#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5bca n VAL 2 N 0.00 2.53 -2.87 0.00 0.31 -0.74 -2.38 118.33 115.18 5bca n VAL 2 Ca 0.00 -0.50 -0.19 0.00 -0.01 0.00 0.00 64.34 63.64 5bca n VAL 2 Cb 0.00 -1.77 0.03 0.00 -0.91 0.00 0.00 33.84 31.19 5bca n VAL 2 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 5bca n ASN 3 N 0.11 -5.45 0.00 4.52 3.02 -1.26 -3.15 115.26 113.05 5bca n ASN 3 Ca 0.05 -0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 5bca n ASN 3 Cb 0.40 -4.30 0.00 0.00 -0.61 0.00 0.00 39.78 35.27 5bca n ASN 3 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 5bca n GLY 4 N -1.39 0.73 3.25 7.41 0.00 -1.00 -4.96 105.19 109.22 5bca n GLY 4 Ca -0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 5bca n GLY 4 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 5bca n LYS 5 N -2.00 -0.49 -1.04 1.61 2.85 -1.19 -1.50 118.16 116.41 5bca n LYS 5 Ca 0.00 -2.03 0.00 0.00 -1.05 0.00 0.00 58.31 55.23 5bca n LYS 5 Cb 0.00 -0.82 0.00 0.00 -0.65 0.00 0.00 35.03 33.56 5bca n LYS 5 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 5bca n GLY 6 N -1.82 3.55 3.77 2.58 0.00 -1.26 0.11 105.19 112.11 5bca n GLY 6 Ca 0.14 -2.13 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 5bca n GLY 6 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 5bca s MET 7 N -0.79 4.04 -0.13 1.61 0.23 -1.26 -4.76 119.30 118.24 5bca s MET 7 Ca 0.00 1.93 -0.33 0.00 -1.03 0.00 0.00 55.69 56.26 5bca s MET 7 Cb 0.00 -2.71 -0.10 0.00 -1.53 0.00 0.00 34.83 30.49 5bca s MET 7 CO 0.00 -0.36 2.01 -1.71 -2.03 0.00 0.00 175.02 172.93 5bca n ASN 8 N 0.12 3.36 0.28 -1.18 2.85 -1.26 -4.74 115.26 114.69 5bca n ASN 8 Ca 0.04 0.74 0.19 0.00 -0.11 0.00 0.00 54.58 55.44 5bca n ASN 8 Cb 0.46 -1.42 0.97 0.00 1.24 0.00 0.00 39.78 41.03 5bca n ASN 8 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 5bca h PRO 9 N 10.98 0.00 -0.22 1.20 0.13 -1.93 -2.54 132.00 139.63 5bca h PRO 9 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 5bca h PRO 9 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 5bca h PRO 9 CO 0.96 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.48 5bca n ASP 10 N -2.87 2.41 -4.62 1.44 8.00 -1.26 -4.74 116.55 114.91 5bca n ASP 10 Ca -0.02 -1.82 -0.56 0.00 0.71 0.00 0.00 54.79 53.10 5bca n ASP 10 Cb 0.11 -0.13 -0.07 0.00 -0.02 0.00 0.00 41.12 41.01 5bca n ASP 10 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 5bca n TYR 11 N 0.82 1.52 -4.05 1.24 9.36 -0.96 -4.87 117.16 120.22 5bca n TYR 11 Ca 0.17 0.72 -0.12 0.00 3.32 0.00 0.00 57.90 61.99 5bca n TYR 11 Cb 0.46 -2.31 -0.12 0.00 -0.63 0.00 0.00 39.34 36.74 5bca n TYR 11 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 5bca s LYS 12 N 1.36 0.47 -0.11 2.98 1.02 -0.07 -4.72 119.74 120.67 5bca s LYS 12 Ca 0.91 -0.69 -0.12 0.00 0.02 0.00 0.00 55.97 56.09 5bca s LYS 12 Cb -1.08 -0.21 -0.05 0.00 -0.52 0.00 0.00 37.83 35.98 5bca s LYS 12 CO 0.56 0.03 0.27 0.00 -0.92 0.00 0.00 175.35 175.29 5bca s ALA 13 N -1.31 3.70 0.38 5.17 0.00 -1.26 -1.30 121.76 127.14 5bca s ALA 13 Ca -0.11 -0.46 0.08 0.00 0.00 0.00 0.00 51.96 51.47 5bca s ALA 13 Cb -0.09 -2.26 -0.06 0.00 0.00 0.00 0.00 23.12 20.70 5bca s ALA 13 CO 0.00 0.33 0.03 0.71 0.00 0.00 0.00 175.76 176.83 5bca s TYR 14 N -0.31 2.52 -0.06 0.00 2.02 0.15 -0.79 117.35 120.88 5bca s TYR 14 Ca 0.17 -0.56 0.03 0.00 -0.37 0.00 0.00 57.07 56.34 5bca s TYR 14 Cb -0.13 -1.67 0.01 0.00 -0.40 0.00 0.00 41.96 39.77 5bca s TYR 14 CO 0.06 0.43 -0.15 -1.17 -1.57 0.00 0.00 175.55 173.15 5bca s LEU 15 N -3.73 1.77 0.16 -1.29 2.96 -0.65 -2.26 118.68 115.64 5bca s LEU 15 Ca 0.36 -0.35 -0.28 0.00 -0.22 0.00 0.00 54.13 53.64 5bca s LEU 15 Cb 0.05 -0.93 -0.07 0.00 0.50 0.00 0.00 46.19 45.73 5bca s LEU 15 CO 0.19 0.08 0.88 -0.32 -1.32 0.00 0.00 176.35 175.86 5bca s MET 16 N 0.48 4.69 0.84 1.98 -2.45 -0.71 -0.45 119.30 123.68 5bca s MET 16 Ca -0.13 1.34 -0.13 0.00 -1.25 0.00 0.00 55.69 55.53 5bca s MET 16 Cb -0.15 -3.32 0.11 0.00 1.25 0.00 0.00 34.83 32.72 5bca s MET 16 CO 0.04 0.40 1.21 0.00 1.05 0.00 0.00 175.02 177.73 5bca s ALA 17 N -0.65 2.57 1.19 4.11 0.00 0.40 -1.60 121.76 127.77 5bca s ALA 17 Ca 0.41 -0.78 -0.13 0.00 0.00 0.00 0.00 51.96 51.46 5bca s ALA 17 Cb -0.24 -2.91 0.30 0.00 0.00 0.00 0.00 23.12 20.27 5bca s ALA 17 CO 0.29 -1.84 1.02 -2.30 0.00 0.00 0.00 175.76 172.92 5bca n PRO 18 N -3.41 -2.58 0.12 0.00 -0.02 -1.26 -4.70 135.00 123.15 5bca n PRO 18 Ca 0.10 -0.72 0.05 0.00 -2.02 0.00 0.00 63.50 60.90 5bca n PRO 18 Cb 0.61 -2.16 0.02 0.00 -0.02 0.00 0.00 33.50 31.94 5bca n PRO 18 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 5bca h LEU 19 N -2.74 0.00-10.21 2.45 5.85 -1.96 -3.46 115.31 105.24 5bca h LEU 19 Ca -0.63 0.00 -0.48 0.00 0.84 0.00 0.00 57.88 57.61 5bca h LEU 19 Cb 1.34 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.38 5bca h LEU 19 CO 0.49 0.34 0.31 -0.54 -0.34 0.00 0.00 178.44 178.71 5bca s LYS 20 N -3.07 3.85 0.62 1.25 1.02 -1.26 -4.85 119.74 117.31 5bca s LYS 20 Ca 0.02 0.79 -0.17 0.00 0.02 0.00 0.00 55.97 56.63 5bca s LYS 20 Cb 0.08 -2.20 -0.02 0.00 -0.52 0.00 0.00 37.83 35.17 5bca s LYS 20 CO 0.76 -0.25 1.15 0.15 -0.92 0.00 0.00 175.35 176.24 5bca s LYS 21 N -4.18 2.89 0.19 1.68 1.02 -1.26 -4.86 119.74 115.21 5bca s LYS 21 Ca 0.56 1.61 -0.12 0.00 0.02 0.00 0.00 55.97 58.04 5bca s LYS 21 Cb -0.10 -1.94 0.17 0.00 -0.52 0.00 0.00 37.83 35.44 5bca s LYS 21 CO 0.35 -1.22 1.80 0.82 -0.92 0.00 0.00 175.35 176.18 5bca h ILE 22 N 0.50 0.98 0.00 2.17 1.08 -1.95 -1.30 117.51 118.99 5bca h ILE 22 Ca -0.49 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 63.78 5bca h ILE 22 Cb 1.27 0.33 0.00 0.00 -3.07 0.00 0.00 36.82 35.35 5bca h ILE 22 CO 0.54 0.11 0.00 -2.65 -0.69 0.00 0.00 178.15 175.46 5bca n PRO 23 N -4.83 0.02 0.15 2.37 -0.02 -1.24 0.28 135.00 131.73 5bca n PRO 23 Ca 0.06 0.29 0.11 0.00 -2.02 0.00 0.00 63.50 61.94 5bca n PRO 23 Cb 0.14 -1.53 0.07 0.00 -0.02 0.00 0.00 33.50 32.15 5bca n PRO 23 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 5bca h GLU 24 N 0.00 0.00 0.02 -0.52 5.08 -1.59 -3.37 114.58 114.20 5bca h GLU 24 Ca 0.00 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.97 5bca h GLU 24 Cb 0.23 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.43 5bca h GLU 24 CO 0.00 0.03 -2.23 0.28 -1.00 0.00 0.00 179.01 176.10 5bca n VAL 25 N -2.88 1.56 -1.96 3.13 0.31 0.84 -5.02 118.33 114.32 5bca n VAL 25 Ca 0.01 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 5bca n VAL 25 Cb 0.56 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.74 5bca n VAL 25 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 5bca n THR 26 N -3.88 0.00 -4.20 2.52 -2.24 0.14 -5.10 114.28 101.52 5bca n THR 26 Ca -0.45 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.08 5bca n THR 26 Cb 0.91 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 69.07 5bca n THR 26 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 5bca s ASN 27 N 1.74 4.92 0.31 3.42 2.20 -1.26 -3.61 114.94 122.66 5bca s ASN 27 Ca 0.00 -0.41 0.02 0.00 -0.94 0.00 0.00 52.86 51.53 5bca s ASN 27 Cb 0.00 -1.08 0.58 0.00 -2.00 0.00 0.00 41.25 38.75 5bca s ASN 27 CO 0.00 0.04 1.90 -0.50 -2.94 0.00 0.00 177.10 175.60 5bca h TRP 28 N 2.27 1.02 0.00 1.54 4.06 -1.98 -2.30 115.95 120.55 5bca h TRP 28 Ca -0.47 0.03 -0.09 0.00 2.06 0.00 0.00 58.89 60.42 5bca h TRP 28 Cb 1.22 -0.33 -0.01 0.00 -1.00 0.00 0.00 29.16 29.04 5bca h TRP 28 CO 0.62 0.50 -0.44 0.93 -3.56 0.00 0.00 178.44 176.49 5bca h GLU 29 N 0.97 0.00 0.12 0.49 3.07 -1.99 -0.58 114.58 116.66 5bca h GLU 29 Ca 0.41 0.00 -0.24 0.00 -0.50 0.00 0.00 59.36 59.03 5bca h GLU 29 Cb 0.30 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.24 5bca h GLU 29 CO -0.17 0.44 -1.00 1.15 -1.40 0.00 0.00 179.01 178.04 5bca h THR 30 N 0.00 1.39 -0.82 1.13 2.02 -1.90 -3.20 112.91 111.53 5bca h THR 30 Ca -0.00 -2.44 0.04 0.00 0.77 0.00 0.00 66.41 64.77 5bca h THR 30 Cb 0.85 2.90 -0.05 0.00 -1.74 0.00 0.00 68.15 70.12 5bca h THR 30 CO 0.06 0.72 0.54 0.15 0.37 0.00 0.00 175.52 177.35 5bca h PHE 31 N -0.04 0.98 -0.41 3.16 3.57 -1.18 0.84 116.94 123.85 5bca h PHE 31 Ca -0.16 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.33 5bca h PHE 31 Cb 1.73 -0.33 -0.02 0.00 2.79 0.00 0.00 35.95 40.13 5bca h PHE 31 CO 0.15 0.57 0.14 0.93 -2.23 0.00 0.00 178.31 177.86 5bca h GLU 32 N 1.01 0.62 -0.03 1.11 5.08 -1.17 -2.28 114.58 118.92 5bca h GLU 32 Ca 0.33 -0.13 -0.07 0.00 -1.00 0.00 0.00 59.36 58.48 5bca h GLU 32 Cb 0.05 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 5bca h GLU 32 CO -0.10 0.61 -0.33 -0.91 -1.00 0.00 0.00 179.01 177.29 5bca h ASN 33 N 0.51 0.06 0.28 1.42 2.35 -1.40 -1.93 115.58 116.87 5bca h ASN 33 Ca 0.13 -0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.77 5bca h ASN 33 Cb 0.24 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 5bca h ASN 33 CO -0.01 0.39 -0.37 0.44 -1.65 0.00 0.00 177.43 176.23 5bca h ASP 34 N 0.05 0.14 -0.16 5.81 3.32 -0.73 -2.23 116.42 122.62 5bca h ASP 34 Ca 0.01 -0.05 -0.18 0.00 0.02 0.00 0.00 57.03 56.82 5bca h ASP 34 Cb 0.61 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.12 5bca h ASP 34 CO 0.04 0.50 -0.59 -0.07 -1.72 0.00 0.00 179.24 177.41 5bca h LEU 35 N 0.12 0.86 -0.92 1.55 3.38 -0.81 0.29 115.31 119.78 5bca h LEU 35 Ca 0.01 -0.48 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 5bca h LEU 35 Cb 0.72 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 5bca h LEU 35 CO 0.05 1.25 0.32 0.03 0.09 0.00 0.00 178.44 180.18 5bca h ARG 36 N 0.57 1.10 -0.32 1.13 3.08 -1.27 0.28 114.38 118.95 5bca h ARG 36 Ca 0.00 -0.18 -0.11 0.00 0.07 0.00 0.00 59.98 59.77 5bca h ARG 36 Cb 1.18 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 31.04 5bca h ARG 36 CO 0.12 0.88 -0.21 2.35 -1.07 0.00 0.00 179.97 182.04 5bca h TRP 37 N 1.08 0.83 0.10 3.04 -0.00 -1.06 -3.00 115.95 116.94 5bca h TRP 37 Ca 0.25 -0.22 0.01 0.00 -0.00 0.00 0.00 58.89 58.93 5bca h TRP 37 Cb 0.18 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 29.14 5bca h TRP 37 CO 0.02 0.95 -0.12 0.00 -0.00 0.00 0.00 178.44 179.29 5bca h ALA 38 N 0.75 -0.22 -0.98 2.65 0.00 0.37 -2.50 119.26 119.33 5bca h ALA 38 Ca 0.06 -0.03 0.16 0.00 0.00 0.00 0.00 54.91 55.11 5bca h ALA 38 Cb 0.76 0.18 -0.10 0.00 0.00 0.00 0.00 17.79 18.63 5bca h ALA 38 CO 0.06 -0.65 0.60 -0.22 0.00 0.00 0.00 179.25 179.04 5bca h LYS 39 N -0.26 0.80 0.00 0.00 3.64 -0.51 0.54 116.57 120.78 5bca h LYS 39 Ca 0.01 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 5bca h LYS 39 Cb 0.26 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 5bca h LYS 39 CO -0.05 0.53 -0.15 0.37 -2.27 0.00 0.00 179.45 177.89 5bca h GLN 40 N 0.82 0.00 -0.62 1.90 4.15 -1.32 -1.96 115.11 118.09 5bca h GLN 40 Ca 0.54 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.96 5bca h GLN 40 Cb 0.73 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.42 5bca h GLN 40 CO -0.34 0.15 0.00 0.09 -1.93 0.00 0.00 178.83 176.79 5bca n ASN 41 N -3.61 3.19 0.00 -0.69 3.02 0.19 -4.90 115.26 112.45 5bca n ASN 41 Ca -0.01 -2.32 0.00 0.00 -0.03 0.00 0.00 54.58 52.22 5bca n ASN 41 Cb 0.28 -0.48 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 5bca n ASN 41 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 5bca n GLY 42 N 0.72 0.57 3.77 7.41 0.00 -0.74 -4.24 105.19 112.69 5bca n GLY 42 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 5bca n GLY 42 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 5bca s PHE 43 N -2.27 3.45 -0.22 1.61 0.08 -1.14 -4.56 117.98 114.93 5bca s PHE 43 Ca 0.00 1.69 0.12 0.00 0.12 0.00 0.00 56.93 58.85 5bca s PHE 43 Cb 0.00 -3.18 -0.21 0.00 -0.57 0.00 0.00 43.02 39.05 5bca s PHE 43 CO 0.00 -0.52 -0.04 0.98 -0.10 0.00 0.00 175.22 175.54 5bca n TYR 44 N 0.58 0.00 -3.94 0.36 9.36 0.03 -4.21 117.16 119.34 5bca n TYR 44 Ca 0.02 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.14 5bca n TYR 44 Cb 0.47 -0.97 -0.07 0.00 -0.63 0.00 0.00 39.34 38.14 5bca n TYR 44 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 5bca s ALA 45 N -2.49 -0.04 -0.14 2.98 0.00 -1.24 -3.39 121.76 117.44 5bca s ALA 45 Ca -0.19 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 50.91 5bca s ALA 45 Cb 0.07 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.97 5bca s ALA 45 CO 0.72 -0.63 -0.06 -1.50 0.00 0.00 0.00 175.76 174.29 5bca s ILE 46 N -3.95 3.71 -0.07 0.00 2.07 -0.54 -1.64 121.20 120.78 5bca s ILE 46 Ca 0.15 -0.43 -0.12 0.00 -1.41 0.00 0.00 60.65 58.85 5bca s ILE 46 Cb 0.03 -2.60 -0.05 0.00 0.13 0.00 0.00 42.46 39.98 5bca s ILE 46 CO -0.02 0.52 0.29 -0.89 -1.91 0.00 0.00 174.94 172.93 5bca s THR 47 N 0.18 5.26 -0.03 4.00 2.01 0.40 -1.84 115.64 125.63 5bca s THR 47 Ca -0.03 0.55 -0.06 0.00 0.31 0.00 0.00 61.69 62.47 5bca s THR 47 Cb -0.14 -3.58 0.01 0.00 0.01 0.00 0.00 72.50 68.79 5bca s THR 47 CO 0.03 0.56 0.13 0.54 -0.69 0.00 0.00 174.62 175.19 5bca s VAL 48 N -0.80 0.04 0.12 3.82 0.11 -0.48 -0.45 120.40 122.76 5bca s VAL 48 Ca 0.19 -0.34 -0.18 0.00 -2.93 0.00 0.00 61.98 58.72 5bca s VAL 48 Cb -0.14 -0.30 -0.07 0.00 -1.53 0.00 0.00 36.38 34.34 5bca s VAL 48 CO 0.08 -0.19 0.60 -1.81 -3.33 0.00 0.00 175.10 170.45 5bca s ASP 49 N -0.62 7.01 -0.24 3.54 1.01 -1.26 -0.36 116.67 125.75 5bca s ASP 49 Ca -0.07 1.25 0.01 0.00 0.71 0.00 0.00 52.55 54.45 5bca s ASP 49 Cb -0.04 -2.36 0.06 0.00 1.01 0.00 0.00 42.92 41.59 5bca s ASP 49 CO 0.01 0.19 -0.06 -0.36 0.21 0.00 0.00 175.17 175.16 5bca s PHE 50 N -1.28 2.49 0.19 4.23 0.08 -0.93 -4.89 117.98 117.88 5bca s PHE 50 Ca 0.34 -1.83 -0.30 0.00 0.12 0.00 0.00 56.93 55.26 5bca s PHE 50 Cb -0.18 -1.64 -0.08 0.00 -0.57 0.00 0.00 43.02 40.56 5bca s PHE 50 CO 0.20 -0.79 1.07 -1.58 -0.10 0.00 0.00 175.22 174.01 5bca s TRP 51 N 1.36 3.66 0.25 0.36 0.52 -1.26 -2.00 118.94 121.83 5bca s TRP 51 Ca -0.06 1.67 -0.04 0.00 0.02 0.00 0.00 56.10 57.70 5bca s TRP 51 Cb -0.19 -3.22 0.39 0.00 -1.15 0.00 0.00 33.47 29.31 5bca s TRP 51 CO -0.06 -0.38 1.82 2.35 0.02 0.00 0.00 176.95 180.70 5bca h TRP 52 N 4.86 0.91 0.00 -1.98 7.01 -1.40 -1.38 115.95 123.97 5bca h TRP 52 Ca -0.45 0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.58 5bca h TRP 52 Cb 1.21 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.99 5bca h TRP 52 CO 0.62 0.39 0.00 0.41 -2.79 0.00 0.00 178.44 177.07 5bca n GLY 53 N -1.32 -1.12 0.11 2.65 0.00 -1.25 -0.79 105.19 103.46 5bca n GLY 53 Ca 0.14 0.10 -0.14 0.00 0.00 0.00 0.00 46.02 46.12 5bca n GLY 53 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 5bca n ASP 54 N -2.15 1.27 0.05 1.61 8.00 -0.59 -4.23 116.55 120.51 5bca n ASP 54 Ca 0.01 0.26 -0.14 0.00 0.71 0.00 0.00 54.79 55.63 5bca n ASP 54 Cb 0.16 -0.23 -0.14 0.00 -0.02 0.00 0.00 41.12 40.90 5bca n ASP 54 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 5bca h MET 55 N 0.02 0.16 -0.98 -1.24 2.86 -0.54 -3.41 114.93 111.80 5bca h MET 55 Ca -0.38 -0.28 -0.39 0.00 -2.06 0.00 0.00 59.70 56.59 5bca h MET 55 Cb 2.04 0.10 -0.40 0.00 0.06 0.00 0.00 31.60 33.40 5bca h MET 55 CO 0.06 0.99 -1.09 -1.91 1.06 0.00 0.00 176.91 176.03 5bca n GLU 56 N -3.37 1.75 0.23 1.72 2.13 0.03 -0.79 120.64 122.35 5bca n GLU 56 Ca -0.14 -3.55 -0.15 0.00 0.66 0.00 0.00 57.16 53.98 5bca n GLU 56 Cb 1.03 -1.52 -0.08 0.00 0.27 0.00 0.00 31.44 31.13 5bca n GLU 56 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 5bca h LYS 57 N 2.82 -0.53 0.00 5.31 3.64 -1.73 -3.33 116.57 122.74 5bca h LYS 57 Ca -0.02 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 5bca h LYS 57 Cb 1.17 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 5bca h LYS 57 CO 0.52 -0.31 0.00 -0.91 -2.27 0.00 0.00 179.45 176.48 5bca h ASN 58 N -0.65 0.00 0.00 4.20 -0.26 -1.93 -3.44 115.58 113.50 5bca h ASN 58 Ca -0.06 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.68 5bca h ASN 58 Cb 0.48 