86 115.11 119.05 1dof h GLN 83 Ca -0.04 0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1dof h GLN 83 Cb 0.44 0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 1dof h GLN 83 CO 0.07 -0.33 0.38 0.87 -0.67 0.00 0.00 178.83 179.15 1dof h LYS 84 N -0.52 0.93 0.00 1.46 1.57 -1.08 -3.15 116.57 115.78 1dof h LYS 84 Ca 0.05 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1dof h LYS 84 Cb 0.59 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1dof h LYS 84 CO -0.26 0.68 -1.42 -1.13 -0.57 0.00 0.00 179.45 176.75 1dof n SER 85 N -4.38 0.46 -0.04 0.86 3.41 -0.59 -4.94 113.62 108.41 1dof n SER 85 Ca 0.07 0.09 -0.00 0.00 -0.26 0.00 0.00 58.87 58.76 1dof n SER 85 Cb 0.09 1.16 -0.00 0.00 -0.26 0.00 0.00 64.21 65.20 1dof n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dof n GLY 86 N 1.25 0.33 3.63 5.00 0.00 0.29 -4.78 105.19 110.91 1dof n GLY 86 Ca -0.01 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 1dof n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dof n ARG 88 N 4.92 1.91 -0.21 0.00 1.85 -1.26 -3.78 116.66 120.09 1dof n ARG 88 Ca -0.10 -1.35 0.11 0.00 -1.00 0.00 0.00 57.85 55.51 1dof n ARG 88 Cb 0.51 -1.44 0.26 0.00 -1.05 0.00 0.00 32.46 30.74 1dof n ARG 88 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1dof n TYR 89 N 0.59 0.54 -1.67 2.89 4.02 -1.26 -4.90 117.16 117.38 1dof n TYR 89 Ca 0.17 -0.27 -0.46 0.00 -0.01 0.00 0.00 57.90 57.33 1dof n TYR 89 Cb 0.41 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.69 1dof n TYR 89 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1dof n VAL 90 N 1.24 0.04 -1.00 -0.72 0.31 -1.25 -2.21 118.33 114.75 1dof n VAL 90 Ca 0.19 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1dof n VAL 90 Cb 0.54 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 1dof n VAL 90 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1dof n HIS 91 N 3.65 0.00 -1.64 3.52 -0.00 -1.26 -4.93 115.22 114.56 1dof n HIS 91 Ca 0.17 0.00 -0.49 0.00 -0.00 0.00 0.00 57.72 57.40 1dof n HIS 91 Cb 0.29 -1.03 -0.05 0.00 -0.00 0.00 0.00 29.99 29.20 1dof n HIS 91 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.34 177.32 1dof n TYR 92 N -2.48 2.15 -0.36 1.57 4.19 -0.94 -0.59 117.16 120.71 1dof n TYR 92 Ca 0.00 0.09 0.00 0.00 3.31 0.00 0.00 57.90 61.30 1dof n TYR 92 Cb 0.26 -2.63 0.00 0.00 0.49 0.00 0.00 39.34 37.46 1dof n TYR 92 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1dof n GLY 93 N 4.86 2.09 3.93 2.98 0.00 -1.26 -5.01 105.19 112.78 1dof n GLY 93 Ca 0.27 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.03 1dof n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dof s ALA 94 N -3.19 3.36 0.21 4.61 0.00 0.25 -4.48 121.76 122.52 1dof s ALA 94 Ca 0.00 -0.80 0.11 0.00 0.00 0.00 0.00 51.96 51.27 1dof s ALA 94 Cb 0.00 -2.53 -0.05 0.00 0.00 0.00 0.00 23.12 20.54 1dof s ALA 94 CO 0.00 -0.83 -0.21 -0.08 0.00 0.00 0.00 175.76 174.64 1dof s THR 95 N -2.97 2.22 0.27 0.00 -1.32 -1.26 -4.75 115.64 107.83 1dof s THR 95 Ca 0.54 -2.12 -0.02 0.00 -1.21 0.00 0.00 61.69 58.88 1dof s THR 95 Cb -0.10 -2.10 0.30 0.00 -1.51 0.00 0.00 72.50 69.08 1dof s THR 95 CO 0.44 -0.27 1.64 0.28 -2.21 0.00 0.00 174.62 174.49 1dof h SER 96 N 2.91 -0.20 0.86 8.08 0.02 -1.96 -1.11 113.55 122.15 1dof h SER 96 Ca -0.43 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1dof h SER 96 Cb 1.22 0.32 0.00 0.00 0.14 0.00 0.00 62.40 64.08 1dof h SER 96 CO 0.53 -0.18 0.00 0.78 -1.14 0.00 0.00 176.83 176.82 1dof h ASN 97 N 0.15 0.00 -0.78 3.07 4.21 -1.97 0.88 115.58 121.14 1dof h ASN 97 Ca 0.49 0.00 0.06 0.00 1.21 0.00 0.00 56.30 58.06 1dof h ASN 97 Cb 0.93 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 38.07 1dof h ASN 97 CO -0.68 0.00 0.47 0.44 -1.29 0.00 0.00 177.43 176.37 1dof h ASP 98 N 0.00 0.73 0.01 5.81 3.32 -1.37 0.62 116.42 125.53 1dof h ASP 98 Ca 0.00 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 1dof h ASP 98 Cb 0.43 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1dof h ASP 98 CO 0.00 0.47 -0.01 0.40 -1.72 0.00 0.00 179.24 178.38 1dof h ILE 99 N 0.86 1.51 0.17 0.35 1.08 -1.17 -2.94 117.51 117.38 1dof h ILE 99 Ca 0.34 -1.90 -0.00 0.00 -0.39 0.00 0.00 64.86 62.91 1dof h ILE 99 Cb 0.17 2.75 -0.00 0.00 -3.07 0.00 0.00 36.82 36.67 1dof h ILE 99 CO -0.17 0.47 -0.11 0.40 -0.69 0.00 0.00 178.15 178.05 1dof h ILE 100 N -0.88 0.78 0.00 -0.67 2.04 -0.79 -0.60 117.51 117.38 1dof h ILE 100 Ca -0.00 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.74 1dof h ILE 100 Cb 0.79 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1dof h ILE 100 CO 0.00 0.00 -0.57 0.44 0.00 0.00 0.00 178.15 178.02 1dof h ASP 101 N -0.27 0.00 -0.03 1.72 3.32 0.10 -1.37 116.42 119.89 1dof h ASP 101 Ca -0.02 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.81 1dof h ASP 101 Cb 0.23 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.79 1dof h ASP 101 CO 0.02 0.57 -0.84 0.74 -1.72 0.00 0.00 179.24 178.01 1dof h THR 102 N 0.00 1.30 -0.70 0.35 2.02 -1.45 -1.18 112.91 113.25 1dof h THR 102 Ca -0.01 -2.08 -0.04 0.00 0.77 0.00 0.00 66.41 65.05 1dof h THR 102 Cb 1.11 2.11 -0.03 0.00 -1.74 0.00 0.00 68.15 69.59 1dof h THR 102 CO 0.07 0.65 0.28 0.00 0.37 0.00 0.00 175.52 176.90 1dof h ALA 103 N 0.59 1.18 -0.29 6.16 0.00 -0.87 -0.46 119.26 125.57 1dof h ALA 103 Ca -0.07 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1dof h ALA 103 Cb 1.47 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1dof h ALA 103 CO 0.17 0.60 0.19 -1.49 0.00 0.00 0.00 179.25 178.71 1dof h TRP 104 N 1.01 0.36 -0.46 0.00 -0.00 -1.07 -0.60 115.95 115.19 1dof h TRP 104 Ca 0.24 0.01 0.02 0.00 -0.00 0.00 0.00 58.89 59.16 1dof h TRP 104 Cb 0.19 -0.12 -0.03 0.00 -0.00 0.00 0.00 29.16 29.20 1dof h TRP 104 CO 0.02 0.22 0.27 0.00 -0.00 0.00 0.00 178.44 178.95 1dof h ALA 105 N 1.11 0.58 0.60 1.49 0.00 -0.66 0.12 119.26 122.50 1dof h ALA 105 Ca 0.11 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1dof h ALA 105 Cb -0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1dof h ALA 105 CO -0.03 -0.05 -0.36 -0.07 0.00 0.00 0.00 179.25 178.75 1dof h LEU 106 N 0.54 -0.89 -0.50 0.00 3.38 -0.64 -0.18 115.31 117.01 1dof h LEU 106 Ca 0.18 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 1dof h LEU 106 Cb 0.02 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1dof h LEU 106 CO -0.09 -0.56 0.24 -0.07 0.09 0.00 0.00 178.44 178.05 1dof h LEU 107 N -0.90 0.65 -0.50 1.67 3.38 -1.03 -1.56 115.31 117.02 1dof h LEU 107 Ca -0.07 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 1dof h LEU 107 Cb 0.73 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1dof h LEU 107 CO 0.08 0.59 -0.04 0.40 0.09 0.00 0.00 178.44 179.56 1dof h ILE 108 N 0.66 1.27 -0.40 1.22 2.04 -0.79 0.14 117.51 121.65 1dof h ILE 108 Ca 0.17 -1.15 -0.09 0.00 1.00 0.00 0.00 64.86 64.79 1dof h ILE 108 Cb 0.11 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1dof h ILE 108 CO -0.02 0.40 -0.13 0.03 0.00 0.00 0.00 178.15 178.43 1dof h ARG 109 N 0.77 0.72 -0.40 2.37 3.08 -0.97 0.33 114.38 120.29 1dof h ARG 109 Ca 0.14 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.90 1dof h ARG 109 Cb 0.58 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 1dof h ARG 109 CO 0.03 0.82 0.09 0.00 -1.07 0.00 0.00 179.97 179.85 1dof h ARG 110 N 0.65 0.64 -0.80 0.04 3.08 -0.93 -1.03 114.38 116.03 1dof h ARG 110 Ca 0.11 -0.16 0.01 0.00 0.07 0.00 0.00 59.98 60.01 1dof h ARG 110 Cb 0.60 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.52 1dof h ARG 110 CO 0.04 0.67 0.53 0.00 -1.07 0.00 0.00 179.97 180.13 1dof h ALA 111 N 0.95 1.01 -0.29 0.04 0.00 -0.35 -2.79 119.26 117.83 1dof h ALA 111 Ca 0.12 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1dof h ALA 111 Cb 0.32 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1dof h ALA 111 CO 0.00 0.43 -0.22 -0.07 0.00 0.00 0.00 179.25 179.39 1dof h LEU 112 N 1.08 0.54 -0.80 0.00 3.38 -0.11 -0.84 115.31 118.57 1dof h LEU 112 Ca 0.29 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1dof h LEU 112 Cb -0.12 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.43 1dof h LEU 112 CO -0.06 0.76 0.51 0.00 0.09 0.00 0.00 178.44 179.73 1dof h ALA 113 N 1.29 1.05 -0.24 1.53 0.00 -0.93 0.81 119.26 122.76 1dof h ALA 113 Ca 0.07 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1dof h ALA 113 Cb 0.65 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1dof h ALA 113 CO 0.05 0.32 -0.35 0.00 0.00 0.00 0.00 179.25 179.26 1dof h ALA 114 N 1.34 0.93 -0.09 0.00 0.00 -1.22 -2.40 119.26 117.81 1dof h ALA 114 Ca 0.32 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1dof h ALA 114 Cb 0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1dof h ALA 114 CO -0.11 0.62 0.03 0.28 0.00 0.00 0.00 179.25 180.07 1dof h VAL 115 N 0.45 1.17 -0.88 0.00 2.07 -0.37 -1.79 116.25 116.89 1dof h VAL 115 Ca 0.05 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.08 1dof h VAL 115 Cb 0.83 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 1dof h VAL 115 CO 0.07 0.15 0.58 0.11 0.02 0.00 0.00 177.57 178.49 1dof h LYS 116 N -0.03 1.10 -0.33 1.57 1.57 -0.83 0.11 116.57 119.73 1dof h LYS 116 Ca 0.03 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1dof h LYS 116 Cb 0.21 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1dof h LYS 116 CO -0.00 0.73 0.06 1.49 -0.57 0.00 0.00 179.45 181.16 1dof h GLU 117 N 1.13 0.55 -0.22 3.15 4.81 -1.20 -1.25 114.58 121.55 1dof h GLU 117 Ca 0.35 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.37 1dof h GLU 117 Cb -0.03 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 1dof h GLU 117 CO -0.11 0.63 -0.14 0.87 -0.73 0.00 0.00 179.01 179.53 1dof h LYS 118 N 0.38 0.37 -0.24 1.92 1.57 -0.97 -1.13 116.57 118.48 1dof h LYS 118 Ca 0.10 -0.10 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 1dof h LYS 118 Cb 0.34 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1dof h LYS 118 CO 0.01 0.51 -0.25 0.00 -0.57 0.00 0.00 179.45 179.15 1dof h ALA 119 N 1.51 1.13 -0.46 3.86 0.00 -0.51 -0.99 119.26 123.81 1dof h ALA 119 Ca 0.07 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.50 1dof h ALA 119 Cb 0.46 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1dof h ALA 119 CO 0.03 0.55 -0.25 0.00 0.00 0.00 0.00 179.25 179.57 1dof h ARG 120 N 0.40 0.97 -0.62 0.00 3.08 -0.89 0.08 114.38 117.40 1dof h ARG 120 Ca 0.06 -0.43 -0.06 0.00 0.07 0.00 0.00 59.98 59.61 1dof h ARG 120 Cb 0.65 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 1dof h ARG 120 CO 0.05 1.10 0.14 0.00 -1.07 0.00 0.00 179.97 180.19 1dof h ALA 121 N 0.87 0.82 -0.30 0.04 0.00 -0.82 0.25 119.26 120.12 1dof h ALA 121 Ca 0.10 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1dof h ALA 121 Cb 0.83 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1dof h ALA 121 CO 0.07 0.54 0.11 0.28 0.00 0.00 0.00 179.25 180.26 1dof h VAL 122 N 0.92 1.18 -0.60 0.00 2.07 -1.02 -1.24 116.25 117.55 1dof h VAL 122 Ca 0.19 -0.57 0.04 0.00 0.82 0.00 0.00 66.70 67.18 1dof h VAL 122 Cb 0.38 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 1dof h VAL 122 CO 0.01 0.19 0.35 1.23 0.02 0.00 0.00 177.57 179.37 1dof h GLY 123 N 0.33 0.87 1.13 2.17 0.00 -0.40 -0.48 103.07 106.70 1dof h GLY 123 Ca 0.10 -0.25 0.02 0.00 0.00 0.00 0.00 47.33 47.19 1dof h GLY 123 CO -0.01 0.19 0.55 -0.55 0.00 0.00 0.00 176.54 176.72 1dof h ASP 124 N 0.67 0.93 -0.36 0.19 3.32 -0.17 -0.16 116.42 120.85 1dof h ASP 124 Ca 0.26 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.16 1dof h ASP 124 Cb 0.09 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1dof h ASP 124 CO -0.14 0.66 -0.28 -0.61 -1.72 0.00 0.00 179.24 177.16 1dof h GLN 125 N 1.10 0.83 -0.61 3.56 5.75 -0.51 -1.20 115.11 124.03 1dof h GLN 125 Ca 0.32 -0.41 -0.06 0.00 -0.15 0.00 0.00 58.65 58.35 1dof h GLN 125 Cb -0.07 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 1dof h GLN 125 CO -0.08 1.04 0.14 -0.07 -2.65 0.00 0.00 178.83 177.21 1dof h LEU 126 N 0.62 0.94 -0.47 -2.39 3.38 -0.89 -1.00 115.31 115.50 1dof h LEU 126 Ca 0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1dof h LEU 126 Cb 0.85 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1dof h LEU 126 CO 0.07 0.93 0.24 0.00 0.09 0.00 0.00 178.44 179.78 1dof h ALA 127 N 1.04 0.60 0.00 1.53 0.00 -0.87 0.25 119.26 121.80 1dof h ALA 127 Ca 0.19 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1dof h ALA 127 Cb 0.37 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1dof h ALA 127 CO 0.00 0.15 -0.49 0.66 0.00 0.00 0.00 179.25 179.57 1dof h SER 128 N 0.61 0.00 -0.21 0.00 4.64 -1.09 -0.62 113.55 116.90 1dof h SER 128 Ca 0.16 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.43 1dof h SER 128 Cb 0.