#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2psf s LYS 4 N 0.00 1.34 0.61 1.43 3.01 -1.26 -5.03 119.74 119.84 2psf s LYS 4 Ca 0.00 -1.59 0.33 0.00 -1.01 0.00 0.00 55.97 53.70 2psf s LYS 4 Cb 0.00 -1.15 1.89 0.00 -1.01 0.00 0.00 37.83 37.56 2psf s LYS 4 CO 0.00 0.19 2.21 -0.39 0.51 0.00 0.00 175.35 177.87 2psf h VAL 5 N 2.57 0.36 -0.01 3.17 -1.51 -2.02 -1.80 116.25 117.01 2psf h VAL 5 Ca -0.38 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 2psf h VAL 5 Cb 1.22 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 2psf h VAL 5 CO 0.62 0.00 -0.23 -1.22 -1.23 0.00 0.00 177.57 175.51 2psf n TYR 6 N -3.60 0.00 -1.31 5.19 4.01 -1.26 -4.92 117.16 115.27 2psf n TYR 6 Ca -0.01 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.42 2psf n TYR 6 Cb 0.18 -0.08 0.09 0.00 -0.31 0.00 0.00 39.34 39.22 2psf n TYR 6 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2psf s ASP 7 N -2.39 4.52 0.78 7.72 1.01 -0.68 -5.01 116.67 122.62 2psf s ASP 7 Ca 0.26 1.74 -0.14 0.00 0.71 0.00 0.00 52.55 55.12 2psf s ASP 7 Cb 0.19 -2.46 0.06 0.00 1.01 0.00 0.00 42.92 41.72 2psf s ASP 7 CO 0.49 -2.01 1.17 -2.65 0.21 0.00 0.00 175.17 172.37 2psf n PRO 8 N -3.50 0.34 -0.33 8.23 -0.02 -1.26 -4.78 135.00 133.67 2psf n PRO 8 Ca 0.09 0.19 0.08 0.00 -2.02 0.00 0.00 63.50 61.83 2psf n PRO 8 Cb 0.53 -2.41 0.28 0.00 -0.02 0.00 0.00 33.50 31.88 2psf n PRO 8 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2psf h GLU 9 N -0.65 0.89 0.00 -0.52 4.81 -1.96 -1.19 114.58 115.97 2psf h GLU 9 Ca -0.47 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 58.68 2psf h GLU 9 Cb 1.31 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.48 2psf h GLU 9 CO 0.47 0.59 -0.15 -0.56 -0.73 0.00 0.00 179.01 178.63 2psf h GLN 10 N 0.92 0.00 0.25 1.92 3.07 -1.98 -0.62 115.11 118.67 2psf h GLN 10 Ca 0.47 0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.88 2psf h GLN 10 Cb 0.52 0.00 0.04 0.00 0.08 0.00 0.00 27.48 28.11 2psf h GLN 10 CO -0.24 0.15 -1.47 -0.09 0.09 0.00 0.00 178.83 177.28 2psf h ARG 11 N 0.00 0.53 0.00 0.06 2.43 -1.59 -2.93 114.38 112.87 2psf h ARG 11 Ca -0.00 -0.90 -0.04 0.00 -0.81 0.00 0.00 59.98 58.23 2psf h ARG 11 Cb 0.38 0.33 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 2psf h ARG 11 CO 0.02 1.43 -0.17 0.87 -1.51 0.00 0.00 179.97 180.61 2psf h LYS 12 N 0.14 0.00 -0.01 0.20 1.57 -0.89 -2.33 116.57 115.25 2psf h LYS 12 Ca -0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 2psf h LYS 12 Cb 2.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.47 2psf h LYS 12 CO 0.27 0.17 -0.18 0.54 -0.57 0.00 0.00 179.45 179.68 2psf n ARG 13 N -4.32 0.95 -1.76 3.15 1.74 -0.29 -4.99 116.66 111.15 2psf n ARG 13 Ca -0.02 -0.51 -0.41 0.00 -0.77 0.00 0.00 57.85 56.13 2psf n ARG 13 Cb 0.23 -1.49 -0.00 0.00 -1.02 0.00 0.00 32.46 30.18 2psf n ARG 13 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 2psf n MET 14 N -0.58 2.65 -3.98 5.56 1.56 -0.88 -4.99 117.12 116.46 2psf n MET 14 Ca 0.14 0.93 -0.34 0.00 -0.27 0.00 0.00 57.70 58.16 2psf n MET 14 Cb 0.33 -2.67 -0.14 0.00 2.15 0.00 0.00 33.22 32.89 2psf n MET 14 CO 0.00 0.00 0.00 0.42 -0.73 0.00 0.00 175.97 175.66 2psf s ILE 15 N -0.84 2.73 0.84 1.12 1.01 -1.26 -5.08 121.20 119.73 2psf s ILE 15 Ca 0.56 -1.15 -0.12 0.00 0.00 0.00 0.00 60.65 59.93 2psf s ILE 15 Cb -0.49 -2.43 0.10 0.00 0.01 0.00 0.00 42.46 39.65 2psf s ILE 15 CO 0.60 0.15 1.16 0.42 0.00 0.00 0.00 174.94 177.26 2psf s THR 16 N 1.28 2.11 0.10 2.92 -4.23 -1.26 -4.84 115.64 111.72 2psf s THR 16 Ca -0.02 0.04 -0.31 0.00 -1.18 0.00 0.00 61.69 60.22 2psf s THR 16 Cb -0.17 -2.93 -0.12 0.00 1.34 0.00 0.00 72.50 70.62 2psf s THR 16 CO -0.05 -0.05 1.61 1.23 -0.54 0.00 0.00 174.62 176.82 2psf h GLY 17 N -1.21 -0.82 0.47 3.99 0.00 -1.93 -1.45 103.07 102.12 2psf h GLY 17 Ca -0.48 0.43 0.14 0.00 0.00 0.00 0.00 47.33 47.42 2psf h GLY 17 CO 0.64 -0.29 0.60 -2.55 0.00 0.00 0.00 176.54 174.94 2psf h PRO 18 N -0.71 0.80 -0.64 4.80 0.11 -1.95 0.16 132.00 134.57 2psf h PRO 18 Ca -0.01 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.01 2psf h PRO 18 Cb 0.66 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.56 2psf h PRO 18 CO -0.11 0.53 0.25 1.96 -0.21 0.00 0.00 178.00 180.42 2psf h GLN 19 N 0.82 0.97 -0.12 1.05 4.20 -1.85 -1.48 115.11 118.70 2psf h GLN 19 Ca 0.48 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.97 2psf h GLN 19 Cb 0.64 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.26 2psf h GLN 19 CO -0.24 0.82 -0.07 2.35 -0.67 0.00 0.00 178.83 181.01 2psf h TRP 20 N 0.91 0.32 -0.25 2.96 2.91 -0.40 -3.23 115.95 119.16 2psf h TRP 20 Ca 0.21 -0.08 -0.02 0.00 1.13 0.00 0.00 58.89 60.13 2psf h TRP 20 Cb 0.22 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.78 2psf h TRP 20 CO 0.01 0.63 0.06 -1.49 -1.03 0.00 0.00 178.44 176.62 2psf h TRP 21 N -0.09 0.35 0.00 2.65 6.55 -0.63 -1.37 115.95 123.42 2psf h TRP 21 Ca 0.03 -0.01 -0.01 0.00 0.95 0.00 0.00 58.89 59.84 2psf h TRP 21 Cb 0.55 -0.11 -0.00 0.00 -0.86 0.00 0.00 29.16 28.74 2psf h TRP 21 CO 0.07 0.32 -0.06 0.00 -1.05 0.00 0.00 178.44 177.73 2psf h ALA 22 N 1.71 1.13 -0.01 1.49 0.00 -1.29 -2.01 119.26 120.29 2psf h ALA 22 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2psf h ALA 22 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2psf h ALA 22 CO -0.00 0.07 -0.13 0.54 0.00 0.00 0.00 179.25 179.72 2psf n ARG 23 N -3.34 1.35 -3.07 0.00 1.74 -0.52 -4.94 116.66 107.88 2psf n ARG 23 Ca -0.01 -0.84 -0.23 0.00 -0.77 0.00 0.00 57.85 55.99 2psf n ARG 23 Cb 0.21 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2psf n ARG 23 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2psf s LYS 25 N -4.50 1.94 0.01 0.00 1.02 0.98 -4.93 119.74 114.26 2psf s LYS 25 Ca 0.46 -1.68 0.06 0.00 0.02 0.00 0.00 55.97 54.84 2psf s LYS 25 Cb -0.10 -1.91 -0.02 0.00 -0.52 0.00 0.00 37.83 35.28 2psf s LYS 25 CO 0.38 0.29 -0.20 -0.65 -0.92 0.00 0.00 175.35 174.25 2psf s GLN 26 N -3.60 1.44 -0.01 1.68 1.11 -1.26 -0.79 119.66 118.22 2psf s GLN 26 Ca 0.31 -0.80 0.00 0.00 0.01 0.00 0.00 55.36 54.89 2psf s GLN 26 Cb -0.04 -1.47 0.01 0.00 -1.01 0.00 0.00 33.01 30.50 2psf s GLN 26 CO 0.17 0.39 -0.01 1.41 0.01 0.00 0.00 175.29 177.26 2psf s MET 27 N -0.81 0.17 0.24 2.91 1.75 -0.61 -4.98 119.30 117.98 2psf s MET 27 Ca 0.07 -0.00 -0.30 0.00 -1.25 0.00 0.00 55.69 54.21 2psf s MET 27 Cb -0.08 -0.25 -0.09 0.00 2.84 0.00 0.00 34.83 37.24 2psf s MET 27 CO 0.00 -0.03 1.34 -0.80 -0.65 0.00 0.00 175.02 174.89 2psf s ASN 28 N 0.36 6.82 -0.07 1.11 0.01 -1.26 -1.10 114.94 120.81 2psf s ASN 28 Ca -0.03 2.53 -0.03 0.00 -0.71 0.00 0.00 52.86 54.62 2psf s ASN 28 Cb -0.06 -2.62 0.04 0.00 0.41 0.00 0.00 41.25 39.02 2psf s ASN 28 CO -0.01 -0.56 0.06 -0.69 -1.51 0.00 0.00 177.10 174.39 2psf s VAL 29 N -0.21 -0.07 0.00 1.60 1.01 -0.07 -4.90 120.40 117.76 2psf s VAL 29 Ca 0.55 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.82 2psf s VAL 29 Cb -0.38 -0.26 0.00 0.00 0.00 0.00 0.00 36.38 35.73 2psf s VAL 29 CO 0.42 0.09 0.00 0.18 0.00 0.00 0.00 175.10 175.80 2psf n LEU 30 N 5.28 0.00 -1.05 3.92 4.77 -1.26 -0.81 117.00 127.86 2psf n LEU 30 Ca -0.04 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.00 2psf n LEU 30 Cb 0.50 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.81 2psf n LEU 30 CO 0.07 0.00 0.67 -0.90 -1.33 0.00 0.00 177.39 175.90 2psf n ASP 31 N 4.69 3.04 0.00 -1.43 5.75 -1.26 -4.94 116.55 122.40 2psf n ASP 31 Ca 0.00 -2.20 0.00 0.00 -0.01 0.00 0.00 54.79 52.58 2psf n ASP 31 Cb 0.00 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 39.67 2psf n ASP 31 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2psf n SER 32 N 0.72 0.00 -3.63 -1.12 2.88 0.01 -4.85 113.62 107.64 2psf n SER 32 Ca 0.16 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.59 2psf n SER 32 Cb 0.55 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.97 2psf n SER 32 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2psf s PHE 33 N 0.16 -0.25 -0.10 0.66 -0.12 -1.26 -0.89 117.98 116.18 2psf s PHE 33 Ca 0.00 0.04 0.04 0.00 -0.05 0.00 0.00 56.93 56.96 2psf s PHE 33 Cb 0.00 0.27 -0.00 0.00 -0.63 0.00 0.00 43.02 42.66 2psf s PHE 33 CO 0.00 -0.67 -0.23 0.42 -0.05 0.00 0.00 175.22 174.69 2psf s ILE 34 N -3.34 2.13 -0.04 -4.49 -1.09 -0.26 -0.70 121.20 113.42 2psf s ILE 34 Ca 0.00 -1.00 -0.19 0.00 -2.23 0.00 0.00 60.65 57.23 2psf s ILE 34 Cb 0.01 -1.81 -0.05 0.00 -1.58 0.00 0.00 42.46 39.03 2psf s ILE 34 CO -0.09 0.56 0.52 0.21 -1.23 0.00 0.00 174.94 174.91 2psf s ASN 35 N 0.27 6.85 0.06 3.58 3.84 -1.26 -1.57 114.94 126.72 2psf s ASN 35 Ca -0.16 1.02 -0.22 0.00 0.21 0.00 0.00 52.86 53.71 2psf s ASN 35 Cb -0.17 -2.32 0.05 0.00 -0.55 0.00 0.00 41.25 38.26 2psf s ASN 35 CO 0.08 0.12 0.51 -0.72 -2.79 0.00 0.00 177.10 174.30 2psf s TYR 36 N -0.12 -0.41 -0.13 0.43 -0.85 0.03 -0.72 117.35 115.58 2psf s TYR 36 Ca 0.28 0.41 -0.10 0.00 -0.52 0.00 0.00 57.07 57.14 2psf s TYR 36 Cb -0.17 0.35 -0.05 0.00 0.38 0.00 0.00 41.96 42.47 2psf s TYR 36 CO 0.14 -0.66 0.19 -0.47 -1.52 0.00 0.00 175.55 173.24 2psf s TYR 37 N -2.66 3.55 -0.10 -3.49 5.04 -0.32 -0.01 117.35 119.35 2psf s TYR 37 Ca -0.04 0.55 -0.03 0.00 -2.44 0.00 0.00 57.07 55.11 2psf s TYR 37 Cb -0.00 -2.10 0.04 0.00 0.35 0.00 0.00 41.96 40.25 2psf s TYR 37 CO -0.03 0.55 0.05 0.34 -1.34 0.00 0.00 175.55 175.11 2psf s ASP 38 N -0.49 1.82 0.22 4.32 -1.08 -1.26 -0.56 116.67 119.65 2psf s ASP 38 Ca 0.15 -0.27 0.25 0.00 -0.52 0.00 0.00 52.55 52.16 2psf s ASP 38 Cb -0.13 -0.30 0.86 0.00 -1.46 0.00 0.00 42.92 41.90 2psf s ASP 38 CO 0.04 -0.27 1.76 -1.54 0.52 0.00 0.00 175.17 175.68 2psf n SER 39 N 5.23 0.77 0.00 -0.34 3.41 -0.29 -4.92 113.62 117.48 2psf n SER 39 Ca -0.06 0.60 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 2psf n SER 39 Cb 0.49 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 2psf n SER 39 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2psf n GLU 40 N -2.25 0.00 -1.58 4.33 1.02 -1.26 -4.90 120.64 116.00 2psf n GLU 40 Ca 0.05 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.86 2psf n GLU 40 Cb 0.37 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.86 2psf n GLU 40 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2psf s LYS 41 N 0.00 2.59 -1.07 3.49 1.02 -1.26 -3.90 119.74 120.62 2psf s LYS 41 Ca 0.00 1.33 -0.03 0.00 0.02 0.00 0.00 55.97 57.29 2psf s LYS 41 Cb 0.00 -1.93 0.00 0.00 -0.52 0.00 0.00 37.83 35.38 2psf s LYS 41 CO 0.00 -1.40 0.91 0.72 -0.92 0.00 0.00 175.35 174.65 2psf n HIS 42 N -2.79 -2.08 1.65 3.18 8.25 -1.26 -2.35 115.22 119.83 2psf n HIS 42 Ca 0.10 0.82 0.12 0.00 -0.26 0.00 0.00 57.72 58.50 2psf n HIS 42 Cb 0.52 -4.56 0.69 0.00 1.12 0.00 0.00 29.99 27.77 2psf n HIS 42 