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.74 5bca h ASN 58 CO 0.09 0.00 0.00 0.61 -1.06 0.00 0.00 177.43 177.07 5bca n GLY 59 N 0.69 1.26 3.68 2.83 0.00 -1.25 -5.01 105.19 107.38 5bca n GLY 59 Ca 0.03 -1.05 -0.49 0.00 0.00 0.00 0.00 46.02 44.51 5bca n GLY 59 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 5bca n ASP 60 N 0.00 3.31 -0.74 1.61 2.03 -1.26 -1.97 116.55 119.52 5bca n ASP 60 Ca 0.00 0.99 -0.09 0.00 0.52 0.00 0.00 54.79 56.20 5bca n ASP 60 Cb 0.00 -1.34 -0.04 0.00 -0.72 0.00 0.00 41.12 39.02 5bca n ASP 60 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 5bca n GLN 61 N 6.38 -0.66 -3.50 -0.67 1.13 -1.26 -4.97 117.38 113.83 5bca n GLN 61 Ca 0.23 0.81 -0.42 0.00 -1.94 0.00 0.00 57.00 55.68 5bca n GLN 61 Cb 0.27 -4.72 -0.05 0.00 0.11 0.00 0.00 30.24 25.86 5bca n GLN 61 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 5bca s GLN 62 N -2.89 3.20 0.16 -1.09 -0.21 -0.83 -5.05 119.66 112.95 5bca s GLN 62 Ca 0.00 -2.56 -0.14 0.00 0.02 0.00 0.00 55.36 52.68 5bca s GLN 62 Cb 0.00 -4.13 -0.07 0.00 1.00 0.00 0.00 33.01 29.81 5bca s GLN 62 CO 0.00 -1.24 0.55 -0.06 -2.12 0.00 0.00 175.29 172.42 5bca s PHE 63 N -0.07 3.59 -0.18 0.91 0.08 -1.26 -4.04 117.98 117.01 5bca s PHE 63 Ca 0.19 1.05 -0.04 0.00 0.12 0.00 0.00 56.93 58.24 5bca s PHE 63 Cb -0.14 -2.36 0.06 0.00 -0.57 0.00 0.00 43.02 40.01 5bca s PHE 63 CO -0.07 0.41 0.07 0.34 -0.10 0.00 0.00 175.22 175.88 5bca s ASP 64 N -1.78 2.50 0.00 1.36 2.15 0.03 -4.99 116.67 115.94 5bca s ASP 64 Ca 0.39 -0.67 0.08 0.00 0.43 0.00 0.00 52.55 52.79 5bca s ASP 64 Cb -0.15 -0.35 0.22 0.00 -0.30 0.00 0.00 42.92 42.35 5bca s ASP 64 CO 0.19 -0.34 1.16 0.49 -0.17 0.00 0.00 175.17 176.51 5bca n PHE 65 N 5.21 0.33 -0.25 -5.34 3.72 -1.26 -4.35 117.46 115.51 5bca n PHE 65 Ca -0.08 -0.46 0.08 0.00 -0.05 0.00 0.00 57.45 56.95 5bca n PHE 65 Cb 0.48 -0.03 0.33 0.00 -0.94 0.00 0.00 39.48 39.33 5bca n PHE 65 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 5bca h SER 66 N 1.58 0.72 -0.19 4.37 4.64 -1.97 -0.69 113.55 122.01 5bca h SER 66 Ca 0.00 0.02 -0.16 0.00 -0.47 0.00 0.00 61.79 61.18 5bca h SER 66 Cb 0.65 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 5bca h SER 66 CO 0.00 0.43 -0.52 0.22 -0.87 0.00 0.00 176.83 176.09 5bca h TYR 67 N 0.80 0.89 -0.50 4.77 3.20 -1.98 -1.58 116.97 122.56 5bca h TYR 67 Ca 0.39 -0.35 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 5bca h TYR 67 Cb 0.43 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 5bca h TYR 67 CO -0.00 1.14 0.09 0.00 -1.64 0.00 0.00 178.16 177.75 5bca h ALA 68 N 0.58 1.22 -0.32 1.82 0.00 -1.80 0.13 119.26 120.89 5bca h ALA 68 Ca -0.01 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.57 5bca h ALA 68 Cb 1.13 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 5bca h ALA 68 CO 0.11 0.53 -0.25 1.96 0.00 0.00 0.00 179.25 181.60 5bca h GLN 69 N 0.74 0.74 -0.63 0.00 4.20 -1.14 0.12 115.11 119.15 5bca h GLN 69 Ca 0.16 -0.36 -0.06 0.00 0.06 0.00 0.00 58.65 58.45 5bca h GLN 69 Cb 0.32 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 5bca h GLN 69 CO 0.00 0.98 0.16 -0.09 -0.67 0.00 0.00 178.83 179.22 5bca h ARG 70 N 0.50 0.98 -0.22 1.46 9.65 -0.67 -0.71 114.38 125.37 5bca h ARG 70 Ca 0.06 -0.21 -0.03 0.00 -1.10 0.00 0.00 59.98 58.70 5bca h ARG 70 Cb 0.81 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.24 5bca h ARG 70 CO 0.07 0.86 0.03 0.35 2.80 0.00 0.00 179.97 184.07 5bca h PHE 71 N 0.94 0.39 -0.96 2.20 3.04 -0.61 -2.46 116.94 119.48 5bca h PHE 71 Ca 0.20 -0.06 0.01 0.00 3.98 0.00 0.00 57.97 62.10 5bca h PHE 71 Cb 0.32 -0.11 -0.05 0.00 2.56 0.00 0.00 35.95 38.68 5bca h PHE 71 CO 0.02 0.51 0.63 0.00 -2.02 0.00 0.00 178.31 177.45 5bca h ALA 72 N 0.83 1.21 -0.64 2.41 0.00 -0.27 -1.98 119.26 120.83 5bca h ALA 72 Ca 0.07 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.95 5bca h ALA 72 Cb 0.34 -0.39 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 5bca h ALA 72 CO 0.01 0.62 0.36 0.37 0.00 0.00 0.00 179.25 180.61 5bca h GLN 73 N 1.30 0.67 -0.33 0.00 5.75 -0.81 0.16 115.11 121.85 5bca h GLN 73 Ca 0.35 -0.04 -0.14 0.00 -0.15 0.00 0.00 58.65 58.67 5bca h GLN 73 Cb -0.14 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.25 5bca h GLN 73 CO -0.07 0.44 -0.34 0.77 -2.65 0.00 0.00 178.83 176.98 5bca h SER 74 N 0.69 0.79 -0.78 -0.69 0.02 -0.95 -0.91 113.55 111.72 5bca h SER 74 Ca 0.27 -0.33 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 5bca h SER 74 Cb 0.12 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.41 5bca h SER 74 CO -0.15 1.06 0.48 0.58 -1.14 0.00 0.00 176.83 177.66 5bca h VAL 75 N 0.63 1.22 -0.25 2.27 2.07 -0.88 -0.57 116.25 120.74 5bca h VAL 75 Ca 0.06 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 5bca h VAL 75 Cb 0.88 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 5bca h VAL 75 CO 0.08 0.22 0.13 0.50 0.02 0.00 0.00 177.57 178.52 5bca h LYS 76 N 1.07 0.35 -0.05 1.57 3.64 -0.14 -0.81 116.57 122.19 5bca h LYS 76 Ca 0.28 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.63 5bca h LYS 76 Cb -0.06 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.70 5bca h LYS 76 CO -0.05 0.34 0.06 -0.91 -2.27 0.00 0.00 179.45 176.62 5bca h ASN 77 N 0.28 0.00 0.39 4.20 2.35 -0.63 -1.69 115.58 120.49 5bca h ASN 77 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 5bca h ASN 77 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 5bca h ASN 77 CO -0.01 0.00 -0.24 0.00 -1.65 0.00 0.00 177.43 175.53 5bca n ALA 78 N -2.31 3.01 -1.78 -0.83 0.00 -0.27 -4.92 120.51 113.41 5bca n ALA 78 Ca -0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 53.44 53.09 5bca n ALA 78 Cb 0.15 -1.22 -0.00 0.00 0.00 0.00 0.00 19.45 18.38 5bca n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5bca n GLY 79 N 1.37 0.36 3.58 0.00 0.00 -0.63 -4.60 105.19 105.26 5bca n GLY 79 Ca 0.11 -0.91 -0.26 0.00 0.00 0.00 0.00 46.02 44.96 5bca n GLY 79 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 5bca n MET 80 N -1.51 0.74 -4.52 1.61 2.81 -0.99 -5.06 117.12 110.19 5bca n MET 80 Ca -0.01 -3.33 -0.26 0.00 -1.81 0.00 0.00 57.70 52.29 5bca n MET 80 Cb 0.40 0.49 -0.10 0.00 -0.71 0.00 0.00 33.22 33.29 5bca n MET 80 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 5bca s LYS 81 N -4.05 1.91 0.11 0.03 -0.14 -1.22 -4.55 119.74 111.83 5bca s LYS 81 Ca 0.23 -1.96 0.01 0.00 -1.36 0.00 0.00 55.97 52.89 5bca s LYS 81 Cb -0.02 -1.73 -0.04 0.00 -1.68 0.00 0.00 37.83 34.36 5bca s LYS 81 CO 0.14 0.08 -0.03 0.00 -0.76 0.00 0.00 175.35 174.79 5bca s MET 82 N -3.66 0.87 -0.30 1.68 0.23 0.59 -1.47 119.30 117.24 5bca s MET 82 Ca 0.34 -1.37 -0.02 0.00 -1.03 0.00 0.00 55.69 53.60 5bca s MET 82 Cb 0.04 -0.08 0.10 0.00 -1.53 0.00 0.00 34.83 33.36 5bca s MET 82 CO 0.17 -0.09 0.11 0.42 -2.03 0.00 0.00 175.02 173.60 5bca s ILE 83 N -3.75 0.45 0.55 3.16 1.01 -0.77 -1.65 121.20 120.20 5bca s ILE 83 Ca 0.15 -1.10 -0.19 0.00 0.00 0.00 0.00 60.65 59.52 5bca s ILE 83 Cb 0.06 -1.35 -0.06 0.00 0.01 0.00 0.00 42.46 41.13 5bca s ILE 83 CO -0.03 -0.69 1.09 -2.16 0.00 0.00 0.00 174.94 173.16 5bca s PRO 84 N 1.83 3.39 -0.12 2.79 0.04 -1.25 -1.38 135.00 140.31 5bca s PRO 84 Ca 0.09 1.47 -0.01 0.00 0.04 0.00 0.00 61.00 62.59 5bca s PRO 84 Cb -0.17 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 5bca s PRO 84 CO -0.30 -0.79 -0.07 0.42 0.04 0.00 0.00 177.00 176.30 5bca s ILE 85 N -1.98 3.60 -0.99 0.56 1.01 0.51 -1.78 121.20 122.13 5bca s ILE 85 Ca 0.69 -0.48 -0.14 0.00 0.00 0.00 0.00 60.65 60.72 5bca s ILE 85 Cb -0.21 -2.52 0.19 0.00 0.01 0.00 0.00 42.46 39.93 5bca s ILE 85 CO 0.28 0.54 1.08 -0.63 0.00 0.00 0.00 174.94 176.21 5bca s ILE 86 N -0.06 5.30 -0.94 2.92 1.01 -0.43 -2.18 121.20 126.81 5bca s ILE 86 Ca 0.00 -2.41 -0.23 0.00 0.00 0.00 0.00 60.65 58.01 5bca s ILE 86 Cb -0.13 -4.68 0.06 0.00 0.01 0.00 0.00 42.46 37.71 5bca s ILE 86 CO 0.03 -1.33 1.36 -0.44 0.00 0.00 0.00 174.94 174.56 5bca s SER 87 N 2.59 6.44 -0.12 3.58 0.01 -0.85 -3.26 113.70 122.10 5bca s SER 87 Ca 0.30 -1.33 0.04 0.00 1.31 0.00 0.00 55.95 56.27 5bca s SER 87 Cb -0.07 -2.54 0.29 0.00 0.21 0.00 0.00 66.02 63.92 5bca s SER 87 CO -0.07 -1.51 1.10 0.35 0.41 0.00 0.00 173.24 173.52 5bca n THR 88 N 6.58 1.31 -4.56 1.44 -2.24 -1.26 -1.09 114.28 114.45 5bca n THR 88 Ca 0.25 -0.60 -0.26 0.00 -2.27 0.00 0.00 64.05 61.17 5bca n THR 88 Cb 0.50 -0.54 -0.10 0.00 -2.10 0.00 0.00 70.33 68.09 5bca n THR 88 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 5bca s HIS 89 N -1.54 2.17 0.20 4.78 -3.43 -1.26 -4.56 115.29 111.66 5bca s HIS 89 Ca 0.21 -0.86 -0.30 0.00 -0.80 0.00 0.00 55.06 53.31 5bca s HIS 89 Cb 0.17 -1.52 -0.08 0.00 -1.43 0.00 0.00 32.58 29.71 5bca s HIS 89 CO 0.05 0.20 1.25 -1.14 -2.00 0.00 0.00 174.74 173.10 5bca s GLN 90 N -3.80 4.44 -0.22 -0.38 0.74 0.05 -4.73 119.66 115.76 5bca s GLN 90 Ca 0.31 1.97 -0.16 0.00 0.05 0.00 0.00 55.36 57.54 5bca s GLN 90 Cb 0.08 -3.21 -0.04 0.00 1.10 0.00 0.00 33.01 30.94 5bca s GLN 90 CO 0.15 -0.16 0.40 0.00 -0.55 0.00 0.00 175.29 175.13 5bca n GLY 92 N 4.11 2.07 0.00 0.00 0.00 -1.26 -0.61 105.19 109.50 5bca n GLY 92 Ca -0.08 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.39 5bca n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5bca n GLY 93 N 0.00 2.99 3.62 -0.02 0.00 -1.07 -4.86 105.19 105.85 5bca n GLY 93 Ca 0.00 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 5bca n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 5bca s ASN 94 N 0.00 2.40 0.09 1.61 0.01 -1.26 -4.88 114.94 112.90 5bca s ASN 94 Ca 0.00 1.71 -0.31 0.00 -0.71 0.00 0.00 52.86 53.55 5bca s ASN 94 Cb 0.00 -2.34 -0.07 0.00 0.41 0.00 0.00 41.25 39.25 5bca s ASN 94 CO 0.00 -3.35 1.31 0.68 -1.51 0.00 0.00 177.10 174.23 5bca s VAL 95 N -2.68 3.63 0.00 1.60 -7.23 -1.26 -2.00 120.40 112.46 5bca s VAL 95 Ca 0.66 1.17 0.00 0.00 -1.81 0.00 0.00 61.98 62.00 5bca s VAL 95 Cb -0.22 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 32.97 5bca s VAL 95 CO 0.60 0.09 0.00 0.61 -0.31 0.00 0.00 175.10 176.09 5bca n GLY 96 N 3.38 3.00 3.51 2.32 0.00 -1.26 -5.05 105.19 111.09 5bca n GLY 96 Ca 0.10 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 5bca n GLY 96 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 5bca n ASP 97 N 0.34 -0.04 -0.08 1.61 8.00 -0.85 -4.88 116.55 120.66 5bca n ASP 97 Ca 0.00 0.99 0.15 0.00 0.71 0.00 0.00 54.79 56.64 5bca n ASP 97 Cb 0.00 -1.19 0.71 0.00 -0.02 0.00 0.00 41.12 40.62 5bca n ASP 97 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 5bca n ASP 98 N 1.10 0.29 -3.93 -2.24 9.92 -1.26 -4.82 116.55 115.61 5bca n ASP 98 Ca 0.11 -0.56 -0.09 0.00 -0.53 0.00 0.00 54.79 53.72 5bca n ASP 98 Cb 0.37 -0.12 -0.07 0.00 -0.64 0.00 0.00 41.12 40.66 5bca n ASP 98 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 5bca s ASN 100 N -2.94 1.23 -0.35 0.00 2.47 -1.24 -2.59 114.94 111.52 5bca s ASN 100 Ca 0.14 -1.01 -0.00 0.00 0.42 0.00 0.00 52.86 52.41 5bca s ASN 100 Cb 0.04 0.65 0.14 0.00 -1.45 0.00 0.00 41.25 40.62 5bca s ASN 100 CO -0.02 -0.33 0.20 -0.69 -3.72 0.00 0.00 177.10 172.54 5bca s VAL 101 N 2.03 0.14 0.97 -5.21 1.01 0.22 -4.90 120.40 114.67 5bca s VAL 101 Ca 0.12 -1.65 -0.13 0.00 0.00 0.00 0.00 61.98 60.33 5bca s VAL 101 Cb -0.14 -1.12 0.17 0.00 0.00 0.00 0.00 36.38 35.29 5bca s VAL 101 CO -0.21 -0.97 1.12 -2.16 0.00 0.00 0.00 175.10 172.88 5bca s PRO 102 N 1.14 0.62 0.44 2.72 0.04 -1.26 -1.24 135.00 137.46 5bca s PRO 102 Ca 0.17 0.32 -0.25 0.00 0.04 0.00 0.00 61.00 61.28 5bca s PRO 102 Cb -0.23 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.46 5bca s PRO 102 CO -0.02 -2.55 1.33 0.42 0.04 0.00 0.00 177.00 176.22 5bca s ILE 103 N -3.15 2.45 -0.05 0.56 -1.09 -1.26 -3.89 121.20 114.76 5bca s ILE 103 Ca 0.65 0.39 -0.37 0.00 -2.23 0.00 0.00 60.65 59.09 5bca s ILE 103 Cb -0.16 -3.22 -0.16 0.00 -1.58 0.00 0.00 42.46 37.35 5bca s ILE 103 CO 0.55 0.04 1.55 -2.65 -1.23 0.00 0.00 174.94 173.21 5bca n PRO 104 N -0.14 1.33 0.29 2.79 -0.02 -1.26 -4.83 135.00 133.16 5bca n PRO 104 Ca 0.05 0.48 0.17 0.00 -2.02 0.00 0.00 63.50 62.18 5bca n PRO 104 Cb 0.44 -2.17 0.86 0.00 -0.02 0.00 0.00 33.50 32.60 5bca n PRO 104 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 5bca h SER 105 N 6.02 0.00 0.87 2.55 4.64 -1.90 -2.20 113.55 123.52 5bca h SER 105 Ca -0.47 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.81 5bca h SER 105 Cb 1.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 5bca h SER 105 CO 0.87 0.05 -0.20 4.11 -0.87 0.00 0.00 176.83 180.79 5bca h TRP 106 N 0.00 0.00 -0.82 4.77 5.08 -1.88 -3.16 115.95 119.94 5bca h TRP 106 Ca -0.00 0.00 0.12 0.00 1.08 0.00 0.00 58.89 60.09 5bca h TRP 106 Cb 0.28 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.38 5bca h TRP 106 CO 0.00 0.20 0.54 0.28 -1.28 0.00 0.00 178.44 178.18 5bca h VAL 107 N 0.00 0.88 0.00 0.12 2.07 -1.76 -2.73 116.25 114.83 5bca h VAL 107 Ca -0.00 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 5bca h VAL 107 Cb 0.69 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 5bca h VAL 107 CO 0.03 0.12 -0.08 -0.50 0.02 0.00 0.00 177.57 177.16 5bca h TRP 108 N 0.66 0.00 0.00 1.57 4.06 -1.76 -2.37 115.95 118.11 5bca h TRP 108 Ca 0.40 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.35 5bca h TRP 108 Cb 0.63 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.79 5bca h TRP 108 CO -0.00 0.08 0.00 0.09 -3.56 0.00 0.00 178.44 175.04 5bca n ASN 109 N -3.24 0.00 0.18 -3.49 3.02 -1.03 -3.02 115.26 107.68 5bca n ASN 109 Ca -0.00 0.03 0.14 0.00 -0.03 0.00 0.00 54.58 54.71 5bca n ASN 109 Cb 0.31 -0.29 0.48 0.00 -0.61 0.00 0.00 39.78 39.68 5bca n ASN 109 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 5bca h GLN 110 N 0.00 0.00 -5.14 3.52 4.20 -1.58 -3.44 115.11 112.66 5bca h GLN 110 Ca 0.00 0.00 -0.40 0.00 0.06 0.00 0.00 58.65 58.31 5bca h GLN 110 Cb 0.17 0.00 -0.24 0.00 0.30 0.00 0.00 27.48 27.72 5bca h GLN 110 CO 0.00 0.00 -0.78 0.15 -0.67 0.00 0.00 178.83 177.53 5bca s LYS 111 N -3.35 0.81 0.00 1.46 -0.14 -1.17 -5.02 119.74 112.32 5bca s LYS 111 Ca 0.05 -0.77 0.14 0.00 -1.36 0.00 0.00 55.97 54.04 5bca s LYS 111 Cb 0.09 -0.78 0.08 0.00 -1.68 0.00 0.00 37.83 35.55 5bca s LYS 111 CO 0.51 0.18 0.91 -1.13 -0.76 0.00 0.00 175.35 175.07 5bca n SER 112 N 1.75 2.02 -1.16 2.83 3.41 -1.26 -4.96 113.62 116.23 5bca n SER 112 Ca -0.19 -1.51 0.00 0.00 -0.26 0.00 0.00 58.87 56.91 5bca n SER 112 Cb 0.55 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 5bca n SER 112 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 5bca n ASP 113 N 0.56 0.00 -1.88 4.04 5.68 -1.26 -5.00 116.55 118.69 5bca n ASP 113 Ca 0.08 -0.48 -0.05 0.00 -0.50 0.00 0.00 54.79 53.84 5bca n ASP 113 Cb 0.34 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 40.63 5bca n ASP 113 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 5bca n ASP 114 N -1.45 4.68 0.24 -1.12 5.68 -1.26 -4.71 116.55 118.61 5bca n ASP 114 Ca 0.00 -3.24 0.11 0.00 -0.50 0.00 0.00 54.79 51.16 5bca n ASP 114 Cb 0.00 -0.73 0.62 0.00 -1.14 0.00 0.00 41.12 39.87 5bca n ASP 114 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 5bca h SER 115 N 2.55 0.00 0.74 -1.12 4.64 -1.95 -3.15 113.55 115.25 5bca h SER 115 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 5bca h SER 115 Cb 2.