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1dof h SER 128 CO -0.02 0.49 -0.09 0.24 -0.87 0.00 0.00 176.83 176.58 1dof h MET 129 N 0.00 0.42 -0.87 4.77 2.07 -0.69 0.57 114.93 121.21 1dof h MET 129 Ca -0.00 -0.18 0.11 0.00 -2.07 0.00 0.00 59.70 57.56 1dof h MET 129 Cb 0.89 -0.01 -0.08 0.00 -1.87 0.00 0.00 31.60 30.52 1dof h MET 129 CO 0.06 0.70 0.50 0.00 1.07 0.00 0.00 176.91 179.24 1dof h ALA 130 N 0.71 1.27 -0.18 6.32 0.00 -0.25 0.45 119.26 127.57 1dof h ALA 130 Ca 0.05 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.82 1dof h ALA 130 Cb 0.57 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.24 1dof h ALA 130 CO 0.03 0.08 -0.58 0.00 0.00 0.00 0.00 179.25 178.78 1dof h ARG 131 N 0.80 0.72 -0.19 0.00 3.08 -0.96 -1.62 114.38 116.21 1dof h ARG 131 Ca 0.43 -0.53 0.03 0.00 0.07 0.00 0.00 59.98 59.98 1dof h ARG 131 Cb 0.45 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1dof h ARG 131 CO -0.28 1.15 0.01 -0.22 -1.07 0.00 0.00 179.97 179.56 1dof h LYS 132 N 0.42 0.08 -0.69 0.04 3.64 -0.51 -2.95 116.57 116.60 1dof h LYS 132 Ca -0.02 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 1dof h LYS 132 Cb 1.20 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.95 1dof h LYS 132 CO 0.12 0.05 0.11 0.66 -2.27 0.00 0.00 179.45 178.12 1dof n TYR 133 N -5.11 2.04 -0.21 1.91 4.02 0.12 -4.66 117.16 115.27 1dof n TYR 133 Ca -0.03 -0.84 0.18 0.00 -0.01 0.00 0.00 57.90 57.20 1dof n TYR 133 Cb 0.10 -0.55 0.53 0.00 -0.02 0.00 0.00 39.34 39.40 1dof n TYR 133 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 1dof h LYS 134 N 3.10 0.36 -0.17 -0.72 2.10 -1.10 -0.88 116.57 119.27 1dof h LYS 134 Ca 0.10 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.73 1dof h LYS 134 Cb 1.99 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 33.24 1dof h LYS 134 CO 0.55 0.24 0.00 0.25 -2.00 0.00 0.00 179.45 178.49 1dof n THR 135 N -4.48 1.34 -2.40 0.07 -2.24 -1.26 -4.59 114.28 100.72 1dof n THR 135 Ca 0.17 -1.33 -0.42 0.00 -2.27 0.00 0.00 64.05 60.20 1dof n THR 135 Cb 0.65 0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 69.13 1dof n THR 135 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1dof s LEU 136 N -1.58 3.46 0.31 3.22 0.20 -0.55 -4.97 118.68 118.78 1dof s LEU 136 Ca 0.20 0.43 -0.28 0.00 0.69 0.00 0.00 54.13 55.17 1dof s LEU 136 Cb 0.14 -3.21 -0.09 0.00 -0.43 0.00 0.00 46.19 42.60 1dof s LEU 136 CO 0.08 -1.61 1.08 -1.61 -0.29 0.00 0.00 176.35 174.00 1dof s GLU 137 N 5.29 4.51 0.18 1.98 2.02 -1.26 -1.01 118.70 130.41 1dof s GLU 137 Ca 0.54 1.72 -0.10 0.00 0.02 0.00 0.00 54.97 57.15 1dof s GLU 137 Cb -0.11 -3.01 -0.01 0.00 0.10 0.00 0.00 34.13 31.10 1dof s GLU 137 CO 0.27 0.12 0.32 0.00 0.02 0.00 0.00 175.26 175.99 1dof s MET 138 N -1.73 1.23 0.21 1.61 0.23 -0.09 -4.63 119.30 116.14 1dof s MET 138 Ca 0.48 -1.18 -0.30 0.00 -1.03 0.00 0.00 55.69 53.66 1dof s MET 138 Cb -0.29 0.40 -0.08 0.00 -1.53 0.00 0.00 34.83 33.32 1dof s MET 138 CO 0.37 -0.46 1.04 0.54 -2.03 0.00 0.00 175.02 174.48 1dof s VAL 139 N -3.98 3.91 0.59 5.16 0.11 -1.26 -1.07 120.40 123.87 1dof s VAL 139 Ca 0.18 1.77 -0.08 0.00 -2.93 0.00 0.00 61.98 60.93 1dof s VAL 139 Cb 0.03 -4.13 -0.01 0.00 -1.53 0.00 0.00 36.38 30.74 1dof s VAL 139 CO 0.02 0.36 0.93 -0.83 -3.33 0.00 0.00 175.10 172.25 1dof s GLY 140 N -0.58 1.59 -0.05 6.54 0.00 -0.65 -4.73 107.32 109.45 1dof s GLY 140 Ca 0.46 -0.49 -0.00 0.00 0.00 0.00 0.00 44.72 44.68 1dof s GLY 140 CO 0.35 -0.22 -0.01 0.50 0.00 0.00 0.00 173.10 173.72 1dof s ARG 141 N -5.04 0.53 -0.05 2.90 0.52 -1.26 -0.38 118.95 116.17 1dof s ARG 141 Ca 0.53 0.05 0.02 0.00 -0.52 0.00 0.00 55.73 55.81 1dof s ARG 141 Cb -0.11 -0.74 0.02 0.00 0.52 0.00 0.00 34.95 34.64 1dof s ARG 141 CO 0.48 -0.18 -0.09 0.95 0.02 0.00 0.00 175.30 176.48 1dof s THR 142 N 1.36 0.86 -0.42 0.02 -4.23 -0.49 -4.67 115.64 108.07 1dof s THR 142 Ca -0.05 -0.32 0.00 0.00 -1.18 0.00 0.00 61.69 60.14 1dof s THR 142 Cb -0.13 -0.82 0.00 0.00 1.34 0.00 0.00 72.50 72.89 1dof s THR 142 CO -0.02 0.29 0.00 1.41 -0.54 0.00 0.00 174.62 175.76 1dof n HIS 143 N 3.88 0.00 -0.71 3.99 8.25 -1.26 -1.72 115.22 127.65 1dof n HIS 143 Ca -0.24 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 1dof n HIS 143 Cb 0.51 -1.45 0.00 0.00 1.12 0.00 0.00 29.99 30.18 1dof n HIS 143 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dof n GLY 144 N -1.08 1.56 3.97 -1.41 0.00 -1.26 -5.02 105.19 101.94 1dof n GLY 144 Ca -0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 1dof n GLY 144 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dof s GLN 145 N -0.01 3.13 0.14 1.61 -1.52 -0.70 -5.05 119.66 117.27 1dof s GLN 145 Ca 0.00 -1.00 -0.30 0.00 -1.95 0.00 0.00 55.36 52.11 1dof s GLN 145 Cb 0.00 -2.80 -0.07 0.00 -0.22 0.00 0.00 33.01 29.92 1dof s GLN 145 CO 0.00 0.13 1.16 -1.58 -0.25 0.00 0.00 175.29 174.75 1dof s TRP 146 N -2.15 3.49 0.30 0.91 0.51 -1.26 -1.40 118.94 119.33 1dof s TRP 146 Ca 0.43 1.45 0.02 0.00 -2.12 0.00 0.00 56.10 55.88 1dof s TRP 146 Cb -0.09 -3.37 -0.01 0.00 -0.81 0.00 0.00 33.47 29.19 1dof s TRP 146 CO 0.30 -1.00 0.07 0.00 -0.51 0.00 0.00 176.95 175.81 1dof n ALA 147 N 2.91 0.36 -1.00 0.98 0.00 0.49 -4.80 120.51 119.45 1dof n ALA 147 Ca 0.05 -1.45 -0.35 0.00 0.00 0.00 0.00 53.44 51.69 1dof n ALA 147 Cb 0.46 0.92 0.09 0.00 0.00 0.00 0.00 19.45 20.92 1dof n ALA 147 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1dof n GLU 148 N -0.70 -0.04 -1.03 0.00 1.02 -1.26 -3.29 120.64 115.35 1dof n GLU 148 Ca -0.07 0.03 -0.33 0.00 -0.02 0.00 0.00 57.16 56.77 1dof n GLU 148 Cb 0.42 -1.72 0.13 0.00 -0.02 0.00 0.00 31.44 30.26 1dof n GLU 148 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1dof s PRO 149 N -3.06 1.51 0.00 3.49 0.02 -1.26 -1.64 135.00 134.06 1dof s PRO 149 Ca 0.58 1.70 0.00 0.00 0.02 0.00 0.00 61.00 63.30 1dof s PRO 149 Cb -0.26 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1dof s PRO 149 CO 0.66 -2.30 0.00 0.44 -0.33 0.00 0.00 177.00 175.47 1dof n ILE 150 N -3.50 0.00 -4.34 2.83 -5.35 -0.23 -4.67 119.36 104.10 1dof n ILE 150 Ca 0.13 0.00 -0.26 0.00 -0.27 0.00 0.00 62.75 62.35 1dof n ILE 150 Cb 0.51 0.00 -0.12 0.00 -1.74 0.00 0.00 39.64 38.28 1dof n ILE 150 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1dof s THR 151 N -1.73 1.97 0.24 7.28 -4.23 -1.26 -0.91 115.64 117.00 1dof s THR 151 Ca 0.00 -1.72 -0.06 0.00 -1.18 0.00 0.00 61.69 58.74 1dof s THR 151 Cb 0.00 -1.80 0.22 0.00 1.34 0.00 0.00 72.50 72.27 1dof s THR 151 CO 0.00 -0.05 1.87 0.25 -0.54 0.00 0.00 174.62 176.15 1dof h LEU 152 N 3.81 0.92 -1.30 4.79 6.46 -1.17 -1.84 115.31 126.98 1dof h LEU 152 Ca -0.47 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.24 1dof h LEU 152 Cb 1.18 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.91 1dof h LEU 152 CO 0.42 0.61 -0.11 1.23 -0.62 0.00 0.00 178.44 179.97 1dof h GLY 153 N 1.07 0.37 1.01 3.75 0.00 -1.41 -1.62 103.07 106.24 1dof h GLY 153 Ca 0.37 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 1dof h GLY 153 CO -0.15 0.21 0.37 -2.75 0.00 0.00 0.00 176.54 174.23 1dof h PHE 154 N 0.32 1.05 -0.13 5.60 3.57 -1.60 0.70 116.94 126.46 1dof h PHE 154 Ca 0.07 -0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.55 1dof h PHE 154 Cb 0.39 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 1dof h PHE 154 CO 0.01 0.76 -0.08 -0.22 -2.23 0.00 0.00 178.31 176.55 1dof h LYS 155 N 1.03 -0.08 -0.11 1.11 3.64 -0.95 -1.56 116.57 119.65 1dof h LYS 155 Ca 0.26 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.56 1dof h LYS 155 Cb 0.09 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1dof h LYS 155 CO -0.04 -0.05 -0.28 0.74 -2.27 0.00 0.00 179.45 177.55 1dof h PHE 156 N -0.08 0.23 -0.40 1.91 0.05 -0.91 -2.48 116.94 115.26 1dof h PHE 156 Ca 0.08 -0.04 -0.07 0.00 3.82 0.00 0.00 57.97 61.75 1dof h PHE 156 Cb 0.19 -0.06 -0.02 0.00 2.00 0.00 0.00 35.95 38.07 1dof h PHE 156 CO -0.21 0.48 -0.04 0.00 -0.18 0.00 0.00 178.31 178.36 1dof h ALA 157 N 1.52 1.18 -0.58 2.45 0.00 -0.36 -1.57 119.26 121.90 1dof h ALA 157 Ca 0.03 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1dof h ALA 157 Cb 0.61 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1dof h ALA 157 CO 0.04 0.53 0.10 -0.91 0.00 0.00 0.00 179.25 179.01 1dof h ASN 158 N 0.63 0.92 -0.63 0.00 2.35 -0.86 -1.84 115.58 116.15 1dof h ASN 158 Ca 0.12 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.59 1dof h ASN 158 Cb 0.45 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1dof h ASN 158 CO 0.02 0.95 0.33 1.88 -1.65 0.00 0.00 177.43 178.96 1dof h TYR 159 N 0.86 0.90 -0.68 1.19 -1.99 -1.10 -0.57 116.97 115.57 1dof h TYR 159 Ca 0.18 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.87 1dof h TYR 159 Cb 0.42 -0.29 -0.03 0.00 2.00 0.00 0.00 36.73 38.83 1dof h TYR 159 CO 0.03 0.65 0.39 -0.92 -0.00 0.00 0.00 178.16 178.30 1dof h TYR 160 N 0.91 0.91 -0.60 4.88 3.20 -0.86 0.36 116.97 125.78 1dof h TYR 160 Ca 0.23 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.00 1dof h TYR 160 Cb 0.07 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.02 1dof h TYR 160 CO 0.01 0.64 0.06 -0.92 -1.64 0.00 0.00 178.16 176.30 1dof h TYR 161 N 0.93 1.09 -0.72 -3.82 -0.00 -0.85 -0.27 116.97 113.32 1dof h TYR 161 Ca 0.24 -0.17 -0.03 0.00 -0.00 0.00 0.00 58.73 58.77 1dof h TYR 161 Cb 0.01 -0.29 -0.03 0.00 -0.00 0.00 0.00 36.73 36.41 1dof h TYR 161 CO -0.01 0.95 0.32 0.93 -0.00 0.00 0.00 178.16 