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2psf n ALA 43 N -4.01 2.47 0.29 -1.41 0.00 -1.25 -1.59 120.51 115.01 2psf n ALA 43 Ca -0.16 -0.15 0.17 0.00 0.00 0.00 0.00 53.44 53.31 2psf n ALA 43 Cb 0.61 -1.38 0.86 0.00 0.00 0.00 0.00 19.45 19.55 2psf n ALA 43 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2psf h GLU 44 N 0.00 0.00 -5.82 0.00 9.09 -1.93 -3.42 114.58 112.50 2psf h GLU 44 Ca 0.00 0.00 -0.50 0.00 0.05 0.00 0.00 59.36 58.91 2psf h GLU 44 Cb 0.00 0.00 -0.17 0.00 -1.65 0.00 0.00 28.75 26.93 2psf h GLU 44 CO 0.00 0.05 -0.77 -0.80 0.05 0.00 0.00 179.01 177.54 2psf s ASN 45 N -5.71 2.65 -0.06 3.06 0.01 -1.15 -4.81 114.94 108.93 2psf s ASN 45 Ca -0.02 -0.91 -0.01 0.00 -0.71 0.00 0.00 52.86 51.21 2psf s ASN 45 Cb 0.12 -0.15 0.03 0.00 0.41 0.00 0.00 41.25 41.65 2psf s ASN 45 CO 0.52 -0.07 -0.01 0.00 -1.51 0.00 0.00 177.10 176.02 2psf s ALA 46 N -2.32 0.69 -0.30 0.60 0.00 -1.26 -2.79 121.76 116.38 2psf s ALA 46 Ca 0.18 -0.10 -0.07 0.00 0.00 0.00 0.00 51.96 51.96 2psf s ALA 46 Cb -0.04 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.45 2psf s ALA 46 CO 0.07 -0.31 0.09 0.08 0.00 0.00 0.00 175.76 175.69 2psf s VAL 47 N 1.60 4.05 -0.28 0.00 1.01 0.47 -1.01 120.40 126.24 2psf s VAL 47 Ca -0.01 -0.67 -0.09 0.00 0.00 0.00 0.00 61.98 61.21 2psf s VAL 47 Cb -0.13 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 2psf s VAL 47 CO -0.04 0.07 0.13 -0.63 0.00 0.00 0.00 175.10 174.63 2psf s ILE 48 N 1.51 4.64 -0.26 2.22 1.01 0.24 -0.86 121.20 129.70 2psf s ILE 48 Ca 0.03 -0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.40 2psf s ILE 48 Cb -0.17 -3.25 -0.05 0.00 0.01 0.00 0.00 42.46 39.00 2psf s ILE 48 CO 0.03 0.23 0.16 -0.36 0.00 0.00 0.00 174.94 175.00 2psf s PHE 49 N 1.65 3.23 -0.26 3.97 0.08 -0.62 -0.85 117.98 125.18 2psf s PHE 49 Ca 0.06 0.08 0.01 0.00 0.12 0.00 0.00 56.93 57.20 2psf s PHE 49 Cb -0.16 -2.31 0.05 0.00 -0.57 0.00 0.00 43.02 40.02 2psf s PHE 49 CO 0.06 -0.11 -0.09 -0.51 -0.10 0.00 0.00 175.22 174.48 2psf s LEU 50 N 1.47 3.34 1.13 -0.37 1.43 0.37 -4.04 118.68 122.02 2psf s LEU 50 Ca 0.07 -1.20 -0.16 0.00 -1.03 0.00 0.00 54.13 51.81 2psf s LEU 50 Cb -0.15 -1.59 0.25 0.00 0.03 0.00 0.00 46.19 44.73 2psf s LEU 50 CO 0.08 -0.17 1.08 -1.38 0.23 0.00 0.00 176.35 176.18 2psf s HIS 51 N 1.19 1.19 0.00 0.29 -3.43 -1.26 -1.89 115.29 111.38 2psf s HIS 51 Ca -0.05 0.78 0.00 0.00 -0.80 0.00 0.00 55.06 54.99 2psf s HIS 51 Cb -0.19 -3.29 0.00 0.00 -1.43 0.00 0.00 32.58 27.67 2psf s HIS 51 CO -0.05 -3.58 0.00 0.41 -2.00 0.00 0.00 174.74 169.52 2psf n GLY 52 N -0.63 5.25 3.77 -1.38 0.00 -1.22 -2.60 105.19 108.37 2psf n GLY 52 Ca 0.08 -1.52 -0.36 0.00 0.00 0.00 0.00 46.02 44.22 2psf n GLY 52 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2psf s ASN 53 N 1.00 5.75 0.00 1.61 2.47 -1.26 -3.56 114.94 120.95 2psf s ASN 53 Ca 0.00 2.31 0.00 0.00 0.42 0.00 0.00 52.86 55.59 2psf s ASN 53 Cb 0.00 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.20 2psf s ASN 53 CO 0.00 -1.21 0.00 0.00 -3.72 0.00 0.00 177.10 172.17 2psf n ALA 54 N -1.03 0.00 -3.29 1.71 0.00 -1.26 -4.93 120.51 111.71 2psf n ALA 54 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2psf n ALA 54 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.92 2psf n ALA 54 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2psf n THR 55 N -1.94 0.00 -3.27 0.00 -2.24 -1.23 -4.89 114.28 100.71 2psf n THR 55 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 2psf n THR 55 Cb 0.00 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 2psf n THR 55 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2psf n SER 56 N -0.76 -0.47 -0.02 3.42 3.41 -1.26 -4.42 113.62 113.52 2psf n SER 56 Ca 0.00 -1.37 0.22 0.00 -0.26 0.00 0.00 58.87 57.46 2psf n SER 56 Cb 0.00 0.80 0.72 0.00 -0.26 0.00 0.00 64.21 65.47 2psf n SER 56 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2psf h SER 57 N 0.44 0.00 -0.93 4.04 4.64 -1.87 -1.40 113.55 118.47 2psf h SER 57 Ca -0.07 0.00 0.24 0.00 -0.47 0.00 0.00 61.79 61.49 2psf h SER 57 Cb 0.27 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.31 2psf h SER 57 CO 0.09 0.00 0.64 0.22 -0.87 0.00 0.00 176.83 176.91 2psf h TYR 58 N 0.00 0.28 -0.62 4.77 3.20 -1.94 -1.49 116.97 121.17 2psf h TYR 58 Ca 0.28 0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.34 2psf h TYR 58 Cb 1.21 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.37 2psf h TYR 58 CO 0.00 0.06 0.48 1.25 -1.64 0.00 0.00 178.16 178.31 2psf h LEU 59 N 0.20 0.00 -2.30 2.82 5.85 -1.66 -2.20 115.31 118.02 2psf h LEU 59 Ca 0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.19 2psf h LEU 59 Cb 1.52 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.55 2psf h LEU 59 CO -0.11 0.00 0.00 0.79 -0.34 0.00 0.00 178.44 178.78 2psf n TRP 60 N -4.19 0.46 -0.04 1.25 7.02 -0.56 -4.65 117.44 116.72 2psf n TRP 60 Ca 0.12 -0.23 0.10 0.00 -1.02 0.00 0.00 57.50 56.47 2psf n TRP 60 Cb 0.72 -0.00 0.49 0.00 -2.42 0.00 0.00 31.31 30.10 2psf n TRP 60 CO 0.00 0.00 0.00 0.07 -2.02 0.00 0.00 177.69 175.74 2psf h ARG 61 N 4.54 0.41 -0.00 -0.99 0.11 -1.52 -0.70 114.38 116.22 2psf h ARG 61 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 2psf h ARG 61 Cb 1.00 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.98 2psf h ARG 61 CO 0.00 0.27 -0.66 0.72 0.10 0.00 0.00 179.97 180.41 2psf n HIS 62 N -4.47 0.00 -0.02 4.08 8.25 -1.26 -4.31 115.22 117.49 2psf n HIS 62 Ca 0.07 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.33 2psf n HIS 62 Cb 0.27 -0.14 -0.13 0.00 1.12 0.00 0.00 29.99 31.11 2psf n HIS 62 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2psf h VAL 63 N 0.23 1.09 -0.27 1.59 2.07 -1.37 -3.41 116.25 116.19 2psf h VAL 63 Ca 0.00 -2.36 -0.02 0.00 0.82 0.00 0.00 66.70 65.15 2psf h VAL 63 Cb 0.51 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.97 2psf h VAL 63 CO 0.00 0.63 0.09 1.62 0.02 0.00 0.00 177.57 179.93 2psf h VAL 64 N -0.50 1.12 -0.46 2.57 3.04 -1.47 -2.69 116.25 117.87 2psf h VAL 64 Ca -0.28 -0.39 0.13 0.00 -1.01 0.00 0.00 66.70 65.15 2psf h VAL 64 Cb 1.60 0.82 -0.02 0.00 -2.01 0.00 0.00 31.29 31.68 2psf h VAL 64 CO 0.01 0.14 0.35 -0.65 -1.01 0.00 0.00 177.57 176.41 2psf h PRO 65 N 0.38 0.00 0.00 4.17 0.11 -1.78 -0.86 132.00 134.02 2psf h PRO 65 Ca 0.09 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.15 2psf h PRO 65 Cb 0.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 2psf h PRO 65 CO -0.01 0.00 -0.26 0.45 -0.21 0.00 0.00 178.00 177.97 2psf h HIS 66 N 0.00 0.00 0.00 0.65 3.86 -1.76 -3.35 115.15 114.55 2psf h HIS 66 Ca 0.22 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.17 2psf h HIS 66 Cb 0.92 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.34 2psf h HIS 66 CO 0.00 0.26 -2.02 -0.89 0.86 0.00 0.00 177.93 176.14 2psf n ILE 67 N -3.30 0.98 -0.32 2.45 5.41 -0.39 -4.54 119.36 119.64 2psf n ILE 67 Ca 0.01 -0.63 0.21 0.00 1.00 0.00 0.00 62.75 63.34 2psf n ILE 67 Cb 0.52 -0.55 0.42 0.00 -0.71 0.00 0.00 39.64 39.32 2psf n ILE 67 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2psf h GLU 68 N 0.00 0.21 0.00 0.38 5.08 -1.52 -1.28 114.58 117.45 2psf h GLU 68 Ca -0.39 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 2psf h GLU 68 Cb 1.86 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.07 2psf h GLU 68 CO 0.02 0.14 0.00 -2.30 -1.00 0.00 0.00 179.01 175.87 2psf n PRO 69 N -5.17 0.15 -0.01 2.33 -0.02 -1.26 -3.31 135.00 127.71 2psf n PRO 69 Ca 0.29 0.48 0.06 0.00 -2.02 0.00 0.00 63.50 62.31 2psf n PRO 69 Cb 0.92 -1.85 -0.09 0.00 -0.02 0.00 0.00 33.50 32.46 2psf n PRO 69 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2psf n VAL 70 N -2.14 0.00 -3.50 -1.45 0.24 -0.49 -5.00 118.33 105.99 2psf n VAL 70 Ca 0.01 -0.28 -0.14 0.00 -2.04 0.00 0.00 64.34 61.89 2psf n VAL 70 Cb 0.15 0.29 -0.04 0.00 -1.47 0.00 0.00 33.84 32.77 2psf n VAL 70 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2psf s ALA 71 N -2.80 -1.75 0.14 2.33 0.00 -1.18 -4.94 121.76 113.57 2psf s ALA 71 Ca -0.04 1.08 -0.31 0.00 0.00 0.00 0.00 51.96 52.69 2psf s ALA 71 Cb 0.08 0.21 -0.10 0.00 0.00 0.00 0.00 23.12 23.31 2psf s ALA 71 CO 0.52 -0.51 1.65 0.50 0.00 0.00 0.00 175.76 177.92 2psf s ARG 72 N -2.12 4.18 -0.17 0.00 3.52 -0.62 -4.30 118.95 119.44 2psf s ARG 72 Ca -0.05 2.43 -0.03 0.00 -0.13 0.00 0.00 55.73 57.96 2psf s ARG 72 Cb -0.00 -3.30 -0.02 0.00 -1.56 0.00 0.00 34.95 30.06 2psf s ARG 72 CO 0.00 -0.70 -0.06 0.00 -0.81 0.00 0.00 175.30 173.73 2psf s ILE 74 N 0.73 1.08 -0.32 0.00 1.01 -0.04 -1.13 121.20 122.53 2psf s ILE 74 Ca -0.03 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.19 2psf s ILE 74 Cb -0.15 -1.03 0.11 0.00 0.01 0.00 0.00 42.46 41.40 2psf s ILE 74 CO 0.02 0.36 0.14 -0.63 0.00 0.00 0.00 174.94 174.82 2psf s ILE 75 N 1.01 0.36 0.45 2.92 1.01 0.28 -1.59 121.20 125.64 2psf s ILE 75 Ca -0.08 -1.23 -0.14 0.00 0.00 0.00 0.00 60.65 59.20 2psf s ILE 75 Cb -0.15 -1.28 -0.08 0.00 0.01 0.00 0.00 42.46 40.96 2psf s ILE 75 CO -0.00 -0.76 0.87 -2.16 0.00 0.00 0.00 174.94 172.88 2psf s PRO 76 N 1.67 3.91 -0.21 2.79 0.04 -1.26 -1.18 135.00 140.77 2psf s PRO 76 Ca 0.11 0.75 -0.25 0.00 0.04 0.00 0.00 61.00 61.65 2psf s PRO 76 Cb -0.18 -2.27 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 2psf s PRO 76 CO -0.25 -0.12 0.83 -0.51 0.04 0.00 0.00 177.00 176.99 2psf s ASP 77 N -2.97 6.89 0.80 6.66 1.01 0.11 -3.82 116.67 125.35 2psf s ASP 77 Ca 0.56 1.11 -0.13 0.00 0.71 0.00 0.00 52.55 54.79 2psf s ASP 77 Cb -0.10 -2.45 0.08 0.00 1.01 0.00 0.00 42.92 41.46 2psf s ASP 77 CO 0.29 -0.46 1.19 -0.76 0.21 0.00 0.00 175.17 175.63 2psf s LEU 78 N 2.53 3.14 0.32 1.23 1.43 -1.26 -4.51 118.68 121.56 2psf s LEU 78 Ca 0.37 2.31 -0.29 0.00 -1.03 0.00 0.00 54.13 55.48 2psf s LEU 78 Cb -0.16 -4.58 -0.12 0.00 0.03 0.00 0.00 46.19 41.36 2psf s LEU 78 CO 0.10 -2.58 1.33 0.00 0.23 0.00 0.00 176.35 175.43 2psf n ILE 79 N -3.29 1.77 -0.84 -0.59 0.13 -1.26 -1.02 119.36 114.26 2psf n ILE 79 Ca 0.13 -0.44 0.00 0.00 -1.10 0.00 0.00 62.75 61.34 2psf n ILE 79 Cb 0.51 -1.59 0.00 0.00 -0.84 0.00 0.00 39.64 37.71 2psf n ILE 79 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2psf n GLY 80 N 1.07 1.09 3.41 4.50 0.00 -0.17 -4.89 105.19 110.19 2psf n GLY 80 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.88 2psf n GLY 80 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2psf s MET 81 N -0.10 1.50 4.44 1.61 -1.94 -0.19 -4.81 119.30 119.82 2psf s MET 81 Ca 0.00 -1.76 0.00 0.00 -1.71 0.00 0.00 55.69 52.22 2psf s MET 81 Cb 0.00 -1.04 0.00 0.00 2.01 0.00 0.00 34.83 35.80 2psf s MET 81 CO 0.00 0.01 0.00 0.41 -0.01 0.00 0.00 175.02 175.43 2psf n GLY 82 N -0.55 2.89 1.21 -0.03 0.00 -1.26 -1.92 105.19 105.53 2psf n GLY 82 Ca -0.05 