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.33 5bca h SER 115 CO 0.68 0.18 -0.67 0.18 -0.87 0.00 0.00 176.83 176.33 5bca n LEU 116 N -3.65 0.65 0.00 5.97 4.77 -1.26 -4.22 117.00 119.26 5bca n LEU 116 Ca -0.01 0.16 -0.12 0.00 -0.03 0.00 0.00 56.01 56.00 5bca n LEU 116 Cb 0.30 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 5bca n LEU 116 CO 0.32 -0.01 -0.08 0.00 -1.33 0.00 0.00 177.39 176.28 5bca n TYR 117 N -1.99 0.35 -4.30 -1.77 0.18 -1.19 -1.20 117.16 107.24 5bca n TYR 117 Ca 0.03 -0.96 -0.30 0.00 1.88 0.00 0.00 57.90 58.55 5bca n TYR 117 Cb 0.42 -0.10 -0.10 0.00 -0.38 0.00 0.00 39.34 39.19 5bca n TYR 117 CO 0.00 0.00 0.00 -0.06 -2.08 0.00 0.00 176.86 174.72 5bca s PHE 118 N -1.79 2.81 -0.09 -3.48 0.08 -0.77 -4.71 117.98 110.03 5bca s PHE 118 Ca 0.02 -0.11 0.02 0.00 0.12 0.00 0.00 56.93 56.97 5bca s PHE 118 Cb 0.00 -1.50 0.01 0.00 -0.57 0.00 0.00 43.02 40.97 5bca s PHE 118 CO 0.01 0.41 -0.13 0.21 -0.10 0.00 0.00 175.22 175.62 5bca s LYS 119 N -1.98 1.93 0.77 0.44 2.20 -1.26 0.52 119.74 122.37 5bca s LYS 119 Ca 0.21 -0.47 -0.08 0.00 -0.36 0.00 0.00 55.97 55.27 5bca s LYS 119 Cb -0.11 -1.64 0.11 0.00 -1.51 0.00 0.00 37.83 34.67 5bca s LYS 119 CO 0.12 -0.04 1.09 -1.54 -0.36 0.00 0.00 175.35 174.63 5bca s SER 120 N 0.90 4.30 0.39 1.43 1.04 0.13 -1.59 113.70 120.30 5bca s SER 120 Ca -0.09 0.26 0.13 0.00 0.48 0.00 0.00 55.95 56.73 5bca s SER 120 Cb -0.15 -0.71 0.96 0.00 0.10 0.00 0.00 66.02 66.22 5bca s SER 120 CO 0.00 -1.94 1.86 -0.33 0.98 0.00 0.00 173.24 173.82 5bca h GLU 121 N -0.86 0.52 -0.42 4.02 5.08 -1.83 -0.95 114.58 120.14 5bca h GLU 121 Ca -0.43 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 5bca h GLU 121 Cb 1.29 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.42 5bca h GLU 121 CO 0.51 0.35 0.00 0.25 -1.00 0.00 0.00 179.01 179.12 5bca n THR 122 N -4.55 0.55 0.00 1.13 -2.24 -1.26 -4.97 114.28 102.94 5bca n THR 122 Ca 0.19 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 5bca n THR 122 Cb 0.59 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 5bca n THR 122 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 5bca n GLY 123 N 1.45 0.12 3.77 3.38 0.00 -0.36 -5.05 105.19 108.49 5bca n GLY 123 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 5bca n GLY 123 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5bca s THR 124 N -2.00 2.54 -0.13 2.61 2.01 -1.26 -4.62 115.64 114.79 5bca s THR 124 Ca 0.00 0.53 -0.10 0.00 0.31 0.00 0.00 61.69 62.43 5bca s THR 124 Cb 0.00 -3.33 -0.05 0.00 0.01 0.00 0.00 72.50 69.13 5bca s THR 124 CO 0.00 0.12 0.20 -0.69 -0.69 0.00 0.00 174.62 173.56 5bca s VAL 125 N -0.92 5.39 -0.07 3.82 1.01 -1.25 0.19 120.40 128.56 5bca s VAL 125 Ca 0.52 0.35 0.05 0.00 0.00 0.00 0.00 61.98 62.90 5bca s VAL 125 Cb -0.42 -3.50 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 5bca s VAL 125 CO 0.54 0.53 -0.23 0.21 0.00 0.00 0.00 175.10 176.15 5bca s ASN 126 N -0.46 2.87 -0.16 3.32 3.84 0.19 -4.95 114.94 119.58 5bca s ASN 126 Ca 0.15 -0.49 0.17 0.00 0.21 0.00 0.00 52.86 52.90 5bca s ASN 126 Cb -0.13 -0.97 0.45 0.00 -0.55 0.00 0.00 41.25 40.05 5bca s ASN 126 CO 0.04 0.19 1.18 0.29 -2.79 0.00 0.00 177.10 176.01 5bca n LYS 127 N 3.19 1.44 0.00 0.43 5.02 -1.26 -1.85 118.16 125.13 5bca n LYS 127 Ca -0.18 -3.06 0.14 0.00 -2.02 0.00 0.00 58.31 53.19 5bca n LYS 127 Cb 0.52 -1.20 0.56 0.00 -0.02 0.00 0.00 35.03 34.90 5bca n LYS 127 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 5bca n GLU 128 N -0.43 1.24 -3.49 1.97 0.28 -1.26 -4.85 120.64 114.09 5bca n GLU 128 Ca 0.17 -0.62 -0.09 0.00 -0.16 0.00 0.00 57.16 56.46 5bca n GLU 128 Cb 0.91 -1.49 -0.02 0.00 1.43 0.00 0.00 31.44 32.27 5bca n GLU 128 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 177.13 176.89 5bca s THR 129 N -2.19 0.00 0.51 3.84 -1.32 -1.26 -0.77 115.64 114.44 5bca s THR 129 Ca 0.35 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.64 5bca s THR 129 Cb 0.21 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 70.12 5bca s THR 129 CO 0.40 0.00 1.04 -0.76 -2.21 0.00 0.00 174.62 173.09 5bca s LEU 130 N -2.46 3.78 -0.03 9.08 1.43 -1.26 -4.89 118.68 124.33 5bca s LEU 130 Ca 0.04 1.89 -0.30 0.00 -1.03 0.00 0.00 54.13 54.73 5bca s LEU 130 Cb -0.01 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.61 5bca s LEU 130 CO -0.09 -0.83 1.36 0.21 0.23 0.00 0.00 176.35 177.22 5bca s ASN 131 N -2.18 6.89 0.00 2.29 3.84 -0.34 -4.85 114.94 120.59 5bca s ASN 131 Ca 0.66 2.02 0.02 0.00 0.21 0.00 0.00 52.86 55.77 5bca s ASN 131 Cb -0.16 -2.56 0.13 0.00 -0.55 0.00 0.00 41.25 38.11 5bca s ASN 131 CO 0.23 -0.70 0.85 -0.81 -2.79 0.00 0.00 177.10 173.88 5bca n PRO 132 N 5.54 0.04 0.17 0.43 -0.04 -1.26 -1.21 135.00 138.67 5bca n PRO 132 Ca 0.13 0.23 0.04 0.00 -0.04 0.00 0.00 63.50 63.85 5bca n PRO 132 Cb 0.44 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.69 5bca n PRO 132 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 5bca h LEU 133 N 0.00 0.00 -4.43 1.53 3.38 -1.89 -3.35 115.31 110.55 5bca h LEU 133 Ca 0.00 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.58 5bca h LEU 133 Cb 0.02 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 5bca h LEU 133 CO 0.00 0.44 1.00 0.00 0.09 0.00 0.00 178.44 179.97 5bca n ALA 134 N -2.33 6.73 0.24 1.53 0.00 -0.35 -4.76 120.51 121.58 5bca n ALA 134 Ca -0.01 -2.58 0.11 0.00 0.00 0.00 0.00 53.44 50.97 5bca n ALA 134 Cb 0.54 -2.60 0.62 0.00 0.00 0.00 0.00 19.45 18.01 5bca n ALA 134 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 5bca h SER 135 N 3.62 0.00 -0.68 0.00 4.64 -1.83 -1.69 113.55 117.62 5bca h SER 135 Ca 0.43 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.68 5bca h SER 135 Cb 1.02 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.08 5bca h SER 135 CO 0.80 0.17 0.16 -2.24 -0.87 0.00 0.00 176.83 174.86 5bca h ASP 136 N 0.00 1.03 -0.05 4.97 2.03 -1.95 -1.60 116.42 120.85 5bca h ASP 136 Ca -0.00 -0.23 -0.12 0.00 -0.73 0.00 0.00 57.03 55.94 5bca h ASP 136 Cb 0.45 -0.27 0.01 0.00 -0.83 0.00 0.00 39.33 38.69 5bca h ASP 136 CO 0.02 0.99 -0.46 0.58 -1.03 0.00 0.00 179.24 179.35 5bca h VAL 137 N 1.01 1.42 -0.32 4.15 2.07 -1.92 -2.86 116.25 119.81 5bca h VAL 137 Ca 0.21 -1.90 -0.01 0.00 0.82 0.00 0.00 66.70 65.82 5bca h VAL 137 Cb 0.37 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 5bca h VAL 137 CO 0.00 0.55 0.15 0.40 0.02 0.00 0.00 177.57 178.69 5bca h ILE 138 N -0.11 1.17 -0.52 4.57 1.08 -1.29 -2.00 117.51 120.40 5bca h ILE 138 Ca -0.04 -0.49 0.10 0.00 -0.39 0.00 0.00 64.86 64.04 5bca h ILE 138 Cb 1.14 0.89 -0.10 0.00 -3.07 0.00 0.00 36.82 35.68 5bca h ILE 138 CO 0.09 0.17 -0.15 -0.09 -0.69 0.00 0.00 178.15 177.49 5bca h ARG 139 N 0.38 -0.02 0.51 2.37 2.43 -1.35 0.13 114.38 118.83 5bca h ARG 139 Ca 0.11 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 5bca h ARG 139 Cb 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 5bca h ARG 139 CO -0.01 -0.01 -0.24 -0.22 -1.51 0.00 0.00 179.97 177.97 5bca h LYS 140 N -0.02 -0.66 -0.23 0.20 3.64 -1.41 0.75 116.57 118.85 5bca h LYS 140 Ca 0.25 0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.53 5bca h LYS 140 Cb 0.40 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 5bca h LYS 140 CO -0.55 -0.44 -0.45 0.93 -2.27 0.00 0.00 179.45 176.67 5bca h GLU 141 N -0.69 0.59 0.01 1.90 4.39 -1.33 -1.32 114.58 118.13 5bca h GLU 141 Ca -0.07 -0.32 -0.24 0.00 0.34 0.00 0.00 59.36 59.06 5bca h GLU 141 Cb 0.52 0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.20 5bca h GLU 141 CO 0.11 0.92 -1.00 1.88 -1.16 0.00 0.00 179.01 179.77 5bca h TYR 142 N 0.47 0.77 0.02 4.33 -1.99 -0.81 -2.27 116.97 117.50 5bca h TYR 142 Ca 0.03 -0.43 0.03 0.00 2.00 0.00 0.00 58.73 60.36 5bca h TYR 142 Cb 0.97 -0.09 -0.04 0.00 2.00 0.00 0.00 36.73 39.57 5bca h TYR 142 CO 0.04 1.26 -0.26 0.78 -0.00 0.00 0.00 178.16 179.98 5bca h GLY 143 N 0.92 -0.41 0.60 3.88 0.00 -0.79 -0.54 103.07 106.73 5bca h GLY 143 Ca -0.10 0.31 0.06 0.00 0.00 0.00 0.00 47.33 47.60 5bca h GLY 143 CO 0.18 -0.21 0.25 0.83 0.00 0.00 0.00 176.54 177.59 5bca h GLU 144 N -0.41 0.46 -0.25 4.80 5.08 -1.21 -1.84 114.58 121.21 5bca h GLU 144 Ca 0.06 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.26 5bca h GLU 144 Cb 0.49 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 5bca h GLU 144 CO -0.21 0.31 -0.34 1.25 -1.00 0.00 0.00 179.01 179.01 5bca h LEU 145 N 0.48 0.73 -0.74 1.33 5.85 -1.15 -2.18 115.31 119.63 5bca h LEU 145 Ca 0.26 -0.51 -0.06 0.00 0.84 0.00 0.00 57.88 58.41 5bca h LEU 145 Cb 0.22 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 5bca h LEU 145 CO -0.21 1.09 0.24 1.88 -0.34 0.00 0.00 178.44 181.10 5bca h TYR 146 N 0.39 1.19 -0.32 1.25 0.05 -0.91 -1.12 116.97 117.50 5bca h TYR 146 Ca 0.03 -0.12 -0.10 0.00 0.05 0.00 0.00 58.73 58.59 5bca h TYR 146 Cb 0.93 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 38.31 5bca h TYR 146 CO 0.08 0.93 -0.22 1.15 -1.05 0.00 0.00 178.16 179.06 5bca h THR 147 N 1.10 1.26 -0.09 -2.88 2.02 -1.30 0.63 112.91 113.64 5bca h THR 147 Ca 0.24 -1.26 -0.14 0.00 0.77 0.00 0.00 66.41 66.02 5bca h THR 147 Cb 0.30 1.25 0.01 0.00 -1.74 0.00 0.00 68.15 67.97 5bca h THR 147 CO -0.01 0.41 -0.49 0.00 0.37 0.00 0.00 175.52 175.80 5bca h ALA 148 N 1.22 0.19 -0.14 6.16 0.00 -1.18 -1.95 119.26 123.56 5bca h ALA 148 Ca 0.08 -0.50 0.03 0.00 0.00 0.00 0.00 54.91 54.52 5bca h ALA 148 Cb 0.67 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 5bca h ALA 148 CO 0.05 0.36 -0.04 0.35 0.00 0.00 0.00 179.25 179.97 5bca h PHE 149 N 0.08 -0.09 -0.86 0.00 3.57 -1.23 0.77 116.94 119.19 5bca h PHE 149 Ca -0.03 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.58 5bca h PHE 149 Cb 1.14 0.06 -0.07 0.00 2.79 0.00 0.00 35.95 39.86 5bca h PHE 149 CO 0.12 -0.07 0.50 0.00 -2.23 0.00 0.00 178.31 176.63 5bca h ALA 150 N 1.13 1.23 -0.42 2.41 0.00 -0.42 -0.75 119.26 122.44 5bca h ALA 150 Ca 0.07 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 5bca h ALA 150 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 5bca h ALA 150 CO -0.15 0.12 -0.15 0.00 0.00 0.00 0.00 179.25 179.07 5bca h ALA 151 N 1.47 0.94 0.00 0.00 0.00 -0.65 0.21 119.26 121.23 5bca h ALA 151 Ca 0.41 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 5bca h ALA 151 Cb 0.38 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 5bca h ALA 151 CO -0.25 0.61 -0.49 0.00 0.00 0.00 0.00 179.25 179.13 5bca h ALA 152 N 1.13 0.83 0.00 0.00 0.00 -0.56 -3.28 119.26 117.38 5bca h ALA 152 Ca 0.11 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.58 5bca h ALA 152 Cb 0.64 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.36 5bca h ALA 152 CO 0.05 0.61 -1.04 -1.33 0.00 0.00 0.00 179.25 177.53 5bca n MET 153 N -3.44 0.44 -0.17 0.00 2.81 -0.31 -4.51 117.12 111.94 5bca n MET 153 Ca 0.00 0.04 0.09 0.00 -1.81 0.00 0.00 57.70 56.02 5bca n MET 153 Cb 0.62 -1.69 0.18 0.00 -0.71 0.00 0.00 33.22 31.62 5bca n MET 153 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 5bca n LYS 154 N -2.28 -0.04 0.18 0.03 4.81 0.70 0.94 118.16 122.51 5bca n LYS 154 Ca 0.01 0.74 0.14 0.00 -0.87 0.00 0.00 58.31 58.32 5bca n LYS 154 Cb 0.49 -1.20 0.58 0.00 0.02 0.00 0.00 35.03 34.92 5bca n LYS 154 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 5bca h PRO 155 N 0.00 0.00 -0.22 1.64 0.11 -1.84 -2.78 132.00 128.91 5bca h PRO 155 Ca 0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.44 5bca h PRO 155 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 5bca h PRO 155 CO -0.45 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.00 5bca n TYR 156 N -2.51 0.75 0.21 0.65 4.01 0.27 -4.75 117.16 115.79 5bca n TYR 156 Ca 0.01 -0.88 0.18 0.00 -0.16 0.00 0.00 57.90 57.05 5bca n TYR 156 Cb 0.23 -0.27 0.84 0.00 -0.31 0.00 0.00 39.34 39.83 5bca n TYR 156 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 5bca h LYS 157 N 1.48 0.00 0.00 -0.72 2.10 -1.38 0.52 116.57 118.57 5bca h LYS 157 Ca 0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 5bca h LYS 157 Cb 1.33 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.66 5bca h LYS 157 CO 0.17 0.00 -0.06 0.38 -2.00 0.00 0.00 179.45 177.94 5bca h ASP 158 N 0.00 0.00 0.20 7.07 2.03 -1.87 -2.81 116.42 121.03 5bca h ASP 158 Ca 0.09 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.39 5bca h ASP 158 Cb 0.58 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.08 5bca h ASP 158 CO -0.00 0.06 -0.53 1.33 -1.03 0.00 0.00 179.24 179.07 5bca n VAL 159 N -3.18 0.00 -3.12 4.15 0.24 0.17 -4.92 118.33 111.68 5bca n VAL 159 Ca 0.01 -0.10 -0.41 0.00 -2.04 0.00 0.00 64.34 61.80 5bca n VAL 159 Cb 0.36 0.68 -0.07 0.00 -1.47 0.00 0.00 33.84 33.34 5bca n VAL 159 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 5bca s ILE 160 N -2.73 4.94 -0.07 1.34 1.01 -1.06 -0.30 121.20 124.32 5bca s ILE 160 Ca 0.16 0.86 0.21 0.00 0.00 0.00 0.00 60.65 61.88 5bca s ILE 160 Cb 0.18 -3.99 -0.31 0.00 0.01 0.00 0.00 42.46 38.34 5bca s ILE 160 CO 0.65 -0.13 0.37 0.00 0.00 0.00 0.00 174.94 175.84 5bca n ALA 161 N 5.86 2.47 -3.54 9.38 0.00 -0.66 -4.94 120.51 129.08 5bca n ALA 161 Ca -0.01 -0.72 -0.07 0.00 0.00 0.00 0.00 53.44 52.63 5bca n ALA 161 Cb 0.49 -0.60 -0.03 0.00 0.00 0.00 0.00 19.45 19.31 5bca n ALA 161 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 5bca s LYS 162 N -3.25 0.62 -0.08 0.00 2.20 -1.26 -4.37 119.74 113.60 5bca s LYS 162 Ca -0.08 -0.17 0.03 0.00 -0.36 0.00 0.00 55.97 55.39 5bca s LYS 162 Cb 0.12 0.29 0.01 0.00 -1.51 0.00 0.00 37.83 36.73 5bca s LYS 162 CO 0.88 -0.26 -0.18 0.42 -0.36 0.00 0.00 175.35 175.85 5bca s ILE 163 N -2.56 1.57 0.01 5.43 1.01 -0.86 -3.77 121.20 122.03 5bca s ILE 163 Ca 0.05 -0.74 0.00 0.00 0.00 0.00 0.00 60.65 59.97 5bca s ILE 163 Cb -0.01 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 5bca s ILE 163 CO -0.06 0.45 0.08 -0.31 0.00 0.00 0.00 174.94 175.10 5bca s TYR 164 N 0.48 3.26 0.19 3.97 2.02 -0.73 -2.22 117.35 124.32 5bca s TYR 164 Ca -0.16 0.18 0.06 0.00 -0.37 0.00 0.00 57.07 56.78 5bca s TYR 164 Cb -0.17 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.64 5bca s TYR 164 CO 0.06 0.54 0.10 -0.51 -1.57 0.00 0.00 175.55 174.17 5bca s LEU 165 N -1.80 3.64 -0.26 -1.29 1.43 -0.14 -1.31 118.68 118.94 5bca s LEU 165 Ca 0.23 -0.25 -0.18 0.00 -1.03 0.00 0.00 54.13 52.90 5bca s LEU 165 Cb -0.12 -2.24 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 5bca s LEU 165 CO 0.15 0.05 0.50 -0.55 0.23 0.00 0.00 176.35 176.72 5bca s SER 166 N -3.23 6.42 0.00 2.29 0.15 -1.20 -4.51 113.70 113.62 5bca s SER 166 Ca 0.30 0.50 0.20 0.00 0.70 0.00 0.00 55.95 57.65 5bca s SER 166 Cb -0.09 -2.27 0.53 0.00 -1.71 0.00 0.00 66.02 62.48 5bca s SER 166 CO 0.22 -0.26 1.44 0.61 1.20 0.00 0.00 173.24 176.45 5bca n GLY 167 N 4.39 2.40 0.00 9.45 0.00 -1.24 -4.77 105.19 115.42 5bca n GLY 167 Ca -0.05 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.29 5bca n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5bca n GLY 168 N 1.36 -0.58 3.68 -0.02 0.00 -0.81 -4.27 105.19 104.56 5bca n GLY 168 Ca 0.21 -0.70 -0.44 0.00 0.00 0.00 0.00 46.02 45.08 5bca n GLY 168 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 5bca n PRO 169 N 0.00 2.13 -1.49 1.61 -0.04 -1.23 -0.36 135.00 135.62 5bca n PRO 169 Ca 0.00 0.76 -0.17 0.00 -0.04 0.00 0.00 63.50 64.05 5bca n PRO 169 Cb 0.00 -2.43 -0.07 0.00 -0.04 0.00 0.00 33.50 30.95 5bca n PRO 169 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 5bca n ALA 170 N 1.93 -0.26 -0.79 0.55 0.00 -1.26 -1.51 120.51 119.16 5bca n ALA 170 Ca 0.11 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.83 5bca n ALA 170 Cb 0.32 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 17.94 5bca n ALA 170 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5bca n GLY 171 N -0.25 0.60 3.60 0.00 0.00 0.51 -5.05 105.19 104.61 5bca n GLY 171 Ca -0.17 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 5bca n GLY 171 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 5bca s GLU 172 N -0.24 2.47 -0.66 1.61 2.02 -0.57 -3.63 118.70 119.70 5bca s GLU 172 Ca 0.00 -0.80 -0.27 0.00 0.02 0.00 0.00 54.97 53.93 5bca s GLU 172 Cb 0.00 -2.47 0.03 0.00 0.10 0.00 0.00 34.13 31.80 5bca s GLU 172 CO 0.00 0.58 1.20 -1.17 0.02 0.00 0.00 175.26 175.89 5bca s LEU 173 N -1.67 3.43 0.07 1.80 2.96 0.99 -1.92 118.68 124.34 5bca s LEU 173 Ca 0.19 -0.28 -0.26 0.00 -0.22 0.00 0.00 54.13 53.56 5bca s LEU 173 Cb -0.11 -2.79 0.09 0.00 