180.35 1dof h GLU 162 N 0.91 1.05 -0.35 1.82 5.08 -0.31 -1.66 114.58 121.12 1dof h GLU 162 Ca 0.18 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 1dof h GLU 162 Cb 0.48 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1dof h GLU 162 CO 0.02 0.84 -0.07 1.25 -1.00 0.00 0.00 179.01 180.05 1dof h LEU 163 N 1.01 0.56 -0.57 1.33 5.85 -0.02 -2.49 115.31 120.99 1dof h LEU 163 Ca 0.24 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 1dof h LEU 163 Cb 0.16 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1dof h LEU 163 CO -0.03 0.68 0.27 0.22 -0.34 0.00 0.00 178.44 179.24 1dof h TYR 164 N 0.55 0.82 -0.34 1.25 3.20 -0.43 0.14 116.97 122.15 1dof h TYR 164 Ca 0.11 -0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.97 1dof h TYR 164 Cb 0.45 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 1dof h TYR 164 CO 0.02 0.63 0.12 0.82 -1.64 0.00 0.00 178.16 178.11 1dof h ILE 165 N 0.77 0.91 -0.54 1.81 2.04 -0.91 -1.79 117.51 119.80 1dof h ILE 165 Ca 0.20 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.92 1dof h ILE 165 Cb 0.12 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 1dof h ILE 165 CO -0.02 0.05 0.19 0.00 0.00 0.00 0.00 178.15 178.36 1dof h ALA 166 N 1.21 1.30 -0.65 1.87 0.00 -1.01 -2.18 119.26 119.82 1dof h ALA 166 Ca 0.15 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1dof h ALA 166 Cb 0.12 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1dof h ALA 166 CO -0.15 0.51 0.16 0.00 0.00 0.00 0.00 179.25 179.76 1dof h ARG 168 N 0.97 1.16 -0.68 0.00 2.47 -0.94 -0.66 114.38 116.70 1dof h ARG 168 Ca 0.21 -0.09 -0.07 0.00 -1.26 0.00 0.00 59.98 58.77 1dof h ARG 168 Cb 0.34 -0.25 -0.03 0.00 -1.65 0.00 0.00 29.97 28.38 1dof h ARG 168 CO 0.00 0.80 0.16 0.37 0.56 0.00 0.00 179.97 181.85 1dof h GLN 169 N 1.18 1.10 -0.56 0.04 5.75 -1.14 -2.13 115.11 119.35 1dof h GLN 169 Ca 0.31 -0.27 -0.10 0.00 -0.15 0.00 0.00 58.65 58.45 1dof h GLN 169 Cb -0.08 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.30 1dof h GLN 169 CO -0.06 0.98 -0.03 1.25 -2.65 0.00 0.00 178.83 178.32 1dof h LEU 170 N 1.02 0.97 -0.98 -2.39 5.85 -0.80 -1.93 115.31 117.06 1dof h LEU 170 Ca 0.21 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.61 1dof h LEU 170 Cb 0.38 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1dof h LEU 170 CO 0.00 1.04 0.19 0.00 -0.34 0.00 0.00 178.44 179.34 1dof h ALA 171 N 1.05 1.18 -0.69 1.25 0.00 -0.85 0.17 119.26 121.37 1dof h ALA 171 Ca 0.16 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1dof h ALA 171 Cb 0.56 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1dof h ALA 171 CO 0.03 0.57 0.17 1.25 0.00 0.00 0.00 179.25 181.28 1dof h LEU 172 N 0.91 1.04 0.05 0.00 5.85 -1.16 -0.49 115.31 121.51 1dof h LEU 172 Ca 0.20 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 1dof h LEU 172 Cb 0.26 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1dof h LEU 172 CO -0.01 1.00 -0.02 0.00 -0.34 0.00 0.00 178.44 179.07 1dof h ALA 173 N 1.08 -0.07 -0.81 1.25 0.00 -0.84 -2.38 119.26 117.49 1dof h ALA 173 Ca 0.22 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.10 1dof h ALA 173 Cb 0.37 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1dof h ALA 173 CO 0.00 -0.46 0.50 1.49 0.00 0.00 0.00 179.25 180.77 1dof h GLU 174 N -0.21 0.89 -0.97 0.00 4.81 -0.22 -1.53 114.58 117.35 1dof h GLU 174 Ca -0.01 -0.05 0.18 0.00 -0.13 0.00 0.00 59.36 59.35 1dof h GLU 174 Cb 0.19 -0.20 -0.09 0.00 0.63 0.00 0.00 28.75 29.28 1dof h GLU 174 CO 0.01 0.59 0.61 1.49 -0.73 0.00 0.00 179.01 180.98 1dof h GLU 175 N 0.92 0.69 -0.36 1.92 4.81 -0.59 -2.47 114.58 119.49 1dof h GLU 175 Ca 0.35 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 1dof h GLU 175 Cb 0.14 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1dof h GLU 175 CO -0.16 0.45 0.00 1.19 -0.73 0.00 0.00 179.01 179.76 1dof n PHE 176 N -4.66 0.47 -2.87 0.92 3.01 -0.60 -4.73 117.46 109.00 1dof n PHE 176 Ca 0.21 -0.24 -0.43 0.00 1.01 0.00 0.00 57.45 58.01 1dof n PHE 176 Cb 0.56 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.99 1dof n PHE 176 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1dof s ILE 177 N -1.53 4.40 0.12 4.37 -1.09 -0.93 -4.79 121.20 121.75 1dof s ILE 177 Ca 0.37 -0.08 0.02 0.00 -2.23 0.00 0.00 60.65 58.74 1dof s ILE 177 Cb 0.21 -4.58 -0.04 0.00 -1.58 0.00 0.00 42.46 36.46 1dof s ILE 177 CO 0.30 -1.24 -0.05 -0.13 -1.23 0.00 0.00 174.94 172.58 1dof s ARG 178 N 3.89 0.93 0.55 2.79 0.52 -1.26 -4.89 118.95 121.48 1dof s ARG 178 Ca 0.25 -1.40 -0.21 0.00 -0.52 0.00 0.00 55.73 53.85 1dof s ARG 178 Cb -0.15 -0.27 -0.05 0.00 0.52 0.00 0.00 34.95 35.00 1dof s ARG 178 CO 0.14 -0.03 1.32 0.00 0.02 0.00 0.00 175.30 176.75 1dof n ALA 179 N -0.11 1.43 -3.90 2.13 0.00 -0.36 -4.68 120.51 115.01 1dof n ALA 179 Ca -0.11 0.12 -0.30 0.00 0.00 0.00 0.00 53.44 53.15 1dof n ALA 179 Cb 0.61 -2.33 -0.15 0.00 0.00 0.00 0.00 19.45 17.58 1dof n ALA 179 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1dof s LYS 180 N -2.87 1.29 -0.34 0.00 2.36 -1.26 -1.07 119.74 117.84 1dof s LYS 180 Ca 0.72 -1.31 0.03 0.00 -2.55 0.00 0.00 55.97 52.86 1dof s LYS 180 Cb -0.42 -2.61 0.10 0.00 -1.05 0.00 0.00 37.83 33.85 1dof s LYS 180 CO 0.49 -0.84 0.06 0.42 1.55 0.00 0.00 175.35 177.03 1dof s ILE 181 N 1.30 2.05 0.00 5.43 -1.09 -1.26 -4.25 121.20 123.38 1dof s ILE 181 Ca 0.05 -2.20 0.00 0.00 -2.23 0.00 0.00 60.65 56.27 1dof s ILE 181 Cb -0.18 -2.52 0.00 0.00 -1.58 0.00 0.00 42.46 38.17 1dof s ILE 181 CO -0.13 -0.61 0.00 0.61 -1.23 0.00 0.00 174.94 173.58 1dof n GLY 182 N 4.34 1.00 2.35 6.18 0.00 -1.26 -4.82 105.19 112.98 1dof n GLY 182 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1dof n GLY 182 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dof n GLY 183 N 0.00 -2.22 0.31 -0.02 0.00 -1.26 -0.87 105.19 101.13 1dof n GLY 183 Ca 0.00 -1.50 -0.00 0.00 0.00 0.00 0.00 46.02 44.51 1dof n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dof n ALA 184 N -0.66 -0.06 -1.19 4.61 0.00 -1.26 -1.46 120.51 120.48 1dof n ALA 184 Ca 0.00 0.82 0.04 0.00 0.00 0.00 0.00 53.44 54.30 1dof n ALA 184 Cb 0.00 -0.39 0.06 0.00 0.00 0.00 0.00 19.45 19.12 1dof n ALA 184 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1dof n VAL 185 N -5.22 0.94 -0.31 0.00 0.24 -1.26 -4.18 118.33 108.54 1dof n VAL 185 Ca 0.09 -1.09 0.00 0.00 -2.04 0.00 0.00 64.34 61.29 1dof n VAL 185 Cb 0.34 0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.96 1dof n VAL 185 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dof n GLY 186 N -0.67 1.44 0.00 7.63 0.00 -0.54 -3.56 105.19 109.49 1dof n GLY 186 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 1dof n GLY 186 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dof n THR 187 N -2.00 0.01 -2.12 2.61 -2.24 -1.19 -4.61 114.28 104.74 1dof n THR 187 Ca 0.00 -0.01 -0.20 0.00 -2.27 0.00 0.00 64.05 61.57 1dof n THR 187 Cb 0.00 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 1dof n THR 187 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1dof n MET 188 N -1.52 -1.52 -0.34 -0.78 0.00 -0.05 -4.87 117.12 108.04 1dof n MET 188 Ca 0.06 1.04 -0.03 0.00 0.00 0.00 0.00 57.70 58.77 1dof n MET 188 Cb 0.34 -5.56 0.10 0.00 0.00 0.00 0.00 33.22 28.10 1dof n MET 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1dof h ALA 189 N 0.64 1.21 -0.96 3.04 0.00 -1.89 -1.42 119.26 119.89 1dof h ALA 189 Ca -0.45 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 54.48 1dof h ALA 189 Cb 1.33 -0.37 -0.08 0.00 0.00 0.00 0.00 17.79 18.67 1dof h ALA 189 CO 0.57 0.66 0.61 0.66 0.00 0.00 0.00 179.25 181.75 1dof h SER 190 N 1.28 0.82 0.48 0.00 4.64 -1.89 -1.43 113.55 117.46 1dof h SER 190 Ca 0.33 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1dof h SER 190 Cb -0.03 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 1dof h SER 190 CO -0.06 0.43 -0.90 0.79 -0.87 0.00 0.00 176.83 176.22 1dof n TRP 191 N -4.60 0.26 0.00 4.77 8.01 -0.97 -4.87 117.44 120.04 1dof n TRP 191 Ca 0.18 0.08 0.00 0.00 -1.31 0.00 0.00 57.50 56.45 1dof n TRP 191 Cb 0.40 -0.42 0.00 0.00 -2.01 0.00 0.00 31.31 29.28 1dof n TRP 191 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1dof n GLY 192 N 1.39 3.60 0.20 6.99 0.00 -0.54 -2.79 105.19 114.05 1dof n GLY 192 Ca 0.03 -0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.11 1dof n GLY 192 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1dof n GLU 193 N 14.00 1.27 -0.14 1.61 0.28 -1.26 -2.30 120.64 134.10 1dof n GLU 193 Ca 0.00 -0.40 0.07 0.00 -0.16 0.00 0.00 57.16 56.66 1dof n GLU 193 Cb 0.00 -1.34 0.14 0.00 1.43 0.00 0.00 31.44 31.68 1dof n GLU 193 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1dof n LEU 194 N -0.38 2.78 0.15 -1.84 4.77 -1.12 -4.65 117.00 116.71 1dof n LEU 194 Ca 0.15 -1.65 -0.13 0.00 -0.03 0.00 0.00 56.01 54.35 1dof n LEU 194 Cb 0.16 -0.18 -0.06 0.00 -2.33 0.00 0.00 43.42 41.01 1dof n LEU 194 CO 0.12 0.65 0.71 1.23 -1.33 0.00 0.00 177.39 178.76 1dof h GLY 195 N 2.55 -0.49 1.45 -0.72 0.00 -1.54 0.78 103.07 105.10 1dof h GLY 195 Ca 0.00 0.27 0.02 0.00 0.00 0.00 0.00 47.33 47.61 1dof h GLY 195 CO 0.00 -0.21 0.34 1.41 0.00 0.00 0.00 176.54 178.08 1dof h LEU 196 N -0.48 0.55 0.01 3.11 4.07 -1.83 0.11 115.31 120.86 1dof h LEU 196 Ca 0.00 -0.01 -0.23 0.00 0.08 0.00 0.00 57.88 57.72 1dof h LEU 196 Cb 0.46 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 42.04 1dof h LEU 196 CO -0.07 0.39 -1.17 -0.33 -1.08 0.00 0.00 178.44 176.18 1dof h GLU 197 N 0.65 0.03 -0.31 1.13 4.39 -1.71 -2.45 114.58 116.31 1dof h GLU 197 Ca 0.20 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 1dof h GLU 197 Cb 0.00 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1dof h GLU 197 CO -0.05 0.92 0.14 0.28 -1.16 0.00 0.00 179.01 179.15 1dof h VAL 198 N 0.01 1.16 0.62 3.13 2.07 0.27 -1.94 116.25 121.57 1dof h VAL 198 Ca -0.08 -0.46 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 1dof h VAL 198 Cb 1.84 0.90 0.01 0.00 -1.52 0.00 0.00 31.29 32.51 1dof h VAL 198 CO 0.13 0.16 -0.30 -0.09 0.02 0.00 0.00 177.57 177.49 1dof h ARG 199 N 0.36 -0.80 -0.42 1.57 2.43 -0.93 -0.45 114.38 116.13 1dof h ARG 199 Ca 0.10 0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.42 1dof h ARG 199 Cb 0.13 0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 29.77 1dof h ARG 199 CO -0.01 -0.50 -0.21 -0.09 -1.51 0.00 0.00 179.97 177.64 1dof h ARG 200 N -0.95 -0.13 -0.29 0.20 2.43 -1.46 0.33 114.38 114.51 1dof h ARG 200 Ca -0.09 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 58.97 1dof h ARG 200 Cb 0.67 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 1dof h ARG 200 CO 0.14 -0.09 -0.33 0.00 -1.51 0.00 0.00 179.97 178.18 1dof h ARG 201 N -0.14 0.63 -0.04 0.20 3.08 -1.30 0.78 114.38 117.59 1dof h ARG 201 Ca 0.20 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1dof h ARG 201 Cb 0.45 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 1dof h ARG 201 CO -0.50 0.88 0.02 0.28 -1.07 0.00 0.00 179.97 179.57 1dof h VAL 202 N 0.53 1.12 -0.71 2.04 2.07 -0.85 -0.28 116.25 120.18 1dof h VAL 202 Ca 