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.89 2psf n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2psf n LYS 83 N 14.00 3.50 -1.53 1.61 4.76 -1.26 -4.66 118.16 134.58 2psf n LYS 83 Ca 0.00 -2.80 -0.29 0.00 -2.87 0.00 0.00 58.31 52.35 2psf n LYS 83 Cb 0.00 -1.85 0.13 0.00 -1.84 0.00 0.00 35.03 31.47 2psf n LYS 83 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2psf s SER 84 N -1.34 3.63 1.11 4.39 0.01 -0.81 -4.47 113.70 116.23 2psf s SER 84 Ca 0.44 1.01 -0.16 0.00 1.31 0.00 0.00 55.95 58.55 2psf s SER 84 Cb 0.32 -1.61 0.23 0.00 0.21 0.00 0.00 66.02 65.16 2psf s SER 84 CO 0.15 -2.48 1.03 0.61 0.41 0.00 0.00 173.24 172.96 2psf n GLY 85 N -2.18 -2.09 3.98 3.44 0.00 0.13 -4.63 105.19 103.84 2psf n GLY 85 Ca 0.07 -1.60 -0.19 0.00 0.00 0.00 0.00 46.02 44.30 2psf n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2psf s LYS 86 N -5.29 3.10 0.19 1.61 -0.14 -1.26 -1.00 119.74 116.95 2psf s LYS 86 Ca 0.62 -1.02 -0.30 0.00 -1.36 0.00 0.00 55.97 53.91 2psf s LYS 86 Cb -0.04 -2.80 -0.08 0.00 -1.68 0.00 0.00 37.83 33.23 2psf s LYS 86 CO 0.46 0.07 1.01 -1.54 -0.76 0.00 0.00 175.35 174.58 2psf s SER 87 N -4.16 7.46 0.40 2.83 1.04 -1.26 -4.73 113.70 115.28 2psf s SER 87 Ca 0.45 1.98 0.13 0.00 0.48 0.00 0.00 55.95 58.99 2psf s SER 87 Cb -0.09 -2.60 0.83 0.00 0.10 0.00 0.00 66.02 64.25 2psf s SER 87 CO 0.31 -0.04 1.89 1.23 0.98 0.00 0.00 173.24 177.61 2psf h GLY 88 N 4.78 0.00 -2.16 7.32 0.00 -1.91 -2.41 103.07 108.69 2psf h GLY 88 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2psf h GLY 88 CO 0.70 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.40 2psf n ASN 89 N -4.19 3.42 0.00 0.19 6.94 -1.26 -4.96 115.26 115.40 2psf n ASN 89 Ca -0.02 -1.96 0.00 0.00 -0.02 0.00 0.00 54.58 52.58 2psf n ASN 89 Cb 0.34 -0.29 0.00 0.00 -2.36 0.00 0.00 39.78 37.47 2psf n ASN 89 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2psf n GLY 90 N 1.33 0.67 3.87 4.83 0.00 -0.91 -5.01 105.19 109.97 2psf n GLY 90 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2psf n GLY 90 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2psf s SER 91 N -2.38 6.32 -0.29 1.61 0.15 -1.26 -5.00 113.70 112.85 2psf s SER 91 Ca 0.00 0.43 0.17 0.00 0.70 0.00 0.00 55.95 57.25 2psf s SER 91 Cb 0.00 -2.02 0.48 0.00 -1.71 0.00 0.00 66.02 62.77 2psf s SER 91 CO 0.00 0.38 1.10 -1.22 1.20 0.00 0.00 173.24 174.70 2psf n TYR 92 N 1.79 1.72 -2.05 3.44 4.01 -1.26 -4.80 117.16 120.01 2psf n TYR 92 Ca -0.18 -2.34 -0.28 0.00 -0.16 0.00 0.00 57.90 54.93 2psf n TYR 92 Cb 0.54 -0.27 0.06 0.00 -0.31 0.00 0.00 39.34 39.37 2psf n TYR 92 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2psf s ARG 93 N -3.62 2.41 0.23 -0.72 0.52 -1.26 -4.51 118.95 112.00 2psf s ARG 93 Ca 0.34 0.10 -0.06 0.00 -0.52 0.00 0.00 55.73 55.58 2psf s ARG 93 Cb 0.37 -2.07 0.41 0.00 0.52 0.00 0.00 34.95 34.17 2psf s ARG 93 CO -0.02 -1.22 1.72 1.25 0.02 0.00 0.00 175.30 177.05 2psf h LEU 94 N -0.70 0.18 -1.16 2.53 5.85 -1.96 -0.94 115.31 119.10 2psf h LEU 94 Ca -0.45 0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.33 2psf h LEU 94 Cb 1.29 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 2psf h LEU 94 CO 0.63 0.07 -0.24 -0.07 -0.34 0.00 0.00 178.44 178.49 2psf h LEU 95 N 0.38 0.00 -0.13 2.25 3.38 -1.98 0.07 115.31 119.28 2psf h LEU 95 Ca 0.38 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.32 2psf h LEU 95 Cb 0.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 2psf h LEU 95 CO -0.41 0.24 -0.03 0.44 0.09 0.00 0.00 178.44 178.77 2psf h ASP 96 N 0.00 0.26 -0.90 -0.43 3.32 -1.53 -1.36 116.42 115.78 2psf h ASP 96 Ca -0.00 -0.36 0.03 0.00 0.02 0.00 0.00 57.03 56.71 2psf h ASP 96 Cb 0.73 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.16 2psf h ASP 96 CO 0.03 0.56 0.58 0.45 -1.72 0.00 0.00 179.24 179.15 2psf h HIS 97 N -0.05 1.10 -0.50 4.55 3.86 -0.95 -2.65 115.15 120.51 2psf h HIS 97 Ca 0.03 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.17 2psf h HIS 97 Cb 0.45 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 28.53 2psf h HIS 97 CO 0.05 0.65 -0.08 -0.92 0.86 0.00 0.00 177.93 178.48 2psf h TYR 98 N 1.15 1.00 0.05 2.45 3.20 -0.90 -0.31 116.97 123.61 2psf h TYR 98 Ca 0.35 -0.18 0.02 0.00 3.14 0.00 0.00 58.73 62.06 2psf h TYR 98 Cb -0.03 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 37.95 2psf h TYR 98 CO -0.01 0.94 -0.23 -0.22 -1.64 0.00 0.00 178.16 177.00 2psf h LYS 99 N 0.82 -0.37 -0.56 1.82 3.64 -0.91 -0.76 116.57 120.25 2psf h LYS 99 Ca 0.14 0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.43 2psf h LYS 99 Cb 0.60 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2psf h LYS 99 CO 0.04 -0.25 -0.08 1.88 -2.27 0.00 0.00 179.45 178.77 2psf h TYR 100 N -0.38 1.16 -0.11 1.91 0.05 -1.30 -1.91 116.97 116.38 2psf h TYR 100 Ca 0.05 -0.23 0.00 0.00 0.05 0.00 0.00 58.73 58.60 2psf h TYR 100 Cb 0.44 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.88 2psf h TYR 100 CO -0.24 1.06 0.07 1.25 -1.05 0.00 0.00 178.16 179.25 2psf h LEU 101 N 0.93 0.12 -0.58 3.88 5.85 -0.90 -0.52 115.31 124.08 2psf h LEU 101 Ca 0.15 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.72 2psf h LEU 101 Cb 0.65 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 2psf h LEU 101 CO 0.04 0.09 -0.49 0.71 -0.34 0.00 0.00 178.44 178.45 2psf h THR 102 N 0.15 1.31 -0.76 1.05 1.35 -1.11 -0.34 112.91 114.56 2psf h THR 102 Ca 0.04 -1.71 -0.03 0.00 -0.55 0.00 0.00 66.41 64.16 2psf h THR 102 Cb -0.01 1.69 -0.04 0.00 -1.73 0.00 0.00 68.15 68.06 2psf h THR 102 CO -0.01 0.53 0.35 0.00 -0.25 0.00 0.00 175.52 176.14 2psf h ALA 103 N 1.03 1.18 -0.37 6.62 0.00 -1.23 -2.72 119.26 123.77 2psf h ALA 103 Ca 0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2psf h ALA 103 Cb 1.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2psf h ALA 103 CO 0.09 0.61 0.11 2.35 0.00 0.00 0.00 179.25 182.41 2psf h TRP 104 N 1.08 0.60 -0.99 0.00 7.01 -0.75 -2.86 115.95 120.05 2psf h TRP 104 Ca 0.26 -0.06 0.19 0.00 2.11 0.00 0.00 58.89 61.38 2psf h TRP 104 Cb 0.13 -0.17 -0.10 0.00 -2.10 0.00 0.00 29.16 26.92 2psf h TRP 104 CO 0.01 0.58 0.61 0.74 -2.79 0.00 0.00 178.44 177.60 2psf h PHE 105 N 0.45 0.98 0.00 2.65 0.04 -0.86 -1.16 116.94 119.04 2psf h PHE 105 Ca 0.12 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.92 2psf h PHE 105 Cb 0.27 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.12 2psf h PHE 105 CO 0.01 0.24 0.00 0.93 -0.60 0.00 0.00 178.31 178.89 2psf h GLU 106 N 0.72 0.00 -0.03 1.51 5.08 -1.25 -2.50 114.58 118.12 2psf h GLU 106 Ca 0.55 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.91 2psf h GLU 106 Cb 0.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 2psf h GLU 106 CO -0.33 0.00 -0.02 1.28 -1.00 0.00 0.00 179.01 178.94 2psf n LEU 107 N -2.79 2.67 -0.68 1.33 4.77 -0.45 -4.60 117.00 117.26 2psf n LEU 107 Ca -0.01 -0.99 0.13 0.00 -0.03 0.00 0.00 56.01 55.12 2psf n LEU 107 Cb 0.18 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.54 2psf n LEU 107 CO 0.21 0.46 0.70 0.18 -1.33 0.00 0.00 177.39 177.60 2psf n LEU 108 N 1.09 2.20 -3.57 2.23 4.77 -0.94 -4.97 117.00 117.80 2psf n LEU 108 Ca 0.12 -0.73 -0.19 0.00 -0.03 0.00 0.00 56.01 55.17 2psf n LEU 108 Cb 0.51 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.65 2psf n LEU 108 CO 0.14 0.37 0.02 0.59 -1.33 0.00 0.00 177.39 177.17 2psf n ASN 109 N 0.63 -1.56 -4.85 -1.43 5.03 -1.26 -4.98 115.26 106.84 2psf n ASN 109 Ca 0.15 -0.73 -0.32 0.00 0.87 0.00 0.00 54.58 54.56 2psf n ASN 109 Cb 0.48 -4.56 -0.02 0.00 -1.02 0.00 0.00 39.78 34.65 2psf n ASN 109 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2psf s LEU 110 N -6.53 3.54 0.96 3.41 1.43 -1.26 -5.08 118.68 115.15 2psf s LEU 110 Ca 0.00 1.55 -0.14 0.00 -1.03 0.00 0.00 54.13 54.50 2psf s LEU 110 Cb -0.00 -4.50 0.17 0.00 0.03 0.00 0.00 46.19 41.89 2psf s LEU 110 CO 0.77 -0.66 1.19 -2.16 0.23 0.00 0.00 176.35 175.71 2psf s PRO 111 N -4.30 0.75 0.17 1.29 0.04 -1.26 -4.97 135.00 126.72 2psf s PRO 111 Ca 0.58 0.03 -0.13 0.00 0.04 0.00 0.00 61.00 61.52 2psf s PRO 111 Cb -0.10 -1.82 0.08 0.00 0.04 0.00 0.00 34.50 32.70 2psf s PRO 111 CO 0.36 -2.41 1.80 0.87 0.04 0.00 0.00 177.00 177.67 2psf h LYS 112 N -1.65 0.78 -5.26 4.56 1.79 -1.94 -3.41 116.57 111.45 2psf h LYS 112 Ca -0.47 -0.08 -0.65 0.00 -2.18 0.00 0.00 60.65 57.27 2psf h LYS 112 Cb 1.30 -0.16 -0.24 0.00 -1.58 0.00 0.00 32.23 31.55 2psf h LYS 112 CO 0.52 0.58 -0.71 0.15 -1.08 0.00 0.00 179.45 178.91 2psf s LYS 113 N -5.94 3.54 0.33 3.15 1.02 -1.26 -4.40 119.74 116.17 2psf s LYS 113 Ca -0.13 -0.59 0.10 0.00 0.02 0.00 0.00 55.97 55.37 2psf s LYS 113 Cb 0.13 -2.84 -0.06 0.00 -0.52 0.00 0.00 37.83 34.54 2psf s LYS 113 CO 0.76 0.16 -0.08 0.96 -0.92 0.00 0.00 175.35 176.23 2psf s ILE 114 N 0.53 2.41 -0.07 2.17 -4.36 -0.27 -4.60 121.20 117.02 2psf s ILE 114 Ca -0.05 -2.17 0.03 0.00 -0.26 0.00 0.00 60.65 58.19 2psf s ILE 114 Cb -0.15 -2.63 -0.02 0.00 1.25 0.00 0.00 42.46 40.91 2psf s ILE 114 CO 0.03 -0.24 -0.14 -0.63 0.24 0.00 0.00 174.94 174.20 2psf s ILE 115 N -2.56 3.03 -0.01 8.37 1.01 -0.18 -0.55 121.20 130.31 2psf s ILE 115 Ca 0.33 -0.72 0.03 0.00 0.00 0.00 0.00 60.65 60.29 2psf s ILE 115 Cb 0.00 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 40.23 2psf s ILE 115 CO 0.17 0.57 -0.07 -0.36 0.00 0.00 0.00 174.94 175.26 2psf s PHE 116 N -0.42 2.90 -0.23 3.97 0.08 -0.90 -0.59 117.98 122.79 2psf s PHE 116 Ca 0.05 -0.02 0.01 0.00 0.12 0.00 0.00 56.93 57.08 2psf s PHE 116 Cb -0.12 -1.63 0.06 0.00 -0.57 0.00 0.00 43.02 40.75 2psf s PHE 116 CO 0.02 0.37 -0.05 0.08 -0.10 0.00 0.00 175.22 175.54 2psf s VAL 117 N -0.96 1.49 0.00 -0.44 1.01 -0.03 -0.20 120.40 121.28 2psf s VAL 117 Ca 0.16 -1.20 0.07 0.00 0.00 0.00 0.00 61.98 61.02 2psf s VAL 117 Cb -0.11 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 2psf s VAL 117 CO 0.06 -0.10 -0.22 -0.83 0.00 0.00 0.00 175.10 174.00 2psf s GLY 118 N 1.41 1.13 -0.05 4.51 0.00 -0.13 -0.48 107.32 113.71 2psf s GLY 118 Ca -0.06 -1.02 0.05 0.00 0.00 0.00 0.00 44.72 43.69 2psf s GLY 118 CO -0.06 -0.88 -0.19 -1.58 0.00 0.00 0.00 173.10 170.39 2psf s HIS 119 N -0.62 1.86 0.00 1.90 5.65 -0.79 -2.25 115.29 121.05 2psf s HIS 119 Ca 0.09 -0.55 0.00 0.00 0.25 0.00 0.00 55.06 54.85 2psf s HIS 119 Cb -0.09 -1.25 0.00 0.00 -1.18 0.00 0.00 32.58 30.06 2psf s HIS 119 CO 0.00 -0.18 0.00 -3.47 -0.65 0.00 0.00 174.74 170.44 2psf n ASP 120 N 3.13 0.00 0.28 9.88 2.03 -0.77 -0.59 116.55 130.51 2psf n ASP 120 Ca -0.18 0.00 0.16 0.00 0.52 0.00 0.00 54.79 55.29 2psf n ASP 120 Cb 0.53 0.00 0.81 0.00 -0.72 0.00 0.00 41.12 41.74 2psf n ASP 120 CO 0.00 0.00 0.00 -0.50 -1.92 0.00 0.00 177.20 174.78 2psf h TRP 121 N 0.00 0.00 -0.89 -0.67 4.06 -1.86 -1.30 115.95 115.29 2psf h TRP 121 Ca 0.00 0.00 0.06 0.00 2.06 0.00 0.00 58.89 61.01 2psf h TRP 121 Cb 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 28.10 2psf h TRP 121 CO 0.00 0.06 0.58 0.78 -3.56 0.00 0.00 178.44 176.30 2psf h GLY 122 N 1.10 1.28 1.19 1.49 0.00 -0.59 -1.59 103.07 105.94 2psf h GLY 122 Ca -0.00 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 2psf h GLY 122 CO 0.01 0.32 0.05 0.00 0.00 0.00 0.00 176.54 176.92 2psf h ALA 123 N 1.51 0.97 -0.81 3.60 0.00 -1.17 -1.99 119.26 121.37 2psf h ALA 123 Ca 0.37 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2psf h ALA 123 Cb 0.15 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 2psf h ALA 123 CO -0.13 0.63 0.49 0.00 0.00 0.00 0.00 179.25 180.24 2psf h ALA 124 N 1.13 1.04 -0.47 0.00 0.00 -1.34 0.66 119.26 120.28 2psf h ALA 124 Ca 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2psf h ALA 124 Cb 0.46 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2psf h ALA 124 CO 0.02 0.50 0.21 -0.07 0.00 0.00 0.00 179.25 179.91 2psf h LEU 125 N 1.12 0.62 -0.49 0.00 3.38 -1.16 -1.16 115.31 117.62 2psf h LEU 125 Ca 0.29 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2psf h LEU 125 Cb -0.04 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2psf h LEU 125 CO -0.05 0.59 0.31 0.00 0.09 0.00 0.00 178.44 179.38 2psf h ALA 126 N 1.06 0.62 -0.54 1.53 0.00 -0.95 -0.98 119.26 120.00 2psf h ALA 126 Ca 0.16 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 2psf h ALA 126 Cb 0.15 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2psf h ALA 126 CO -0.02 0.09 -0.11 0.74 0.00 0.00 0.00 179.25 179.95 2psf h PHE 127 N 0.66 1.12 -0.33 0.00 0.04 -0.71 -0.51 116.94 117.20 2psf h PHE 127 Ca 0.18 -0.23 -0.08 0.00 2.80 0.00 0.00 57.97 60.64 2psf h PHE 127 Cb -0.04 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 37.82 2psf h PHE 127 CO -0.03 1.04 -0.09 1.25 -0.60 0.00 0.00 178.31 179.88 2psf h HIS 128 N 0.90 0.73 -0.56 -0.55 2.76 -1.14 -0.70 115.15 116.59 2psf h HIS 128 Ca 0.14 -0.16 0.04 0.00 -2.20 0.00 0.00 60.37 58.19 2psf h HIS 128 Cb 0.67 -0.18 -0.04 0.00 1.55 0.00 0.00 27.41 29.41 2psf h HIS 128 CO 0.04 0.82 0.31 -0.92 -1.30 0.00 0.00 177.93 176.88 2psf h TYR 129 N 0.43 0.57 -0.35 5.26 3.20 -1.00 -1.67 116.97 123.41 2psf h TYR 129 Ca 0.08 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.98 2psf h TYR 129 Cb 0.59 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 2psf h TYR 129 CO 0.05 0.30 0.22 0.00 -1.64 0.00 0.00 178.16 177.09 2psf h ALA 130 N 1.28 0.45 -0.87 1.82 0.00 -0.86 0.43 119.26 121.49 2psf h ALA 130 Ca 0.24 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.18 2psf h ALA 130 Cb 0.10 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 2psf h ALA 130 CO -0.14 -0.08 0.54 -0.92 0.00 0.00 0.00 179.25 178.65 2psf h TYR 131 N 0.47 1.00 0.00 0.00 3.20 -0.69 -2.15 116.97 118.79 2psf h TYR 131 Ca 0.13 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2psf h TYR 131 Cb -0.03 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 37.92 2psf h TYR 131 CO -0.05 0.49 -0.18 0.39 -1.64 0.00 0.00 178.16 177.18 2psf n GLU 132 N -4.62 0.28 -3.19 1.82 1.02 -0.67 -4.24 120.64 111.04 2psf n GLU 132 Ca 0.13 0.18 -0.21 0.00 -0.02 0.00 0.00 57.16 57.25 2psf n GLU 132 Cb 0.19 -1.78 -0.05 0.00 -0.02 0.00 0.00 31.44 29.79 2psf n GLU 132 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2psf n HIS 133 N -2.24 0.13 0.30 -0.32 8.25 0.10 -4.97 115.22 116.48 2psf n HIS 133 Ca 0.05 -3.73 0.17 0.00 -0.26 0.00 0.00 57.72 53.95 2psf n HIS 133 Cb 0.44 -0.40 0.78 0.00 1.12 0.00 0.00 29.99 31.93 2psf n HIS 133 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2psf h GLN 134 N 3.41 0.00 -0.34 -0.41 4.20 -1.59 -0.74 115.11 119.64 2psf h GLN 134 Ca 0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2psf h GLN 134 Cb 0.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.70 2psf h GLN 134 CO 0.50 0.00 0.00 -0.40 -0.67 0.00 0.00 178.83 178.26 2psf n ASP 135 N -2.85 2.37 -0.26 1.46 5.75 -1.26 -4.19 116.55 117.58 2psf n ASP 135 Ca -0.00 -1.89 0.06 0.00 -0.01 0.00 0.00 54.79 52.95 2psf n ASP 135 Cb 0.20 -0.22 0.12 0.00 -1.03 0.00 0.00 41.12 40.19 2psf n ASP 135 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2psf n ARG 136 N 0.78 2.27 -4.21 0.11 1.74 -0.28 -4.69 116.66 112.37 2psf n ARG 136 Ca 0.17 -2.23 -0.31 0.00 -0.77 0.00 0.00 57.85 54.70 2psf n ARG 136 Cb 0.41 -1.38 -0.16 0.00 -1.02 0.00 0.00 32.46 30.31 2psf n ARG 136 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2psf s ILE 137 N -2.08 1.72 -0.14 0.55 -1.09 -1.26 -1.11 121.20 117.79 2psf s ILE 137 Ca 0.23 -0.74 0.04 0.00 -2.23 0.00 0.00 60.65 57.95 2psf s ILE 137 Cb 0.19 -1.58 -0.23 0.00 -1.58 0.00 0.00 42.46 39.26 2psf s ILE 137 CO 0.05 0.48 0.28 1.17 -1.23 0.00 0.00 174.94 175.69 2psf n LYS 138 N 4.53 0.69 -3.56 2.79 4.81 0.29 -4.85 118.16 122.87 2psf n LYS 138 Ca -0.19 0.21 -0.07 0.00 -0.87 0.00 0.00 58.31 57.39 2psf n LYS 138 Cb 0.50 -1.66 -0.03 0.00 0.02 0.00 0.00 35.03 33.86 2psf n LYS 138 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2psf s ALA 139 N -2.55 -1.96 -0.04 3.14 0.00 -1.25 -4.29 121.76 114.82 2psf s ALA 139 Ca -0.18 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.18 2psf s ALA 139 Cb 0.07 -0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.10 2psf s ALA 139 CO 0.76 -0.55 -0.02 0.42 0.00 0.00 0.00 175.76 176.37 2psf s ILE 140 N -2.35 0.34 -0.16 0.00 1.01 -0.84 -2.12 121.20 117.09 2psf s ILE 140 Ca 0.06 0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.66 2psf s ILE 140 Cb -0.01 -0.42 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 2psf s ILE 140 CO -0.05 0.19 0.04 -0.69 0.00 0.00 0.00 174.94 174.43 2psf s VAL 141 N 1.14 4.64 0.05 2.92 1.01 0.72 -1.28 120.40 129.59 2psf s VAL 141 Ca -0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 2psf s VAL 141 Cb -0.14 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 2psf s VAL 141 CO -0.01 0.50 -0.02 -1.38 0.00 0.00 0.00 175.10 174.19 2psf s HIS 142 N 0.03 0.46 -0.27 5.22 -0.00 -0.15 -0.96 115.29 119.62 2psf s HIS 142 Ca 0.05 -0.96 -0.24 0.00 -0.00 0.00 0.00 55.06 53.91 2psf s HIS 142 Cb -0.12 -0.35 0.08 0.00 -0.00 0.00 0.00 32.58 32.19 2psf s HIS 142 CO 0.01 -0.36 0.79 0.00 -0.00 0.00 0.00 174.74 175.19 2psf s MET 143 N -3.52 0.74 -1.50 -0.38 0.23 -0.96 -1.62 119.30 112.30 2psf s MET 143 Ca 0.03 0.93 -0.00 0.00 -1.03 0.00 0.00 55.69 55.62 2psf s MET 143 Cb 0.05 0.34 0.00 0.00 -1.53 0.00 0.00 34.83 33.69 2psf s MET 143 CO -0.09 -0.10 0.15 0.39 -2.03 0.00 0.00 175.02 173.35 2psf n GLU 144 N 2.80 -1.81 -3.98 3.16 -0.58 -1.26 -2.76 120.64 116.21 2psf n GLU 144 Ca -0.14 0.21 -0.22 0.00 -0.42 0.00 0.00 57.16 56.58 2psf n GLU 144 Cb 0.56 -3.93 -0.05 0.00 -0.57 0.00 0.00 31.44 27.45 2psf n GLU 144 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2psf s SER 145 N -4.38 5.11 -1.07 1.62 1.04 -1.26 -1.84 113.70 112.91 2psf s SER 145 Ca 0.00 -0.54 -0.18 0.00 0.48 0.00 0.00 55.95 55.71 2psf s SER 145 Cb -0.00 -0.97 0.11 0.00 0.10 0.00 0.00 66.02 65.26 2psf s SER 145 CO 0.96 -0.26 1.36 -0.69 0.98 0.00 0.00 173.24 175.60 2psf s VAL 146 N -2.31 4.53 0.04 5.02 1.01 -1.25 -4.83 120.40 122.62 2psf s VAL 146 Ca 0.38 -1.70 0.10 0.00 0.00 0.00 0.00 61.98 60.76 2psf s VAL 146 Cb -0.05 -4.94 -0.21 0.00 0.00 0.00 0.00 36.38 31.18 2psf s VAL 146 CO 0.25 -1.71 1.02 -0.37 0.00 0.00 0.00 175.10 174.29 2psf h VAL 147 N 5.73 1.32 -3.05 2.92 -1.51 -1.95 -3.42 116.25 116.30 2psf h VAL 147 Ca 0.25 -3.08 0.03 0.00 -1.23 0.00 0.00 66.70 62.66 2psf h VAL 147 Cb 0.96 2.65 -0.04 0.00 -2.13 0.00 0.00 31.29 32.74 2psf h VAL 147 CO 1.26 0.75 0.22 -0.62 -1.23 0.00 0.00 177.57 177.96 2psf s ASP 148 N -6.44 -0.15 0.88 4.19 -1.08 -1.26 -4.63 116.67 108.18 2psf s ASP 148 Ca -0.01 -0.81 -0.10 0.00 -0.52 0.00 0.00 52.55 51.11 2psf s ASP 148 Cb 0.09 0.76 0.13 0.00 -1.46 0.00 0.00 42.92 42.44 2psf s ASP 148 CO 0.82 -1.45 1.13 0.68 0.52 0.00 0.00 175.17 176.88 2psf s VAL 149 N -3.41 2.36 -0.06 1.11 -7.23 -1.26 -4.91 120.40 107.00 2psf s VAL 149 Ca 0.13 0.12 0.04 0.00 -1.81 0.00 0.00 61.98 60.46 2psf s VAL 149 Cb -0.05 -2.25 -0.00 0.00 0.56 0.00 0.00 36.38 34.63 2psf s VAL 149 CO 0.09 -0.15 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.90 2psf s ILE 150 N -2.71 1.62 0.15 -0.62 1.01 -0.37 -4.92 121.20 115.36 2psf s ILE 150 Ca 0.65 -0.80 0.07 0.00 0.00 0.00 0.00 60.65 60.58 2psf s ILE 150 Cb -0.21 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 40.81 2psf s ILE 150 CO 0.58 0.46 -0.16 -1.61 0.00 0.00 0.00 174.94 174.20 2psf s GLU 151 N 0.20 1.19 0.27 2.79 2.02 -1.26 -1.03 118.70 122.88 2psf s GLU 151 Ca -0.10 -1.36 -0.31 0.00 0.02 0.00 0.00 54.97 53.22 2psf s GLU 151 Cb -0.14 -1.16 -0.12 0.00 0.10 0.00 0.00 34.13 32.80 2psf s GLU 151 CO 0.04 0.23 1.54 -1.13 0.02 0.00 0.00 175.26 175.96 2psf n SER 152 N 0.32 3.47 -3.67 -0.19 3.41 -1.26 -4.99 113.62 110.71 2psf n SER 152 Ca -0.14 1.14 -0.23 0.00 -0.26 0.00 0.00 58.87 59.38 2psf n SER 152 Cb 0.57 -1.53 -0.08 0.00 -0.26 0.00 0.00 64.21 62.91 2psf n SER 152 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 2psf s TRP 153 N 0.07 1.78 0.15 7.33 -2.14 -1.16 -4.96 118.94 120.02 2psf s TRP 153 Ca 0.66 -1.52 -0.16 0.00 2.66 0.00 0.00 56.10 57.74 2psf s TRP 153 Cb -0.55 -0.92 0.05 0.00 -3.10 0.00 0.00 33.47 28.94 2psf s TRP 153 CO 0.48 -0.63 1.76 -0.44 -2.66 0.00 0.00 176.95 175.46 2psf h ASP 154 N 1.93 0.20 0.71 -2.66 3.32 -1.98 -1.10 116.42 116.84 2psf h ASP 154 Ca -0.29 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 56.73 2psf h ASP 154 Cb 1.25 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 2psf h ASP 154 CO 0.44 0.16 -0.27 -0.33 -1.72 0.00 0.00 179.24 177.52 2psf h GLU 155 N 0.32 0.00 -2.14 3.56 5.08 -2.01 -3.36 114.58 116.03 2psf h GLU 155 Ca 0.16 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.94 2psf h GLU 155 Cb 0.10 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 28.96 2psf h GLU 155 CO -0.13 0.27 -1.01 1.87 -1.00 0.00 0.00 179.01 179.00 2psf n TRP 156 N -3.57 0.02 0.26 4.33 -0.00 -0.51 -4.98 117.44 112.99 2psf n TRP 156 Ca -0.01 -3.59 0.14 0.00 -0.00 0.00 0.00 57.50 54.05 2psf n TRP 156 Cb 0.41 -0.24 0.59 0.00 -0.00 0.00 0.00 31.31 32.07 2psf n TRP 156 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 2psf h PRO 157 N 4.43 0.00 -0.66 5.87 0.13 -1.48 -3.05 132.00 137.23 2psf h PRO 157 Ca 0.13 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.81 2psf h PRO 157 Cb 0.86 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 31.70 2psf h PRO 157 CO 0.49 0.08 -0.21 -0.40 -0.23 0.00 0.00 178.00 177.73 2psf n ASP 158 N -3.21 4.68 -0.28 1.44 5.68 -1.26 -4.76 116.55 118.84 2psf n ASP 158 Ca 0.01 -3.78 -0.02 0.00 -0.50 0.00 0.00 54.79 50.50 2psf n ASP 158 Cb 0.36 -0.58 0.17 0.00 -1.14 0.00 0.00 41.12 39.92 2psf n ASP 158 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2psf h ILE 159 N 1.52 1.23 -1.00 2.12 2.10 -1.94 -1.73 117.51 119.81 2psf h ILE 159 Ca 0.37 -0.50 0.03 0.00 1.08 0.00 0.00 64.86 65.83 2psf h ILE 159 Cb 1.41 0.05 -0.05 0.00 -1.09 0.00 0.00 36.82 37.14 2psf h ILE 159 CO 0.81 0.24 0.66 -0.33 -1.08 0.00 0.00 178.15 178.45 2psf h GLU 160 N 1.15 1.27 -0.29 2.19 4.39 -1.90 -0.17 114.58 121.21 2psf h GLU 160 Ca 0.30 -0.08 -0.18 0.00 0.34 0.00 0.00 59.36 59.74 2psf h GLU 160 Cb -0.05 -0.29 0.00 0.00 -0.10 0.00 0.00 28.75 28.31 2psf h GLU 160 CO -0.06 0.84 -0.52 0.93 -1.16 0.00 0.00 179.01 179.04 2psf h GLU 161 N 1.31 0.87 -0.44 2.33 3.07 -1.78 -0.52 114.58 119.42 2psf h GLU 161 Ca 0.39 -0.54 -0.10 0.00 -0.50 0.00 0.00 59.36 58.60 2psf h GLU 161 Cb -0.06 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 2psf h GLU 161 CO -0.11 1.18 -0.13 -0.44 -1.40 0.00 0.00 179.01 178.11 2psf h ASP 162 N 0.66 0.80 -0.01 1.42 3.32 -0.85 -1.00 116.42 120.75 2psf h ASP 162 Ca 0.02 -0.25 -0.16 0.00 0.02 0.00 0.00 57.03 56.65 2psf h ASP 162 Cb 1.13 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 2psf h ASP 162 CO 0.12 0.94 -0.54 0.40 -1.72 0.00 0.00 179.24 178.44 2psf h ILE 163 N 0.72 1.31 -0.74 0.35 1.08 -1.01 -1.57 117.51 117.66 2psf h ILE 163 Ca 0.12 -1.78 0.07 0.00 -0.39 0.00 0.00 64.86 62.87 2psf h ILE 163 Cb 0.63 1.74 -0.06 0.00 -3.07 0.00 0.00 36.82 36.06 2psf h ILE 163 CO 0.04 0.56 0.42 0.00 -0.69 0.00 0.00 178.15 178.48 2psf h ALA 164 N 0.94 1.01 -0.09 1.87 0.00 -0.76 0.20 119.26 122.43 2psf h ALA 164 Ca 0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2psf h ALA 164 Cb 1.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2psf h ALA 164 CO 0.10 0.10 0.05 1.25 0.00 0.00 0.00 179.25 180.75 2psf h LEU 165 N 0.76 0.08 -1.44 0.00 5.85 -0.92 -2.02 115.31 117.62 2psf h LEU 165 Ca 0.34 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 59.00 2psf h LEU 165 Cb 0.23 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2psf h LEU 165 CO -0.20 0.06 -0.28 -0.29 -0.34 0.00 0.00 178.44 177.40 2psf h ILE 166 N 0.10 1.01 -0.00 4.05 6.09 -0.78 -1.80 117.51 126.18 2psf h ILE 166 Ca 0.03 -1.01 0.00 0.00 -1.37 0.00 0.00 64.86 62.51 2psf h ILE 166 Cb -0.00 1.58 0.00 0.00 0.47 0.00 0.00 36.82 38.86 2psf h ILE 166 CO -0.02 0.27 -0.10 0.29 -3.07 0.00 0.00 178.15 175.52 2psf n LYS 167 N -3.94 0.35 -2.45 2.19 5.02 0.01 -4.24 118.16 115.11 2psf n LYS 167 Ca -0.02 -0.08 -0.24 0.00 -2.02 0.00 0.00 58.31 55.95 2psf n LYS 167 Cb 0.35 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 33.95 2psf n LYS 167 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2psf s SER 168 N -2.70 4.64 0.38 4.39 1.04 -0.71 -4.94 113.70 115.79 2psf s SER 168 Ca 0.23 0.00 0.05 0.00 0.48 0.00 0.00 55.95 56.71 2psf s SER 168 Cb 0.20 -0.57 0.75 0.00 0.10 0.00 0.00 66.02 66.49 2psf s SER 168 CO 0.51 -1.66 2.01 -0.33 0.98 0.00 0.00 173.24 174.75 2psf h GLU 169 N -0.47 0.60 -0.26 4.02 5.08 -1.90 -1.78 114.58 119.87 2psf h GLU 169 Ca -0.41 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 57.79 2psf h GLU 169 Cb 1.29 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 2psf h GLU 169 CO 0.49 0.44 -0.31 0.93 -1.00 0.00 0.00 179.01 179.56 2psf h GLU 170 N 0.61 0.54 -0.63 2.33 4.39 -1.94 -0.98 114.58 118.90 2psf h GLU 170 Ca 0.16 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.63 2psf h GLU 170 Cb 0.01 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 2psf h GLU 170 CO -0.03 0.79 0.40 0.78 -1.16 0.00 0.00 179.01 179.80 2psf h GLY 171 N 1.04 0.90 0.88 -3.84 0.00 -1.04 -1.13 103.07 99.88 2psf h GLY 171 Ca 0.06 -0.35 0.03 0.00 0.00 0.00 0.00 47.33 47.06 2psf h GLY 171 CO 0.06 0.35 0.36 -2.09 0.00 0.00 0.00 176.54 175.21 2psf h GLU 172 N 0.86 0.69 -0.47 4.80 4.81 -0.85 -2.30 114.58 122.11 2psf h GLU 172 Ca 0.23 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2psf h GLU 172 Cb -0.07 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 2psf h GLU 172 CO -0.05 0.45 0.30 0.87 -0.73 0.00 0.00 179.01 179.85 2psf h LYS 173 N 0.71 0.64 -0.97 1.92 1.57 -0.97 0.13 116.57 119.59 2psf h LYS 173 Ca 0.23 -0.05 0.13 0.00 -1.87 0.00 0.00 60.65 59.09 2psf h LYS 173 Cb 0.02 -0.14 -0.08 0.00 0.08 0.00 0.00 32.23 32.11 2psf h LYS 173 CO -0.10 0.45 0.62 0.52 -0.57 0.00 0.00 179.45 180.36 2psf h MET 174 N 0.64 0.89 0.00 3.15 2.86 -0.73 -1.14 114.93 120.59 2psf h MET 174 Ca 0.17 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.70 2psf h MET 174 Cb -0.04 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.41 2psf h MET 174 CO -0.03 0.59 -0.74 0.28 1.06 0.00 0.00 176.91 178.06 2psf n VAL 175 N -4.60 1.45 -0.08 -2.22 0.31 -0.91 -1.42 118.33 110.86 2psf n VAL 175 Ca 0.18 0.15 -0.06 0.00 -0.01 0.00 0.00 64.34 64.60 2psf n VAL 175 Cb 0.38 -2.30 0.12 0.00 -0.91 0.00 0.00 33.84 31.13 2psf n VAL 175 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2psf h LEU 176 N -1.00 0.74 0.06 7.52 3.38 -0.81 0.73 115.31 125.93 2psf h LEU 176 Ca -0.09 -0.24 -0.26 0.00 0.09 0.00 0.00 57.88 57.37 2psf h LEU 176 Cb 0.73 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2psf h LEU 176 CO -0.06 0.92 -1.37 -0.08 0.09 0.00 0.00 178.44 177.94 2psf h GLU 177 N 0.66 0.13 -0.02 1.13 4.81 -1.36 -0.07 114.58 119.86 2psf h GLU 177 Ca 0.10 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2psf h GLU 177 Cb 0.66 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.12 2psf h GLU 177 CO 0.05 1.10 -0.05 0.09 -0.73 0.00 0.00 179.01 179.47 2psf n ASN 178 N -4.10 2.17 -3.69 1.04 3.02 -0.93 -4.89 115.26 107.88 2psf n ASN 178 Ca -0.29 -1.59 -0.25 0.00 -0.03 0.00 0.00 54.58 52.43 2psf n ASN 178 Cb 0.81 0.07 0.06 0.00 -0.61 0.00 0.00 39.78 40.11 2psf n ASN 178 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2psf n ASN 179 N 0.71 -5.04 -0.23 6.41 5.15 0.25 -4.78 115.26 117.72 2psf n ASN 179 Ca 0.09 -0.65 0.03 0.00 -0.60 0.00 0.00 54.58 53.45 2psf n ASN 179 Cb 0.38 -4.61 0.13 0.00 -0.53 0.00 0.00 39.78 35.15 2psf n ASN 179 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2psf h PHE 180 N -2.37 -0.06 -0.08 1.20 3.57 -1.39 0.12 116.94 117.93 2psf h PHE 180 Ca -0.58 0.05 -0.16 0.00 3.53 0.00 0.00 57.97 60.81 2psf h PHE 180 Cb 1.37 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 40.23 2psf h PHE 180 CO 0.51 -0.21 -0.64 0.74 -2.23 0.00 0.00 178.31 176.49 2psf h PHE 181 N 0.11 0.40 0.14 0.41 0.04 -1.90 -0.89 116.94 115.26 2psf h PHE 181 Ca 0.37 -0.16 -0.32 0.00 2.80 0.00 0.00 57.97 60.66 2psf h PHE 181 Cb 0.63 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.70 2psf h PHE 181 CO -0.40 0.86 -1.63 0.28 -0.60 0.00 0.00 178.31 176.82 2psf h VAL 182 N 0.22 0.92 0.00 -0.55 2.07 -1.76 -1.27 116.25 115.89 2psf h VAL 182 Ca -0.01 -2.42 -0.09 0.00 0.82 0.00 0.00 66.70 64.99 2psf h VAL 182 Cb 1.17 2.68 -0.02 0.00 -1.52 0.00 0.00 31.29 33.61 2psf h VAL 182 CO 0.10 0.78 -1.16 -0.33 0.02 0.00 0.00 177.57 176.99 2psf h GLU 183 N -0.12 0.00 0.00 1.57 5.08 -0.87 -3.38 114.58 116.86 2psf h GLU 183 Ca -0.34 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 2psf h GLU 183 Cb 1.91 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.16 2psf h GLU 183 CO 0.10 0.18 -0.49 2.41 -1.00 0.00 0.00 179.01 180.21 2psf n THR 184 N -2.83 1.15 -0.07 1.13 -1.04 -0.54 -4.70 114.28 107.38 2psf n THR 184 Ca -0.05 0.25 -0.12 0.00 -2.04 0.00 0.00 64.05 62.10 2psf n THR 184 Cb 0.71 -1.76 -0.05 0.00 -1.82 0.00 0.00 70.33 67.41 2psf n THR 184 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2psf h VAL 185 N -0.27 1.26 0.37 12.58 2.07 -1.26 -2.78 116.25 128.22 2psf h VAL 185 Ca -0.04 -0.92 -0.00 0.00 0.82 0.00 0.00 66.70 66.56 2psf h VAL 185 Cb 0.44 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 2psf h VAL 185 CO -0.02 0.28 -0.38 0.25 0.02 0.00 0.00 177.57 177.71 2psf h LEU 186 N 0.11 -1.05 -1.80 2.57 5.85 -1.40 -1.61 115.31 117.99 2psf h LEU 186 Ca 0.05 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 2psf h LEU 186 Cb 0.42 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 2psf h LEU 186 CO 0.01 -0.53 -0.15 1.55 -0.34 0.00 0.00 178.44 178.99 2psf h PRO 187 N -0.78 0.00 0.00 5.25 0.13 -1.76 -2.71 132.00 132.12 2psf h PRO 187 Ca -0.03 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.02 2psf h PRO 187 Cb 0.70 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 2psf h PRO 187 CO -0.07 0.15 -0.39 0.66 -0.23 0.00 0.00 178.00 178.11 2psf h SER 188 N 0.00 0.00 -0.42 1.44 4.64 -1.11 -3.18 113.55 114.93 2psf h SER 188 Ca -0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2psf h SER 188 Cb 0.30 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.33 2psf h SER 188 CO 0.02 0.39 0.06 0.29 -0.87 0.00 0.00 176.83 176.72 2psf n LYS 189 N -3.74 3.02 -4.97 4.77 4.76 -0.66 -4.79 118.16 116.54 2psf n LYS 189 Ca -0.01 -2.99 -0.32 0.00 -2.87 0.00 0.00 58.31 52.11 2psf n LYS 189 Cb 0.47 -1.96 -0.15 0.00 -1.84 0.00 0.00 35.03 31.55 2psf n LYS 189 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2psf s ILE 190 N -2.96 2.64 0.06 -0.18 1.01 -1.18 -2.02 121.20 118.58 2psf s ILE 190 Ca 0.47 -0.82 -0.15 0.00 0.00 0.00 0.00 60.65 60.15 2psf s ILE 190 Cb 0.38 -2.07 -0.22 0.00 0.01 0.00 0.00 42.46 40.57 2psf s ILE 190 CO 0.09 0.54 1.19 0.24 0.00 0.00 0.00 174.94 177.00 2psf h MET 191 N 6.57 0.65 -7.54 2.79 2.86 -1.86 -3.46 114.93 114.93 2psf h MET 191 Ca -0.25 -0.65 -0.47 0.00 -2.06 0.00 0.00 59.70 56.27 2psf h MET 191 Cb 1.22 0.17 0.11 0.00 0.06 0.00 0.00 31.60 33.16 2psf h MET 191 CO 0.52 1.25 0.36 -0.98 1.06 0.00 0.00 176.91 179.12 2psf s ARG 192 N -3.39 1.73 0.01 1.72 1.70 -1.26 -5.04 118.95 114.42 2psf s ARG 192 Ca -0.11 0.25 -0.29 0.00 -0.47 0.00 0.00 55.73 55.11 2psf s ARG 192 Cb 0.06 -1.91 -0.04 0.00 -0.57 0.00 0.00 34.95 32.50 2psf s ARG 192 CO 0.89 -1.78 0.94 0.21 -1.08 0.00 0.00 175.30 174.48 2psf s LYS 193 N -5.41 4.56 0.21 3.89 2.20 -1.26 -5.06 119.74 118.87 2psf s LYS 193 Ca 0.62 1.36 -0.30 0.00 -0.36 0.00 0.00 55.97 57.29 2psf s LYS 193 Cb -0.13 -3.44 -0.08 0.00 -1.51 0.00 0.00 37.83 32.67 2psf s LYS 193 CO 0.51 0.01 1.01 -0.51 -0.36 0.00 0.00 175.35 176.00 2psf s LEU 194 N 0.82 4.57 0.69 5.43 1.43 -1.26 -5.05 118.68 125.32 2psf s LEU 194 Ca 0.49 2.01 -0.16 0.00 -1.03 0.00 0.00 54.13 55.44 2psf s LEU 194 Cb -0.21 -3.61 0.02 0.00 0.03 0.00 0.00 46.19 42.42 2psf s LEU 194 CO 0.27 -0.02 1.23 -1.61 0.23 0.00 0.00 176.35 176.46 2psf s GLU 195 N -0.83 2.34 0.30 1.70 0.41 -1.26 -4.76 118.70 116.60 2psf s GLU 195 Ca 0.44 1.86 0.06 0.00 -0.41 0.00 0.00 54.97 56.92 2psf s GLU 195 Cb -0.27 -1.85 0.72 0.00 -1.78 0.00 0.00 34.13 30.95 2psf s GLU 