0.50 0.00 0.00 46.19 43.88 5bca s LEU 173 CO 0.10 -1.63 1.18 0.00 -1.32 0.00 0.00 176.35 174.67 5bca s ARG 174 N 5.19 0.80 0.10 1.98 1.70 -1.26 -4.63 118.95 122.84 5bca s ARG 174 Ca 0.37 -0.51 0.03 0.00 -0.47 0.00 0.00 55.73 55.15 5bca s ARG 174 Cb -0.09 0.22 -0.04 0.00 -0.57 0.00 0.00 34.95 34.48 5bca s ARG 174 CO 0.19 -0.37 0.11 0.71 -1.08 0.00 0.00 175.30 174.85 5bca s TYR 175 N -2.10 3.20 -1.42 5.89 2.02 -0.54 -4.54 117.35 119.85 5bca s TYR 175 Ca 0.26 0.06 -0.09 0.00 -0.37 0.00 0.00 57.07 56.92 5bca s TYR 175 Cb -0.01 -1.60 -0.07 0.00 -0.40 0.00 0.00 41.96 39.88 5bca s TYR 175 CO 0.02 0.52 2.68 -0.35 -1.57 0.00 0.00 175.55 176.85 5bca n PRO 176 N 0.20 3.19 0.04 -1.71 -0.04 -1.26 -4.62 135.00 130.79 5bca n PRO 176 Ca -0.08 -2.03 0.13 0.00 -0.04 0.00 0.00 63.50 61.48 5bca n PRO 176 Cb 0.52 -2.75 0.47 0.00 -0.04 0.00 0.00 33.50 31.71 5bca n PRO 176 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 5bca n SER 177 N 4.00 0.38 -4.00 3.54 3.41 -1.26 -4.52 113.62 115.17 5bca n SER 177 Ca 0.68 0.42 -0.31 0.00 -0.26 0.00 0.00 58.87 59.39 5bca n SER 177 Cb 0.22 -0.47 -0.15 0.00 -0.26 0.00 0.00 64.21 63.55 5bca n SER 177 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 5bca s TYR 178 N -3.05 3.56 0.03 7.33 1.13 -1.26 -2.77 117.35 122.32 5bca s TYR 178 Ca 0.12 -2.85 -0.09 0.00 -1.41 0.00 0.00 57.07 52.84 5bca s TYR 178 Cb 0.16 -2.75 0.00 0.00 -1.10 0.00 0.00 41.96 38.27 5bca s TYR 178 CO 0.59 -0.94 0.18 0.95 -2.51 0.00 0.00 175.55 173.82 5bca s THR 179 N 0.98 0.10 0.14 -3.49 -4.23 -1.25 -4.67 115.64 103.22 5bca s THR 179 Ca 0.09 -0.86 -0.14 0.00 -1.18 0.00 0.00 61.69 59.60 5bca s THR 179 Cb -0.19 -0.83 0.00 0.00 1.34 0.00 0.00 72.50 72.83 5bca s THR 179 CO -0.09 -0.48 1.63 0.74 -0.54 0.00 0.00 174.62 175.88 5bca h THR 180 N 3.61 1.24 -0.31 3.99 2.02 -1.94 0.43 112.91 121.94 5bca h THR 180 Ca -0.32 -0.85 -0.05 0.00 0.77 0.00 0.00 66.41 65.97 5bca h THR 180 Cb 1.19 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.52 5bca h THR 180 CO 0.47 0.30 -0.01 0.28 0.37 0.00 0.00 175.52 176.93 5bca h SER 181 N 0.59 0.45 0.23 4.18 0.02 -2.01 -1.24 113.55 115.78 5bca h SER 181 Ca 0.14 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 5bca h SER 181 Cb 0.35 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.77 5bca h SER 181 CO 0.00 0.53 -0.18 -0.67 -1.14 0.00 0.00 176.83 175.37 5bca n ASP 182 N -4.29 0.94 -1.09 3.07 2.03 -1.02 -4.91 116.55 111.28 5bca n ASP 182 Ca 0.01 -0.90 -0.07 0.00 0.52 0.00 0.00 54.79 54.35 5bca n ASP 182 Cb 0.24 0.06 0.01 0.00 -0.72 0.00 0.00 41.12 40.71 5bca n ASP 182 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 5bca n GLY 183 N 1.30 0.27 0.47 0.27 0.00 -0.47 -4.96 105.19 102.08 5bca n GLY 183 Ca 0.14 -0.50 0.07 0.00 0.00 0.00 0.00 46.02 45.72 5bca n GLY 183 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 5bca n THR 184 N -3.68 1.68 -1.20 2.61 -2.24 0.14 -4.96 114.28 106.63 5bca n THR 184 Ca -0.04 -2.37 -0.30 0.00 -2.27 0.00 0.00 64.05 59.07 5bca n THR 184 Cb 0.54 -0.05 0.13 0.00 -2.10 0.00 0.00 70.33 68.85 5bca n THR 184 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 5bca s GLY 185 N -2.78 1.63 0.36 3.38 0.00 -1.17 -3.92 107.32 104.82 5bca s GLY 185 Ca 0.32 -0.00 -0.25 0.00 0.00 0.00 0.00 44.72 44.78 5bca s GLY 185 CO -0.04 0.46 0.91 2.98 0.00 0.00 0.00 173.10 177.42 5bca n TYR 186 N -3.83 0.85 -1.42 1.90 4.19 -1.26 -1.69 117.16 115.89 5bca n TYR 186 Ca 0.07 0.64 -0.28 0.00 3.31 0.00 0.00 57.90 61.64 5bca n TYR 186 Cb 0.55 -2.18 0.11 0.00 0.49 0.00 0.00 39.34 38.30 5bca n TYR 186 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 5bca n PRO 187 N 0.48 2.63 -1.64 2.98 -0.04 -1.26 -5.15 135.00 133.00 5bca n PRO 187 Ca 0.10 -3.34 -0.30 0.00 -0.04 0.00 0.00 63.50 59.92 5bca n PRO 187 Cb 0.36 -2.21 0.21 0.00 -0.04 0.00 0.00 33.50 31.82 5bca n PRO 187 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 5bca s SER 188 N -2.04 2.18 0.62 3.54 0.01 -0.68 -4.62 113.70 112.70 5bca s SER 188 Ca 0.59 0.33 -0.15 0.00 1.31 0.00 0.00 55.95 58.03 5bca s SER 188 Cb 0.48 -0.39 -0.02 0.00 0.21 0.00 0.00 66.02 66.30 5bca s SER 188 CO 0.02 -3.32 1.07 0.00 0.41 0.00 0.00 173.24 171.43 5bca s ARG 189 N -5.77 3.15 0.58 12.44 1.70 -1.26 -4.72 118.95 125.07 5bca s ARG 189 Ca 0.74 1.23 0.01 0.00 -0.47 0.00 0.00 55.73 57.24 5bca s ARG 189 Cb -0.05 -2.01 0.05 0.00 -0.57 0.00 0.00 34.95 32.37 5bca s ARG 189 CO 0.54 -0.95 0.82 0.20 -1.08 0.00 0.00 175.30 174.83 5bca s GLY 190 N -2.82 1.81 -0.00 3.88 0.00 -0.89 -4.73 107.32 104.57 5bca s GLY 190 Ca 0.64 -1.34 0.01 0.00 0.00 0.00 0.00 44.72 44.03 5bca s GLY 190 CO 0.40 -1.02 -0.00 0.54 0.00 0.00 0.00 173.10 173.02 5bca s LYS 191 N -4.84 2.78 0.67 2.90 1.02 -1.11 -4.83 119.74 116.32 5bca s LYS 191 Ca 0.58 -0.61 -0.16 0.00 0.02 0.00 0.00 55.97 55.80 5bca s LYS 191 Cb -0.10 -2.67 0.00 0.00 -0.52 0.00 0.00 37.83 34.55 5bca s LYS 191 CO 0.39 0.62 1.15 -0.06 -0.92 0.00 0.00 175.35 176.54 5bca s PHE 192 N -1.08 2.42 -0.28 3.18 0.40 -1.26 -4.56 117.98 116.80 5bca s PHE 192 Ca 0.19 1.56 0.17 0.00 -0.60 0.00 0.00 56.93 58.26 5bca s PHE 192 Cb -0.11 -3.30 0.49 0.00 0.51 0.00 0.00 43.02 40.60 5bca s PHE 192 CO 0.10 -2.01 1.13 1.04 0.70 0.00 0.00 175.22 176.18 5bca n GLN 193 N -2.34 2.42 -2.40 0.44 1.13 -1.26 -2.60 117.38 112.76 5bca n GLN 193 Ca 0.12 -3.76 -0.21 0.00 -1.94 0.00 0.00 57.00 51.21 5bca n GLN 193 Cb 0.51 -1.85 0.02 0.00 0.11 0.00 0.00 30.24 29.03 5bca n GLN 193 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 5bca n ALA 194 N -0.61 4.58 -0.53 -1.58 0.00 -1.19 -4.35 120.51 116.82 5bca n ALA 194 Ca 0.21 -3.85 0.07 0.00 0.00 0.00 0.00 53.44 49.87 5bca n ALA 194 Cb 0.86 -0.57 0.18 0.00 0.00 0.00 0.00 19.45 19.92 5bca n ALA 194 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 5bca n TYR 195 N -0.50 0.58 -1.50 0.00 4.02 -0.62 -4.26 117.16 114.88 5bca n TYR 195 Ca 0.33 -0.68 -0.31 0.00 -0.01 0.00 0.00 57.90 57.23 5bca n TYR 195 Cb 0.79 -0.15 0.06 0.00 -0.02 0.00 0.00 39.34 40.02 5bca n TYR 195 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 5bca s THR 196 N -1.82 3.63 0.35 -0.72 -4.23 -1.26 -4.86 115.64 106.73 5bca s THR 196 Ca 0.29 0.58 0.35 0.00 -1.18 0.00 0.00 61.69 61.73 5bca s THR 196 Cb 0.20 -3.16 0.38 0.00 1.34 0.00 0.00 72.50 71.26 5bca s THR 196 CO 0.11 -0.65 2.12 -0.33 -0.54 0.00 0.00 174.62 175.33 5bca h GLU 197 N -0.70 0.00 0.04 3.99 4.39 -1.93 -2.03 114.58 118.34 5bca h GLU 197 Ca -0.44 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.26 5bca h GLU 197 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 5bca h GLU 197 CO 0.54 0.04 -0.02 0.35 -1.16 0.00 0.00 179.01 178.76 5bca h PHE 198 N 0.00 -0.05 -0.93 4.33 3.57 -1.90 -2.29 116.94 119.66 5bca h PHE 198 Ca -0.00 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.61 5bca h PHE 198 Cb 0.33 0.02 -0.08 0.00 2.79 0.00 0.00 35.95 39.01 5bca h PHE 198 CO 0.00 0.49 0.57 0.00 -2.23 0.00 0.00 178.31 177.13 5bca h ALA 199 N 0.27 1.37 0.06 2.41 0.00 -1.80 0.57 119.26 122.15 5bca h ALA 199 Ca -0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 5bca h ALA 199 Cb 0.56 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.17 5bca h ALA 199 CO 0.01 0.18 -0.03 0.87 0.00 0.00 0.00 179.25 180.28 5bca h LYS 200 N 0.92 -0.08 -0.74 0.00 1.57 -1.40 -0.77 116.57 116.07 5bca h LYS 200 Ca 0.46 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.29 5bca h LYS 200 Cb 0.43 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.70 5bca h LYS 200 CO -0.26 -0.00 0.45 0.77 -0.57 0.00 0.00 179.45 179.84 5bca h SER 201 N -0.14 0.70 0.13 0.86 0.02 -0.79 -1.41 113.55 112.92 5bca h SER 201 Ca -0.01 0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.86 5bca h SER 201 Cb 0.12 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 5bca h SER 201 CO 0.01 0.46 -0.34 0.11 -1.14 0.00 0.00 176.83 175.94 5bca h LYS 202 N 0.83 0.30 -0.15 3.45 6.56 0.02 -2.02 116.57 125.56 5bca h LYS 202 Ca 0.32 -0.12 -0.13 0.00 -1.06 0.00 0.00 60.65 59.66 5bca h LYS 202 Cb 0.13 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.78 5bca h LYS 202 CO -0.16 0.60 -0.41 0.35 -2.06 0.00 0.00 179.45 177.78 5bca h PHE 203 N 0.26 0.71 -0.66 -1.35 3.57 -0.87 -1.92 116.94 116.68 5bca h PHE 203 Ca 0.03 -0.27 0.03 0.00 3.53 0.00 0.00 57.97 61.29 5bca h PHE 203 Cb 0.72 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 5bca h PHE 203 CO 0.02 1.03 0.43 -0.09 -2.23 0.00 0.00 178.31 177.47 5bca h ARG 204 N 0.19 0.78 -0.18 1.11 2.43 -1.07 0.61 114.38 118.26 5bca h ARG 204 Ca -0.01 -0.05 -0.21 0.00 -0.81 0.00 0.00 59.98 58.90 5bca h ARG 204 Cb 1.02 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 30.40 5bca h ARG 204 CO 0.09 0.52 -0.73 -0.07 -1.51 0.00 0.00 179.97 178.26 5bca h LEU 205 N 0.81 0.93 -0.34 3.80 3.38 -1.22 -1.18 115.31 121.49 5bca h LEU 205 Ca 0.26 -0.59 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 5bca h LEU 205 Cb 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 5bca h LEU 205 CO -0.07 1.38 0.01 -0.25 0.09 0.00 0.00 178.44 179.60 5bca h TRP 206 N 0.55 0.64 -0.37 1.13 7.01 -0.77 -1.59 115.95 122.56 5bca h TRP 206 Ca -0.04 -0.11 0.04 0.00 2.11 0.00 0.00 58.89 60.89 5bca h TRP 206 Cb 1.35 -0.17 -0.04 0.00 -2.10 0.00 0.00 29.16 28.21 5bca h TRP 206 CO 0.08 0.70 0.13 0.28 -2.79 0.00 0.00 178.44 176.85 5bca h VAL 207 N 0.40 0.90 0.00 2.65 2.07 -0.74 -1.16 116.25 120.37 5bca h VAL 207 Ca 0.10 -0.10 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 5bca h VAL 207 Cb 0.44 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 5bca h VAL 207 CO 0.02 0.05 -0.24 -0.07 0.02 0.00 0.00 177.57 177.35 5bca h LEU 208 N 0.29 0.00 -0.41 2.57 3.38 -1.02 -1.86 115.31 118.25 5bca h LEU 208 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 5bca h LEU 208 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 5bca h LEU 208 CO -0.16 0.24 -0.28 -0.46 0.09 0.00 0.00 178.44 177.87 5bca n ASN 209 N -3.55 0.91 -0.00 -0.43 6.94 -0.62 -0.54 115.26 117.97 5bca n ASN 209 Ca -0.01 -0.78 -0.11 0.00 -0.02 0.00 0.00 54.58 53.66 5bca n ASN 209 Cb 0.39 0.13 -0.14 0.00 -2.36 0.00 0.00 39.78 37.80 5bca n ASN 209 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 5bca h LYS 210 N 1.00 0.07 0.00 -3.83 3.64 -0.42 -3.39 116.57 113.63 5bca h LYS 210 Ca 0.00 -0.11 -0.10 0.00 -1.27 0.00 0.00 60.65 59.17 5bca h LYS 210 Cb 0.50 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.34 5bca h LYS 210 CO 0.00 0.71 -1.78 0.66 -2.27 0.00 0.00 179.45 176.76 5bca n TYR 211 N -3.18 0.00 0.00 1.91 4.01 -0.96 -5.02 117.16 113.92 5bca n TYR 211 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 5bca n TYR 211 Cb 1.04 -0.47 0.00 0.00 -0.31 0.00 0.00 39.34 39.60 5bca n TYR 211 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 5bca n GLY 212 N 1.85 2.70 3.39 2.72 0.00 0.30 -4.75 105.19 111.40 5bca n GLY 212 Ca -0.11 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 5bca n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 5bca s SER 213 N 0.00 -0.02 0.13 1.61 1.04 -1.26 -4.91 113.70 110.30 5bca s SER 213 Ca 0.00 -0.82 -0.22 0.00 0.48 0.00 0.00 55.95 55.39 5bca s SER 213 Cb 0.00 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.58 5bca s SER 213 CO 0.00 -0.94 1.66 0.25 0.98 0.00 0.00 173.24 175.19 5bca h LEU 214 N 2.46 -0.55 -0.90 2.42 5.85 -1.94 -0.48 115.31 122.18 5bca h LEU 214 Ca -0.31 0.10 0.24 0.00 0.84 0.00 0.00 57.88 58.75 5bca h LEU 214 Cb 1.24 0.26 -0.16 0.00 0.37 0.00 0.00 40.66 42.37 5bca h LEU 214 CO 0.45 -0.22 0.10 0.78 -0.34 0.00 0.00 178.44 179.21 5bca h ASN 215 N -0.22 -0.27 1.59 1.25 -0.26 -1.95 1.07 115.58 116.79 5bca h ASN 215 Ca 0.10 0.23 0.00 0.00 -0.56 0.00 0.00 56.30 56.08 5bca h ASN 215 Cb 0.37 0.38 0.00 0.00 -1.06 0.00 0.00 38.32 38.00 5bca h ASN 215 CO -0.27 -0.25 0.00 -0.33 -1.06 0.00 0.00 177.43 175.52 5bca h GLU 216 N 0.09 0.00 0.05 0.81 4.39 -1.52 -2.47 114.58 115.93 5bca h GLU 216 Ca 0.55 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 60.15 5bca h GLU 216 Cb 1.10 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.76 5bca h GLU 216 CO -0.77 0.00 -0.39 0.28 -1.16 0.00 0.00 179.01 176.97 5bca h VAL 217 N 0.00 1.60 -0.29 3.13 2.07 0.26 -2.00 116.25 121.01 5bca h VAL 217 Ca 0.00 -2.27 0.08 0.00 0.82 0.00 0.00 66.70 65.34 5bca h VAL 217 Cb 0.80 3.08 -0.01 0.00 -1.52 0.00 0.00 31.29 33.64 5bca h VAL 217 CO 0.00 0.62 0.24 0.78 0.02 0.00 0.00 177.57 179.23 5bca h ASN 218 N -0.58 0.00 0.04 0.57 2.35 -0.68 0.26 115.58 117.55 5bca h ASN 218 Ca -0.06 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.46 5bca h ASN 218 Cb 1.24 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.59 5bca h ASN 218 CO 0.07 0.00 -1.20 0.50 -1.65 0.00 0.00 177.43 175.16 5bca h LYS 219 N 0.00 0.08 0.00 0.81 1.63 -1.45 0.50 116.57 118.15 5bca h LYS 219 Ca 0.14 -0.14 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 5bca h LYS 219 Cb 0.61 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.29 5bca h LYS 219 CO -0.00 1.07 -0.14 0.00 -3.45 0.00 0.00 179.45 176.92 5bca h ALA 220 N -0.26 1.60 0.00 5.00 0.00 -0.93 -2.74 119.26 121.93 5bca h ALA 220 Ca -0.30 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.48 5bca h ALA 220 Cb 1.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.21 5bca h ALA 220 CO -0.09 0.18 -1.06 0.91 0.00 0.00 0.00 179.25 179.20 5bca n TRP 221 N -4.14 0.06 -3.58 0.00 7.02 0.89 -4.82 117.44 112.87 5bca n TRP 221 Ca -0.02 0.02 -0.22 0.00 -1.02 0.00 0.00 57.50 56.25 5bca n TRP 221 Cb 0.22 -0.20 0.05 0.00 -2.42 0.00 0.00 31.31 28.96 5bca n TRP 221 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 5bca n GLY 222 N 1.44 -0.63 3.64 6.99 0.00 0.14 -4.87 105.19 111.89 5bca n GLY 222 Ca 0.03 0.29 -0.29 0.00 0.00 0.00 0.00 46.02 46.05 5bca n GLY 222 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 5bca s THR 223 N -3.54 0.97 -0.39 2.61 -4.23 0.82 -5.00 115.64 106.88 5bca s THR 223 Ca 0.20 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.82 5bca s THR 223 Cb -0.05 -2.31 0.33 0.00 1.34 0.00 0.00 72.50 71.81 5bca s THR 223 CO 0.80 0.00 0.70 0.29 -0.54 0.00 0.00 174.62 175.87 5bca n LYS 224 N -1.08 1.03 -2.96 3.99 5.02 -1.26 -4.63 118.16 118.27 5bca n LYS 224 Ca -0.12 -3.43 -0.40 0.00 -2.02 0.00 0.00 58.31 52.34 5bca n LYS 224 Cb 0.66 -1.64 -0.05 0.00 -0.02 0.00 0.00 35.03 33.98 5bca n LYS 224 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 5bca s LEU 225 N -2.22 4.44 0.15 -0.35 1.02 -1.26 -4.97 118.68 115.50 5bca s LEU 225 Ca 0.39 1.46 -0.17 0.00 0.02 0.00 0.00 54.13 55.83 5bca s LEU 225 Cb 0.31 -3.25 0.05 0.00 0.02 0.00 0.00 46.19 43.32 5bca s LEU 225 CO -0.09 -0.00 1.71 -0.29 0.02 0.00 0.00 176.35 177.70 5bca h ILE 226 N 4.16 0.78 -4.08 -0.59 2.10 -1.98 -3.47 117.51 114.43 5bca h ILE 226 Ca -0.44 -0.04 -0.16 0.00 1.08 0.00 0.00 64.86 65.30 5bca h ILE 226 Cb 1.21 0.66 -0.18 0.00 -1.09 0.00 0.00 36.82 37.42 5bca h ILE 226 CO 0.71 0.02 -0.69 -0.94 -1.08 0.00 0.00 178.15 176.17 5bca s SER 227 N -5.26 0.50 0.00 2.19 1.04 -1.26 -5.00 113.70 105.91 5bca s SER 227 Ca -0.13 -0.78 0.10 0.00 0.48 0.00 0.00 55.95 55.61 5bca s SER 227 Cb 0.12 0.14 0.45 0.00 0.10 0.00 0.00 66.02 66.83 5bca s SER 227 CO 0.70 -0.44 1.29 -1.84 0.98 0.00 0.00 173.24 173.93 5bca n GLU 228 N 0.74 0.04 0.22 4.02 0.00 -1.26 -0.29 120.64 124.11 5bca n GLU 228 Ca -0.18 0.29 0.10 0.00 0.00 0.00 0.00 57.16 57.37 5bca n GLU 228 Cb 0.58 -1.50 0.45 0.00 0.00 0.00 0.00 31.44 30.97 5bca n GLU 228 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 5bca h LEU 229 N 0.00 0.00 -0.37 -1.84 5.85 -1.99 -2.19 115.31 114.77 5bca h LEU 229 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 5bca h LEU 229 Cb 0.15 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.18 5bca h LEU 229 CO 0.00 0.21 -0.01 0.00 -0.34 0.00 0.00 178.44 178.30 5bca n ALA 230 N -2.21 2.65 -2.54 1.25 0.00 0.61 -4.67 120.51 115.60 5bca n ALA 230 Ca 0.00 -0.29 -0.43 0.00 0.00 0.00 0.00 53.44 52.72 5bca n ALA 230 Cb 0.44 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 5bca n ALA 230 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 5bca s ILE 231 N -2.05 4.04 0.15 0.00 1.01 -0.82 -5.00 121.20 118.54 5bca s ILE 231 Ca 0.43 1.00 0.00 0.00 0.00 0.00 0.00 60.65 62.07 5bca s ILE 231 Cb 0.21 -4.