0.06 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 1dof h VAL 202 Cb 0.83 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1dof h VAL 202 CO 0.07 0.10 0.32 0.00 0.02 0.00 0.00 177.57 178.08 1dof h ALA 203 N 0.88 0.91 -0.65 1.67 0.00 -0.72 -1.62 119.26 119.72 1dof h ALA 203 Ca 0.01 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1dof h ALA 203 Cb 0.14 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1dof h ALA 203 CO -0.00 0.50 0.24 1.49 0.00 0.00 0.00 179.25 181.47 1dof h GLU 204 N 0.99 0.99 -0.42 0.00 4.81 -0.79 -0.40 114.58 119.76 1dof h GLU 204 Ca 0.24 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1dof h GLU 204 Cb 0.15 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1dof h GLU 204 CO -0.03 0.85 0.21 0.00 -0.73 0.00 0.00 179.01 179.32 1dof h ARG 205 N 0.93 0.57 -0.00 1.92 3.08 -0.66 -1.84 114.38 118.38 1dof h ARG 205 Ca 0.21 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1dof h ARG 205 Cb 0.24 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1dof h ARG 205 CO -0.01 0.43 -0.22 1.28 -1.07 0.00 0.00 179.97 180.38 1dof n LEU 206 N -4.42 0.27 -0.72 3.04 4.77 -0.65 -4.95 117.00 114.35 1dof n LEU 206 Ca 0.03 0.23 -0.06 0.00 -0.03 0.00 0.00 56.01 56.17 1dof n LEU 206 Cb 0.11 -0.35 -0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1dof n LEU 206 CO 0.36 0.06 -0.08 0.61 -1.33 0.00 0.00 177.39 177.01 1dof n GLY 207 N 1.47 0.14 3.37 -0.72 0.00 -0.39 -5.04 105.19 104.01 1dof n GLY 207 Ca 0.07 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 1dof n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dof s LEU 208 N -1.83 2.26 0.88 0.99 1.43 -0.30 -5.03 118.68 117.08 1dof s LEU 208 Ca 0.00 -0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 52.29 1dof s LEU 208 Cb 0.00 -1.22 0.12 0.00 0.03 0.00 0.00 46.19 45.11 1dof s LEU 208 CO 0.00 0.20 1.10 -2.16 0.23 0.00 0.00 176.35 175.72 1dof s PRO 209 N -1.75 1.41 0.08 1.29 0.04 -1.26 -4.37 135.00 130.43 1dof s PRO 209 Ca 0.13 0.66 0.05 0.00 0.04 0.00 0.00 61.00 61.87 1dof s PRO 209 Cb -0.10 -1.84 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1dof s PRO 209 CO 0.04 -2.10 -0.13 -3.38 0.04 0.00 0.00 177.00 171.48 1dof s HIS 210 N -3.05 1.17 0.39 0.56 -3.43 -1.26 -1.23 115.29 108.44 1dof s HIS 210 Ca 0.63 -0.52 -0.27 0.00 -0.80 0.00 0.00 55.06 54.10 1dof s HIS 210 Cb -0.16 -0.65 -0.10 0.00 -1.43 0.00 0.00 32.58 30.24 1dof s HIS 210 CO 0.56 0.05 1.36 -1.01 -2.00 0.00 0.00 174.74 173.70 1dof s HIS 211 N -1.65 2.77 0.23 0.38 3.76 -0.23 -4.86 115.29 115.69 1dof s HIS 211 Ca 0.01 1.34 0.01 0.00 -0.15 0.00 0.00 55.06 56.26 1dof s HIS 211 Cb -0.08 -3.79 0.23 0.00 1.11 0.00 0.00 32.58 30.06 1dof s HIS 211 CO 0.02 -2.35 1.57 -0.24 -0.85 0.00 0.00 174.74 172.89 1dof h VAL 212 N 2.70 1.33 -2.67 -0.90 3.04 -2.00 -3.45 116.25 114.30 1dof h VAL 212 Ca -0.50 -1.75 -0.10 0.00 -1.01 0.00 0.00 66.70 63.34 1dof h VAL 212 Cb 1.24 1.78 -0.20 0.00 -2.01 0.00 0.00 31.29 32.10 1dof h VAL 212 CO 0.63 0.53 -0.12 -0.51 -1.01 0.00 0.00 177.57 177.10 1dof s ILE 213 N -4.01 0.03 0.30 3.17 2.07 -1.26 -5.18 121.20 116.33 1dof s ILE 213 Ca -0.06 -0.28 -0.09 0.00 -1.41 0.00 0.00 60.65 58.81 1dof s ILE 213 Cb 0.12 -0.74 0.00 0.00 0.13 0.00 0.00 42.46 41.98 1dof s ILE 213 CO 0.81 -0.15 0.51 0.42 -1.91 0.00 0.00 174.94 174.62 1dof s THR 214 N -1.10 0.00 0.00 4.00 -4.23 -1.26 -4.88 115.64 108.17 1dof s THR 214 Ca -0.11 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1dof s THR 214 Cb -0.03 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.36 1dof s THR 214 CO 0.06 0.00 0.00 0.35 -0.54 0.00 0.00 174.62 174.49 1dof n THR 215 N -0.46 0.00 0.27 3.99 -2.24 -1.26 -4.38 114.28 110.20 1dof n THR 215 Ca -0.01 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.90 1dof n THR 215 Cb 0.62 0.00 0.82 0.00 -2.10 0.00 0.00 70.33 69.67 1dof n THR 215 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1dof h GLN 216 N 0.00 0.00 -5.97 -0.78 4.15 -1.43 -2.97 115.11 108.11 1dof h GLN 216 Ca 0.00 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 58.86 1dof h GLN 216 Cb 0.00 0.00 -0.14 0.00 0.21 0.00 0.00 27.48 27.55 1dof h GLN 216 CO 0.00 0.00 -0.74 0.14 -1.93 0.00 0.00 178.83 176.30 1dof s VAL 217 N -4.78 2.21 0.40 2.39 -7.23 -1.26 -4.55 120.40 107.58 1dof s VAL 217 Ca -0.05 -2.33 -0.27 0.00 -1.81 0.00 0.00 61.98 57.53 1dof s VAL 217 Cb 0.16 -2.26 -0.10 0.00 0.56 0.00 0.00 36.38 34.75 1dof s VAL 217 CO 0.59 -0.44 1.43 0.00 -0.31 0.00 0.00 175.10 176.37 1dof s ALA 218 N -2.68 3.41 0.18 1.32 0.00 -1.26 -4.79 121.76 117.94 1dof s ALA 218 Ca 0.28 1.47 -0.32 0.00 0.00 0.00 0.00 51.96 53.39 1dof s ALA 218 Cb -0.03 -3.58 -0.11 0.00 0.00 0.00 0.00 23.12 19.40 1dof s ALA 218 CO 0.13 -1.05 1.74 -1.25 0.00 0.00 0.00 175.76 175.33 1dof s PRO 219 N -2.22 4.13 0.00 0.00 0.04 -1.26 -4.85 135.00 130.85 1dof s PRO 219 Ca 0.56 2.59 0.16 0.00 0.04 0.00 0.00 61.00 64.35 1dof s PRO 219 Cb -0.44 -3.24 0.77 0.00 0.04 0.00 0.00 34.50 31.63 1dof s PRO 219 CO 0.58 -0.77 1.49 0.54 0.04 0.00 0.00 177.00 178.89 1dof n ARG 220 N 4.50 0.14 -0.30 4.56 3.00 -1.26 -1.38 116.66 125.92 1dof n ARG 220 Ca 0.16 0.17 0.06 0.00 -0.01 0.00 0.00 57.85 58.23 1dof n ARG 220 Cb 0.36 -1.50 0.27 0.00 0.00 0.00 0.00 32.46 31.59 1dof n ARG 220 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1dof h GLU 221 N 0.00 0.92 -0.59 5.56 3.07 -1.88 -1.35 114.58 120.31 1dof h GLU 221 Ca 0.00 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1dof h GLU 221 Cb 0.21 -0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 27.88 1dof h GLU 221 CO 0.00 0.61 0.33 0.66 -1.40 0.00 0.00 179.01 179.21 1dof h SER 222 N 0.95 0.73 0.65 1.42 4.64 -1.53 -1.36 113.55 119.05 1dof h SER 222 Ca 0.41 -0.09 -0.06 0.00 -0.47 0.00 0.00 61.79 61.58 1dof h SER 222 Cb 0.33 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 1dof h SER 222 CO -0.17 0.60 -0.30 -0.26 -0.87 0.00 0.00 176.83 175.83 1dof h PHE 223 N 0.79 0.00 -0.27 4.77 -1.00 -1.55 -2.69 116.94 117.00 1dof h PHE 223 Ca 0.21 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.82 1dof h PHE 223 Cb 0.03 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.59 1dof h PHE 223 CO -0.01 0.30 -0.51 0.00 -1.61 0.00 0.00 178.31 176.47 1dof h ALA 224 N 1.70 0.57 -0.82 2.45 0.00 -0.66 0.60 119.26 123.11 1dof h ALA 224 Ca -0.00 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 1dof h ALA 224 Cb 0.70 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1dof h ALA 224 CO 0.04 0.68 0.38 0.28 0.00 0.00 0.00 179.25 180.63 1dof h VAL 225 N 0.61 1.26 0.61 0.00 2.07 -0.97 -1.53 116.25 118.29 1dof h VAL 225 Ca 0.02 -0.74 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1dof h VAL 225 Cb 1.10 0.22 0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1dof h VAL 225 CO 0.11 0.31 -0.29 0.25 0.02 0.00 0.00 177.57 177.97 1dof h LEU 226 N 1.17 -0.70 -0.54 2.57 6.46 -1.25 -0.76 115.31 122.26 1dof h LEU 226 Ca 0.28 0.02 0.07 0.00 -0.12 0.00 0.00 57.88 58.13 1dof h LEU 226 Cb 0.14 0.18 -0.06 0.00 -0.73 0.00 0.00 40.66 40.19 1dof h LEU 226 CO -0.03 -0.50 0.20 0.00 -0.62 0.00 0.00 178.44 177.50 1dof h ALA 227 N -0.44 0.67 -0.69 1.25 0.00 -0.65 -1.25 119.26 118.17 1dof h ALA 227 Ca -0.08 0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1dof h ALA 227 Cb 0.63 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 1dof h ALA 227 CO 0.14 -0.19 0.37 0.77 0.00 0.00 0.00 179.25 180.34 1dof h SER 228 N 0.39 0.53 -0.51 0.00 0.02 -1.05 -0.81 113.55 112.12 1dof h SER 228 Ca 0.26 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.18 1dof h SER 228 Cb 0.28 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 1dof h SER 228 CO -0.25 0.33 0.07 0.00 -1.14 0.00 0.00 176.83 175.83 1dof h ALA 229 N 1.38 1.07 -0.51 3.77 0.00 -0.49 -0.24 119.26 124.25 1dof h ALA 229 Ca 0.32 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1dof h ALA 229 Cb 0.25 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1dof h ALA 229 CO -0.21 0.60 -0.03 -0.07 0.00 0.00 0.00 179.25 179.53 1dof h LEU 230 N 0.85 0.91 -0.59 0.00 4.07 -0.65 -1.46 115.31 118.44 1dof h LEU 230 Ca 0.17 -0.32 -0.11 0.00 0.08 0.00 0.00 57.88 57.70 1dof h LEU 230 Cb 0.40 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.88 1dof h LEU 230 CO 0.01 1.01 -0.12 0.00 -1.08 0.00 0.00 178.44 178.27 1dof h ALA 231 N 0.93 0.79 -0.46 1.53 0.00 -0.85 -1.85 119.26 119.35 1dof h ALA 231 Ca 0.14 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1dof h ALA 231 Cb 0.56 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1dof h ALA 231 CO 0.03 0.67 0.00 1.25 0.00 0.00 0.00 179.25 181.20 1dof h LEU 232 N 0.89 0.79 -0.44 0.00 5.85 -0.86 0.12 115.31 121.65 1dof h LEU 232 Ca 0.14 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 1dof h LEU 232 Cb 0.68 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1dof h LEU 232 CO 0.05 0.90 0.15 -0.03 -0.34 0.00 0.00 178.44 179.18 1dof h MET 233 N 0.65 0.68 -0.40 1.25 4.05 -1.21 -1.78 114.93 118.17 1dof h MET 233 Ca 0.13 -0.14 -0.04 0.00 -0.28 0.00 0.00 59.70 59.37 1dof h MET 233 Cb 0.50 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.18 1dof h MET 233 CO 0.02 0.65 0.08 0.00 0.23 0.00 0.00 176.91 177.89 1dof h ALA 234 N 1.00 1.40 -0.44 0.39 0.00 -1.12 -2.92 119.26 117.57 1dof h ALA 234 Ca 0.15 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1dof h ALA 234 Cb 0.24 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1dof h ALA 234 CO -0.01 0.43 -0.21 0.00 0.00 0.00 0.00 179.25 179.46 1dof h ALA 235 N 1.52 0.80 -0.51 0.00 0.00 -0.00 0.45 119.26 121.51 1dof h ALA 235 Ca 0.13 -0.38 0.07 0.00 0.00 0.00 0.00 54.91 54.73 1dof h ALA 235 Cb 0.24 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1dof h ALA 235 CO -0.00 0.65 0.19 0.28 0.00 0.00 0.00 179.25 180.37 1dof h VAL 236 N 0.77 0.83 0.00 0.00 2.07 -1.16 -1.82 116.25 116.93 1dof h VAL 236 Ca 0.10 -0.13 -0.12 0.00 0.82 0.00 0.00 66.70 67.38 1dof h VAL 236 Cb 0.75 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1dof h VAL 236 CO 0.06 0.07 -0.55 -0.26 0.02 0.00 0.00 177.57 176.91 1dof h PHE 237 N 0.37 0.00 -0.42 1.57 -1.00 -1.40 -2.38 116.94 113.67 1dof h PHE 237 Ca 0.25 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.00 1dof h PHE 237 Cb 0.26 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.81 1dof h PHE 237 CO -0.16 0.55 0.17 1.49 -1.61 0.00 0.00 178.31 178.75 1dof h GLU 238 N 0.00 0.63 -0.56 1.51 4.81 -0.65 0.10 114.58 120.43 1dof h GLU 238 Ca -0.01 -0.12 0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1dof h GLU 238 Cb 0.98 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.23 1dof h GLU 238 CO 0.07 0.59 0.35 -0.09 -0.73 0.00 0.00 179.01 179.20 1dof h ARG 239 N 0.54 0.67 -0.44 1.92 2.43 -0.99 -0.41 114.38 118.10 1dof h ARG 239 Ca 0.14 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1dof h ARG 239 Cb 0.19 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1dof h ARG 239 CO -0.01 0.44 0.20 1.25 -1.51 0.00 0.00 179.97 180.34 1dof h LEU 240 N 0.69 0.58 -0.40 3.80 5.85 -1.21 -0.64 115.31 123.98 1dof h LEU 240 