195 CO 0.34 -1.70 1.79 -1.35 -0.49 0.00 0.00 175.26 173.84 2psf h PRO 196 N 0.08 0.77 0.00 0.39 0.11 -2.00 -0.44 132.00 130.91 2psf h PRO 196 Ca -0.49 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.46 2psf h PRO 196 Cb 1.31 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2psf h PRO 196 CO 0.51 0.51 -0.54 0.93 -0.21 0.00 0.00 178.00 179.20 2psf h GLU 197 N 0.79 0.00 -0.07 1.05 3.07 -1.98 -0.82 114.58 116.62 2psf h GLU 197 Ca 0.57 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.40 2psf h GLU 197 Cb 0.85 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.76 2psf h GLU 197 CO -0.36 0.54 -0.05 0.93 -1.40 0.00 0.00 179.01 178.67 2psf h GLU 198 N 0.00 0.15 -0.93 2.33 5.08 -1.44 -2.36 114.58 117.41 2psf h GLU 198 Ca -0.01 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2psf h GLU 198 Cb 0.95 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.16 2psf h GLU 198 CO 0.07 0.56 0.59 0.35 -1.00 0.00 0.00 179.01 179.58 2psf h PHE 199 N -0.26 1.20 -0.77 4.33 3.57 -1.24 -2.48 116.94 121.30 2psf h PHE 199 Ca 0.01 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.60 2psf h PHE 199 Cb 0.52 -0.40 -0.05 0.00 2.79 0.00 0.00 35.95 38.81 2psf h PHE 199 CO 0.08 0.78 0.50 0.00 -2.23 0.00 0.00 178.31 177.44 2psf h ALA 200 N 1.33 1.70 -0.52 2.41 0.00 -1.08 0.27 119.26 123.36 2psf h ALA 200 Ca 0.34 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 2psf h ALA 200 Cb -0.11 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2psf h ALA 200 CO -0.07 0.17 0.14 0.00 0.00 0.00 0.00 179.25 179.49 2psf h ALA 201 N 1.59 1.26 0.01 0.00 0.00 -0.95 0.09 119.26 121.27 2psf h ALA 201 Ca 0.34 -0.19 -0.24 0.00 0.00 0.00 0.00 54.91 54.82 2psf h ALA 201 Cb 0.31 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.90 2psf h ALA 201 CO -0.12 0.52 -0.98 1.88 0.00 0.00 0.00 179.25 180.54 2psf h TYR 202 N 0.77 0.69 -0.18 0.00 0.05 -1.20 -3.32 116.97 113.78 2psf h TYR 202 Ca 0.17 -0.38 -0.14 0.00 0.05 0.00 0.00 58.73 58.43 2psf h TYR 202 Cb 0.26 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 2psf h TYR 202 CO 0.01 1.21 -0.48 1.25 -1.05 0.00 0.00 178.16 179.11 2psf h LEU 203 N 0.25 0.52 -0.52 3.88 5.85 -0.73 -3.39 115.31 121.18 2psf h LEU 203 Ca -0.09 -0.25 0.10 0.00 0.84 0.00 0.00 57.88 58.48 2psf h LEU 203 Cb 1.63 -0.15 -0.10 0.00 0.37 0.00 0.00 40.66 42.41 2psf h LEU 203 CO 0.17 0.92 -0.18 -0.08 -0.34 0.00 0.00 178.44 178.93 2psf h GLU 204 N 0.38 -0.06 0.00 1.25 4.57 -1.08 0.17 114.58 119.82 2psf h GLU 204 Ca 0.02 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2psf h GLU 204 Cb 0.98 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.59 2psf h GLU 204 CO 0.09 -0.04 -0.03 -1.35 -1.18 0.00 0.00 179.01 176.50 2psf h PRO 205 N -0.06 0.00 0.00 0.92 0.11 -1.80 -2.96 132.00 128.21 2psf h PRO 205 Ca 0.25 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.35 2psf h PRO 205 Cb 0.44 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 2psf h PRO 205 CO -0.57 0.03 -0.29 1.19 -0.21 0.00 0.00 178.00 178.15 2psf n PHE 206 N -3.54 0.00 0.12 0.65 3.72 0.49 -4.74 117.46 114.15 2psf n PHE 206 Ca -0.03 -1.21 -0.01 0.00 -0.05 0.00 0.00 57.45 56.15 2psf n PHE 206 Cb 0.12 -0.20 0.23 0.00 -0.94 0.00 0.00 39.48 38.70 2psf n PHE 206 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2psf h LYS 207 N 0.53 0.15 -6.61 -1.08 3.64 -1.08 -3.44 116.57 108.69 2psf h LYS 207 Ca -0.01 -0.08 -0.51 0.00 -1.27 0.00 0.00 60.65 58.78 2psf h LYS 207 Cb 1.03 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.82 2psf h LYS 207 CO 0.00 0.58 0.11 -1.21 -2.27 0.00 0.00 179.45 176.66 2psf s GLU 208 N -4.03 4.20 0.65 1.90 0.41 -1.26 -5.06 118.70 115.51 2psf s GLU 208 Ca -0.04 0.84 -0.15 0.00 -0.41 0.00 0.00 54.97 55.21 2psf s GLU 208 Cb 0.13 -2.78 -0.00 0.00 -1.78 0.00 0.00 34.13 29.70 2psf s GLU 208 CO 0.76 0.34 1.11 0.15 -0.49 0.00 0.00 175.26 177.14 2psf s LYS 209 N -2.20 2.83 0.00 1.61 1.02 -1.26 -4.65 119.74 117.09 2psf s LYS 209 Ca 0.46 1.41 0.00 0.00 0.02 0.00 0.00 55.97 57.86 2psf s LYS 209 Cb -0.15 -1.95 0.00 0.00 -0.52 0.00 0.00 37.83 35.20 2psf s LYS 209 CO 0.20 -1.23 0.00 0.41 -0.92 0.00 0.00 175.35 173.81 2psf n GLY 210 N -0.45 0.30 0.29 -3.33 0.00 -0.04 -4.62 105.19 97.33 2psf n GLY 210 Ca 0.10 -1.79 0.15 0.00 0.00 0.00 0.00 46.02 44.48 2psf n GLY 210 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2psf h GLU 211 N 0.00 0.00 -0.09 1.61 4.57 -1.90 -1.68 114.58 117.08 2psf h GLU 211 Ca 0.00 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.21 2psf h GLU 211 Cb 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2psf h GLU 211 CO 0.00 0.05 0.09 -0.24 -1.18 0.00 0.00 179.01 177.74 2psf h VAL 212 N 0.00 0.60 -0.00 0.32 3.04 -1.87 -0.04 116.25 118.30 2psf h VAL 212 Ca -0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2psf h VAL 212 Cb 0.15 0.93 0.00 0.00 -2.01 0.00 0.00 31.29 30.36 2psf h VAL 212 CO 0.01 0.00 -0.01 0.54 -1.01 0.00 0.00 177.57 177.10 2psf n ARG 213 N -3.97 1.02 -0.25 4.17 1.74 -0.63 -4.45 116.66 114.28 2psf n ARG 213 Ca -0.01 -0.16 0.06 0.00 -0.77 0.00 0.00 57.85 56.97 2psf n ARG 213 Cb 0.20 -1.50 0.19 0.00 -1.02 0.00 0.00 32.46 30.33 2psf n ARG 213 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2psf h ARG 214 N 0.38 0.32 -0.33 5.56 9.65 -1.16 -1.34 114.38 127.46 2psf h ARG 214 Ca 0.00 -0.02 0.06 0.00 -1.10 0.00 0.00 59.98 58.92 2psf h ARG 214 Cb 0.12 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.62 2psf h ARG 214 CO 0.00 0.21 0.22 -1.35 2.80 0.00 0.00 179.97 181.86 2psf h PRO 215 N 0.33 0.17 0.00 0.20 0.11 -1.83 0.96 132.00 131.94 2psf h PRO 215 Ca 0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.52 2psf h PRO 215 Cb 0.69 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.77 2psf h PRO 215 CO -0.47 0.11 0.00 1.79 -0.21 0.00 0.00 178.00 179.22 2psf h THR 216 N 0.17 0.00 0.13 -1.15 1.35 -1.58 -2.25 112.91 109.58 2psf h THR 216 Ca 0.15 -0.56 -0.36 0.00 -0.55 0.00 0.00 66.41 65.09 2psf h THR 216 Cb 0.36 1.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.27 2psf h THR 216 CO -0.02 0.00 -1.95 0.25 -0.25 0.00 0.00 175.52 173.54 2psf h LEU 217 N 0.00 0.44 -0.82 3.87 5.85 -1.14 -3.40 115.31 120.11 2psf h LEU 217 Ca 0.00 -0.95 -0.07 0.00 0.84 0.00 0.00 57.88 57.70 2psf h LEU 217 Cb 0.67 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2psf h LEU 217 CO 0.00 1.85 0.08 0.28 -0.34 0.00 0.00 178.44 180.31 2psf h SER 218 N 0.06 0.92 0.49 1.25 0.02 -0.77 -3.09 113.55 112.43 2psf h SER 218 Ca -0.41 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.31 2psf h SER 218 Cb 2.03 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 64.32 2psf h SER 218 CO 0.10 0.93 -0.39 -0.50 -1.14 0.00 0.00 176.83 175.83 2psf h TRP 219 N 0.91 -1.05 0.00 3.45 -0.00 -1.62 -2.28 115.95 115.36 2psf h TRP 219 Ca 0.18 0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 59.06 2psf h TRP 219 Cb 0.42 0.40 -0.00 0.00 -0.00 0.00 0.00 29.16 29.97 2psf h TRP 219 CO 0.03 -0.56 -0.07 -1.00 -0.00 0.00 0.00 178.44 176.83 2psf h PRO 220 N -0.87 0.00 0.00 0.49 0.13 -1.78 -0.70 132.00 129.28 2psf h PRO 220 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2psf h PRO 220 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2psf h PRO 220 CO -0.01 0.07 0.00 0.54 -0.23 0.00 0.00 178.00 178.38 2psf n ARG 221 N -4.11 0.13 0.00 0.86 1.74 -0.89 -2.08 116.66 112.31 2psf n ARG 221 Ca -0.03 0.40 0.15 0.00 -0.77 0.00 0.00 57.85 57.60 2psf n ARG 221 Cb 0.16 -1.77 0.69 0.00 -1.02 0.00 0.00 32.46 30.52 2psf n ARG 221 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2psf n GLU 222 N -2.02 0.75 -1.64 5.56 -0.58 -0.27 -4.70 120.64 117.74 2psf n GLU 222 Ca 0.02 -0.20 -0.49 0.00 -0.42 0.00 0.00 57.16 56.07 2psf n GLU 222 Cb 0.18 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.51 2psf n GLU 222 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16 2psf n ILE 223 N -0.95 0.07 -1.54 -3.67 3.06 -0.88 -4.62 119.36 110.82 2psf n ILE 223 Ca 0.16 -0.01 -0.40 0.00 -2.50 0.00 0.00 62.75 60.00 2psf n ILE 223 Cb 0.25 -1.29 -0.02 0.00 0.54 0.00 0.00 39.64 39.12 2psf n ILE 223 CO 0.00 0.00 0.00 -0.81 -2.50 0.00 0.00 176.55 173.24 2psf n PRO 224 N 3.49 3.39 -2.12 9.51 -0.04 -1.26 -4.18 135.00 143.79 2psf n PRO 224 Ca 0.18 -2.46 -0.41 0.00 -0.04 0.00 0.00 63.50 60.77 2psf n PRO 224 Cb 0.24 -3.00 -0.03 0.00 -0.04 0.00 0.00 33.50 30.68 2psf n PRO 224 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2psf s LEU 225 N 0.90 4.40 0.37 1.53 1.43 -1.26 -1.24 118.68 124.82 2psf s LEU 225 Ca 0.59 2.53 0.06 0.00 -1.03 0.00 0.00 54.13 56.28 2psf s LEU 225 Cb 0.16 -3.62 0.76 0.00 0.03 0.00 0.00 46.19 43.52 2psf s LEU 225 CO -0.07 -0.61 1.99 0.58 0.23 0.00 0.00 176.35 178.47 2psf h VAL 226 N 3.63 1.06 -3.63 -1.59 2.07 -1.44 -0.53 116.25 115.82 2psf h VAL 226 Ca -0.45 -0.25 -0.69 0.00 0.82 0.00 0.00 66.70 66.13 2psf h VAL 226 Cb 1.22 0.27 -0.33 0.00 -1.52 0.00 0.00 31.29 30.93 2psf h VAL 226 CO 0.77 0.13 -0.62 -0.54 0.02 0.00 0.00 177.57 177.33 2psf s LYS 227 N -5.63 2.25 0.00 1.57 1.02 -1.26 -4.65 119.74 113.03 2psf s LYS 227 Ca -0.09 -1.51 0.00 0.00 0.02 0.00 0.00 55.97 54.38 2psf s LYS 227 Cb 0.19 -3.40 0.00 0.00 -0.52 0.00 0.00 37.83 34.10 2psf s LYS 227 CO 0.76 -0.83 0.00 0.41 -0.92 0.00 0.00 175.35 174.77 2psf n GLY 228 N 4.63 0.86 3.75 -3.33 0.00 -1.25 -5.00 105.19 104.85 2psf n GLY 228 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 2psf n GLY 228 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2psf s GLY 229 N -2.12 2.80 0.15 -0.02 0.00 -0.21 -4.86 107.32 103.06 2psf s GLY 229 Ca 0.00 1.11 -0.33 0.00 0.00 0.00 0.00 44.72 45.50 2psf s GLY 229 CO 0.00 1.55 1.65 0.28 0.00 0.00 0.00 173.10 176.57 2psf n LYS 230 N -1.36 2.33 -0.05 2.90 4.76 -1.26 -4.85 118.16 120.62 2psf n LYS 230 Ca 0.12 0.84 -0.01 0.00 -2.87 0.00 0.00 58.31 56.39 2psf n LYS 230 Cb 0.48 -2.64 0.25 0.00 -1.84 0.00 0.00 35.03 31.28 2psf n LYS 230 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 2psf h PRO 231 N 6.54 0.64 -0.60 1.97 0.13 -1.97 0.07 132.00 138.78 2psf h PRO 231 Ca -0.45 -0.14 -0.08 0.00 -0.87 0.00 0.00 66.00 64.46 2psf h PRO 231 Cb 1.24 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 2psf h PRO 231 CO 0.91 0.64 0.05 0.38 -0.23 0.00 0.00 178.00 179.75 2psf h ASP 232 N 0.61 0.97 -0.19 1.44 2.03 -1.99 -1.00 116.42 118.29 2psf h ASP 232 Ca 0.13 -0.25 -0.18 0.00 -0.73 0.00 0.00 57.03 56.00 2psf h ASP 232 Cb 0.34 -0.26 0.01 0.00 -0.83 0.00 0.00 39.33 38.59 2psf h ASP 232 CO 0.01 1.00 -0.60 0.58 -1.03 0.00 0.00 179.24 179.20 2psf h VAL 233 N 0.94 1.30 -0.40 4.15 2.07 -1.79 -1.61 116.25 120.91 2psf h VAL 233 Ca 0.18 -1.82 0.04 0.00 0.82 0.00 0.00 66.70 65.92 2psf h VAL 233 Cb 0.48 1.90 -0.04 0.00 -1.52 0.00 