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.05 5bca s ILE 231 CO 0.37 -1.14 0.03 -0.76 0.00 0.00 0.00 174.94 173.44 5bca s LEU 232 N 4.96 1.92 1.15 2.97 1.43 -1.26 -4.65 118.68 125.20 5bca s LEU 232 Ca 0.48 -1.20 -0.16 0.00 -1.03 0.00 0.00 54.13 52.22 5bca s LEU 232 Cb -0.08 0.14 0.26 0.00 0.03 0.00 0.00 46.19 46.53 5bca s LEU 232 CO 0.29 -0.66 1.07 -2.16 0.23 0.00 0.00 176.35 175.11 5bca s PRO 233 N -3.99 -0.80 0.15 1.29 0.05 -1.26 -4.92 135.00 125.52 5bca s PRO 233 Ca 0.25 0.31 -0.32 0.00 0.05 0.00 0.00 61.00 61.28 5bca s PRO 233 Cb 0.07 -1.61 -0.12 0.00 0.05 0.00 0.00 34.50 32.89 5bca s PRO 233 CO 0.03 -3.51 1.76 -2.30 0.05 0.00 0.00 177.00 173.03 5bca n PRO 234 N -4.69 2.65 0.20 0.56 -0.02 -1.26 -4.90 135.00 127.54 5bca n PRO 234 Ca 0.08 0.96 0.07 0.00 -2.02 0.00 0.00 63.50 62.59 5bca n PRO 234 Cb 0.58 -2.81 0.39 0.00 -0.02 0.00 0.00 33.50 31.63 5bca n PRO 234 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 5bca h SER 235 N 7.56 0.00 -3.07 2.55 4.64 -2.00 -3.39 113.55 119.83 5bca h SER 235 Ca -0.45 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.34 5bca h SER 235 Cb 1.22 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.91 5bca h SER 235 CO 0.94 0.33 -0.76 -0.62 -0.87 0.00 0.00 176.83 175.85 5bca s ASP 236 N -6.40 3.24 0.28 4.97 -1.08 -1.26 -5.01 116.67 111.41 5bca s ASP 236 Ca -0.00 -1.10 0.00 0.00 -0.52 0.00 0.00 52.55 50.93 5bca s ASP 236 Cb 0.11 -0.53 0.53 0.00 -1.46 0.00 0.00 42.92 41.57 5bca s ASP 236 CO 0.67 -0.38 1.84 1.23 0.52 0.00 0.00 175.17 179.05 5bca h GLY 237 N 8.29 1.61 0.76 2.66 0.00 -1.99 -0.61 103.07 113.78 5bca h GLY 237 Ca -0.16 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 5bca h GLY 237 CO 0.39 0.17 -0.06 -2.09 0.00 0.00 0.00 176.54 174.94 5bca h GLU 238 N 0.99 -0.17 0.03 4.80 4.81 -1.95 0.13 114.58 123.23 5bca h GLU 238 Ca 0.48 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.73 5bca h GLU 238 Cb 0.46 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 5bca h GLU 238 CO -0.26 0.09 -0.03 1.96 -0.73 0.00 0.00 179.01 180.04 5bca h GLN 239 N -0.42 -0.07 -0.74 1.92 1.08 -1.91 0.13 115.11 115.10 5bca h GLN 239 Ca -0.02 0.01 0.16 0.00 -1.45 0.00 0.00 58.65 57.34 5bca h GLN 239 Cb 0.34 0.02 -0.11 0.00 -0.05 0.00 0.00 27.48 27.68 5bca h GLN 239 CO 0.03 -0.05 0.22 0.35 -0.95 0.00 0.00 178.83 178.43 5bca h PHE 240 N -0.08 0.36 0.00 2.96 3.57 -0.93 0.73 116.94 123.55 5bca h PHE 240 Ca 0.00 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 5bca h PHE 240 Cb 0.07 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 5bca h PHE 240 CO -0.09 -0.04 -0.11 -0.07 -2.23 0.00 0.00 178.31 175.77 5bca h LEU 241 N 0.32 0.00 0.24 0.59 3.38 -0.58 0.25 115.31 119.52 5bca h LEU 241 Ca 0.42 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 58.04 5bca h LEU 241 Cb 0.69 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.47 5bca h LEU 241 CO -0.48 0.11 -1.57 0.24 0.09 0.00 0.00 178.44 176.83 5bca h MET 242 N 0.00 0.50 0.00 1.13 2.86 0.24 -3.39 114.93 116.26 5bca h MET 242 Ca -0.00 -0.85 0.00 0.00 -2.06 0.00 0.00 59.70 56.79 5bca h MET 242 Cb 0.91 0.32 0.00 0.00 0.06 0.00 0.00 31.60 32.89 5bca h MET 242 CO 0.01 1.41 0.00 0.27 1.06 0.00 0.00 176.91 179.66 5bca n ASN 243 N -3.68 0.00 0.24 1.22 6.94 0.69 -4.89 115.26 115.77 5bca n ASN 243 Ca -0.19 0.00 0.08 0.00 -0.02 0.00 0.00 54.58 54.44 5bca n ASN 243 Cb 1.10 0.00 0.59 0.00 -2.36 0.00 0.00 39.78 39.11 5bca n ASN 243 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 5bca h GLY 244 N 0.00 0.00 1.99 4.83 0.00 -1.20 -2.32 103.07 106.37 5bca h GLY 244 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 5bca h GLY 244 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 176.54 176.64 5bca h TYR 245 N 0.00 0.00 0.00 5.60 -0.00 -0.82 -1.72 116.97 120.03 5bca h TYR 245 Ca -0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.73 58.67 5bca h TYR 245 Cb 0.31 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.03 5bca h TYR 245 CO 0.00 0.00 -0.27 -0.07 -0.00 0.00 0.00 178.16 177.82 5bca h LEU 246 N 0.00 0.00-10.34 0.10 3.38 -1.70 -3.31 115.31 103.44 5bca h LEU 246 Ca 0.00 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.46 5bca h LEU 246 Cb 0.01 0.00 0.10 0.00 0.09 0.00 0.00 40.66 40.86 5bca h LEU 246 CO -0.00 0.27 0.35 -0.94 0.09 0.00 0.00 178.44 178.22 5bca s SER 247 N -6.57 5.06 0.35 -0.43 1.04 -0.65 -4.87 113.70 107.63 5bca s SER 247 Ca -0.02 1.61 0.03 0.00 0.48 0.00 0.00 55.95 58.05 5bca s SER 247 Cb 0.13 -2.43 0.66 0.00 0.10 0.00 0.00 66.02 64.48 5bca s SER 247 CO 0.67 -1.65 1.98 -0.03 0.98 0.00 0.00 173.24 175.20 5bca h MET 248 N -0.86 0.82 -0.50 4.02 4.05 -1.87 -1.94 114.93 118.64 5bca h MET 248 Ca -0.44 -0.05 0.08 0.00 -0.28 0.00 0.00 59.70 59.01 5bca h MET 248 Cb 1.22 -0.18 -0.07 0.00 -0.80 0.00 0.00 31.60 31.77 5bca h MET 248 CO 0.56 0.54 0.12 -0.92 0.23 0.00 0.00 176.91 177.44 5bca h TYR 249 N 0.84 0.19 -0.57 1.39 3.20 -1.88 -1.53 116.97 118.61 5bca h TYR 249 Ca 0.27 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 62.10 5bca h TYR 249 Cb 0.05 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 5bca h TYR 249 CO -0.00 0.01 0.05 0.78 -1.64 0.00 0.00 178.16 177.36 5bca h GLY 250 N 0.26 1.02 1.45 1.82 0.00 -1.46 0.35 103.07 106.52 5bca h GLY 250 Ca 0.25 -0.68 -0.20 0.00 0.00 0.00 0.00 47.33 46.70 5bca h GLY 250 CO -0.31 0.63 -0.77 0.50 0.00 0.00 0.00 176.54 176.59 5bca h LYS 251 N 0.88 0.54 -0.13 4.80 1.57 -1.23 -0.71 116.57 122.29 5bca h LYS 251 Ca 0.17 -0.45 -0.03 0.00 -1.87 0.00 0.00 60.65 58.47 5bca h LYS 251 Cb 0.45 0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 5bca h LYS 251 CO 0.02 1.08 -0.04 -0.44 -0.57 0.00 0.00 179.45 179.49 5bca h ASP 252 N 0.36 0.27 -0.54 0.86 3.32 -0.96 -1.43 116.42 118.29 5bca h ASP 252 Ca -0.04 -0.38 -0.04 0.00 0.02 0.00 0.00 57.03 56.58 5bca h ASP 252 Cb 1.36 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.82 5bca h ASP 252 CO 0.14 0.59 0.17 0.22 -1.72 0.00 0.00 179.24 178.64 5bca h TYR 253 N -0.06 0.88 -0.04 4.55 3.20 -0.35 -1.47 116.97 123.67 5bca h TYR 253 Ca 0.03 -0.09 -0.09 0.00 3.14 0.00 0.00 58.73 61.72 5bca h TYR 253 Cb 0.48 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 5bca h TYR 253 CO 0.06 0.75 -0.39 -0.07 -1.64 0.00 0.00 178.16 176.87 5bca h LEU 254 N 0.75 0.09 0.05 2.82 3.38 -1.07 -1.20 115.31 120.13 5bca h LEU 254 Ca 0.17 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 5bca h LEU 254 Cb 0.28 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.01 5bca h LEU 254 CO -0.00 0.47 -0.03 -0.08 0.09 0.00 0.00 178.44 178.89 5bca h GLU 255 N 0.07 -0.07 -0.08 1.13 4.81 -0.91 -0.84 114.58 118.69 5bca h GLU 255 Ca 0.01 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.28 5bca h GLU 255 Cb 0.72 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.06 5bca h GLU 255 CO 0.05 0.24 -0.26 2.35 -0.73 0.00 0.00 179.01 180.66 5bca h TRP 256 N -0.38 -0.69 -0.36 0.92 7.01 -1.22 0.37 115.95 121.58 5bca h TRP 256 Ca -0.01 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.01 5bca h TRP 256 Cb 0.34 0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 27.70 5bca h TRP 256 CO 0.03 -0.34 0.18 -0.92 -2.79 0.00 0.00 178.44 174.59 5bca h TYR 257 N -0.35 0.52 -0.23 2.65 3.20 -1.20 -2.11 116.97 119.46 5bca h TYR 257 Ca 0.09 -0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.79 5bca h TYR 257 Cb 0.48 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 5bca h TYR 257 CO -0.33 0.45 -0.44 0.37 -1.64 0.00 0.00 178.16 176.57 5bca h GLN 258 N 0.45 0.57 -0.99 1.82 4.15 -1.13 -3.27 115.11 116.71 5bca h GLN 258 Ca 0.13 -0.31 0.10 0.00 0.77 0.00 0.00 58.65 59.34 5bca h GLN 258 Cb 0.12 0.01 -0.08 0.00 0.21 0.00 0.00 27.48 27.74 5bca h GLN 258 CO -0.02 0.90 0.63 0.78 -1.93 0.00 0.00 178.83 179.20 5bca h GLY 259 N 1.05 1.57 0.13 2.39 0.00 -0.24 -0.62 103.07 107.34 5bca h GLY 259 Ca 0.03 -0.44 0.18 0.00 0.00 0.00 0.00 47.33 47.11 5bca h GLY 259 CO 0.08 0.22 0.58 -2.22 0.00 0.00 0.00 176.54 175.20 5bca h ILE 260 N 1.04 0.70 -0.07 2.60 1.08 -1.52 0.45 117.51 121.80 5bca h ILE 260 Ca 0.47 -0.25 -0.13 0.00 -0.39 0.00 0.00 64.86 64.56 5bca h ILE 260 Cb 0.38 -0.09 -0.01 0.00 -3.07 0.00 0.00 36.82 34.02 5bca h ILE 260 CO -0.23 0.13 -0.53 -0.07 -0.69 0.00 0.00 178.15 176.77 5bca h LEU 261 N 0.73 0.20 -0.12 1.44 3.38 -1.27 -0.96 115.31 118.71 5bca h LEU 261 Ca 0.56 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.41 5bca h LEU 261 Cb 0.86 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 5bca h LEU 261 CO -0.38 0.70 -0.00 -0.33 0.09 0.00 0.00 178.44 178.51 5bca h GLU 262 N 0.15 0.22 -0.52 1.13 5.08 0.14 -0.16 114.58 120.61 5bca h GLU 262 Ca 0.00 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 5bca h GLU 262 Cb 0.98 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.19 5bca h GLU 262 CO 0.08 0.47 0.11 -0.91 -1.00 0.00 0.00 179.01 177.77 5bca h ASN 263 N -0.05 0.75 -0.37 1.42 2.35 -0.53 -2.59 115.58 116.56 5bca h ASN 263 Ca 0.03 -0.14 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 5bca h ASN 263 Cb 0.38 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 5bca h ASN 263 CO 0.01 0.75 0.12 -0.74 -1.65 0.00 0.00 177.43 175.92 5bca h HIS 264 N 0.78 0.60 -0.79 1.19 2.76 -1.11 -1.70 115.15 116.88 5bca h HIS 264 Ca 0.17 -0.06 0.07 0.00 -2.20 0.00 0.00 60.37 58.35 5bca h HIS 264 Cb 0.30 -0.17 -0.06 0.00 1.55 0.00 0.00 27.41 29.03 5bca h HIS 264 CO 0.02 0.57 0.46 1.15 -1.30 0.00 0.00 177.93 178.83 5bca h THR 265 N 0.45 0.98 -0.17 6.26 2.02 -0.64 -1.67 112.91 120.14 5bca h THR 265 Ca 0.12 -0.28 -0.19 0.00 0.77 0.00 0.00 66.41 66.82 5bca h THR 265 Cb 0.25 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 5bca h THR 265 CO -0.00 0.15 -0.66 0.11 0.37 0.00 0.00 175.52 175.48 5bca h LYS 266 N 0.83 0.67 -0.16 6.66 1.57 -1.23 -1.60 116.57 123.30 5bca h LYS 266 Ca 0.36 -0.49 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 5bca h LYS 266 Cb 0.23 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 5bca h LYS 266 CO -0.20 1.11 0.10 1.25 -0.57 0.00 0.00 179.45 181.14 5bca h LEU 267 N 0.48 0.19 -0.31 2.94 5.85 -0.89 -0.96 115.31 122.61 5bca h LEU 267 Ca -0.02 -0.03 -0.20 0.00 0.84 0.00 0.00 57.88 58.48 5bca h LEU 267 Cb 1.25 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 5bca h LEU 267 CO 0.13 0.16 -0.85 0.16 -0.34 0.00 0.00 178.44 177.71 5bca h ILE 268 N 0.20 1.45 0.28 4.05 3.07 -1.36 -2.04 117.51 123.16 5bca h ILE 268 Ca 0.06 -2.47 0.00 0.00 1.55 0.00 0.00 64.86 64.00 5bca h ILE 268 Cb 0.00 2.38 -0.04 0.00 -0.27 0.00 0.00 36.82 38.89 5bca h ILE 268 CO -0.01 0.73 -0.52 1.23 -1.05 0.00 0.00 178.15 178.52 5bca h GLY 269 N 1.63 -1.21 -0.61 0.16 0.00 -1.29 -0.97 103.07 100.78 5bca h GLY 269 Ca -0.05 0.63 0.13 0.00 0.00 0.00 0.00 47.33 48.04 5bca h GLY 269 CO 0.13 -0.31 -0.33 -2.09 0.00 0.00 0.00 176.54 173.95 5bca h GLU 270 N -0.86 -0.09 -0.23 4.80 4.81 -0.83 -2.09 114.58 120.09 5bca h GLU 270 Ca -0.03 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.10 5bca h GLU 270 Cb 0.81 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 5bca h GLU 270 CO -0.20 -0.06 -0.31 -0.07 -0.73 0.00 0.00 179.01 177.65 5bca h LEU 271 N -0.09 0.49 -0.16 1.64 3.38 -1.36 0.84 115.31 120.04 5bca h LEU 271 Ca 0.29 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 5bca h LEU 271 Cb 0.57 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 5bca h LEU 271 CO -0.79 0.77 -0.22 0.00 0.09 0.00 0.00 178.44 178.29 5bca h ALA 272 N 1.26 0.25 -0.36 1.53 0.00 -0.89 -0.04 119.26 121.01 5bca h ALA 272 Ca 0.05 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 5bca h ALA 272 Cb 0.74 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 5bca h ALA 272 CO 0.06 0.20 0.22 0.45 0.00 0.00 0.00 179.25 180.18 5bca h HIS 273 N 0.08 0.48 -0.11 0.00 3.86 -1.05 0.85 115.15 119.26 5bca h HIS 273 Ca 0.02 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.19 5bca h HIS 273 Cb 0.79 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 29.09 5bca h HIS 273 CO 0.09 0.35 -0.10 -0.91 0.86 0.00 0.00 177.93 178.22 5bca h ASN 274 N 0.47 0.15 0.46 2.45 2.35 -0.82 -1.55 115.58 119.09 5bca h ASN 274 Ca 0.13 -0.02 -0.30 0.00 -0.55 0.00 0.00 56.30 55.55 5bca h ASN 274 Cb 0.01 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.31 5bca h ASN 274 CO -0.02 0.27 -1.66 0.00 -1.65 0.00 0.00 177.43 174.36 5bca h ALA 275 N 1.75 0.56 0.00 -0.83 0.00 -0.14 -3.41 119.26 117.19 5bca h ALA 275 Ca 0.03 -1.33 -0.14 0.00 0.00 0.00 0.00 54.91 53.48 5bca h ALA 275 Cb 0.27 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 5bca h ALA 275 CO 0.02 1.41 -1.79 1.19 0.00 0.00 0.00 179.25 180.07 5bca n PHE 276 N -3.25 0.00 -0.02 0.00 3.72 0.29 -4.77 117.46 113.43 5bca n PHE 276 Ca -0.18 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.13 5bca n PHE 276 Cb 1.04 -0.51 -0.02 0.00 -0.94 0.00 0.00 39.48 39.05 5bca n PHE 276 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 5bca h ASP 277 N 0.00 -0.47 0.24 4.37 3.32 -1.45 -1.27 116.42 121.16 5bca h ASP 277 Ca -0.20 0.10 -0.07 0.00 0.02 0.00 0.00 57.03 56.87 5bca h ASP 277 Cb 1.30 0.24 -0.01 0.00 0.22 0.00 0.00 39.33 41.08 5bca h ASP 277 CO 0.01 -0.19 -0.30 0.71 -1.72 0.00 0.00 179.24 177.75 5bca h THR 278 N -0.16 1.24 0.01 0.35 1.35 -1.87 -1.83 112.91 111.99 5bca h THR 278 Ca 0.11 -1.15 -0.00 0.00 -0.55 0.00 0.00 66.41 64.82 5bca h THR 278 Cb 0.32 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 5bca h THR 278 CO -0.27 0.34 -0.00 0.74 -0.25 0.00 0.00 175.52 176.07 5bca h THR 279 N 0.10 0.77 0.03 6.82 2.02 -1.82 -3.41 112.91 117.42 5bca h THR 279 Ca 0.01 -1.57 -0.36 0.00 0.77 0.00 0.00 66.41 65.27 5bca h THR 279 Cb 0.59 1.45 -0.05 0.00 -1.74 0.00 0.00 68.15 68.40 5bca h THR 279 CO 0.04 0.26 -2.19 0.49 0.37 0.00 0.00 175.52 174.49 5bca n PHE 280 N -4.71 0.50 -3.54 3.16 3.72 -0.49 -5.03 117.46 111.06 5bca n PHE 280 Ca -0.04 0.13 -0.25 0.00 -0.05 0.00 0.00 57.45 57.24 5bca n PHE 280 Cb 0.21 -1.08 0.05 0.00 -0.94 0.00 0.00 39.48 37.72 5bca n PHE 280 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 5bca n GLN 281 N -3.15 -2.04 -4.23 -1.08 6.02 -0.69 -5.01 117.38 107.20 5bca n GLN 281 Ca -0.34 0.61 -0.14 0.00 -0.01 0.00 0.00 57.00 57.12 5bca n GLN 281 Cb 1.06 -4.83 -0.10 0.00 1.02 0.00 0.00 30.24 27.39 5bca n GLN 281 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 5bca s VAL 282 N -3.47 1.11 0.39 5.09 -7.23 -1.26 -5.10 120.40 109.93 5bca s VAL 282 Ca 0.41 -1.97 -0.27 0.00 -1.81 0.00 0.00 61.98 58.33 5bca s VAL 282 Cb -0.11 -1.75 -0.11 0.00 0.56 0.00 0.00 36.38 34.98 5bca s VAL 282 CO 0.81 -0.71 1.46 -0.81 -0.31 0.00 0.00 175.10 175.55 5bca n PRO 283 N -0.03 2.56 -4.51 4.82 -0.05 -1.26 -4.84 135.00 131.69 5bca n PRO 283 Ca -0.12 0.90 -0.34 0.00 -0.05 0.00 0.00 63.50 63.90 5bca n PRO 283 Cb 0.60 -2.64 -0.12 0.00 -0.05 0.00 0.00 33.50 31.29 5bca n PRO 283 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 5bca s ILE 284 N -1.13 3.72 0.27 0.52 1.01 -1.26 -2.02 121.20 122.31 5bca s ILE 284 Ca 0.55 -0.43 0.02 0.00 0.00 0.00 0.00 60.65 60.79 5bca s ILE 284 Cb -0.48 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.34 5bca s ILE 284 CO 0.63 0.52 0.08 -0.83 0.00 0.00 0.00 174.94 175.33 5bca s GLY 285 N 0.13 1.80 0.26 6.18 0.00 -0.94 -0.63 107.32 114.13 5bca s GLY 285 Ca -0.02 -1.91 0.04 0.00 0.00 0.00 0.00 44.72 42.83 5bca s GLY 285 CO 0.03 -1.65 0.14 0.00 0.00 0.00 0.00 173.10 