Ca 0.22 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1dof h LEU 240 Cb -0.01 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 1dof h LEU 240 CO -0.08 0.56 0.13 0.00 -0.34 0.00 0.00 178.44 178.71 1dof h ALA 241 N 1.04 0.52 -0.64 1.25 0.00 -0.64 0.10 119.26 120.89 1dof h ALA 241 Ca 0.15 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1dof h ALA 241 Cb 0.14 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1dof h ALA 241 CO -0.02 0.15 0.42 0.28 0.00 0.00 0.00 179.25 180.08 1dof h VAL 242 N 0.49 1.14 -0.32 0.00 2.07 -0.88 -0.74 116.25 118.02 1dof h VAL 242 Ca 0.13 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1dof h VAL 242 Cb 0.24 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1dof h VAL 242 CO -0.01 0.15 0.15 -0.08 0.02 0.00 0.00 177.57 177.80 1dof h GLU 243 N 0.84 0.46 -0.52 1.57 4.81 -0.82 -1.20 114.58 119.73 1dof h GLU 243 Ca 0.24 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.32 1dof h GLU 243 Cb -0.07 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 1dof h GLU 243 CO -0.06 0.44 0.02 0.82 -0.73 0.00 0.00 179.01 179.49 1dof h ILE 244 N 0.37 1.25 -0.64 2.32 2.04 -0.86 -0.95 117.51 121.05 1dof h ILE 244 Ca 0.11 -1.02 0.06 0.00 1.00 0.00 0.00 64.86 65.01 1dof h ILE 244 Cb 0.13 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 1dof h ILE 244 CO -0.01 0.36 0.35 0.03 0.00 0.00 0.00 178.15 178.88 1dof h ARG 245 N 0.80 0.63 -0.18 2.37 3.08 -0.80 0.81 114.38 121.09 1dof h ARG 245 Ca 0.16 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.11 1dof h ARG 245 Cb 0.46 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 1dof h ARG 245 CO 0.02 0.42 -0.10 0.93 -1.07 0.00 0.00 179.97 180.17 1dof h GLU 246 N 0.65 0.39 0.00 0.04 4.39 -0.67 -3.08 114.58 116.30 1dof h GLU 246 Ca 0.28 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1dof h GLU 246 Cb 0.17 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1dof h GLU 246 CO -0.18 0.70 0.00 -0.07 -1.16 0.00 0.00 179.01 178.30 1dof h LEU 247 N 0.07 0.00 -0.33 1.33 3.38 -1.06 -1.26 115.31 117.44 1dof h LEU 247 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1dof h LEU 247 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1dof h LEU 247 CO 0.03 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 177.36 1dof n SER 248 N -2.80 0.79 -4.63 -0.43 7.64 0.27 -1.56 113.62 112.90 1dof n SER 248 Ca 0.01 0.62 -0.39 0.00 1.01 0.00 0.00 58.87 60.12 1dof n SER 248 Cb 0.27 -0.82 0.03 0.00 -1.01 0.00 0.00 64.21 62.69 1dof n SER 248 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1dof n ARG 249 N -2.29 1.22 0.26 1.43 1.74 -0.48 -4.54 116.66 114.01 1dof n ARG 249 Ca 0.04 0.45 0.16 0.00 -0.77 0.00 0.00 57.85 57.74 1dof n ARG 249 Cb 0.35 -2.17 0.90 0.00 -1.02 0.00 0.00 32.46 30.52 1dof n ARG 249 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1dof h PRO 250 N 1.09 0.00 0.00 5.56 0.13 -1.91 0.35 132.00 137.22 1dof h PRO 250 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1dof h PRO 250 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1dof h PRO 250 CO 0.54 0.00 -0.16 0.39 -0.23 0.00 0.00 178.00 178.54 1dof n GLU 251 N -3.75 0.26 -0.02 0.86 4.71 -1.26 -4.32 120.64 117.13 1dof n GLU 251 Ca -0.01 0.18 -0.04 0.00 -0.01 0.00 0.00 57.16 57.28 1dof n GLU 251 Cb 0.19 -1.76 -0.01 0.00 -1.01 0.00 0.00 31.44 28.84 1dof n GLU 251 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 1dof n ILE 252 N -2.20 1.18 -1.72 -3.67 5.41 0.03 -5.03 119.36 113.36 1dof n ILE 252 Ca 0.05 0.27 -0.17 0.00 1.00 0.00 0.00 62.75 63.90 1dof n ILE 252 Cb 0.43 -1.87 -0.05 0.00 -0.71 0.00 0.00 39.64 37.44 1dof n ILE 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1dof n GLY 253 N 2.48 1.10 0.09 7.39 0.00 0.10 -4.83 105.19 111.53 1dof n GLY 253 Ca -0.06 -0.21 -0.17 0.00 0.00 0.00 0.00 46.02 45.58 1dof n GLY 253 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1dof h GLU 254 N 0.00 0.10 -3.18 1.61 5.08 -1.57 -3.41 114.58 113.21 1dof h GLU 254 Ca -0.36 -0.17 -0.59 0.00 -1.00 0.00 0.00 59.36 57.25 1dof h GLU 254 Cb 1.15 0.06 -0.40 0.00 0.50 0.00 0.00 28.75 30.06 1dof h GLU 254 CO 0.49 1.08 -0.76 0.08 -1.00 0.00 0.00 179.01 178.90 1dof s VAL 255 N -2.30 0.88 -0.23 3.13 1.01 -1.19 -1.43 120.40 120.26 1dof s VAL 255 Ca -0.18 -1.78 -0.07 0.00 0.00 0.00 0.00 61.98 59.94 1dof s VAL 255 Cb -0.01 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1dof s VAL 255 CO 0.73 -0.80 0.06 -0.69 0.00 0.00 0.00 175.10 174.40 1dof s VAL 256 N 1.15 4.32 0.43 2.92 1.01 0.38 -2.56 120.40 128.05 1dof s VAL 256 Ca 0.14 -0.18 -0.23 0.00 0.00 0.00 0.00 61.98 61.71 1dof s VAL 256 Cb -0.20 -3.00 -0.09 0.00 0.00 0.00 0.00 36.38 33.09 1dof s VAL 256 CO -0.14 0.37 1.04 -0.70 0.00 0.00 0.00 175.10 175.67 1dof s GLU 257 N 1.36 4.06 0.00 2.72 2.12 -1.26 -0.29 118.70 127.42 1dof s GLU 257 Ca 0.05 1.44 0.00 0.00 0.36 0.00 0.00 54.97 56.82 1dof s GLU 257 Cb -0.15 -2.38 0.00 0.00 0.26 0.00 0.00 34.13 31.86 1dof s GLU 257 CO 0.03 -0.22 0.00 0.41 -0.54 0.00 0.00 175.26 174.94 1dof n GLY 258 N 0.10 -0.09 0.00 -1.50 0.00 -1.26 -4.70 105.19 97.74 1dof n GLY 258 Ca 0.06 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1dof n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dof n GLY 259 N 0.00 0.58 0.00 -0.02 0.00 -1.24 -4.92 105.19 99.59 1dof n GLY 259 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1dof n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dof n ALA 269 N 0.00 0.00 -2.70 4.61 0.00 -1.26 -4.29 120.51 116.87 1dof n ALA 269 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1dof n ALA 269 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1dof n ALA 269 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1dof s ASN 270 N 0.00 6.60 -1.15 0.00 0.01 -1.26 -4.94 114.94 114.19 1dof s ASN 270 Ca 0.00 0.71 -0.10 0.00 -0.71 0.00 0.00 52.86 52.76 1dof s ASN 270 Cb 0.00 -2.27 -0.07 0.00 0.41 0.00 0.00 41.25 39.32 1dof s ASN 270 CO 0.00 -0.05 2.34 -0.81 -1.51 0.00 0.00 177.10 177.07 1dof n PRO 271 N 4.06 2.54 0.13 -0.60 -0.04 -1.26 -4.67 135.00 135.15 1dof n PRO 271 Ca -0.07 -1.84 -0.00 0.00 -0.04 0.00 0.00 63.50 61.55 1dof n PRO 271 Cb 0.51 -2.70 0.13 0.00 -0.04 0.00 0.00 33.50 31.40 1dof n PRO 271 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1dof h THR 272 N 3.52 1.28 -0.13 0.52 1.35 -1.94 -1.19 112.91 116.32 1dof h THR 272 Ca 0.60 -2.27 -0.11 0.00 -0.55 0.00 0.00 66.41 64.08 1dof h THR 272 Cb 0.31 2.28 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 1dof h THR 272 CO 1.66 0.61 -0.34 0.00 -0.25 0.00 0.00 175.52 177.21 1dof h ALA 273 N 1.38 0.22 -0.88 6.62 0.00 -1.97 -1.35 119.26 123.28 1dof h ALA 273 Ca -0.01 -0.43 0.03 0.00 0.00 0.00 0.00 54.91 54.50 1dof h ALA 273 Cb 1.23 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 1dof h ALA 273 CO 0.08 0.27 0.58 0.77 0.00 0.00 0.00 179.25 180.95 1dof h SER 274 N 0.06 0.97 -0.37 0.00 0.02 -1.84 -0.86 113.55 111.53 1dof h SER 274 Ca -0.00 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.88 1dof h SER 274 Cb 0.95 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 1dof h SER 274 CO 0.07 0.68 0.09 -0.33 -1.14 0.00 0.00 176.83 176.19 1dof h GLU 275 N 1.13 0.69 -0.33 3.45 5.08 -1.05 -2.38 114.58 121.16 1dof h GLU 275 Ca 0.34 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.42 1dof h GLU 275 Cb -0.03 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1dof h GLU 275 CO -0.09 0.64 -0.37 -0.09 -1.00 0.00 0.00 179.01 178.10 1dof h ARG 276 N 0.66 0.78 -0.26 2.33 2.43 -0.46 -2.10 114.38 117.76 1dof h ARG 276 Ca 0.15 -0.39 0.01 0.00 -0.81 0.00 0.00 59.98 58.94 1dof h ARG 276 Cb 0.29 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1dof h ARG 276 CO 0.00 1.02 0.14 0.82 -1.51 0.00 0.00 179.97 180.44 1dof h ILE 277 N 0.64 1.01 -0.04 1.20 2.04 -0.81 -2.16 117.51 119.40 1dof h ILE 277 Ca 0.06 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 1dof h ILE 277 Cb 0.92 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1dof h ILE 277 CO 0.08 0.05 0.02 0.58 0.00 0.00 0.00 178.15 178.89 1dof h VAL 278 N 0.30 1.10 -0.87 1.67 2.07 -1.31 0.15 116.25 119.36 1dof h VAL 278 Ca 0.11 -0.30 0.13 0.00 0.82 0.00 0.00 66.70 67.46 1dof h VAL 278 Cb 0.01 1.24 -0.09 0.00 -1.52 0.00 0.00 31.29 30.93 1dof h VAL 278 CO -0.06 0.08 0.48 -1.28 0.02 0.00 0.00 177.57 176.82 1dof h SER 279 N -0.06 0.64 0.71 0.57 0.87 -1.13 -2.20 113.55 112.95 1dof h SER 279 Ca 0.01 0.07 -0.24 0.00 -1.23 0.00 0.00 61.79 60.41 1dof h SER 279 Cb 0.12 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 1dof h SER 279 CO -0.00 0.30 -1.08 -0.07 -0.53 0.00 0.00 176.83 175.45 1dof h LEU 280 N 0.72 0.27 -1.34 2.23 3.38 -1.35 -3.00 115.31 116.23 1dof h LEU 280 Ca 0.46 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1dof h LEU 280 Cb 0.57 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 1dof h LEU 280 CO -0.32 1.18 0.38 0.00 0.09 0.00 0.00 178.44 179.77 1dof h ALA 281 N 0.79 1.51 -0.77 1.53 0.00 -0.37 0.77 119.26 122.72 1dof h ALA 281 Ca -0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1dof h ALA 281 Cb 1.80 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 19.30 1dof h ALA 281 CO 0.17 0.44 0.44 0.00 0.00 0.00 0.00 179.25 180.30 1dof h ARG 282 N 0.85 1.06 0.04 0.00 3.08 -1.34 -1.99 114.38 116.07 1dof h ARG 282 Ca 0.23 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1dof h ARG 282 Cb -0.05 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.78 1dof h ARG 282 CO -0.04 0.76 -0.02 -0.92 -1.07 0.00 0.00 179.97 178.68 1dof h TYR 283 N 1.06 -0.05 -0.55 3.04 3.20 -1.06 -1.93 116.97 120.67 1dof h TYR 283 Ca 0.27 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.13 1dof h TYR 283 Cb -0.01 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 1dof h TYR 283 CO -0.00 0.14 0.28 0.28 -1.64 0.00 0.00 178.16 177.22 1dof h VAL 284 N -0.23 1.19 0.00 1.81 2.07 -0.76 -2.32 116.25 118.02 1dof h VAL 284 Ca -0.01 -0.52 -0.05 0.00 0.82 0.00 0.00 66.70 66.95 1dof h VAL 284 Cb 0.21 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1dof h VAL 284 CO 0.01 0.21 -0.24 0.08 0.02 0.00 0.00 177.57 177.65 1dof h ARG 285 N 0.74 0.00 -0.46 1.57 0.11 -1.32 -1.96 114.38 113.06 1dof h ARG 285 Ca 0.19 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.21 1dof h ARG 285 Cb 0.08 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.14 1dof h ARG 285 CO -0.03 0.24 0.03 0.00 0.10 0.00 0.00 179.97 180.32 1dof h ALA 286 N 1.76 1.20 0.00 0.08 0.00 -0.82 -2.72 119.26 118.77 1dof h ALA 286 Ca -0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1dof h ALA 286 Cb 0.44 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1dof h ALA 286 CO 0.03 0.53 -0.06 -0.07 0.00 0.00 0.00 179.25 179.68 1dof h LEU 287 N 0.70 0.00 -1.91 0.00 3.38 -0.95 -2.60 115.31 113.92 1dof h LEU 287 Ca 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1dof h LEU 287 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1dof h LEU 287 CO 0.01 0.06 -0.08 0.71 0.09 0.00 0.00 178.44 179.24 1dof h THR 288 N 0.00 0.97 -0.49 0.22 1.35 -1.49 -1.75 112.91 111.72 1dof h THR 288 Ca -0.00 -0.27 -0.09 0.00 -0.55 0.00 0.00 66.41 65.50 1dof h THR 288 Cb 0.25 1.15 -0.02 0.00 -1.73 0.00 0.00 68.15 67.80 1dof h THR 288 CO 0.01 0.07 -0.06 -0.74 -0.25 0.00 0.00 175.52 174.55 1dof h HIS 289 N 0.00 0.95 -0.02 4.73 2.76 -1.64 0.22 115.15 122.15 1dof h HIS 289 Ca -0.00 -0.16 -0.00 0.00 -2.20 0.00 0.00 60.37 58.00 1dof h HIS 289 Cb 0.14 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 28.85 1dof h HIS 289 CO 0.00 0.89 0.00 0.28 -1.30 0.00 0.00 177.93 177.81 1dof h VAL 290 N 0.79 1.16 -0.64 5.26 2.07 -1.47 -1.69 116.25 121.73 1dof h VAL 290 Ca 0.14 -0.48 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 1dof h VAL 290 Cb 0.56 1.