0.00 31.29 32.11 2psf h VAL 233 CO 0.02 0.57 0.17 0.58 0.02 0.00 0.00 177.57 178.93 2psf h VAL 234 N 0.46 0.93 -0.75 2.57 2.07 -0.88 -0.05 116.25 120.60 2psf h VAL 234 Ca -0.02 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 2psf h VAL 234 Cb 1.22 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 2psf h VAL 234 CO 0.13 0.06 0.31 -0.61 0.02 0.00 0.00 177.57 177.49 2psf h GLN 235 N 0.35 1.10 -0.37 1.57 5.75 -1.13 -0.13 115.11 122.26 2psf h GLN 235 Ca 0.18 -0.19 0.02 0.00 -0.15 0.00 0.00 58.65 58.51 2psf h GLN 235 Cb 0.12 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.46 2psf h GLN 235 CO -0.15 0.89 0.20 0.82 -2.65 0.00 0.00 178.83 177.94 2psf h ILE 236 N 1.07 1.01 -0.26 2.39 2.04 -0.69 -0.62 117.51 122.45 2psf h ILE 236 Ca 0.25 -0.14 -0.14 0.00 1.00 0.00 0.00 64.86 65.83 2psf h ILE 236 Cb 0.19 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2psf h ILE 236 CO -0.02 0.07 -0.40 0.58 0.00 0.00 0.00 178.15 178.38 2psf h VAL 237 N 0.41 1.30 -0.77 1.67 2.07 -0.83 -0.57 116.25 119.53 2psf h VAL 237 Ca 0.15 -1.60 0.06 0.00 0.82 0.00 0.00 66.70 66.13 2psf h VAL 237 Cb 0.03 1.70 -0.06 0.00 -1.52 0.00 0.00 31.29 31.44 2psf h VAL 237 CO -0.09 0.51 0.47 0.03 0.02 0.00 0.00 177.57 178.51 2psf h ARG 238 N 0.46 0.83 -0.09 1.57 3.08 -0.91 0.72 114.38 120.05 2psf h ARG 238 Ca 0.02 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2psf h ARG 238 Cb 1.00 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.86 2psf h ARG 238 CO 0.09 0.55 -0.00 -0.91 -1.07 0.00 0.00 179.97 178.63 2psf h ASN 239 N 0.86 0.15 0.89 7.04 2.35 -0.93 -2.49 115.58 123.46 2psf h ASN 239 Ca 0.34 -0.31 -0.10 0.00 -0.55 0.00 0.00 56.30 55.67 2psf h ASN 239 Cb 0.16 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2psf h ASN 239 CO -0.17 0.43 -0.47 0.10 -1.65 0.00 0.00 177.43 175.67 2psf h TYR 240 N -0.13 0.00 -0.24 1.19 -0.00 -0.94 -2.38 116.97 114.48 2psf h TYR 240 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 58.72 2psf h TYR 240 Cb 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.07 2psf h TYR 240 CO 0.03 0.47 0.00 -0.97 -0.00 0.00 0.00 178.16 177.70 2psf h ASN 241 N 0.00 0.41 -0.73 0.10 -0.73 -0.82 0.26 115.58 114.07 2psf h ASN 241 Ca -0.00 -0.30 0.01 0.00 1.87 0.00 0.00 56.30 57.87 2psf h ASN 241 Cb 1.05 -0.11 -0.04 0.00 0.27 0.00 0.00 38.32 39.49 2psf h ASN 241 CO 0.06 0.61 0.48 0.00 -0.37 0.00 0.00 177.43 178.21 2psf h ALA 242 N 0.81 0.92 -0.31 1.57 0.00 -1.36 -0.76 119.26 120.13 2psf h ALA 242 Ca 0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2psf h ALA 242 Cb 0.40 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2psf h ALA 242 CO 0.01 0.35 0.18 -0.92 0.00 0.00 0.00 179.25 178.87 2psf h TYR 243 N 0.99 0.42 -0.48 0.00 3.20 -1.28 -2.70 116.97 117.12 2psf h TYR 243 Ca 0.27 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.07 2psf h TYR 243 Cb -0.10 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 2psf h TYR 243 CO -0.02 0.33 0.05 -0.07 -1.64 0.00 0.00 178.16 176.81 2psf h LEU 244 N 0.39 0.72 -1.81 2.82 3.38 -0.62 -2.03 115.31 118.16 2psf h LEU 244 Ca 0.11 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2psf h LEU 244 Cb 0.04 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2psf h LEU 244 CO -0.02 0.76 -0.15 0.03 0.09 0.00 0.00 178.44 179.15 2psf h ARG 245 N 0.72 0.00 -0.11 1.13 3.08 -0.95 -2.73 114.38 115.52 2psf h ARG 245 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2psf h ARG 245 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 2psf h ARG 245 CO 0.01 0.15 0.00 0.00 -1.07 0.00 0.00 179.97 179.06 2psf n ALA 246 N -2.35 2.47 -2.00 0.04 0.00 -0.82 -4.42 120.51 113.43 2psf n ALA 246 Ca -0.02 -0.71 -0.40 0.00 0.00 0.00 0.00 53.44 52.30 2psf n ALA 246 Cb 0.25 -0.88 -0.00 0.00 0.00 0.00 0.00 19.45 18.81 2psf n ALA 246 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2psf n SER 247 N 1.18 7.48 0.18 0.00 3.41 -0.84 -4.74 113.62 120.29 2psf n SER 247 Ca 0.16 -3.08 0.13 0.00 -0.26 0.00 0.00 58.87 55.82 2psf n SER 247 Cb 0.56 -1.40 0.70 0.00 -0.26 0.00 0.00 64.21 63.80 2psf n SER 247 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2psf h ASP 248 N 4.88 0.00 -0.23 4.04 3.32 -1.85 -2.10 116.42 124.47 2psf h ASP 248 Ca 0.66 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.71 2psf h ASP 248 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 2psf h ASP 248 CO 1.54 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 179.53 2psf n ASP 249 N -4.36 2.46 -4.39 6.45 8.00 -1.26 -4.60 116.55 118.86 2psf n ASP 249 Ca 0.01 -1.84 -0.42 0.00 0.71 0.00 0.00 54.79 53.26 2psf n ASP 249 Cb 0.27 -0.15 -0.10 0.00 -0.02 0.00 0.00 41.12 41.12 2psf n ASP 249 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2psf s LEU 250 N -1.60 5.04 0.25 0.64 2.96 -0.79 -5.07 118.68 120.12 2psf s LEU 250 Ca 0.35 -1.10 -0.30 0.00 -0.22 0.00 0.00 54.13 52.86 2psf s LEU 250 Cb 0.20 -2.08 -0.10 0.00 0.50 0.00 0.00 46.19 44.71 2psf s LEU 250 CO 0.29 -0.47 1.43 -2.84 -1.32 0.00 0.00 176.35 173.44 2psf s PRO 251 N 1.58 4.27 0.09 0.98 0.02 -1.26 -4.74 135.00 135.95 2psf s PRO 251 Ca 0.03 2.29 0.05 0.00 0.02 0.00 0.00 61.00 63.40 2psf s PRO 251 Cb -0.21 -3.11 -0.03 0.00 0.02 0.00 0.00 34.50 31.17 2psf s PRO 251 CO 0.07 -0.41 -0.13 0.15 -0.33 0.00 0.00 177.00 176.35 2psf s LYS 252 N -0.45 0.89 -0.09 5.54 1.02 0.12 -1.99 119.74 124.77 2psf s LYS 252 Ca 0.59 -1.08 0.01 0.00 0.02 0.00 0.00 55.97 55.51 2psf s LYS 252 Cb -0.42 -0.79 0.02 0.00 -0.52 0.00 0.00 37.83 36.12 2psf s LYS 252 CO 0.44 0.16 -0.12 -1.17 -0.92 0.00 0.00 175.35 173.74 2psf s LEU 253 N -2.11 1.55 -0.21 3.17 2.96 -0.40 -0.90 118.68 122.74 2psf s LEU 253 Ca 0.03 -0.34 -0.05 0.00 -0.22 0.00 0.00 54.13 53.55 2psf s LEU 253 Cb -0.07 -0.91 -0.02 0.00 0.50 0.00 0.00 46.19 45.69 2psf s LEU 253 CO 0.02 -0.01 -0.00 0.12 -1.32 0.00 0.00 176.35 175.15 2psf s PHE 254 N 1.04 3.02 -0.41 5.38 5.36 0.27 -0.98 117.98 131.66 2psf s PHE 254 Ca -0.07 -0.57 -0.12 0.00 -0.96 0.00 0.00 56.93 55.20 2psf s PHE 254 Cb -0.15 -2.11 0.04 0.00 -0.34 0.00 0.00 43.02 40.47 2psf s PHE 254 CO -0.01 -0.33 0.27 0.42 -1.46 0.00 0.00 175.22 174.11 2psf s ILE 255 N 1.19 4.79 0.11 3.12 1.01 -0.64 -1.84 121.20 128.93 2psf s ILE 255 Ca 0.03 -0.96 -0.25 0.00 0.00 0.00 0.00 60.65 59.47 2psf s ILE 255 Cb -0.14 -3.75 -0.07 0.00 0.01 0.00 0.00 42.46 38.50 2psf s ILE 255 CO 0.01 -0.37 0.77 -0.70 0.00 0.00 0.00 174.94 174.65 2psf s GLU 256 N 1.57 4.52 0.10 2.79 2.12 -0.24 -4.38 118.70 125.19 2psf s GLU 256 Ca 0.03 1.10 -0.11 0.00 0.36 0.00 0.00 54.97 56.36 2psf s GLU 256 Cb -0.21 -3.31 -0.06 0.00 0.26 0.00 0.00 34.13 30.82 2psf s GLU 256 CO 0.07 0.45 0.44 -1.54 -0.54 0.00 0.00 175.26 174.13 2psf s SER 257 N -0.66 6.69 -0.20 -1.70 1.04 -1.26 -0.91 113.70 116.70 2psf s SER 257 Ca 0.37 0.86 0.00 0.00 0.48 0.00 0.00 55.95 57.67 2psf s SER 257 Cb -0.22 -2.21 0.05 0.00 0.10 0.00 0.00 66.02 63.74 2psf s SER 257 CO 0.25 0.15 -0.07 -0.62 0.98 0.00 0.00 173.24 173.93 2psf s ASP 258 N -1.75 3.38 0.15 7.02 2.15 0.55 -2.67 116.67 125.51 2psf s ASP 258 Ca 0.34 -0.92 0.26 0.00 0.43 0.00 0.00 52.55 52.67 2psf s ASP 258 Cb -0.14 -1.12 0.93 0.00 -0.30 0.00 0.00 42.92 42.29 2psf s ASP 258 CO 0.18 -0.19 1.80 -0.81 -0.17 0.00 0.00 175.17 175.99 2psf n PRO 259 N 4.74 0.18 0.00 4.34 -0.04 -1.02 -1.19 135.00 142.02 2psf n PRO 259 Ca -0.13 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2psf n PRO 259 Cb 0.46 -1.72 0.00 0.00 -0.04 0.00 0.00 33.50 32.20 2psf n PRO 259 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2psf n GLY 260 N 1.24 -1.53 0.34 0.55 0.00 0.35 -4.69 105.19 101.44 2psf n GLY 260 Ca 0.06 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.52 2psf n GLY 260 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2psf n PHE 261 N -1.91 0.00 0.24 1.61 7.35 -0.91 -4.72 117.46 119.12 2psf n PHE 261 Ca 0.00 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.81 2psf n PHE 261 Cb 0.00 0.00 0.18 0.00 0.35 0.00 0.00 39.48 40.01 2psf n PHE 261 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2psf h PHE 262 N 0.00 0.00 -0.40 -5.13 0.05 -1.94 -3.39 116.94 106.13 2psf h PHE 262 Ca 0.00 0.00 0.08 0.00 3.82 0.00 0.00 57.97 61.87 2psf h PHE 262 Cb 0.00 0.00 -0.09 0.00 2.00 0.00 0.00 35.95 37.86 2psf h PHE 262 CO 0.00 0.00 -0.25 0.77 -0.18 0.00 0.00 178.31 178.65 2psf h SER 263 N 0.00 -0.85 -0.46 2.17 0.02 -1.89 -0.40 113.55 112.15 2psf h SER 263 Ca 0.00 0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 2psf h SER 263 Cb 0.98 0.43 -0.02 0.00 0.14 0.00 0.00 62.40 63.93 2psf h SER 263 CO 0.00 -0.27 0.27 -1.13 -1.14 0.00 0.00 176.83 174.55 2psf h ASN 264 N -0.19 0.57 1.35 3.07 -0.00 -1.84 0.25 115.58 118.80 2psf h ASN 264 Ca 0.19 -0.03 -0.11 0.00 -0.00 0.00 0.00 56.30 56.34 2psf h ASN 264 Cb 0.48 -0.15 -0.02 0.00 -0.00 0.00 0.00 38.32 38.64 2psf h ASN 264 CO -0.51 0.46 -0.52 0.00 -0.00 0.00 0.00 177.43 176.86 2psf h ALA 265 N 1.63 0.69 0.00 1.57 0.00 -1.56 -3.36 119.26 118.23 2psf h ALA 265 Ca 0.17 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2psf h ALA 265 Cb 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2psf h ALA 265 CO -0.03 0.66 -1.11 -0.89 0.00 0.00 0.00 179.25 177.88 2psf n ILE 266 N -3.28 0.00 -0.35 0.00 2.08 -0.25 -4.55 119.36 113.01 2psf n ILE 266 Ca 0.01 -0.24 0.02 0.00 0.56 0.00 0.00 62.75 63.10 2psf n ILE 266 Cb 0.72 0.62 0.17 0.00 -0.75 0.00 0.00 39.64 40.40 2psf n ILE 266 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 2psf h VAL 267 N 0.00 1.06 -0.68 1.39 2.07 -0.67 0.12 116.25 119.54 2psf h VAL 267 Ca 0.00 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 2psf h VAL 267 Cb 0.48 -0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 2psf h VAL 267 CO 0.00 0.20 0.35 -0.33 0.02 0.00 0.00 177.57 177.80 2psf h GLU 268 N 1.09 0.96 -0.18 1.57 4.39 -1.81 0.14 114.58 120.73 2psf h GLU 268 Ca 0.42 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.99 2psf h GLU 268 Cb 0.19 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 2psf h GLU 268 CO -0.18 0.72 0.10 0.78 -1.16 0.00 0.00 179.01 179.27 2psf h GLY 269 N 1.02 0.28 1.52 -3.84 0.00 -1.31 -2.94 103.07 97.80 2psf h GLY 269 Ca 0.24 -0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.45 2psf h GLY 269 CO -0.03 0.12 0.31 0.00 0.00 0.00 0.00 176.54 176.94 2psf h ALA 270 N 0.98 1.67 0.00 3.60 0.00 -0.30 -1.78 119.26 123.44 2psf h ALA 270 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2psf h ALA 270 Cb 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2psf h ALA 270 CO -0.01 0.30 0.00 0.87 0.00 0.00 0.00 179.25 180.41 2psf h LYS 271 N 0.63 0.00 0.00 0.00 1.57 -0.81 -2.28 116.57 115.69 2psf h LYS 271 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2psf h LYS 