171.62 5bca n ALA 286 N -0.51 0.44 -2.94 3.20 0.00 -1.05 -0.97 120.51 118.68 5bca n ALA 286 Ca -0.01 -1.40 -0.23 0.00 0.00 0.00 0.00 53.44 51.80 5bca n ALA 286 Cb 0.66 1.01 -0.16 0.00 0.00 0.00 0.00 19.45 20.97 5bca n ALA 286 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 5bca s LYS 287 N -3.02 1.37 -0.19 0.00 1.02 -1.26 -1.01 119.74 116.65 5bca s LYS 287 Ca 0.19 -0.46 -0.04 0.00 0.02 0.00 0.00 55.97 55.68 5bca s LYS 287 Cb 0.01 -1.23 -0.02 0.00 -0.52 0.00 0.00 37.83 36.07 5bca s LYS 287 CO 0.14 0.19 -0.03 0.42 -0.92 0.00 0.00 175.35 175.14 5bca s ILE 288 N 0.09 3.71 0.83 2.17 1.01 -1.01 -0.01 121.20 128.00 5bca s ILE 288 Ca -0.03 -0.40 -0.12 0.00 0.00 0.00 0.00 60.65 60.10 5bca s ILE 288 Cb -0.10 -2.66 0.10 0.00 0.01 0.00 0.00 42.46 39.82 5bca s ILE 288 CO 0.01 0.45 1.18 0.00 0.00 0.00 0.00 174.94 176.58 5bca s ALA 289 N 0.87 1.77 -0.74 9.38 0.00 -1.26 -4.40 121.76 127.37 5bca s ALA 289 Ca -0.00 0.71 -0.18 0.00 0.00 0.00 0.00 51.96 52.49 5bca s ALA 289 Cb -0.15 -3.46 0.14 0.00 0.00 0.00 0.00 23.12 19.65 5bca s ALA 289 CO 0.01 -2.38 0.85 0.20 0.00 0.00 0.00 175.76 174.44 5bca s GLY 290 N -2.42 2.01 -1.02 0.00 0.00 -1.26 -4.89 107.32 99.74 5bca s GLY 290 Ca 0.70 -2.62 -0.14 0.00 0.00 0.00 0.00 44.72 42.66 5bca s GLY 290 CO 0.53 1.64 1.12 0.14 0.00 0.00 0.00 173.10 176.53 5bca s VAL 291 N 2.15 5.30 -1.64 1.40 1.01 -1.26 -4.80 120.40 122.56 5bca s VAL 291 Ca 0.19 -2.47 0.25 0.00 0.00 0.00 0.00 61.98 59.95 5bca s VAL 291 Cb -0.15 -4.70 0.11 0.00 0.00 0.00 0.00 36.38 31.63 5bca s VAL 291 CO -0.02 -1.35 1.36 0.00 0.00 0.00 0.00 175.10 175.09 5bca n HIS 292 N 4.86 0.00 -3.25 5.22 1.44 -1.26 -4.71 115.22 117.52 5bca n HIS 292 Ca 0.25 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.66 5bca n HIS 292 Cb 0.45 -0.10 -0.04 0.00 0.12 0.00 0.00 29.99 30.42 5bca n HIS 292 CO 0.00 0.00 0.00 1.67 -2.81 0.00 0.00 176.34 175.20 5bca s TRP 293 N -2.62 3.46 -1.03 -1.40 -2.14 -1.26 -2.01 118.94 111.93 5bca s TRP 293 Ca 0.19 0.78 0.00 0.00 2.66 0.00 0.00 56.10 59.74 5bca s TRP 293 Cb 0.18 -2.21 0.00 0.00 -3.10 0.00 0.00 33.47 28.34 5bca s TRP 293 CO 0.60 0.13 0.00 1.04 -2.66 0.00 0.00 176.95 176.06 5bca n GLN 294 N -0.83 -1.15 0.20 3.25 1.13 -0.07 -4.21 117.38 115.69 5bca n GLN 294 Ca -0.00 0.79 -0.15 0.00 -1.94 0.00 0.00 57.00 55.70 5bca n GLN 294 Cb 0.54 -4.89 -0.08 0.00 0.11 0.00 0.00 30.24 25.91 5bca n GLN 294 CO 0.00 0.00 0.00 -0.92 -1.44 0.00 0.00 177.06 174.70 5bca h TYR 295 N 0.00 -0.44 -0.59 1.08 5.03 -1.61 -0.85 116.97 119.59 5bca h TYR 295 Ca -0.20 -0.01 -0.34 0.00 2.58 0.00 0.00 58.73 60.76 5bca h TYR 295 Cb 0.87 0.15 -0.20 0.00 1.55 0.00 0.00 36.73 39.10 5bca h TYR 295 CO 0.42 -0.18 0.10 0.27 -1.32 0.00 0.00 178.16 177.45 5bca n ASN 296 N -5.23 3.46 -4.74 -2.11 6.94 -1.24 -1.85 115.26 110.48 5bca n ASN 296 Ca -0.10 -3.76 -0.41 0.00 -0.02 0.00 0.00 54.58 50.29 5bca n ASN 296 Cb 0.25 -0.69 -0.02 0.00 -2.36 0.00 0.00 39.78 36.96 5bca n ASN 296 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 5bca s ASN 297 N -2.31 6.51 0.15 0.53 3.84 -1.22 -4.90 114.94 117.53 5bca s ASN 297 Ca 0.50 2.80 -0.09 0.00 0.21 0.00 0.00 52.86 56.28 5bca s ASN 297 Cb 0.43 -2.62 -0.03 0.00 -0.55 0.00 0.00 41.25 38.48 5bca s ASN 297 CO 0.02 -0.82 1.43 1.55 -2.79 0.00 0.00 177.10 176.49 5bca h PRO 298 N 5.20 0.75 0.00 0.43 0.13 -1.94 -3.03 132.00 133.54 5bca h PRO 298 Ca -0.46 -0.50 -0.18 0.00 -0.87 0.00 0.00 66.00 64.00 5bca h PRO 298 Cb 1.22 0.07 -0.03 0.00 0.13 0.00 0.00 31.00 32.38 5bca h PRO 298 CO 0.81 1.12 -1.63 0.25 -0.23 0.00 0.00 178.00 178.32 5bca n THR 299 N -3.98 1.07 -3.42 1.56 -2.24 -1.26 -4.59 114.28 101.43 5bca n THR 299 Ca -0.04 -0.69 -0.26 0.00 -2.27 0.00 0.00 64.05 60.78 5bca n THR 299 Cb 0.64 -0.61 -0.09 0.00 -2.10 0.00 0.00 70.33 68.17 5bca n THR 299 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 5bca n ILE 300 N -2.79 0.49 -1.94 2.28 -5.35 -1.24 -4.41 119.36 106.40 5bca n ILE 300 Ca -0.13 -4.40 -0.40 0.00 -0.27 0.00 0.00 62.75 57.56 5bca n ILE 300 Cb 0.85 -1.98 -0.00 0.00 -1.74 0.00 0.00 39.64 36.77 5bca n ILE 300 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 5bca s PRO 301 N -1.37 4.01 -1.62 6.28 0.04 -1.15 -2.21 135.00 138.99 5bca s PRO 301 Ca 0.34 2.34 -0.15 0.00 0.04 0.00 0.00 61.00 63.58 5bca s PRO 301 Cb 0.10 -2.85 0.12 0.00 0.04 0.00 0.00 34.50 31.91 5bca s PRO 301 CO -0.11 -0.52 0.78 0.72 0.04 0.00 0.00 177.00 177.91 5bca n HIS 302 N 0.27 -1.86 1.22 0.56 8.25 -0.37 -4.82 115.22 118.46 5bca n HIS 302 Ca 0.03 0.82 0.11 0.00 -0.26 0.00 0.00 57.72 58.41 5bca n HIS 302 Cb 0.42 -3.32 0.61 0.00 1.12 0.00 0.00 29.99 28.82 5bca n HIS 302 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 5bca n GLY 303 N -1.55 -0.87 0.01 -1.41 0.00 -0.90 -2.38 105.19 98.09 5bca n GLY 303 Ca 0.01 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 45.97 5bca n GLY 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5bca n ALA 304 N -1.15 2.48 0.08 4.61 0.00 -1.26 -2.10 120.51 123.17 5bca n ALA 304 Ca 0.14 -0.34 -0.23 0.00 0.00 0.00 0.00 53.44 53.00 5bca n ALA 304 Cb 0.13 -0.45 -0.15 0.00 0.00 0.00 0.00 19.45 18.98 5bca n ALA 304 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 5bca h GLU 305 N 0.00 0.41 -0.01 0.00 5.08 -1.74 -3.28 114.58 115.04 5bca h GLU 305 Ca -0.01 -0.69 0.03 0.00 -1.00 0.00 0.00 59.36 57.68 5bca h GLU 305 Cb 0.67 0.26 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 5bca h GLU 305 CO 0.00 1.33 -0.15 0.87 -1.00 0.00 0.00 179.01 180.06 5bca h LYS 306 N 0.05 -0.24 -0.44 2.33 1.57 -1.58 0.35 116.57 118.60 5bca h LYS 306 Ca -0.32 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 5bca h LYS 306 Cb 2.06 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 34.40 5bca h LYS 306 CO 0.18 -0.16 0.22 -1.35 -0.57 0.00 0.00 179.45 177.77 5bca h PRO 307 N -0.25 0.60 0.00 3.15 0.11 -1.84 0.55 132.00 134.32 5bca h PRO 307 Ca 0.06 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.10 5bca h PRO 307 Cb 0.32 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.31 5bca h PRO 307 CO -0.16 0.46 0.00 0.00 -0.21 0.00 0.00 178.00 178.09 5bca n ALA 308 N -2.47 1.68 0.00 -0.75 0.00 -0.71 -4.58 120.51 113.69 5bca n ALA 308 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 5bca n ALA 308 Cb 0.11 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.26 5bca n ALA 308 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5bca n GLY 309 N 0.04 0.65 3.30 0.00 0.00 0.18 -1.47 105.19 107.90 5bca n GLY 309 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 5bca n GLY 309 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 5bca s TYR 310 N -2.00 4.14 -0.15 1.61 2.02 0.03 -4.53 117.35 118.47 5bca s TYR 310 Ca 0.00 -2.65 0.02 0.00 -0.37 0.00 0.00 57.07 54.07 5bca s TYR 310 Cb 0.00 -3.73 -0.23 0.00 -0.40 0.00 0.00 41.96 37.59 5bca s TYR 310 CO 0.00 -0.92 0.25 -1.71 -1.57 0.00 0.00 175.55 171.59 5bca n ASN 311 N 2.83 1.58 -3.43 2.29 4.05 -1.26 -3.78 115.26 117.53 5bca n ASN 311 Ca 0.22 0.14 -0.19 0.00 0.45 0.00 0.00 54.58 55.20 5bca n ASN 311 Cb 0.40 -0.36 -0.11 0.00 1.23 0.00 0.00 39.78 40.93 5bca n ASN 311 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 5bca s ASP 312 N -6.53 1.94 0.54 1.20 -1.08 -1.26 -4.99 116.67 106.48 5bca s ASP 312 Ca -0.20 -0.77 0.25 0.00 -0.52 0.00 0.00 52.55 51.31 5bca s ASP 312 Cb 0.07 0.35 1.51 0.00 -1.46 0.00 0.00 42.92 43.40 5bca s ASP 312 CO 0.75 -0.39 2.13 1.88 0.52 0.00 0.00 175.17 180.06 5bca h TYR 313 N 8.29 0.00 0.14 -5.34 0.05 -1.97 -2.23 116.97 115.91 5bca h TYR 313 Ca -0.15 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.62 5bca h TYR 313 Cb 1.07 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.82 5bca h TYR 313 CO 0.26 0.08 -0.07 1.03 -1.05 0.00 0.00 178.16 178.41 5bca h SER 314 N 0.00 -0.16 -0.76 3.88 0.87 -1.99 0.01 113.55 115.39 5bca h SER 314 Ca -0.00 -0.24 -0.01 0.00 -1.23 0.00 0.00 61.79 60.31 5bca h SER 314 Cb 0.19 0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.15 5bca h SER 314 CO 0.01 0.16 0.44 0.45 -0.53 0.00 0.00 176.83 177.36 5bca h HIS 315 N -0.50 1.03 -0.20 2.24 3.86 -1.96 -2.03 115.15 117.59 5bca h HIS 315 Ca -0.02 -0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.22 5bca h HIS 315 Cb 0.39 -0.33 -0.04 0.00 1.06 0.00 0.00 27.41 28.49 5bca h HIS 315 CO 0.02 0.71 -0.05 1.25 0.86 0.00 0.00 177.93 180.72 5bca h LEU 316 N 1.05 -0.19 -1.72 2.43 5.85 -0.76 -2.01 115.31 119.97 5bca h LEU 316 Ca 0.27 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 59.02 5bca h LEU 316 Cb 0.00 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 5bca h LEU 316 CO -0.05 -0.07 -0.17 -0.07 -0.34 0.00 0.00 178.44 177.75 5bca h LEU 317 N 0.00 0.00 -2.10 2.25 3.38 -0.86 -0.34 115.31 117.63 5bca h LEU 317 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 5bca h LEU 317 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 5bca h LEU 317 CO -0.21 0.17 -0.08 0.44 0.09 0.00 0.00 178.44 178.85 5bca h ASP 318 N 0.00 0.00 0.03 -0.43 3.32 -0.61 -1.42 116.42 117.31 5bca h ASP 318 Ca -0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 5bca h ASP 318 Cb 0.42 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.98 5bca h ASP 318 CO 0.02 0.08 -0.49 0.00 -1.72 0.00 0.00 179.24 177.13 5bca h ALA 319 N 1.92 0.02 -0.77 3.45 0.00 -0.87 -2.53 119.26 120.48 5bca h ALA 319 Ca -0.00 -0.56 0.14 0.00 0.00 0.00 0.00 54.91 54.49 5bca h ALA 319 Cb 0.20 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 5bca h ALA 319 CO 0.01 0.24 0.51 0.74 0.00 0.00 0.00 179.25 180.75 5bca h PHE 320 N -0.37 0.57 0.33 0.00 -1.00 -1.39 -1.97 116.94 113.12 5bca h PHE 320 Ca -0.07 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.71 5bca h PHE 320 Cb 1.26 -0.18 0.00 0.00 3.61 0.00 0.00 35.95 40.65 5bca h PHE 320 CO 0.18 0.23 -0.16 -0.22 -1.61 0.00 0.00 178.31 176.72 5bca h LYS 321 N 0.49 -0.43 -0.65 1.51 1.63 -1.20 -1.70 116.57 116.22 5bca h LYS 321 Ca 0.37 0.03 -0.05 0.00 -0.85 0.00 0.00 60.65 60.15 5bca h LYS 321 Cb 0.75 0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.46 5bca h LYS 321 CO -0.13 -0.16 0.19 0.66 -3.45 0.00 0.00 179.45 176.57 5bca h SER 322 N -0.67 0.95 0.23 4.20 4.64 -1.23 -2.79 113.55 118.88 5bca h SER 322 Ca -0.05 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 5bca h SER 322 Cb 0.47 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 5bca h SER 322 CO 0.08 0.91 0.00 0.00 -0.87 0.00 0.00 176.83 176.95 5bca n ALA 323 N -2.42 1.72 -3.62 5.18 0.00 -0.76 -4.90 120.51 115.71 5bca n ALA 323 Ca 0.04 -0.06 -0.25 0.00 0.00 0.00 0.00 53.44 53.18 5bca n ALA 323 Cb 0.22 -1.20 0.04 0.00 0.00 0.00 0.00 19.45 18.52 5bca n ALA 323 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 5bca n LYS 324 N -1.29 -2.80 -5.08 0.00 5.02 -0.72 -4.69 118.16 108.61 5bca n LYS 324 Ca 0.06 0.59 -0.32 0.00 -2.02 0.00 0.00 58.31 56.61 5bca n LYS 324 Cb 0.10 -4.83 -0.15 0.00 -0.02 0.00 0.00 35.03 30.12 5bca n LYS 324 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 5bca s LEU 325 N -6.36 2.34 0.77 -0.35 1.43 -0.73 -4.67 118.68 111.10 5bca s LEU 325 Ca 0.28 -0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 5bca s LEU 325 Cb -0.08 -1.47 0.06 0.00 0.03 0.00 0.00 46.19 44.73 5bca s LEU 325 CO 0.82 0.23 1.12 -1.81 0.23 0.00 0.00 176.35 176.95 5bca s ASP 326 N -0.05 4.27 -0.11 2.29 1.01 0.20 -4.67 116.67 119.61 5bca s ASP 326 Ca -0.06 2.02 -0.04 0.00 0.71 0.00 0.00 52.55 55.19 5bca s ASP 326 Cb -0.14 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.20 5bca s ASP 326 CO 0.05 -2.20 0.03 -0.69 0.21 0.00 0.00 175.17 172.57 5bca s VAL 327 N -2.58 4.56 -0.05 -1.27 1.01 -0.20 -2.53 120.40 119.34 5bca s VAL 327 Ca 0.66 -0.14 0.06 0.00 0.00 0.00 0.00 61.98 62.55 5bca s VAL 327 Cb -0.21 -2.96 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 5bca s VAL 327 CO 0.51 0.58 -0.25 -0.89 0.00 0.00 0.00 175.10 175.06 5bca s THR 328 N -0.64 2.11 0.31 3.92 2.01 -0.18 -0.37 115.64 122.80 5bca s THR 328 Ca 0.11 -1.05 0.10 0.00 0.31 0.00 0.00 61.69 61.16 5bca s THR 328 Cb -0.12 -1.76 -0.06 0.00 0.01 0.00 0.00 72.50 70.58 5bca s THR 328 CO 0.02 0.57 -0.14 0.12 -0.69 0.00 0.00 174.62 174.51 5bca s PHE 329 N -0.23 2.29 0.39 4.92 5.36 0.97 -2.39 117.98 129.29 5bca s PHE 329 Ca -0.02 -0.45 0.03 0.00 -0.96 0.00 0.00 56.93 55.54 5bca s PHE 329 Cb -0.13 -1.17 -0.04 0.00 -0.34 0.00 0.00 43.02 41.34 5bca s PHE 329 CO 0.03 0.61 0.09 -0.08 -1.46 0.00 0.00 175.22 174.41 5bca s THR 330 N -2.62 0.86 0.00 0.12 -1.32 -1.26 -0.62 115.64 110.80 5bca s THR 330 Ca 0.31 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.79 5bca s THR 330 Cb -0.01 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.50 5bca s THR 330 CO 0.15 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.56 5bca h LEU 332 N 0.00 0.00 -0.88 0.00 3.38 -1.89 -3.11 115.31 112.81 5bca h LEU 332 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 5bca h LEU 332 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 5bca h LEU 332 CO 0.00 0.00 0.00 -1.84 0.09 0.00 0.00 178.44 176.69 5bca n GLU 333 N -2.95 1.60 -3.16 1.13 0.00 -1.26 -3.71 120.64 112.29 5bca n GLU 333 Ca 0.04 -0.88 -0.20 0.00 0.00 0.00 0.00 57.16 56.13 5bca n GLU 333 Cb 0.51 -1.46 0.01 0.00 0.00 0.00 0.00 31.44 30.50 5bca n GLU 333 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.13 175.49 5bca s MET 334 N -1.95 2.99 0.26 3.44 -1.94 -1.18 -4.79 119.30 116.14 5bca s MET 334 Ca 0.37 -0.85 0.11 0.00 -1.71 0.00 0.00 55.69 53.61 5bca s MET 334 Cb 0.20 -2.69 -0.05 0.00 2.01 0.00 0.00 34.83 34.30 5bca s MET 334 CO 0.32 -0.18 -0.15 0.95 -0.01 0.00 0.00 175.02 175.94 5bca s THR 335 N -2.39 2.73 0.40 2.05 -4.23 -1.26 -4.24 115.64 108.70 5bca s THR 335 Ca 0.49 -2.22 -0.26 0.00 -1.18 0.00 0.00 61.69 58.52 5bca s THR 335 Cb -0.10 -2.42 -0.09 0.00 1.34 0.00 0.00 72.50 71.23 5bca s THR 335 CO 0.34 -0.35 1.32 -1.81 -0.54 0.00 0.00 174.62 173.58 5bca s ASP 336 N -3.43 6.33 0.00 3.99 1.01 -1.26 -4.41 116.67 118.91 5bca s ASP 336 Ca 0.29 2.69 0.00 0.00 0.71 0.00 0.00 52.55 56.24 5bca s ASP 336 Cb -0.06 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.23 5bca s ASP 336 CO 0.16 -0.84 0.00 0.29 0.21 0.00 0.00 175.17 174.99 5bca n LYS 337 N 0.19 0.00 -0.61 8.23 4.76 0.52 -5.00 118.16 126.25 5bca n LYS 337 Ca 0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 5bca n LYS 337 Cb 0.43 -0.08 0.00 0.00 -1.84 0.00 0.00 35.03 33.54 5bca n LYS 337 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 5bca n GLY 338 N 3.20 0.75 3.77 0.72 0.00 -0.90 -4.93 105.19 107.81 5bca n GLY 338 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 5bca n GLY 338 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 5bca s SER 339 N -2.51 4.47 0.40 1.61 1.04 -1.26 -4.71 113.70 112.74 5bca s SER 339 Ca 0.00 -1.13 -0.23 0.00 0.48 0.00 0.00 55.95 55.07 5bca s SER 339 Cb 0.00 -0.27 -0.10 0.00 0.10 0.00 0.00 66.02 65.75 5bca s SER 339 CO 0.00 -0.66 1.00 -0.47 0.98 0.00 0.00 173.24 174.09 5bca s TYR 340 N -2.64 3.34 -2.02 5.02 6.14 -1.26 0.06 117.35 125.98 5bca s TYR 340 Ca 0.38 1.66 0.25 0.00 0.64 0.00 0.00 57.07 60.00 5bca s TYR 340 Cb 0.02 -3.01 0.54 0.00 0.42 0.00 0.00 41.96 39.94 5bca s TYR 340 CO 0.21 -0.34 1.44 -0.35 0.64 0.00 0.00 175.55 177.14 5bca n PRO 341 N -0.19 1.16 0.05 4.97 -0.04 -1.26 -4.83 135.00 134.86 5bca n PRO 341 Ca 0.05 -0.80 -0.02 0.00 -0.04 0.00 0.00 63.50 62.70 5bca n PRO 341 Cb 0.51 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.41 5bca n PRO 341 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 5bca h GLU 342 N 1.95 0.00 -6.34 0.54 3.07 -1.83 -3.47 114.58 108.50 5bca h GLU 342 Ca 0.00 0.00 -0.47 0.00 -0.50 0.00 0.00 59.36 58.39 5bca h GLU 342 Cb 0.61 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.51 5bca h GLU 342 CO 0.00 0.43 -0.87 0.66 -1.40 0.00 0.00 179.01 177.83 5bca n TYR 343 N -3.03 -1.75 -3.43 4.33 4.01 0.11 -0.89 117.16 116.51 5bca n TYR 343 Ca -0.07 0.75 -0.40 0.00 -0.16 0.00 0.00 57.90 58.01 5bca n TYR 343 Cb 0.86 -3.92 -0.10 0.00 -0.31 0.00 0.00 39.34 35.88 5bca n TYR 343 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 5bca s SER 344 N -4.28 6.16 -0.51 7.72 0.15 -1.26 -2.47 113.70 119.20 5bca s SER 344 Ca 0.05 -0.14 0.07 0.00 0.70 0.00 0.00 55.95 56.63 5bca s SER 344 Cb -0.02 -2.19 0.34 0.00 -1.71 0.00 0.00 66.02 62.45 5bca s SER 344 CO 0.86 -0.27 0.87 0.23 1.20 0.00 0.00 173.24 176.12 5bca n MET 345 N 5.31 2.47 -0.05 5.44 2.81 -0.85 -0.36 117.12 131.90 5bca n MET 345 Ca -0.10 -4.37 -0.08 0.00 -1.81 0.00 0.00 57.70 51.33 5bca n MET 345 Cb 0.50 -2.06 -0.02 0.00 -0.71 0.00 0.00 33.22 30.93 5bca n MET 345 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 5bca h PRO 346 N 3.06 0.09 -0.66 0.03 0.13 -1.77 -1.34 132.00 131.54 5bca h PRO 346 Ca 0.12 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.22 5bca h PRO 346 Cb 0.66 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.74 5bca h PRO 346 CO 0.72 0.06 0.30 -0.22 -0.23 0.00 0.00 178.00 178.63 5bca h LYS 347 N 0.09 0.97 -0.60 0.86 3.64 -1.80 0.11 116.57 119.83 5bca h LYS 347 Ca 0.10 -0.15 0.02 0.00 -1.27 0.00 0.00 60.65 59.35 5bca h LYS 347 Cb 0.12 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 5bca h LYS 347 CO -0.16 0.78 0.38 1.15 -2.27 0.00 0.00 179.45 179.33 5bca h THR 348 N 0.92 1.10 0.14 1.00 2.02 -1.92 -1.21 112.91 114.96 5bca h THR 348 Ca 0.23 -0.26 0.01 0.00 0.77 0.00 0.00 66.41 67.15 5bca h THR 348 Cb 0.14 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 5bca h THR 348 CO -0.03 0.14 -0.19 0.25 0.37 0.00 0.00 175.52 176.06 5bca h LEU 349 N 0.76 -0.52 -0.55 2.58 6.46 -0.33 -1.82 115.31 121.90 5bca h LEU 349 Ca 0.24 0.06 0.03 0.00 -0.12 0.00 0.00 57.88 58.08 5bca h LEU 349 Cb -0.02 0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.06 5bca h LEU 349 CO -0.08 -0.27 0.32 0.58 -0.62 0.00 0.00 178.44 178.36 5bca h VAL 350 N -0.38 1.03 -0.42 1.05 2.07 -0.64 -2.20 116.25 116.76 5bca h VAL 350 Ca 0.01 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.36 5bca h VAL 350 Cb 0.38 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 5bca h VAL 350 CO -0.08 0.11 0.20 1.56 0.02 0.00 0.00 177.57 179.38 5bca h GLN 351 N 0.62 0.39 -0.65 1.57 4.20 -1.07 -0.66 115.11 119.51 5bca h GLN 351 Ca 0.23 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.85 5bca h GLN 351 Cb 0.07 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 5bca h GLN 351 CO -0.12 0.26 0.14 -0.97 -0.67 0.00 0.00 178.83 177.47 5bca h ASN 352 N 0.40 0.99 -0.10 1.46 -0.73 -1.07 -2.35 115.58 114.18 5bca h ASN 352 Ca 0.18 -0.21 -0.04 0.00 1.87 0.00 0.00 56.30 58.10 5bca h ASN 352 Cb 0.10 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.43 5bca h ASN 352 CO -0.14 0.96 -0.10 0.40 -0.37 0.00 0.00 177.43 178.18 5bca h ILE 353 N 0.99 1.36 -0.45 2.57 1.08 -1.28 -1.84 117.51 119.95 5bca h ILE 353 Ca 0.21 -1.26 0.08 0.00 -0.39 0.00 0.00 64.86 63.49 5bca h ILE 353 Cb 0.37 1.99 -0.07 0.00 -3.07 0.00 0.00 36.82 36.04 5bca h ILE 353 CO 0.00 0.36 0.01 0.00 -0.69 0.00 0.00 178.15 177.83 5bca h ALA 354 N 0.57 0.42 -0.26 1.87 0.00 -1.17 -0.59 119.26 120.11 5bca h ALA 354 Ca 0.01 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.07 5bca h ALA 354 Cb 0.62 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 5bca h ALA 354 CO 0.02 -0.38 0.12 1.15 0.00 0.00 0.00 179.25 180.16 5bca h THR 355 N 0.12 0.98 -0.66 0.00 2.02 -1.41 0.14 112.91 114.10 5bca h THR 355 Ca 0.22 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.29 5bca h THR 355 Cb 0.32 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 5bca h THR 355 CO -0.36 0.05 0.34 -0.07 0.37 0.00 0.00 175.52 175.84 5bca h LEU 356 N 0.26 0.82 0.10 2.58 3.38 -0.72 -2.03 115.31 119.71 5bca h LEU 356 Ca 0.11 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 5bca h LEU 356 Cb 0.04 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.58 5bca h LEU 356 CO -0.08 0.68 -0.05 0.00 0.09 0.00 0.00 178.44 179.08 5bca h ALA 357 N 1.45 -0.14 -0.93 1.53 0.00 -0.70 -1.43 119.26 119.03 5bca h ALA 357 Ca 0.23 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.98 5bca h ALA 357 Cb 0.06 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 5bca h ALA 357 CO -0.03 -0.35 0.61 -0.91 0.00 0.00 0.00 179.25 178.56 5bca h ASN 358 N -0.60 0.96 -0.20 0.00 2.35 -0.66 -1.27 115.58 116.16 5bca h ASN 358 Ca -0.01 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.74 5bca h ASN 358 Cb 0.48 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 5bca h ASN 358 CO 0.02 0.63 0.12 -0.08 -1.65 0.00 0.00 177.43 176.47 5bca h GLU 359 N 1.10 0.24 -0.00 0.81 4.81 -1.34 -2.49 114.58 117.70 5bca h GLU 359 Ca 0.39 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.61 5bca h GLU 359 Cb 0.14 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.47 5bca h GLU 359 CO -0.14 0.16 -0.00 1.63 -0.73 0.00 0.00 179.01 179.92 5bca n LYS 360 N -4.97 1.02 -2.24 1.92 5.02 -0.54 -4.90 118.16 113.46 5bca n LYS 360 Ca -0.03 -0.11 -0.08 0.00 -2.02 0.00 0.00 58.31 56.07 5bca n LYS 360 Cb 0.04 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.55 5bca n LYS 360 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 5bca n GLY 361 N 1.05 0.07 3.67 0.72 0.00 -0.57 -5.02 105.19 105.11 5bca n GLY 361 Ca 0.22 -0.52 -0.38 0.00 0.00 0.00 0.00 46.02 45.34 5bca n GLY 361 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5bca s ILE 362 N -2.49 5.16 0.22 -0.61 1.01 -0.66 -5.04 121.20 118.79 5bca s ILE 362 Ca 0.02 0.83 -0.31 0.00 0.00 0.00 0.00 60.65 61.19 5bca s ILE 362 Cb -0.01 -3.78 -0.10 0.00 0.01 0.00 0.00 42.46 38.57 5bca s ILE 362 CO 0.03 0.23 1.53 -0.69 0.00 0.00 0.00 174.94 176.05 5bca s VAL 363 N 1.36 2.51 -0.09 2.92 1.01 -1.26 -4.50 120.40 122.34 5bca s VAL 363 Ca 0.22 0.40 0.04 0.00 0.00 0.00 0.00 61.98 62.63 5bca s VAL 363 Cb -0.15 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 5bca s VAL 363 CO 0.09 0.05 -0.22 -0.22 0.00 0.00 0.00 175.10 174.79 5bca s LEU 364 N 0.31 2.21 0.23 3.92 2.96 -1.26 -1.03 118.68 126.02 5bca s LEU 364 Ca 0.65 -0.50 0.11 0.00 -0.22 0.00 0.00 54.13 54.17 5bca s LEU 364 Cb -0.44 -1.44 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 5bca s LEU 364 CO 0.38 0.18 -0.22 0.20 -1.32 0.00 0.00 176.35 175.58 5bca s ASN 365 N 0.20 3.43 0.15 3.68 -0.87 0.50 -0.65 114.94 121.38 5bca s ASN 365 Ca -0.14 -0.94 0.03 0.00 -1.57 0.00 0.00 52.86 50.24 5bca s ASN 365 Cb -0.17 -0.26 -0.04 0.00 -0.02 0.00 0.00 41.25 40.75 5bca s ASN 365 CO 0.07 0.07 -0.07 -0.83 -2.57 0.00 0.00 177.10 173.77 5bca s GLY 366 N -3.06 1.08 0.03 0.66 0.00 -0.52 -0.02 107.32 105.49 5bca s GLY 366 Ca 0.25 -1.51 -0.01 0.00 0.00 0.00 0.00 44.72 43.45 5bca s GLY 366 CO 0.12 -1.56 -0.01 -0.54 0.00 0.00 0.00 173.10 171.11 5bca s GLU 367 N -3.80 0.45 0.56 2.90 2.02 0.21 -0.19 118.70 120.85 5bca s GLU 367 Ca 0.18 -0.82 -0.18 0.00 0.02 0.00 0.00 54.97 54.17 5bca s GLU 367 Cb 0.04 0.16 -0.05 0.00 0.10 0.00 0.00 34.13 34.38 5bca s GLU 367 CO 0.01 -0.08 1.10 0.54 0.02 0.00 0.00 175.26 176.85 5bca s ASN 368 N -2.01 5.72 -0.05 -0.19 4.22 -1.23 -2.31 114.94 119.09 5bca s ASN 368 Ca -0.07 2.06 0.06 0.00 -2.14 0.00 0.00 52.86 52.77 5bca s ASN 368 Cb -0.03 -2.57 -0.24 0.00 1.28 0.00 0.00 41.25 39.69 5bca s ASN 368 CO -0.04 -1.21 0.64 0.00 -2.04 0.00 0.00 177.10 174.44 5bca h ALA 369 N 0.95 0.64 -2.22 3.54 0.00 -1.92 -3.43 119.26 116.82 5bca h ALA 369 Ca -0.49 -1.40 -0.35 0.00 0.00 0.00 0.00 54.91 52.67 5bca h ALA 369 Cb 1.25 0.50 -0.14 0.00 0.00 0.00 0.00 17.79 19.39 5bca h ALA 369 CO 0.57 1.47 -0.70 -0.51 0.00 0.00 0.00 179.25 180.08 5bca s LEU 370 N -6.42 2.42 0.69 0.00 1.43 -1.26 -5.00 118.68 110.54 5bca s LEU 370 Ca -0.09 -1.08 -0.16 0.00 -1.03 0.00 0.00 54.13 51.77 5bca s LEU 370 Cb 0.08 -0.34 0.02 0.00 0.03 0.00 0.00 46.19 45.97 5bca s LEU 370 CO 0.81 -0.38 1.21 -0.44 0.23 0.00 0.00 176.35 177.78 5bca s SER 371 N -3.22 4.48 -0.22 2.29 0.01 -1.26 -4.97 113.70 110.80 5bca s SER 371 Ca 0.21 2.37 -0.04 0.00 1.31 0.00 0.00 55.95 59.80 5bca s SER 371 Cb 0.03 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.66 5bca s SER 371 CO 0.04 -2.07 -0.02 -0.63 0.41 0.00 0.00 173.24 170.96 5bca s ILE 372 N -1.87 3.56 -1.93 1.44 1.01 -1.26 -4.94 121.20 117.22 5bca s ILE 372 Ca 0.75 -0.43 0.16 0.00 0.00 0.00 0.00 60.65 61.13 5bca s ILE 372 Cb -0.30 -2.63 0.12 0.00 0.01 0.00 0.00 42.46 39.66 5bca s ILE 372 CO 0.42 0.41 0.99 0.61 0.00 0.00 0.00 174.94 177.37 5bca n GLY 373 N 4.75 0.13 3.37 6.18 0.00 -1.26 -4.97 105.19 113.39 5bca n GLY 373 Ca -0.18 -0.45 -0.15 0.00 0.00 0.00 0.00 46.02 45.24 5bca n GLY 373 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 5bca s ASN 374 N -1.34 -0.39 0.65 1.61 2.20 -1.26 -5.02 114.94 111.38 5bca s ASN 374 Ca 0.18 0.31 0.32 0.00 -0.94 0.00 0.00 52.86 52.72 5bca s ASN 374 Cb 0.13 0.43 1.73 0.00 -2.00 0.00 0.00 41.25 41.53 5bca s ASN 374 CO 0.21 -0.56 2.01 1.05 -2.94 0.00 0.00 177.10 176.86 5bca h GLU 375 N 3.33 0.00 0.00 3.55 4.11 -1.97 -0.88 114.58 122.72 5bca h GLU 375 Ca -0.29 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.07 5bca h GLU 375 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 5bca h GLU 375 CO 0.40 0.00 -0.36 1.49 0.07 0.00 0.00 179.01 180.62 5bca h GLU 376 N 0.00 0.00 -0.02 1.06 4.57 -2.00 -2.24 114.58 115.95 5bca h GLU 376 Ca 0.04 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 58.03 5bca h GLU 376 Cb 0.62 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.20 5bca h GLU 376 CO -0.00 0.36 -0.83 0.93 -1.18 0.00 0.00 179.01 178.29 5bca h GLU 377 N 0.00 0.28 -0.96 1.92 5.08 -1.51 -2.87 114.58 116.52 5bca h GLU 377 Ca -0.00 -0.28 0.05 0.00 -1.00 0.00 0.00 59.36 58.13 5bca h GLU 377 Cb 0.64 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.90 5bca h GLU 377 CO 0.05 0.96 0.62 1.88 -1.00 0.00 0.00 179.01 181.52 5bca h TYR 378 N 0.17 1.16 -0.29 4.33 0.05 -1.57 -1.91 116.97 118.91 5bca h TYR 378 Ca -0.04 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.72 5bca h TYR 378 Cb 1.43 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 38.77 5bca h TYR 378 CO 0.04 0.62 -0.04 0.87 -1.05 0.00 0.00 178.16 178.60 5bca h LYS 379 N 1.16 0.46 -0.01 4.88 1.57 -1.19 0.59 116.57 124.02 5bca h LYS 379 Ca 0.40 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 59.08 5bca h LYS 379 Cb 0.10 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 5bca h LYS 379 CO -0.15 0.52 -0.00 0.00 -0.57 0.00 0.00 179.45 179.24 5bca h ARG 380 N 0.44 0.02 -0.40 3.15 3.08 -1.31 -1.94 114.38 117.41 5bca h ARG 380 Ca 0.09 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.22 5bca h ARG 380 Cb 0.35 -0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.32 5bca h ARG 380 CO 0.01 0.34 -0.10 0.28 -1.07 0.00 0.00 179.97 179.43 5bca h VAL 381 N -0.31 0.60 -0.94 2.04 2.07 -0.74 0.14 116.25 119.11 5bca h VAL 381 Ca 0.00 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.72 5bca h VAL 381 Cb 0.33 0.60 -0.08 0.00 -1.52 0.00 0.00 31.29 30.62 5bca h VAL 381 CO 0.00 0.00 0.61 0.00 0.02 0.00 0.00 177.57 178.20 5bca h ALA 382 N 1.40 2.04 -0.11 1.67 0.00 0.37 0.14 119.26 124.78 5bca h ALA 382 Ca 0.19 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 5bca h ALA 382 Cb 0.29 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 5bca h ALA 382 CO -0.41 -0.35 -0.05 1.49 0.00 0.00 0.00 179.25 179.93 5bca h GLU 383 N 0.53 0.22 -0.19 0.00 4.81 0.04 -1.34 114.58 118.65 5bca h GLU 383 Ca 0.50 -0.10 -0.19 0.00 -0.13 0.00 0.00 59.36 59.44 5bca h GLU 383 Cb 1.08 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.46 5bca h GLU 383 CO -0.24 0.58 -0.66 0.52 -0.73 0.00 0.00 179.01 178.48 5bca h MET 384 N -0.13 0.70 0.69 1.92 2.86 -0.73 -2.56 114.93 117.68 5bca h MET 384 Ca 0.02 -0.51 -0.03 0.00 -2.06 0.00 0.00 59.70 57.12 5bca h MET 384 Cb 0.51 0.09 0.01 0.00 0.06 0.00 0.00 31.60 32.26 5bca h MET 384 CO 0.02 1.13 -0.33 0.00 1.06 0.00 0.00 176.91 178.78 5bca h ALA 385 N 0.74 -1.06 0.00 6.32 0.00 -0.70 -0.53 119.26 124.03 5bca h ALA 385 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.69 5bca h ALA 385 Cb 1.26 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.41 5bca h ALA 385 CO 0.13 -1.00 0.00 1.19 0.00 0.00 0.00 179.25 179.58 5bca n PHE 386 N -4.94 0.00 -0.01 0.00 3.72 -0.51 -2.69 117.46 113.03 5bca n PHE 386 Ca -0.12 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.31 5bca n PHE 386 Cb 0.37 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.85 5bca n PHE 386 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 5bca n ASN 387 N -0.99 3.29 -1.55 4.37 3.02 -0.96 -4.07 115.26 118.37 5bca n ASN 387 Ca 0.21 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.80 5bca n ASN 387 Cb 0.10 1.26 0.33 0.00 -0.61 0.00 0.00 39.78 40.85 5bca n ASN 387 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 5bca n TYR 388 N -1.82 1.74 -2.89 3.10 4.02 -0.22 -1.79 117.16 119.30 5bca n TYR 388 Ca -0.03 -0.92 -0.16 0.00 -0.01 0.00 0.00 57.90 56.79 5bca n TYR 388 Cb 0.26 -0.49 0.03 0.00 -0.02 0.00 0.00 39.34 39.13 5bca n TYR 388 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 5bca n ASN 389 N -0.01 -4.77 -4.76 7.72 5.15 -1.23 -4.90 115.26 112.47 5bca n ASN 389 Ca 0.29 -0.24 -0.41 0.00 -0.60 0.00 0.00 54.58 53.62 5bca n ASN 389 Cb 1.13 -3.56 -0.03 0.00 -0.53 0.00 0.00 39.78 36.79 5bca n ASN 389 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 5bca s PHE 390 N -3.03 3.32 -0.20 1.20 0.40 -1.10 -4.73 117.98 113.83 5bca s PHE 390 Ca 0.25 1.51 0.18 0.00 -0.60 0.00 0.00 56.93 58.28 5bca s PHE 390 Cb -0.11 -3.49 0.03 0.00 0.51 0.00 0.00 43.02 39.95 5bca s PHE 390 CO 0.32 -1.28 1.19 0.00 0.70 0.00 0.00 175.22 176.15 5bca h ALA 391 N 3.90 0.68 -2.57 5.36 0.00 -1.23 -3.41 119.26 121.98 5bca h ALA 391 Ca -0.47 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 53.92 5bca h ALA 391 Cb 1.22 0.06 -0.16 0.00 0.00 0.00 0.00 17.79 18.91 5bca h ALA 391 CO 0.68 0.52 -0.22 0.20 0.00 0.00 0.00 179.25 180.43 5bca s GLY 392 N -4.52 -0.14 -0.08 0.00 0.00 -1.23 -0.89 107.32 100.46 5bca s GLY 392 Ca 0.01 -0.03 0.01 0.00 0.00 0.00 0.00 44.72 44.71 5bca s GLY 392 CO 0.76 -0.26 -0.10 -0.12 0.00 0.00 0.00 173.10 173.39 5bca s PHE 393 N -2.87 1.40 -0.19 1.90 5.36 -0.42 -1.44 117.98 121.72 5bca s PHE 393 Ca -0.03 -0.57 -0.05 0.00 -0.96 0.00 0.00 56.93 55.32 5bca s PHE 393 Cb 0.00 -1.09 -0.03 0.00 -0.34 0.00 0.00 43.02 41.57 5bca s PHE 393 CO -0.05 -0.35 -0.00 0.99 -1.46 0.00 0.00 175.22 174.35 5bca s THR 394 N 1.03 4.01 -0.31 0.12 2.01 0.73 -0.68 115.64 122.56 5bca s THR 394 Ca -0.08 -0.30 -0.22 0.00 0.31 0.00 0.00 61.69 61.41 5bca s THR 394 Cb -0.15 -2.80 -0.00 0.00 0.01 0.00 0.00 72.50 69.56 5bca s THR 394 CO -0.01 0.44 0.70 -0.22 -0.69 0.00 0.00 174.62 174.85 5bca s LEU 395 N 0.80 4.12 -0.23 4.42 2.96 -0.96 -3.56 118.68 126.24 5bca s LEU 395 Ca 0.00 0.52 -0.18 0.00 -0.22 0.00 0.00 54.13 54.25 5bca s LEU 395 Cb -0.14 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.59 5bca s LEU 395 CO 0.02 -0.55 0.52 -0.76 -1.32 0.00 0.00 176.35 174.26 5bca s LEU 396 N 2.77 4.11 0.16 -0.68 1.02 -1.26 -1.74 118.68 123.06 5bca s LEU 396 Ca 0.28 0.61 -0.11 0.00 0.02 0.00 0.00 54.13 54.93 5bca s LEU 396 Cb -0.15 -2.69 0.00 0.00 0.02 0.00 0.00 46.19 43.38 5bca s LEU 396 CO 0.12 -0.23 0.34 -0.60 0.02 0.00 0.00 176.35 176.00 5bca s ARG 397 N 1.93 1.18 0.10 1.70 3.52 -1.26 -4.56 118.95 121.55 5bca s ARG 397 Ca 0.23 -1.05 -0.17 0.00 -0.13 0.00 0.00 55.73 54.60 5bca s ARG 397 Cb -0.15 0.41 -0.02 0.00 -1.56 0.00 0.00 34.95 33.63 5bca s ARG 397 CO 0.09 -0.45 0.90 0.98 -0.81 0.00 0.00 175.30 176.02 5bca n TYR 398 N -0.23 -0.23 -0.06 5.12 4.19 -0.63 -1.70 117.16 123.62 5bca n TYR 398 Ca -0.09 0.73 0.04 0.00 3.31 0.00 0.00 57.90 61.89 5bca n