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 1dof h VAL 290 CO 0.03 0.13 0.25 0.00 0.02 0.00 0.00 177.57 178.00 1dof h ALA 291 N 0.81 1.23 -0.40 1.67 0.00 -1.15 -1.53 119.26 119.89 1dof h ALA 291 Ca 0.01 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1dof h ALA 291 Cb 0.20 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1dof h ALA 291 CO -0.00 0.56 -0.36 0.74 0.00 0.00 0.00 179.25 180.18 1dof h PHE 292 N 0.93 1.14 0.00 0.00 -1.00 -0.88 -2.94 116.94 114.18 1dof h PHE 292 Ca 0.22 -0.33 -0.02 0.00 2.81 0.00 0.00 57.97 60.64 1dof h PHE 292 Cb 0.19 -0.24 -0.00 0.00 3.61 0.00 0.00 35.95 39.50 1dof h PHE 292 CO 0.01 1.17 -0.12 0.93 -1.61 0.00 0.00 178.31 178.70 1dof h GLU 293 N 0.78 0.00 0.00 1.51 5.08 -0.77 -2.81 114.58 118.37 1dof h GLU 293 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1dof h GLU 293 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1dof h GLU 293 CO 0.09 0.12 0.00 0.09 -1.00 0.00 0.00 179.01 178.31 1dof n ASN 294 N -3.56 0.00 -0.09 1.42 3.02 -0.63 -3.64 115.26 111.78 1dof n ASN 294 Ca -0.02 0.33 -0.13 0.00 -0.03 0.00 0.00 54.58 54.73 1dof n ASN 294 Cb 0.25 -0.43 -0.04 0.00 -0.61 0.00 0.00 39.78 38.94 1dof n ASN 294 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1dof h VAL 295 N 0.00 1.30 0.00 2.41 2.07 -1.54 -3.33 116.25 117.16 1dof h VAL 295 Ca 0.00 -1.46 -0.55 0.00 0.82 0.00 0.00 66.70 65.51 1dof h VAL 295 Cb 0.32 1.61 0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1dof h VAL 295 CO 0.00 0.46 2.92 0.00 0.02 0.00 0.00 177.57 180.98 1dof n ALA 296 N -2.49 7.14 -1.69 1.67 0.00 -1.24 -4.73 120.51 119.17 1dof n ALA 296 Ca -0.04 -3.08 -0.34 0.00 0.00 0.00 0.00 53.44 49.98 1dof n ALA 296 Cb 0.47 -3.14 0.02 0.00 0.00 0.00 0.00 19.45 16.80 1dof n ALA 296 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dof s LEU 297 N 0.13 3.63 0.02 0.00 1.43 -1.25 -4.98 118.68 117.65 1dof s LEU 297 Ca 0.67 2.10 -0.30 0.00 -1.03 0.00 0.00 54.13 55.57 1dof s LEU 297 Cb 0.20 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.81 1dof s LEU 297 CO -0.05 -1.33 1.13 0.26 0.23 0.00 0.00 176.35 176.59 1dof s TRP 298 N -1.98 3.46 0.00 0.29 0.51 -1.26 -4.84 118.94 115.12 1dof s TRP 298 Ca 0.70 1.41 0.00 0.00 -2.12 0.00 0.00 56.10 56.10 1dof s TRP 298 Cb -0.22 -3.32 0.00 0.00 -0.81 0.00 0.00 33.47 29.11 1dof s TRP 298 CO 0.32 -0.87 0.00 0.72 -0.51 0.00 0.00 176.95 176.60 1dof n HIS 299 N 4.19 0.00 1.75 -1.98 8.25 -1.26 -0.71 115.22 125.47 1dof n HIS 299 Ca 0.08 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.62 1dof n HIS 299 Cb 0.48 0.00 0.40 0.00 1.12 0.00 0.00 29.99 31.98 1dof n HIS 299 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1dof n GLU 300 N 14.00 1.22 0.00 -0.41 4.71 -1.26 -4.86 120.64 134.04 1dof n GLU 300 Ca 0.00 -0.33 0.00 0.00 -0.01 0.00 0.00 57.16 56.82 1dof n GLU 300 Cb 0.00 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.16 1dof n GLU 300 CO 0.00 0.00 0.00 2.89 0.09 0.00 0.00 177.13 180.11 1dof n ARG 301 N -0.40 0.00 -4.23 3.49 -4.01 0.12 -1.92 116.66 109.71 1dof n ARG 301 Ca 0.12 0.00 -0.13 0.00 -1.04 0.00 0.00 57.85 56.80 1dof n ARG 301 Cb 0.13 0.00 -0.10 0.00 -3.04 0.00 0.00 32.46 29.45 1dof n ARG 301 CO 0.00 0.00 0.00 0.16 -3.04 0.00 0.00 177.63 174.75 1dof s ASP 302 N 0.00 0.96 -0.13 2.89 1.47 -1.24 -4.64 116.67 115.98 1dof s ASP 302 Ca 0.00 -1.22 0.12 0.00 1.18 0.00 0.00 52.55 52.64 1dof s ASP 302 Cb 0.00 0.18 0.58 0.00 -0.34 0.00 0.00 42.92 43.34 1dof s ASP 302 CO 0.00 -0.64 1.43 -0.11 0.68 0.00 0.00 175.17 176.53 1dof n LEU 303 N -0.24 4.14 0.00 2.11 7.94 -1.26 -4.27 117.00 125.43 1dof n LEU 303 Ca -0.05 -2.09 0.07 0.00 -1.11 0.00 0.00 56.01 52.82 1dof n LEU 303 Cb 0.64 -0.57 0.33 0.00 0.53 0.00 0.00 43.42 44.35 1dof n LEU 303 CO 0.33 0.59 0.72 0.35 -1.11 0.00 0.00 177.39 178.27 1dof n THR 304 N 0.65 0.87 0.05 1.96 -2.24 -1.26 -1.90 114.28 112.41 1dof n THR 304 Ca 0.20 0.22 -0.06 0.00 -2.27 0.00 0.00 64.05 62.14 1dof n THR 304 Cb 0.83 -0.97 -0.11 0.00 -2.10 0.00 0.00 70.33 67.98 1dof n THR 304 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1dof h ASN 305 N 0.00 0.00 0.74 3.42 -1.07 -1.91 -3.43 115.58 113.33 1dof h ASN 305 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 56.33 1dof h ASN 305 Cb 0.21 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 36.47 1dof h ASN 305 CO 0.00 0.92 -0.35 -1.28 0.07 0.00 0.00 177.43 176.79 1dof h SER 306 N 0.00 -0.84 -0.59 6.14 0.87 -1.71 -2.24 113.55 115.18 1dof h SER 306 Ca -0.09 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 1dof h SER 306 Cb 1.78 0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 63.93 1dof h SER 306 CO 0.11 -0.49 0.34 0.00 -0.53 0.00 0.00 176.83 176.25 1dof h ALA 307 N -1.10 0.75 0.00 6.23 0.00 -1.82 -2.14 119.26 121.17 1dof h ALA 307 Ca -0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1dof h ALA 307 Cb 0.78 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1dof h ALA 307 CO 0.17 0.25 -0.02 -2.95 0.00 0.00 0.00 179.25 176.70 1dof h ASN 308 N 0.79 0.00 0.70 0.00 7.08 -1.82 -2.72 115.58 119.62 1dof h ASN 308 Ca 0.21 0.00 -0.20 0.00 -3.08 0.00 0.00 56.30 53.23 1dof h ASN 308 Cb 0.02 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.24 1dof h ASN 308 CO -0.04 0.02 -0.90 -0.33 -2.08 0.00 0.00 177.43 174.10 1dof h GLU 309 N 0.00 0.12 -0.88 4.14 5.08 -1.16 0.28 114.58 122.16 1dof h GLU 309 Ca -0.00 -0.14 0.12 0.00 -1.00 0.00 0.00 59.36 58.33 1dof h GLU 309 Cb 0.88 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.11 1dof h GLU 309 CO 0.00 0.94 0.57 0.00 -1.00 0.00 0.00 179.01 179.52 1dof h ARG 310 N 0.06 0.76 0.00 2.33 3.08 -1.07 -2.25 114.38 117.29 1dof h ARG 310 Ca -0.04 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1dof h ARG 310 Cb 1.55 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.43 1dof h ARG 310 CO 0.13 0.50 -0.03 0.28 -1.07 0.00 0.00 179.97 179.78 1dof h VAL 311 N 0.78 0.00 -0.23 2.04 2.07 -1.40 -3.42 116.25 116.10 1dof h VAL 311 Ca 0.42 -0.79 -0.11 0.00 0.82 0.00 0.00 66.70 67.04 1dof h VAL 311 Cb 0.55 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1dof h VAL 311 CO -0.19 0.00 -0.34 4.11 0.02 0.00 0.00 177.57 181.17 1dof h TRP 312 N -0.79 0.56 0.45 1.57 5.08 -0.40 -2.75 115.95 119.67 1dof h TRP 312 Ca 0.00 -0.14 -0.02 0.00 1.08 0.00 0.00 58.89 59.81 1dof h TRP 312 Cb 0.03 -0.13 0.00 0.00 -3.00 0.00 0.00 29.16 26.07 1dof h TRP 312 CO -0.01 0.76 -0.21 0.82 -1.28 0.00 0.00 178.44 178.52 1dof h ILE 313 N 0.41 0.55 -0.68 0.12 2.04 -1.63 0.46 117.51 118.78 1dof h ILE 313 Ca 0.05 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 1dof h ILE 313 Cb 0.79 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 1dof h ILE 313 CO 0.06 0.03 0.35 -0.65 0.00 0.00 0.00 178.15 177.95 1dof h PRO 314 N -0.71 0.96 -0.40 2.37 0.11 -1.78 -2.61 132.00 129.93 1dof h PRO 314 Ca -0.06 -0.13 -0.13 0.00 0.11 0.00 0.00 66.00 65.79 1dof h PRO 314 Cb 0.52 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 1dof h PRO 314 CO 0.10 0.74 -0.25 0.93 -0.21 0.00 0.00 178.00 179.31 1dof h GLU 315 N 0.93 0.88 -0.49 1.05 5.08 -1.40 -0.52 114.58 120.12 1dof h GLU 315 Ca 0.24 -0.41 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1dof h GLU 315 Cb 0.08 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1dof h GLU 315 CO -0.03 1.06 0.28 0.00 -1.00 0.00 0.00 179.01 179.31 1dof h ALA 316 N 0.81 0.63 -0.38 3.43 0.00 -0.89 0.42 119.26 123.27 1dof h ALA 316 Ca 0.08 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1dof h ALA 316 Cb 0.82 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1dof h ALA 316 CO 0.07 0.14 -0.23 -0.07 0.00 0.00 0.00 179.25 179.16 1dof h LEU 317 N 0.65 0.78 -0.42 0.00 3.38 -1.35 0.04 115.31 118.39 1dof h LEU 317 Ca 0.17 -0.28 -0.18 0.00 0.09 0.00 0.00 57.88 57.68 1dof h LEU 317 Cb 0.03 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1dof h LEU 317 CO -0.03 0.98 -0.71 -0.07 0.09 0.00 0.00 178.44 178.70 1dof h LEU 318 N 0.67 0.50 -0.32 1.67 3.38 -0.78 -0.47 115.31 119.96 1dof h LEU 318 Ca 0.09 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 1dof h LEU 318 Cb 0.73 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1dof h LEU 318 CO 0.06 1.05 0.03 0.00 0.09 0.00 0.00 178.44 179.67 1dof h ALA 319 N 0.94 0.42 -0.45 1.53 0.00 -0.06 0.63 119.26 122.27 1dof h ALA 319 Ca -0.03 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1dof h ALA 319 Cb 1.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1dof h ALA 319 CO 0.12 0.14 0.11 1.25 0.00 0.00 0.00 179.25 180.87 1dof h LEU 320 N 0.35 0.68 -0.87 0.00 6.46 -0.90 -1.29 115.31 119.75 1dof h LEU 320 Ca 0.09 -0.23 0.07 0.00 -0.12 0.00 0.00 57.88 57.70 1dof h LEU 320 Cb 0.38 -0.18 -0.07 0.00 -0.73 0.00 0.00 40.66 40.06 1dof h LEU 320 CO 0.01 0.73 0.53 -0.78 -0.62 0.00 0.00 178.44 178.31 1dof h ASP 321 N 0.59 0.82 -0.64 1.25 3.58 -0.85 -0.70 116.42 120.46 1dof h ASP 321 Ca 0.14 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.62 1dof h ASP 321 Cb 0.31 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.19 1dof h ASP 321 CO 0.00 0.51 0.40 -0.08 -2.88 0.00 0.00 179.24 177.19 1dof h GLU 322 N 0.95 0.86 0.12 0.28 4.57 -0.53 -0.80 114.58 120.02 1dof h GLU 322 Ca 0.39 -0.07 0.01 0.00 -1.18 0.00 0.00 59.36 58.51 1dof h GLU 322 Cb 0.23 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 1dof h GLU 322 CO -0.20 0.60 -0.17 0.82 -1.18 0.00 0.00 179.01 178.88 1dof h ILE 323 N 0.87 0.61 -0.66 2.32 2.04 -0.36 0.00 117.51 122.33 1dof h ILE 323 Ca 0.23 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.03 1dof h ILE 323 Cb -0.05 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 1dof h ILE 323 CO -0.05 0.00 0.19 -0.07 0.00 0.00 0.00 178.15 178.22 1dof h LEU 324 N -0.34 0.98 -0.28 1.44 3.38 -0.90 0.68 115.31 120.27 1dof h LEU 324 Ca 0.02 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1dof h LEU 324 Cb 0.35 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1dof h LEU 324 CO -0.08 0.94 0.11 0.74 0.09 0.00 0.00 178.44 180.24 1dof h THR 325 N 0.97 1.18 -0.46 0.22 2.02 -1.06 -1.43 112.91 114.35 1dof h THR 325 Ca 0.21 -0.55 -0.03 0.00 0.77 0.00 0.00 66.41 66.81 1dof h THR 325 Cb 0.33 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 1dof h THR 325 CO -0.00 0.19 0.17 0.28 0.37 0.00 0.00 175.52 176.53 1dof h SER 326 N 0.29 0.65 -0.23 4.18 0.02 -0.65 -2.69 113.55 115.13 1dof h SER 326 Ca 0.09 