271 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2psf h LYS 271 CO -0.04 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.47 2psf n LYS 272 N -2.45 0.26 -3.45 3.15 5.02 -0.67 -4.72 118.16 115.30 2psf n LYS 272 Ca 0.01 0.01 -0.39 0.00 -2.02 0.00 0.00 58.31 55.92 2psf n LYS 272 Cb 0.19 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.61 2psf n LYS 272 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2psf s PHE 273 N -2.73 3.26 0.86 2.13 0.08 -0.86 -4.54 117.98 116.18 2psf s PHE 273 Ca 0.22 0.35 -0.11 0.00 0.12 0.00 0.00 56.93 57.52 2psf s PHE 273 Cb 0.19 -2.50 0.11 0.00 -0.57 0.00 0.00 43.02 40.24 2psf s PHE 273 CO 0.47 -0.17 1.09 -1.25 -0.10 0.00 0.00 175.22 175.26 2psf s PRO 274 N 1.85 1.58 -1.28 0.24 0.04 -1.26 -3.89 135.00 132.28 2psf s PRO 274 Ca 0.13 0.96 -0.06 0.00 0.04 0.00 0.00 61.00 62.07 2psf s PRO 274 Cb -0.16 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.56 2psf s PRO 274 CO 0.10 -2.06 1.11 -1.71 0.04 0.00 0.00 177.00 174.48 2psf n ASN 275 N -3.78 -4.85 -4.41 6.66 2.85 -1.26 -4.75 115.26 105.72 2psf n ASN 275 Ca 0.08 -0.56 -0.34 0.00 -0.11 0.00 0.00 54.58 53.65 2psf n ASN 275 Cb 0.54 -5.00 -0.13 0.00 1.24 0.00 0.00 39.78 36.44 2psf n ASN 275 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2psf s THR 276 N -3.33 3.51 -0.00 -0.44 2.01 -1.25 -0.70 115.64 115.43 2psf s THR 276 Ca 0.38 -0.48 -0.19 0.00 0.31 0.00 0.00 61.69 61.71 2psf s THR 276 Cb -0.17 -2.54 -0.06 0.00 0.01 0.00 0.00 72.50 69.75 2psf s THR 276 CO 0.72 0.48 0.55 -0.70 -0.69 0.00 0.00 174.62 174.98 2psf s GLU 277 N 0.67 4.24 -0.15 4.92 2.12 -0.08 -4.96 118.70 125.45 2psf s GLU 277 Ca -0.04 0.65 -0.01 0.00 0.36 0.00 0.00 54.97 55.93 2psf s GLU 277 Cb -0.15 -3.32 -0.01 0.00 0.26 0.00 0.00 34.13 30.91 2psf s GLU 277 CO 0.02 0.44 -0.11 -0.06 -0.54 0.00 0.00 175.26 175.01 2psf s PHE 278 N -0.39 2.85 0.28 5.30 0.08 -1.26 -0.57 117.98 124.27 2psf s PHE 278 Ca 0.29 -0.77 0.04 0.00 0.12 0.00 0.00 56.93 56.61 2psf s PHE 278 Cb -0.18 -1.91 -0.06 0.00 -0.57 0.00 0.00 43.02 40.31 2psf s PHE 278 CO 0.16 -0.32 0.03 0.14 -0.10 0.00 0.00 175.22 175.13 2psf s VAL 279 N 0.65 1.09 -0.02 -0.44 -7.23 -0.77 -5.00 120.40 108.69 2psf s VAL 279 Ca -0.06 -2.02 0.01 0.00 -1.81 0.00 0.00 61.98 58.10 2psf s VAL 279 Cb -0.15 -2.59 0.01 0.00 0.56 0.00 0.00 36.38 34.20 2psf s VAL 279 CO 0.02 -0.13 -0.03 -0.75 -0.31 0.00 0.00 175.10 173.90 2psf s LYS 280 N -3.89 0.41 0.16 4.82 2.20 -1.26 -1.08 119.74 121.10 2psf s LYS 280 Ca 0.33 -0.09 0.02 0.00 -0.36 0.00 0.00 55.97 55.87 2psf s LYS 280 Cb 0.07 -0.45 -0.05 0.00 -1.51 0.00 0.00 37.83 35.89 2psf s LYS 280 CO 0.13 0.01 -0.02 0.14 -0.36 0.00 0.00 175.35 175.25 2psf s VAL 281 N 0.32 0.70 0.29 4.02 -7.23 -0.09 -4.94 120.40 113.47 2psf s VAL 281 Ca -0.03 -1.98 -0.30 0.00 -1.81 0.00 0.00 61.98 57.87 2psf s VAL 281 Cb -0.07 -2.02 -0.11 0.00 0.56 0.00 0.00 36.38 34.75 2psf s VAL 281 CO -0.00 -0.57 1.48 -0.75 -0.31 0.00 0.00 175.10 174.95 2psf s LYS 282 N -3.89 4.21 0.00 4.82 2.20 -1.26 -0.33 119.74 125.49 2psf s LYS 282 Ca 0.21 2.42 0.00 0.00 -0.36 0.00 0.00 55.97 58.24 2psf s LYS 282 Cb 0.06 -3.06 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 2psf s LYS 282 CO 0.02 -0.48 0.00 0.41 -0.36 0.00 0.00 175.35 174.94 2psf n GLY 283 N 1.75 1.66 0.00 5.54 0.00 -0.33 -3.95 105.19 109.86 2psf n GLY 283 Ca 0.05 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2psf n GLY 283 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2psf n LEU 284 N 0.00 0.00 -0.13 0.99 4.77 -1.26 -0.50 117.00 120.87 2psf n LEU 284 Ca 0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.70 2psf n LEU 284 Cb 0.00 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 2psf n LEU 284 CO 0.00 0.00 -1.40 1.57 -1.33 0.00 0.00 177.39 176.23 2psf n HIS 285 N 0.00 0.00 -2.04 -1.77 -0.00 -0.97 -2.15 115.22 108.29 2psf n HIS 285 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.31 2psf n HIS 285 Cb 0.00 -0.94 -0.00 0.00 -0.00 0.00 0.00 29.99 29.04 2psf n HIS 285 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 2psf n PHE 286 N -4.11 2.74 0.31 1.57 3.72 -0.86 -4.76 117.46 116.07 2psf n PHE 286 Ca -0.51 -2.84 0.20 0.00 -0.05 0.00 0.00 57.45 54.24 2psf n PHE 286 Cb 0.87 -1.97 0.99 0.00 -0.94 0.00 0.00 39.48 38.44 2psf n PHE 286 CO 0.00 0.00 0.00 1.37 -0.05 0.00 0.00 176.76 178.08 2psf h LEU 287 N 6.74 0.00 -2.18 4.37 8.10 -1.83 -1.39 115.31 129.12 2psf h LEU 287 Ca 0.60 0.00 0.05 0.00 0.11 0.00 0.00 57.88 58.64 2psf h LEU 287 Cb 0.43 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.65 2psf h LEU 287 CO 1.58 0.02 0.15 1.56 -4.11 0.00 0.00 178.44 177.64 2psf h GLN 288 N 0.00 0.00 0.00 0.17 7.50 -1.89 -0.29 115.11 120.61 2psf h GLN 288 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2psf h GLN 288 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.72 2psf h GLN 288 CO 0.00 0.00 -0.33 0.93 -1.50 0.00 0.00 178.83 177.93 2psf h GLU 289 N 0.00 0.00 0.00 1.46 4.39 -1.54 -3.14 114.58 115.74 2psf h GLU 289 Ca 0.08 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.68 2psf h GLU 289 Cb 0.38 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 2psf h GLU 289 CO -0.00 0.00 -1.95 -0.25 -1.16 0.00 0.00 179.01 175.65 2psf n ASP 290 N -2.80 0.76 -2.77 1.42 8.00 -0.60 -4.75 116.55 115.81 2psf n ASP 290 Ca 0.03 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.43 2psf n ASP 290 Cb 0.52 1.55 0.05 0.00 -0.02 0.00 0.00 41.12 43.22 2psf n ASP 290 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2psf n ALA 291 N -2.30 2.05 0.07 2.24 0.00 -0.22 -4.83 120.51 117.52 2psf n ALA 291 Ca -0.11 -2.46 0.00 0.00 0.00 0.00 0.00 53.44 50.87 2psf n ALA 291 Cb 0.67 -0.98 0.32 0.00 0.00 0.00 0.00 19.45 19.46 2psf n ALA 291 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2psf h PRO 292 N 2.72 0.35 0.02 0.00 0.13 -1.73 -1.86 132.00 131.64 2psf h PRO 292 Ca -0.11 -0.09 -0.18 0.00 -0.87 0.00 0.00 66.00 64.75 2psf h PRO 292 Cb 1.17 -0.04 0.02 0.00 0.13 0.00 0.00 31.00 32.27 2psf h PRO 292 CO 0.30 0.49 -0.70 -0.44 -0.23 0.00 0.00 178.00 177.42 2psf h ASP 293 N 0.33 0.58 -0.45 1.44 3.32 -1.90 0.43 116.42 120.18 2psf h ASP 293 Ca 0.06 -0.78 0.01 0.00 0.02 0.00 0.00 57.03 56.34 2psf h ASP 293 Cb 0.44 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2psf h ASP 293 CO 0.03 1.29 0.29 -0.33 -1.72 0.00 0.00 179.24 178.80 2psf h GLU 294 N -0.07 0.58 -0.19 3.56 3.07 -1.96 -0.78 114.58 118.80 2psf h GLU 294 Ca -0.09 -0.03 0.02 0.00 -0.50 0.00 0.00 59.36 58.76 2psf h GLU 294 Cb 1.42 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 29.17 2psf h GLU 294 CO 0.14 0.38 0.04 1.98 -1.40 0.00 0.00 179.01 180.15 2psf h MET 295 N 0.60 0.11 -0.87 2.33 4.05 -1.31 -0.90 114.93 118.94 2psf h MET 295 Ca 0.17 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.55 2psf h MET 295 Cb -0.06 -0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 30.68 2psf h MET 295 CO -0.04 0.08 0.43 0.78 0.23 0.00 0.00 176.91 178.39 2psf h GLY 296 N 0.12 1.33 1.07 1.39 0.00 -0.59 -0.62 103.07 105.77 2psf h GLY 296 Ca 0.09 -0.64 -0.13 0.00 0.00 0.00 0.00 47.33 46.64 2psf h GLY 296 CO -0.11 0.61 -0.25 0.50 0.00 0.00 0.00 176.54 177.30 2psf h LYS 297 N 1.23 0.91 -0.69 4.80 1.57 -0.95 0.18 116.57 123.62 2psf h LYS 297 Ca 0.30 -0.42 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2psf h LYS 297 Cb 0.10 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 2psf h LYS 297 CO -0.04 1.07 0.26 1.88 -0.57 0.00 0.00 179.45 182.06 2psf h TYR 298 N 0.74 1.06 -0.41 -1.35 0.05 -0.87 -1.18 116.97 115.01 2psf h TYR 298 Ca 0.09 -0.09 -0.08 0.00 0.05 0.00 0.00 58.73 58.71 2psf h TYR 298 Cb 0.82 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 38.23 2psf h TYR 298 CO 0.06 0.83 -0.04 0.82 -1.05 0.00 0.00 178.16 178.78 2psf h ILE 299 N 0.99 1.27 -0.29 -2.88 2.04 -1.00 -1.58 117.51 116.05 2psf h ILE 299 Ca 0.23 -1.09 0.04 0.00 1.00 0.00 0.00 64.86 65.04 2psf h ILE 299 Cb 0.23 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 2psf h ILE 299 CO -0.02 0.37 0.05 0.50 0.00 0.00 0.00 178.15 179.05 2psf h LYS 300 N 0.58 0.15 -0.46 2.37 3.64 -0.77 1.00 116.57 123.08 2psf h LYS 300 Ca 0.11 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2psf h LYS 300 Cb 0.54 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 2psf h LYS 300 CO 0.03 0.10 0.29 1.03 -2.27 0.00 0.00 179.45 178.63 2psf h SER 301 N 0.15 0.54 -0.16 4.20 0.87 -1.10 0.24 113.55 118.29 2psf h SER 301 Ca 0.14 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2psf h SER 301 Cb 0.15 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2psf h SER 301 CO -0.19 0.41 0.10 0.15 -0.53 0.00 0.00 176.83 176.77 2psf h PHE 302 N 0.62 0.20 -0.35 2.24 3.57 -0.92 -1.66 116.94 120.64 2psf h PHE 302 Ca 0.17 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 2psf h PHE 302 Cb -0.04 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.61 2psf h PHE 302 CO -0.04 0.16 0.16 0.28 -2.23 0.00 0.00 178.31 176.64 2psf h VAL 303 N 0.19 1.17 -0.61 1.41 2.07 -0.54 0.55 116.25 120.51 2psf h VAL 303 Ca 0.06 -0.50 0.09 0.00 0.82 0.00 0.00 66.70 67.16 2psf h VAL 303 Cb 0.01 0.86 -0.07 0.00 -1.52 0.00 0.00 31.29 30.57 2psf h VAL 303 CO -0.01 0.18 0.25 -0.33 0.02 0.00 0.00 177.57 177.68 2psf h GLU 304 N 0.43 0.44 -0.04 1.57 5.08 -0.81 -0.87 114.58 120.37 2psf h GLU 304 Ca 0.12 -0.03 -0.20 0.00 -1.00 0.00 0.00 59.36 58.25 2psf h GLU 304 Cb 0.14 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 2psf h GLU 304 CO -0.01 0.29 -0.81 0.00 -1.00 0.00 0.00 179.01 177.47 2psf h ARG 305 N 0.45 0.38 -0.33 2.33 3.08 -0.92 -1.48 114.38 117.89 2psf h ARG 305 Ca 0.30 -0.35 0.04 0.00 0.07 0.00 0.00 59.98 60.04 2psf h ARG 305 Cb 0.34 0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 2psf h ARG 305 CO -0.28 1.01 0.11 0.28 -1.07 0.00 0.00 179.97 180.02 2psf h VAL 306 N 0.24 0.90 -0.14 2.04 2.07 -0.53 -0.73 116.25 120.09 2psf h VAL 306 Ca -0.05 -0.08 -0.11 0.00 0.82 0.00 0.00 66.70 67.28 2psf h VAL 306 Cb 1.42 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 2psf h VAL 306 CO 0.14 0.04 -0.41 -0.07 0.02 0.00 0.00 177.57 177.29 2psf h LEU 307 N 0.24 0.34 -0.25 2.57 3.38 -1.02 -2.96 115.31 117.62 2psf h LEU 307 Ca 0.15 -0.15 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 2psf h LEU 307 Cb 0.13 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2psf h LEU 307 CO -0.16 0.72 -0.82 0.11 0.09 0.00 0.00 178.44 178.38 2psf h LYS 308 N 0.27 0.54 -0.02 1.13 1.79 -1.10 -3.51 116.57 115.67 2psf h LYS 308 Ca 0.02 -0.48 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 2psf h LYS 308 Cb 0.84 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.61 2psf h LYS 308 CO 0.07 1.11 0.00 0.09 -1.08 0.00 0.00 179.45 179.64