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1dof h SER 326 Cb 0.19 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1dof h SER 326 CO -0.01 0.65 0.14 0.00 -1.14 0.00 0.00 176.83 176.48 1dof h ALA 327 N 1.02 0.29 -0.41 3.77 0.00 0.55 -0.74 119.26 123.74 1dof h ALA 327 Ca 0.15 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1dof h ALA 327 Cb 0.21 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1dof h ALA 327 CO -0.01 -0.22 0.21 1.25 0.00 0.00 0.00 179.25 180.48 1dof h LEU 328 N 0.29 0.31 -0.45 0.00 6.46 -1.22 -2.06 115.31 118.63 1dof h LEU 328 Ca 0.08 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.85 1dof h LEU 328 Cb -0.00 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 39.87 1dof h LEU 328 CO -0.02 0.22 0.25 -0.09 -0.62 0.00 0.00 178.44 178.18 1dof h ARG 329 N 0.42 0.63 -0.19 1.25 2.43 -1.27 -1.63 114.38 116.01 1dof h ARG 329 Ca 0.17 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1dof h ARG 329 Cb 0.08 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1dof h ARG 329 CO -0.12 0.50 0.12 0.28 -1.51 0.00 0.00 179.97 179.24 1dof h VAL 330 N 0.59 1.08 -0.32 0.20 2.07 -0.93 -2.24 116.25 116.71 1dof h VAL 330 Ca 0.16 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1dof h VAL 330 Cb 0.05 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1dof h VAL 330 CO -0.03 0.08 0.15 -0.07 0.02 0.00 0.00 177.57 177.72 1dof h LEU 331 N 0.23 0.42 -1.90 2.57 3.38 -1.25 -0.26 115.31 118.51 1dof h LEU 331 Ca 0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1dof h LEU 331 Cb 0.02 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1dof h LEU 331 CO -0.01 0.44 -0.12 0.11 0.09 0.00 0.00 178.44 178.95 1dof h LYS 332 N 0.38 0.00 -0.07 1.13 1.57 -1.26 -3.03 116.57 115.29 1dof h LYS 332 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1dof h LYS 332 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1dof h LYS 332 CO -0.01 0.12 0.00 0.09 -0.57 0.00 0.00 179.45 179.07 1dof n ASN 333 N -4.03 2.54 -4.76 0.86 3.02 -0.85 -5.03 115.26 107.01 1dof n ASN 333 Ca -0.02 -1.75 -0.38 0.00 -0.03 0.00 0.00 54.58 52.40 1dof n ASN 333 Cb 0.20 -0.03 0.03 0.00 -0.61 0.00 0.00 39.78 39.36 1dof n ASN 333 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1dof s VAL 334 N -1.40 2.41 -0.24 2.41 -7.23 -0.13 -3.66 120.40 112.56 1dof s VAL 334 Ca 0.22 0.31 -0.09 0.00 -1.81 0.00 0.00 61.98 60.60 1dof s VAL 334 Cb 0.15 -3.15 -0.04 0.00 0.56 0.00 0.00 36.38 33.89 1dof s VAL 334 CO 0.22 -0.01 0.12 -0.47 -0.31 0.00 0.00 175.10 174.65 1dof s TYR 335 N -1.39 3.19 -0.41 2.82 5.04 0.60 -4.91 117.35 122.30 1dof s TYR 335 Ca 0.69 -0.06 -0.15 0.00 -2.44 0.00 0.00 57.07 55.12 1dof s TYR 335 Cb -0.36 -2.25 0.02 0.00 0.35 0.00 0.00 41.96 39.72 1dof s TYR 335 CO 0.43 -0.13 0.30 0.42 -1.34 0.00 0.00 175.55 175.24 1dof s ILE 336 N 1.30 5.22 -0.86 3.14 -1.09 -1.26 -0.47 121.20 127.18 1dof s ILE 336 Ca 0.06 -0.70 -0.16 0.00 -2.23 0.00 0.00 60.65 57.61 1dof s ILE 336 Cb -0.15 -3.93 0.18 0.00 -1.58 0.00 0.00 42.46 36.99 1dof s ILE 336 CO 0.05 -0.33 0.91 -0.62 -1.23 0.00 0.00 174.94 173.72 1dof s ASP 337 N 1.75 6.68 0.43 3.58 -1.08 -0.52 -4.89 116.67 122.62 1dof s ASP 337 Ca 0.05 -2.38 0.10 0.00 -0.52 0.00 0.00 52.55 49.79 1dof s ASP 337 Cb -0.19 -2.29 0.93 0.00 -1.46 0.00 0.00 42.92 39.91 1dof s ASP 337 CO 0.10 -0.79 2.04 -0.33 0.52 0.00 0.00 175.17 176.71 1dof h GLU 338 N 8.26 0.35 -0.32 4.34 5.08 -1.94 -0.45 114.58 129.91 1dof h GLU 338 Ca 0.11 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 1dof h GLU 338 Cb 1.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 1dof h GLU 338 CO 0.91 0.29 -0.21 0.93 -1.00 0.00 0.00 179.01 179.93 1dof h GLU 339 N 0.35 0.71 -0.20 2.33 4.39 -1.98 -1.99 114.58 118.19 1dof h GLU 339 Ca 0.09 -0.33 -0.17 0.00 0.34 0.00 0.00 59.36 59.29 1dof h GLU 339 Cb 0.06 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1dof h GLU 339 CO -0.01 0.94 -0.57 0.00 -1.16 0.00 0.00 179.01 178.21 1dof h ARG 340 N 0.47 0.63 -0.26 2.33 3.08 -1.69 0.25 114.38 119.19 1dof h ARG 340 Ca 0.07 -0.41 0.04 0.00 0.07 0.00 0.00 59.98 59.75 1dof h ARG 340 Cb 0.75 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.81 1dof h ARG 340 CO 0.06 1.02 0.01 0.82 -1.07 0.00 0.00 179.97 180.82 1dof h ILE 341 N 0.48 0.83 -0.21 2.04 2.04 -1.08 1.58 117.51 123.19 1dof h ILE 341 Ca 0.01 -0.03 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 1dof h ILE 341 Cb 1.13 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1dof h ILE 341 CO 0.11 0.02 0.07 0.74 0.00 0.00 0.00 178.15 179.09 1dof h THR 342 N 0.10 1.19 -0.13 -0.27 2.02 -1.12 -1.64 112.91 113.05 1dof h THR 342 Ca 0.12 -0.59 -0.06 0.00 0.77 0.00 0.00 66.41 66.65 1dof h THR 342 Cb 0.15 1.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1dof h THR 342 CO -0.20 0.19 -0.17 -0.08 0.37 0.00 0.00 175.52 175.63 1dof h GLU 343 N 0.17 0.34 -0.73 6.66 4.81 -0.02 -1.00 114.58 124.80 1dof h GLU 343 Ca 0.07 -0.19 0.10 0.00 -0.13 0.00 0.00 59.36 59.21 1dof h GLU 343 Cb 0.23 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.57 1dof h GLU 343 CO -0.00 0.76 0.48 -0.91 -0.73 0.00 0.00 179.01 178.61 1dof h ASN 344 N -0.06 0.53 -0.19 1.04 2.35 0.23 -2.71 115.58 116.78 1dof h ASN 344 Ca 0.02 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.76 1dof h ASN 344 Cb 0.72 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 1dof h ASN 344 CO 0.04 0.31 0.04 0.25 -1.65 0.00 0.00 177.43 176.43 1dof h LEU 345 N 0.59 0.28 -0.88 1.61 5.85 -0.94 0.65 115.31 122.48 1dof h LEU 345 Ca 0.34 -0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.87 1dof h LEU 345 Cb 0.53 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 1dof h LEU 345 CO -0.12 0.44 0.56 1.56 -0.34 0.00 0.00 178.44 180.55 1dof h GLN 346 N 0.11 1.05 -0.67 1.25 1.08 -1.25 0.47 115.11 117.15 1dof h GLN 346 Ca 0.06 -0.06 -0.08 0.00 -1.45 0.00 0.00 58.65 57.12 1dof h GLN 346 Cb 0.27 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 1dof h GLN 346 CO 0.00 0.70 0.12 -0.22 -0.95 0.00 0.00 178.83 178.48 1dof h LYS 347 N 1.08 1.11 -0.02 1.46 3.11 -1.29 -3.04 116.57 118.99 1dof h LYS 347 Ca 0.35 -0.29 -0.14 0.00 -2.81 0.00 0.00 60.65 57.76 1dof h LYS 347 Cb 0.03 -0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 31.11 1dof h LYS 347 CO -0.13 1.01 -0.64 0.00 -2.81 0.00 0.00 179.45 176.88 1dof h ALA 348 N 1.05 0.88 -0.97 5.00 0.00 0.30 -3.41 119.26 122.12 1dof h ALA 348 Ca 0.21 -0.58 0.17 0.00 0.00 0.00 0.00 54.91 54.71 1dof h ALA 348 Cb 0.43 -0.09 -0.17 0.00 0.00 0.00 0.00 17.79 17.96 1dof h ALA 348 CO 0.01 0.78 -0.33 -0.07 0.00 0.00 0.00 179.25 179.64 1dof h LEU 349 N 0.07 -1.22 -2.43 0.00 3.38 0.02 0.11 115.31 115.23 1dof h LEU 349 Ca -0.01 0.30 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 1dof h LEU 349 Cb 1.15 0.69 -0.00 0.00 0.09 0.00 0.00 40.66 42.59 1dof h LEU 349 CO 0.09 -0.30 -0.01 1.55 0.09 0.00 0.00 178.44 179.85 1dof h PRO 350 N -0.01 0.00 0.00 1.13 0.13 -1.79 -2.74 132.00 128.72 1dof h PRO 350 Ca 0.39 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.49 1dof h PRO 350 Cb 0.64 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.76 1dof h PRO 350 CO -0.98 0.01 -1.17 0.66 -0.23 0.00 0.00 178.00 176.29 1dof n TYR 351 N -3.79 0.88 -0.38 1.56 4.02 0.36 -4.10 117.16 115.70 1dof n TYR 351 Ca -0.03 0.26 0.10 0.00 -0.01 0.00 0.00 57.90 58.23 1dof n TYR 351 Cb 0.10 -0.94 0.29 0.00 -0.02 0.00 0.00 39.34 38.77 1dof n TYR 351 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 176.86 176.29 1dof n ILE 352 N -2.67 1.13 -0.57 -0.72 -5.35 -1.03 -4.43 119.36 105.71 1dof n ILE 352 Ca -0.02 -1.04 0.08 0.00 -0.27 0.00 0.00 62.75 61.50 1dof n ILE 352 Cb 0.60 0.44 0.27 0.00 -1.74 0.00 0.00 39.64 39.21 1dof n ILE 352 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1dof n LEU 353 N 1.32 3.96 -0.30 7.28 4.77 -1.24 -4.17 117.00 128.61 1dof n LEU 353 Ca 0.22 -2.44 0.01 0.00 -0.03 0.00 0.00 56.01 53.77 1dof n LEU 353 Cb 0.62 -0.46 0.08 0.00 -2.33 0.00 0.00 43.42 41.33 1dof n LEU 353 CO 0.16 0.76 0.66 0.74 -1.33 0.00 0.00 177.39 178.38 1dof h THR 354 N 2.87 0.13 -0.81 -5.08 2.02 -1.87 -0.86 112.91 109.31 1dof h THR 354 Ca 0.00 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.34 1dof h THR 354 Cb 1.22 0.13 -0.10 0.00 -1.74 0.00 0.00 68.15 67.65 1dof h THR 354 CO 0.15 0.00 0.35 -0.08 0.37 0.00 0.00 175.52 176.31 1dof h GLU 355 N -0.03 0.46 -0.54 6.66 4.81 -1.93 0.45 114.58 124.47 1dof h GLU 355 Ca 0.37 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.52 1dof h GLU 355 Cb 0.60 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.86 1dof h GLU 355 CO -0.86 0.30 0.13 0.74 -0.73 0.00 0.00 179.01 178.59 1dof h PHE 356 N 0.47 0.91 -0.49 0.92 -1.00 -1.52 0.16 116.94 116.39 1dof h PHE 356 Ca 0.46 -0.11 -0.03 0.00 2.81 0.00 0.00 57.97 61.10 1dof h PHE 356 Cb 0.74 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 40.02 1dof h PHE 356 CO -0.15 0.79 0.19 0.45 -1.61 0.00 0.00 178.31 177.98 1dof h HIS 357 N 0.76 0.75 -0.27 -0.55 3.86 -1.24 -1.28 115.15 117.19 1dof h HIS 357 Ca 0.17 -0.06 0.03 0.00 -1.16 0.00 0.00 60.37 59.35 1dof h HIS 357 Cb 0.34 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.56 1dof h HIS 357 CO 0.02 0.64 0.09 1.98 0.86 0.00 0.00 177.93 181.53 1dof h MET 358 N 0.65 0.21 -0.46 2.45 1.85 -0.83 -2.78 114.93 116.02 1dof h MET 358 Ca 0.16 -0.01 -0.10 0.00 -0.61 0.00 0.00 59.70 59.14 1dof h MET 358 Cb 0.21 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.18 1dof h MET 358 CO -0.01 0.14 -0.12 -0.91 -0.40 0.00 0.00 176.91 175.61 1dof h ASN 359 N 0.22 0.84 -0.30 1.39 -0.26 -0.05 -2.05 115.58 115.37 1dof h ASN 359 Ca 0.12 -0.27 0.05 0.00 -0.56 0.00 0.00 56.30 55.64 1dof h ASN 359 Cb 0.08 -0.23 -0.04 0.00 -1.06 0.00 0.00 38.32 37.07 1dof h ASN 359 CO -0.12 0.98 0.03 -0.09 -1.06 0.00 0.00 177.43 177.17 1dof h ARG 360 N 0.76 0.13 -0.77 0.81 2.43 -1.08 -1.58 114.38 115.07 1dof h ARG 360 Ca 0.12 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1dof h ARG 360 Cb 0.63 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.11 1dof h ARG 360 CO 0.04 0.08 0.51 0.52 -1.51 0.00 0.00 179.97 179.62 1dof h MET 361 N 0.13 1.00 -0.19 0.20 2.86 -1.20 0.15 114.93 117.87 1dof h MET 361 Ca 0.14 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.65 1dof h MET 361 Cb 0.17 -0.22 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 1dof h MET 361 CO -0.21 0.66 -0.17 0.82 1.06 0.00 0.00 176.91 179.07 1dof h ILE 362 N 1.03 1.33 0.00 -1.22 2.04 -1.05 0.34 117.51 119.98 1dof h ILE 362 Ca 0.29 -1.31 -0.02 0.00 1.00 0.00 0.00 64.86 64.82 1dof h ILE 362 Cb -0.09 1.75 -0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1dof h ILE 362 CO -0.07 0.40 -0.09 0.11 0.00 0.00 0.00 178.15 178.50 1dof h LYS 363 N 0.13 0.00 -0.65 2.37 1.57 -0.24 0.10 116.57 119.84 1dof h LYS 363 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1dof h LYS 363 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1dof h LYS 363 CO 0.04 0.09 0.00 0.39 -0.57 0.00 0.00 179.45 179.41 1dof n GLU 364 N -3.57 2.20 -0.27 3.15 1.02 -0.08 -4.92 120.64 118.17 1dof n GLU 364 Ca -0.02 -1.13 0.00 0.00 -0.02 0.00 0.00 57.16 55.99 1dof n GLU 364 Cb 0.22 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 1dof n GLU 364 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dof n GLY 365 N 0.48 1.28 3.74 0.62 0.00 0.02 -5.01 105.19 106.32 1dof n GLY 365 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 1dof n GLY 365 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dof s ALA 366 N -2.85 2.31 0.93 4.61 0.00 0.09 -4.96 121.76 121.88 1dof s ALA 366 Ca 0.00 0.88 -0.13 0.00 0.00 0.00 0.00 51.96 52.71 1dof s ALA 366 Cb 0.00 -3.44 0.15 0.00 0.00 0.00 0.00 23.12 19.82 1dof s ALA 366 CO 0.00 -1.56 1.16 -1.54 0.00 0.00 0.00 175.76 173.82 1dof s SER 367 N -1.96 3.39 0.08 0.00 1.04 -1.26 -4.31 113.70 110.68 1dof s SER 367 Ca 0.74 0.84 -0.21 0.00 0.48 0.00 0.00 55.95 57.81 1dof s SER 367 Cb -0.28 -1.33 -0.11 0.00 0.10 0.00 0.00 66.02 64.40 1dof s SER 367 CO 0.41 -2.61 1.62 -0.09 0.98 0.00 0.00 173.24 173.55 1dof h ARG 368 N -1.54 0.22 -0.77 4.02 2.43 -1.96 -1.37 114.38 115.41 1dof h ARG 368 Ca -0.49 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 58.67 1dof h ARG 368 Cb 1.32 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.79 1dof h ARG 368 CO 0.58 0.31 0.49 0.00 -1.51 0.00 0.00 179.97 179.84 1dof h ALA 369 N 0.90 1.00 0.75 2.80 0.00 -1.99 0.16 119.26 122.89 1dof h ALA 369 Ca 0.05 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1dof h ALA 369 Cb 0.17 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1dof h ALA 369 CO -0.00 0.30 -0.47 0.93 0.00 0.00 0.00 179.25 180.01 1dof h GLU 370 N 0.96 -1.11 -0.74 0.00 5.08 -1.86 -2.55 114.58 114.36 1dof h GLU 370 Ca 0.30 0.08 0.12 0.00 -1.00 0.00 0.00 59.36 58.86 1dof h GLU 370 Cb -0.00 0.25 -0.08 0.00 0.50 0.00 0.00 28.75 29.42 1dof h GLU 370 CO -0.11 -0.74 0.33 0.00 -1.00 0.00 0.00 179.01 177.50 1dof h ALA 371 N -1.03 1.04 -0.66 3.43 0.00 -0.87 -1.44 119.26 119.74 1dof h ALA 371 Ca -0.10 0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1dof h ALA 371 Cb 0.92 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 1dof h ALA 371 CO 0.10 -0.14 0.40 0.10 0.00 0.00 0.00 179.25 179.71 1dof h TYR 372 N 0.52 0.75 0.37 0.00 -0.00 -0.62 0.42 116.97 118.41 1dof h TYR 372 Ca 0.39 0.02 -0.01 0.00 -0.00 0.00 0.00 58.73 59.13 1dof h TYR 372 Cb 0.52 -0.24 -0.00 0.00 -0.00 0.00 0.00 36.73 37.01 1dof h TYR 372 CO -0.14 0.41 -0.22 1.57 -0.00 0.00 0.00 178.16 179.78 1dof h LYS 373 N 0.78 -0.54 -0.11 0.10 5.09 -0.84 -3.02 116.57 118.02 1dof h LYS 373 Ca 0.27 0.04 -0.19 0.00 0.09 0.00 0.00 60.65 60.86 1dof h LYS 373 Cb 0.06 0.12 -0.00 0.00 0.10 0.00 0.00 32.23 32.51 1dof h LYS 373 CO -0.12 -0.36 -0.71 0.87 -2.09 0.00 0.00 179.45 177.04 1dof h LYS 374 N -0.56 0.51 -0.38 0.07 1.57 -1.31 -3.33 116.57 113.14 1dof h LYS 374 Ca -0.04 -0.40 -0.10 0.00 -1.87 0.00 0.00 60.65 58.24 1dof h LYS 374 Cb 0.46 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 1dof h LYS 374 CO 0.05 1.03 -0.19 0.00 -0.57 0.00 0.00 179.45 179.76 1dof h ALA 375 N 0.87 0.95 0.00 3.86 0.00 -0.98 -3.15 119.26 120.81 1dof h ALA 375 Ca -0.03 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1dof h ALA 375 Cb 1.29 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1dof h ALA 375 CO 0.13 0.61 -0.03 1.57 0.00 0.00 0.00 179.25 181.53 1dof h LYS 376 N 0.64 0.00 -0.01 0.00 5.09 -1.64 -1.74 116.57 118.92 1dof h LYS 376 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.84 1dof h LYS 376 Cb 0.67 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.00 1dof h LYS 376 CO 0.05 0.03 -0.28 -0.85 -2.09 0.00 0.00 179.45 176.31 1dof n GLU 377 N -4.05 0.61 -2.80 0.07 -0.00 -1.19 -4.90 120.64 108.37 1dof n GLU 377 Ca -0.03 -0.33 -0.42 0.00 -0.00 0.00 0.00 57.16 56.38 1dof n GLU 377 Cb 0.12 -1.49 -0.03 0.00 -0.00 0.00 0.00 31.44 30.03 1dof n GLU 377 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1dof s VAL 378 N -2.62 4.87 -0.80 3.84 1.01 -0.66 -5.01 120.40 121.04 1dof s VAL 378 Ca 0.22 1.86 -0.03 0.00 0.00 0.00 0.00 61.98 64.03 1dof s VAL 378 Cb 0.19 -4.23 0.20 0.00 0.00 0.00 0.00 36.38 32.54 1dof s VAL 378 CO 0.55 0.09 0.66 -1.59 0.00 0.00 0.00 175.10 174.82 1dof s LYS 379 N 1.56 3.06 -0.13 2.72 -2.85 -1.26 -4.84 119.74 117.99 1dof s LYS 379 Ca 0.45 -2.97 -0.08 0.00 -1.00 0.00 0.00 55.97 52.38 1dof s LYS 379 Cb -0.19 -3.91 0.05 0.00 -2.06 0.00 0.00 37.83 31.72 1dof s LYS 379 CO 0.20 -1.23 0.32 0.00 0.10 0.00 0.00 175.35 174.73 1dof s ALA 380 N -0.81 -0.77 0.25 0.59 0.00 -1.26 -5.04 121.76 114.73 1dof s ALA 380 Ca 0.23 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 53.07 1dof s ALA 380 Cb -0.12 -0.72 -0.09 0.00 0.00 0.00 0.00 23.12 22.18 1dof s ALA 380 CO -0.09 -0.21 1.30 -0.51 0.00 0.00 0.00 175.76 176.24 1dof s LEU 381 N 1.14 4.43 -0.02 0.00 1.02 -1.26 -4.83 118.68 119.16 1dof s LEU 381 Ca -0.08 2.50 -0.09 0.00 0.02 0.00 0.00 54.13 56.48 1dof s LEU 381 Cb -0.08 -3.63 0.01 0.00 0.02 0.00 0.00 46.19 42.51 1dof s LEU 381 CO -0.09 -0.50 0.20 0.28 0.02 0.00 0.00 176.35 176.26 1dof s THR 382 N -0.43 0.06 -0.19 5.49 -1.32 -1.26 -5.05 115.64 112.93 1dof s THR 382 Ca 0.53 -0.47 0.15 0.00 -1.21 0.00 0.00 61.69 60.69 1dof s THR 382 Cb -0.37 -0.44 0.45 0.00 -1.51 0.00 0.00 72.50 70.62 1dof s THR 382 CO 0.44 -0.26 1.34 0.49 -2.21 0.00 0.00 174.62 174.42 1dof n PHE 383 N 1.78 0.65 0.31 9.09 3.01 -1.26 -4.67 117.46 126.37 1dof n PHE 383 Ca -0.20 -1.12 0.20 0.00 1.01 0.00 0.00 57.45 57.34 1dof n PHE 383 Cb 0.56 -0.31 0.97 0.00 -0.01 0.00 0.00 39.48 40.70 1dof n PHE 383 CO 0.00 0.00 0.00 1.05 1.01 0.00 0.00 176.76 178.82 1dof h GLU 384 N 1.06 0.00 0.00 -1.08 4.11 -2.03 -2.04 114.58 114.61 1dof h GLU 384 Ca 0.05 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.46 1dof h GLU 384 Cb 1.34 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.59 1dof h GLU 384 CO 0.18 0.00 -0.08 0.10 0.07 0.00 0.00 179.01 179.29 1dof h TYR 385 N 0.00 0.00 0.00 2.06 -0.00 -2.02 -1.48 116.97 115.53 1dof h TYR 385 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1dof h TYR 385 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.97 1dof h TYR 385 CO 0.00 0.08 0.00 1.04 -0.00 0.00 0.00 178.16 179.28 1dof n GLN 386 N -4.35 0.17 -0.01 0.10 6.02 -0.77 -0.92 117.38 117.62 1dof n GLN 386 Ca -0.03 0.08 0.12 0.00 -0.01 0.00 0.00 57.00 57.16 1dof n GLN 386 Cb 0.16 -1.50 0.64 0.00 1.02 0.00 0.00 30.24 30.55 1dof n GLN 386 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1dof n LYS 387 N -1.11 1.15 -1.34 -1.09 5.02 -0.56 -4.92 118.16 115.31 1dof n LYS 387 Ca 0.04 -0.22 -0.36 0.00 -2.02 0.00 0.00 58.31 55.76 1dof n LYS 387 Cb 0.03 -1.38 0.08 0.00 -0.02 0.00 0.00 35.03 33.75 1dof n LYS 387 CO 0.00 0.00 0.00 -2.67 -0.52 0.00 0.00 177.40 174.21 1dof n TRP 388 N -0.63 0.37 -1.13 2.13 2.14 -0.10 -4.90 117.44 115.33 1dof n TRP 388 Ca 0.17 0.39 -0.26 0.00 2.07 0.00 0.00 57.50 59.87 1dof n TRP 388 Cb 0.13 -2.05 0.06 0.00 -0.81 0.00 0.00 31.31 28.64 1dof n TRP 388 CO 0.00 0.00 0.00 -0.35 2.07 0.00 0.00 177.69 179.41 1dof n PRO 389 N -1.60 2.27 -0.24 -2.67 -0.04 -1.26 -4.64 135.00 126.81 1dof n PRO 389 Ca 0.12 -2.47 -0.04 0.00 -0.04 0.00 0.00 63.50 61.08 1dof n PRO 389 Cb 0.49 -1.97 0.13 0.00 -0.04 0.00 0.00 33.50 32.12 1dof n PRO 389 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1dof h VAL 390 N 1.01 1.24 -0.39 0.52 -1.51 -1.96 -1.72 116.25 113.44 1dof h VAL 390 Ca 0.46 -0.72 -0.07 0.00 -1.23 0.00 0.00 66.70 65.14 1dof h VAL 390 Cb 0.85 0.32 -0.02 0.00 -2.13 0.00 0.00 31.29 30.32 1dof h VAL 390 CO 1.20 0.30 -0.04 -0.33 -1.23 0.00 0.00 177.57 177.47 1dof h GLU 391 N 1.06 0.63 -0.34 5.19 5.08 -1.89 0.13 114.58 124.44 1dof h GLU 391 Ca 0.25 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 1dof h GLU 391 Cb 0.15 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1dof h GLU 391 CO -0.03 0.68 -0.09 -0.09 -1.00 0.00 0.00 179.01 178.48 1dof h ARG 392 N 0.59 0.66 -0.42 2.33 9.65 -1.83 -1.15 114.38 124.22 1dof h ARG 392 Ca 0.12 -0.26 0.05 0.00 -1.10 0.00 0.00 59.98 58.79 1dof h ARG 392 Cb 0.43 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.93 1dof h ARG 392 CO 0.02 0.84 0.14 -0.07 2.80 0.00 0.00 179.97 183.70 1dof h LEU 393 N 0.45 0.13 -0.23 3.80 3.38 -1.11 0.17 115.31 121.90 1dof h LEU 393 Ca 0.08 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1dof h LEU 393 Cb 0.60 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1dof h LEU 393 CO 0.04 0.11 0.12 0.40 0.09 0.00 0.00 178.44 179.19 1dof h ILE 394 N 0.30 1.14 -0.06 1.22 2.04 -0.87 -1.62 117.51 119.66 1dof h ILE 394 Ca 0.20 -0.38 -0.12 0.00 1.00 0.00 0.00 64.86 65.55 1dof h ILE 394 Cb 0.19 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1dof h ILE 394 CO -0.21 0.13 -0.52 -0.33 0.00 0.00 0.00 178.15 177.22 1dof h GLU 395 N 0.25 0.16 -0.03 2.37 4.39 -0.64 -1.82 114.58 119.26 1dof h GLU 395 Ca 0.08 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1dof h GLU 395 Cb 0.11 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1dof h GLU 395 CO -0.01 0.65 0.01 -0.44 -1.16 0.00 0.00 179.01 178.06 1dof h ASP 396 N 0.13 0.03 -0.71 1.42 3.32 -0.50 -2.36 116.42 117.75 1dof h ASP 396 Ca 0.00 -0.09 0.07 0.00 0.02 0.00 0.00 57.03 57.02 1dof h ASP 396 Cb 0.97 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 40.45 1dof h ASP 396 CO 0.08 0.12 0.40 0.00 -1.72 0.00 0.00 179.24 178.12 1dof h ALA 397 N 0.92 0.97 0.00 3.45 0.00 -1.02 -2.69 119.26 120.89 1dof h ALA 397 Ca 0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1dof h ALA 397 Cb 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1dof h ALA 397 CO -0.00 0.08 0.00 1.28 0.00 0.00 0.00 179.25 180.61 1dof n LEU 398 N -4.76 0.42 0.09 0.00 4.77 -0.71 -2.15 117.00 114.66 1dof n LEU 398 Ca 0.10 0.57 0.13 0.00 -0.03 0.00 0.00 56.01 56.78 1dof n LEU 398 Cb 0.19 -0.47 0.44 0.00 -2.33 0.00 0.00 43.42 41.25 1dof n LEU 398 CO 0.29 -0.27 0.90 -1.54 -1.33 0.00 0.00 177.39 175.44 1dof n SER 399 N -1.93 0.68 -4.75 -1.43 3.41 -0.90 -4.81 113.62 103.89 1dof n SER 399 Ca 0.04 0.57 -0.38 0.00 -0.26 0.00 0.00 58.87 58.85 1dof n SER 399 Cb 0.30 -0.75 0.03 0.00 -0.26 0.00 0.00 64.21 63.53 1dof n SER 399 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1dof s LEU 400 N -4.29 3.87 -0.03 1.04 1.43 -0.92 -5.00 118.68 114.79 1dof s LEU 400 Ca 0.11 2.62 -0.03 0.00 -1.03 0.00 0.00 54.13 55.80 1dof s LEU 400 Cb 0.13 -4.29 -0.04 0.00 0.03 0.00 0.00 46.19 42.02 1dof s LEU 400 CO 0.57 -1.41 0.14 -1.59 0.23 0.00 0.00 176.35 174.29 1dof s LYS 401 N -2.89 3.33 -0.10 1.70 0.00 -1.26 -5.09 119.74 115.43 1dof s LYS 401 Ca 0.70 -0.33 -0.03 0.00 0.00 0.00 0.00 55.97 56.31 1dof s LYS 401 Cb -0.37 -3.05 -0.03 0.00 0.00 0.00 0.00 37.83 34.38 1dof s LYS 401 CO 0.43 0.69 0.03 -0.51 0.00 0.00 0.00 175.35 175.99 1dof s LEU 402 N -1.69 3.74 0.00 2.77 1.43 -1.26 -4.99 118.68 118.68 1dof s LEU 402 Ca 0.23 0.19 0.00 0.00 -1.03 0.00 0.00 54.13 53.52 1dof s LEU 402 Cb -0.12 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.22 1dof s LEU 402 CO 0.14 0.36 0.00 0.00 0.23 0.00 0.00 176.35 177.08