TYR 398 Cb 0.63 -0.56 0.39 0.00 0.49 0.00 0.00 39.34 40.28 5bca n TYR 398 CO 0.00 0.00 0.00 -0.56 0.91 0.00 0.00 176.86 177.21 5bca h GLN 399 N 0.00 0.64 -0.56 2.98 -0.00 -1.96 -0.47 115.11 115.74 5bca h GLN 399 Ca 0.10 -0.04 0.01 0.00 -0.00 0.00 0.00 58.65 58.73 5bca h GLN 399 Cb 0.25 -0.14 -0.03 0.00 -0.00 0.00 0.00 27.48 27.56 5bca h GLN 399 CO -0.55 0.42 0.36 -0.44 -0.00 0.00 0.00 178.83 178.62 5bca h ASP 400 N 0.66 0.61 0.50 0.06 3.32 -1.71 -1.47 116.42 118.38 5bca h ASP 400 Ca 0.19 -0.01 -0.25 0.00 0.02 0.00 0.00 57.03 56.98 5bca h ASP 400 Cb -0.02 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.34 5bca h ASP 400 CO -0.05 0.44 -1.69 1.33 -1.72 0.00 0.00 179.24 177.55 5bca n VAL 401 N -4.72 1.43 0.10 -1.35 0.24 -1.13 -4.00 118.33 108.90 5bca n VAL 401 Ca 0.04 -0.76 -0.13 0.00 -2.04 0.00 0.00 64.34 61.44 5bca n VAL 401 Cb 0.04 -0.87 -0.08 0.00 -1.47 0.00 0.00 33.84 31.46 5bca n VAL 401 CO 0.00 0.00 0.00 -0.03 -2.14 0.00 0.00 176.83 174.66 5bca h MET 402 N 0.00 -0.18 -0.93 7.34 -1.53 -0.93 -2.55 114.93 116.15 5bca h MET 402 Ca -0.27 0.01 -0.10 0.00 -3.44 0.00 0.00 59.70 55.91 5bca h MET 402 Cb 1.88 0.04 -0.06 0.00 -0.55 0.00 0.00 31.60 32.92 5bca h MET 402 CO 0.06 -0.06 0.12 0.66 0.14 0.00 0.00 176.91 177.84 5bca n TYR 403 N -5.14 0.91 -3.36 1.39 4.01 -0.57 -4.58 117.16 109.83 5bca n TYR 403 Ca -0.08 -0.64 -0.15 0.00 -0.16 0.00 0.00 57.90 56.87 5bca n TYR 403 Cb 0.13 -0.38 -0.08 0.00 -0.31 0.00 0.00 39.34 38.70 5bca n TYR 403 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 5bca s ASN 404 N -0.01 1.11 0.52 7.72 3.84 -0.96 -5.02 114.94 122.14 5bca s ASN 404 Ca 0.19 -1.10 0.27 0.00 0.21 0.00 0.00 52.86 52.43 5bca s ASN 404 Cb 0.16 0.68 1.44 0.00 -0.55 0.00 0.00 41.25 42.98 5bca s ASN 404 CO 0.05 -0.31 2.08 0.78 -2.79 0.00 0.00 177.10 176.90 5bca h ASN 405 N 7.62 0.00 0.05 -4.21 -0.26 -1.81 -2.71 115.58 114.26 5bca h ASN 405 Ca -0.03 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.71 5bca h ASN 405 Cb 1.08 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.34 5bca h ASN 405 CO 0.25 0.11 -0.02 0.28 -1.06 0.00 0.00 177.43 176.99 5bca h SER 406 N 0.00 -0.06 -0.28 5.81 0.02 -1.95 -2.95 113.55 114.14 5bca h SER 406 Ca -0.00 -0.20 -0.06 0.00 -0.84 0.00 0.00 61.79 60.69 5bca h SER 406 Cb 0.31 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 5bca h SER 406 CO 0.01 0.16 -0.07 -0.07 -1.14 0.00 0.00 176.83 175.73 5bca h LEU 407 N -0.28 0.55 -0.59 5.07 3.38 -1.85 -2.98 115.31 118.62 5bca h LEU 407 Ca -0.01 -0.36 0.11 0.00 0.09 0.00 0.00 57.88 57.71 5bca h LEU 407 Cb 0.25 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.77 5bca h LEU 407 CO 0.01 0.79 0.13 -0.03 0.09 0.00 0.00 178.44 179.43 5bca h MET 408 N 0.31 0.25 -0.07 1.13 4.05 -1.52 0.86 114.93 119.94 5bca h MET 408 Ca 0.07 -0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.42 5bca h MET 408 Cb 0.55 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 5bca h MET 408 CO 0.03 0.17 -0.24 0.78 0.23 0.00 0.00 176.91 177.87 5bca h GLY 409 N 0.26 0.12 0.65 1.39 0.00 -1.51 0.49 103.07 104.47 5bca h GLY 409 Ca 0.31 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.54 5bca h GLY 409 CO -0.40 0.08 -0.03 0.50 0.00 0.00 0.00 176.54 176.69 5bca h LYS 410 N 0.10 0.12 0.02 4.80 1.79 0.49 -2.04 116.57 121.85 5bca h LYS 410 Ca 0.02 -0.05 0.03 0.00 -2.18 0.00 0.00 60.65 58.46 5bca h LYS 410 Cb 0.49 -0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.10 5bca h LYS 410 CO 0.03 0.50 -0.21 0.35 -1.08 0.00 0.00 179.45 179.05 5bca h PHE 411 N -0.27 -0.55 -0.12 -1.35 3.04 0.11 -0.92 116.94 116.89 5bca h PHE 411 Ca 0.01 0.02 0.04 0.00 3.98 0.00 0.00 57.97 62.02 5bca h PHE 411 Cb 0.47 0.24 -0.05 0.00 2.56 0.00 0.00 35.95 39.16 5bca h PHE 411 CO 0.07 -0.29 -0.18 -0.22 -2.02 0.00 0.00 178.31 175.66 5bca h LYS 412 N -0.34 -0.23 -0.68 1.11 3.64 -0.04 0.34 116.57 120.36 5bca h LYS 412 Ca 0.05 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.55 5bca h LYS 412 Cb 0.41 0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.21 5bca h LYS 412 CO -0.17 -0.15 0.31 0.22 -2.27 0.00 0.00 179.45 177.38 5bca h ASP 413 N -0.24 0.37 0.13 4.20 3.58 -0.92 -2.56 116.42 120.99 5bca h ASP 413 Ca 0.10 0.07 -0.36 0.00 0.42 0.00 0.00 57.03 57.26 5bca h ASP 413 Cb 0.38 0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.40 5bca h ASP 413 CO -0.26 0.20 -2.15 0.18 -2.88 0.00 0.00 179.24 174.34 5bca n LEU 414 N -4.92 2.07 0.00 2.28 4.77 -0.39 -4.67 117.00 116.14 5bca n LEU 414 Ca 0.11 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 5bca n LEU 414 Cb 0.29 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 5bca n LEU 414 CO 0.23 0.75 -0.35 0.18 -1.33 0.00 0.00 177.39 176.87 5bca n LEU 415 N -3.24 0.00 -2.86 2.23 4.77 0.11 -4.85 117.00 113.17 5bca n LEU 415 Ca -0.34 -0.11 -0.31 0.00 -0.03 0.00 0.00 56.01 55.23 5bca n LEU 415 Cb 1.05 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.08 5bca n LEU 415 CO 0.38 0.00 2.10 0.61 -1.33 0.00 0.00 177.39 179.16 5bca n GLY 416 N 1.99 4.42 3.71 -0.72 0.00 -0.49 -4.73 105.19 109.36 5bca n GLY 416 Ca 0.00 -1.79 -0.27 0.00 0.00 0.00 0.00 46.02 43.96 5bca n GLY 416 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 5bca s VAL 417 N -0.80 3.98 -0.29 1.61 -7.23 -1.26 -4.33 120.40 112.08 5bca s VAL 417 Ca 0.60 -1.27 -0.07 0.00 -1.81 0.00 0.00 61.98 59.43 5bca s VAL 417 Cb 0.28 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 34.23 5bca s VAL 417 CO -0.12 -0.08 0.08 -0.89 -0.31 0.00 0.00 175.10 173.77 5bca s THR 418 N -1.68 4.01 0.35 5.32 2.01 -1.26 -4.85 115.64 119.54 5bca s THR 418 Ca 0.28 -0.62 -0.27 0.00 0.31 0.00 0.00 61.69 61.40 5bca s THR 418 Cb -0.10 -3.04 -0.09 0.00 0.01 0.00 0.00 72.50 69.28 5bca s THR 418 CO 0.20 0.12 1.11 -2.16 -0.69 0.00 0.00 174.62 173.20 5bca s PRO 419 N 1.52 4.33 -0.05 4.92 0.04 -1.26 -0.20 135.00 144.30 5bca s PRO 419 Ca 0.03 1.74 -0.07 0.00 0.04 0.00 0.00 61.00 62.74 5bca s PRO 419 Cb -0.17 -2.86 0.01 0.00 0.04 0.00 0.00 34.50 31.53 5bca s PRO 419 CO 0.03 -0.05 0.19 0.54 0.04 0.00 0.00 177.00 177.74 5bca s VAL 420 N -1.37 0.03 0.29 -0.36 0.11 -0.67 -4.88 120.40 113.54 5bca s VAL 420 Ca 0.52 -0.22 -0.29 0.00 -2.93 0.00 0.00 61.98 59.06 5bca s VAL 420 Cb -0.29 -0.34 -0.10 0.00 -1.53 0.00 0.00 36.38 34.12 5bca s VAL 420 CO 0.37 -0.12 1.10 -0.32 -3.33 0.00 0.00 175.10 172.80 5bca s MET 421 N -0.39 4.59 0.06 1.54 1.75 -1.26 -0.84 119.30 124.74 5bca s MET 421 Ca -0.05 1.80 -0.04 0.00 -1.25 0.00 0.00 55.69 56.15 5bca s MET 421 Cb -0.03 -3.13 -0.02 0.00 2.84 0.00 0.00 34.83 34.48 5bca s MET 421 CO 0.01 0.17 0.05 -0.65 -0.65 0.00 0.00 175.02 173.95 5bca s GLN 422 N -1.54 0.65 -0.19 4.11 -1.52 -0.46 -4.12 119.66 116.59 5bca s GLN 422 Ca 0.46 -1.02 -0.01 0.00 -1.95 0.00 0.00 55.36 52.83 5bca s GLN 422 Cb -0.32 0.24 0.00 0.00 -0.22 0.00 0.00 33.01 32.72 5bca s GLN 422 CO 0.41 -0.15 -0.11 0.99 -0.25 0.00 0.00 175.29 176.17 5bca s THR 423 N -3.48 2.85 -0.21 -0.19 2.01 -1.05 0.28 115.64 115.85 5bca s THR 423 Ca 0.03 -0.68 -0.06 0.00 0.31 0.00 0.00 61.69 61.29 5bca s THR 423 Cb 0.04 -2.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.27 5bca s THR 423 CO -0.09 0.48 0.03 -0.63 -0.69 0.00 0.00 174.62 173.72 5bca s ILE 424 N 1.23 4.19 -0.10 1.82 -1.09 -0.62 0.12 121.20 126.75 5bca s ILE 424 Ca 0.02 -0.23 0.03 0.00 -2.23 0.00 0.00 60.65 58.24 5bca s ILE 424 Cb -0.14 -2.91 0.01 0.00 -1.58 0.00 0.00 42.46 37.84 5bca s ILE 424 CO -0.05 0.41 -0.19 -0.69 -1.23 0.00 0.00 174.94 173.19 5bca s VAL 425 N 1.02 1.71 -0.23 2.92 1.01 0.60 -1.82 120.40 125.62 5bca s VAL 425 Ca 0.03 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 5bca s VAL 425 Cb -0.14 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.73 5bca s VAL 425 CO 0.02 0.48 -0.07 -0.69 0.00 0.00 0.00 175.10 174.85 5bca s VAL 426 N 0.64 3.01 0.07 2.92 1.01 0.51 0.11 120.40 128.67 5bca s VAL 426 Ca -0.13 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.17 5bca s VAL 426 Cb -0.16 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 5bca s VAL 426 CO 0.04 0.35 -0.14 -1.59 0.00 0.00 0.00 175.10 173.76 5bca s LYS 427 N 1.40 2.09 0.00 2.72 -2.85 1.56 -2.87 119.74 121.79 5bca s LYS 427 Ca 0.04 -1.00 0.00 0.00 -1.00 0.00 0.00 55.97 54.01 5bca s LYS 427 Cb -0.15 -2.25 0.00 0.00 -2.06 0.00 0.00 37.83 33.37 5bca s LYS 427 CO -0.05 0.53 0.00 0.09 0.10 0.00 0.00 175.35 176.02 5bca n ASN 428 N 1.14 -1.17 -4.61 0.03 3.02 -1.26 -1.00 115.26 111.40 5bca n ASN 428 Ca -0.15 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.01 5bca n ASN 428 Cb 0.52 -0.29 -0.09 0.00 -0.61 0.00 0.00 39.78 39.31 5bca n ASN 428 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 5bca s VAL 429 N -2.55 5.17 -1.17 2.41 1.01 -1.26 -4.24 120.40 119.76 5bca s VAL 429 Ca 0.00 0.59 -0.13 0.00 0.00 0.00 0.00 61.98 62.43 5bca s VAL 429 Cb 0.00 -3.70 -0.06 0.00 0.00 0.00 0.00 36.38 32.61 5bca s VAL 429 CO 0.00 0.16 2.26 -0.81 0.00 0.00 0.00 175.10 176.72 5bca n PRO 430 N 5.28 2.46 -2.90 2.72 -0.04 -1.26 -4.94 135.00 136.32 5bca n PRO 430 Ca -0.08 -2.04 -0.25 0.00 -0.04 0.00 0.00 63.50 61.09 5bca n PRO 430 Cb 0.51 -2.89 0.00 0.00 -0.04 0.00 0.00 33.50 31.08 5bca n PRO 430 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 5bca s THR 431 N 3.55 4.53 0.36 0.52 -4.23 -1.26 -5.10 115.64 114.01 5bca s THR 431 Ca 0.53 -0.20 0.03 0.00 -1.18 0.00 0.00 61.69 60.87 5bca s THR 431 Cb 0.14 -3.70 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 5bca s THR 431 CO -0.01 -0.57 0.09 0.42 -0.54 0.00 0.00 174.62 174.01 5bca s THR 432 N -2.61 0.87 0.12 3.99 -4.23 -1.26 -5.08 115.64 107.45 5bca s THR 432 Ca 0.47 -2.00 -0.32 0.00 -1.18 0.00 0.00 61.69 58.65 5bca s THR 432 Cb -0.10 -2.57 -0.12 0.00 1.34 0.00 0.00 72.50 71.06 5bca s THR 432 CO 0.41 0.00 1.78 -0.38 -0.54 0.00 0.00 174.62 175.89 5bca n ILE 433 N -0.78 0.26 0.00 2.99 5.41 -1.26 -2.25 119.36 123.73 5bca n ILE 433 Ca -0.04 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.66 5bca n ILE 433 Cb 0.66 -1.98 0.00 0.00 -0.71 0.00 0.00 39.64 37.61 5bca n ILE 433 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 5bca n GLY 434 N 4.07 2.04 3.68 7.39 0.00 -1.26 -4.90 105.19 116.21 5bca n GLY 434 Ca 0.18 -0.39 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 5bca n GLY 434 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 5bca n ASP 435 N 0.15 1.69 -4.39 1.61 9.92 -0.95 -4.15 116.55 120.44 5bca n ASP 435 Ca 0.00 0.89 -0.23 0.00 -0.53 0.00 0.00 54.79 54.92 5bca n ASP 435 Cb 0.00 -1.48 -0.11 0.00 -0.64 0.00 0.00 41.12 38.89 5bca n ASP 435 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 5bca s THR 436 N -1.39 2.08 0.06 -3.53 -4.23 0.48 -4.95 115.64 104.15 5bca s THR 436 Ca 0.75 -2.10 0.09 0.00 -1.18 0.00 0.00 61.69 59.25 5bca s THR 436 Cb -0.42 -2.04 -0.03 0.00 1.34 0.00 0.00 72.50 71.35 5bca s THR 436 CO 0.47 -0.33 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.30 5bca s VAL 437 N -2.20 2.38 0.11 2.29 1.01 -1.26 -1.35 120.40 121.38 5bca s VAL 437 Ca 0.21 -1.40 -0.11 0.00 0.00 0.00 0.00 61.98 60.68 5bca s VAL 437 Cb -0.05 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.35 5bca s VAL 437 CO 0.09 0.30 0.26 -0.31 0.00 0.00 0.00 175.10 175.44 5bca s TYR 438 N -0.90 0.08 0.28 5.22 1.51 -0.70 -2.21 117.35 120.64 5bca s TYR 438 Ca 0.13 -0.48 0.11 0.00 -1.01 0.00 0.00 57.07 55.83 5bca s TYR 438 Cb -0.10 0.03 -0.05 0.00 -0.11 0.00 0.00 41.96 41.73 5bca s TYR 438 CO 0.04 -0.61 -0.19 0.96 -1.11 0.00 0.00 175.55 174.64 5bca s ILE 439 N -3.86 2.39 0.14 2.71 -4.36 0.07 -1.21 121.20 117.07 5bca s ILE 439 Ca 0.06 -2.37 -0.21 0.00 -0.26 0.00 0.00 60.65 57.86 5bca s ILE 439 Cb 0.04 -2.31 0.06 0.00 1.25 0.00 0.00 42.46 41.50 5bca s ILE 439 CO -0.10 -0.40 0.54 0.28 0.24 0.00 0.00 174.94 175.50 5bca s THR 440 N -2.56 0.02 0.16 8.37 -1.32 -1.07 -0.33 115.64 118.91 5bca s THR 440 Ca 0.30 -0.19 -0.19 0.00 -1.21 0.00 0.00 61.69 60.40 5bca s THR 440 Cb -0.04 -1.05 0.07 0.00 -1.51 0.00 0.00 72.50 69.97 5bca s THR 440 CO 0.14 -0.10 0.91 0.61 -2.21 0.00 0.00 174.62 173.97 5bca n GLY 441 N -0.24 0.68 0.00 6.08 0.00 -1.14 -2.19 105.19 108.37 5bca n GLY 441 Ca -0.17 -1.12 0.10 0.00 0.00 0.00 0.00 46.02 44.83 5bca n GLY 441 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 5bca n ASN 442 N -1.21 0.00 -4.80 1.61 6.94 -0.61 -0.97 115.26 116.21 5bca n ASN 442 Ca -0.02 -0.42 -0.26 0.00 -0.02 0.00 0.00 54.58 53.86 5bca n ASN 442 Cb 0.51 -0.09 -0.05 0.00 -2.36 0.00 0.00 39.78 37.80 5bca n ASN 442 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 5bca s ARG 443 N -2.17 2.26 0.38 -3.83 0.52 -1.26 -4.73 118.95 110.11 5bca s ARG 443 Ca 0.26 -1.93 0.17 0.00 -0.52 0.00 0.00 55.73 53.71 5bca s ARG 443 Cb 0.13 -2.00 0.75 0.00 0.52 0.00 0.00 34.95 34.35 5bca s ARG 443 CO 0.24 -0.29 1.79 0.00 0.02 0.00 0.00 175.30 177.06 5bca h ALA 444 N 1.19 1.15 0.00 2.13 0.00 -1.90 -0.08 119.26 121.75 5bca h ALA 444 Ca -0.41 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.13 5bca h ALA 444 Cb 1.28 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 5bca h ALA 444 CO 0.66 0.47 -0.12 0.93 0.00 0.00 0.00 179.25 181.19 5bca h GLU 445 N 0.00 0.00 -0.25 0.00 3.07 -1.88 -2.82 114.58 112.70 5bca h GLU 445 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 5bca h GLU 445 Cb 0.78 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 5bca h GLU 445 CO 0.05 0.12 0.00 1.28 -1.40 0.00 0.00 179.01 179.05 5bca n LEU 446 N -3.81 2.91 0.00 1.33 4.77 -0.40 -4.54 117.00 117.26 5bca n LEU 446 Ca -0.02 -1.41 0.00 0.00 -0.03 0.00 0.00 56.01 54.55 5bca n LEU 446 Cb 0.22 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 5bca n LEU 446 CO 0.31 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.60 5bca n GLY 447 N 1.07 0.86 3.86 -0.72 0.00 -0.82 -2.90 105.19 106.54 5bca n GLY 447 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 5bca n GLY 447 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 5bca n SER 448 N 0.00 -2.63 -0.51 1.61 7.64 -0.18 -0.35 113.62 119.21 5bca n SER 448 Ca 0.00 -1.04 -0.04 0.00 1.01 0.00 0.00 58.87 58.80 5bca n SER 448 Cb 0.00 -3.03 -0.02 0.00 -1.01 0.00 0.00 64.21 60.15 5bca n SER 448 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 5bca n TRP 449 N -4.38 -0.20 -2.05 1.43 7.02 -0.15 -4.94 117.44 114.17 5bca n TRP 449 Ca -0.21 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 55.87 5bca n TRP 449 Cb 0.64 -1.61 -0.02 0.00 -2.42 0.00 0.00 31.31 27.90 5bca n TRP 449 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 5bca s ASP 450 N -1.31 6.68 0.00 -0.99 2.15 0.53 -4.90 116.67 118.83 5bca s ASP 450 Ca 0.00 2.75 0.06 0.00 0.43 0.00 0.00 52.55 55.78 5bca s ASP 450 Cb 0.00 -2.65 -0.06 0.00 -0.30 0.00 0.00 42.92 39.91 5bca s ASP 450 CO 0.00 -0.61 0.25 0.35 -0.17 0.00 0.00 175.17 174.99 5bca n THR 451 N 0.94 0.00 -0.07 1.71 -2.24 -1.26 -3.82 114.28 109.54 5bca n THR 451 Ca 0.01 -0.37 -0.07 0.00 -2.27 0.00 0.00 64.05 61.35 5bca n THR 451 Cb 0.41 1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.60 5bca n THR 451 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 5bca h LYS 452 N 0.04 0.00 0.00 -0.78 1.63 -1.97 -3.44 116.57 112.05 5bca h LYS 452 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 5bca h LYS 452 Cb 0.14 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.77 5bca h LYS 452 CO 0.00 0.30 -0.05 0.00 -3.45 0.00 0.00 179.45 176.25 5bca n GLN 453 N -4.65 5.76 -0.04 1.90 10.64 -1.26 -4.84 117.38 124.89 5bca n GLN 453 Ca -0.09 0.00 0.06 0.00 -1.83 0.00 0.00 57.00 55.15 5bca n GLN 453 Cb 0.26 -0.46 0.08 0.00 -0.86 0.00 0.00 30.24 29.26 5bca n GLN 453 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 5bca n TYR 454 N -0.89 0.10 -1.43 2.61 4.01 -1.26 -3.88 117.16 116.42 5bca n TYR 454 Ca 0.00 -0.10 -0.34 0.00 -0.16 0.00 0.00 57.90 57.30 5bca n TYR 454 Cb 0.00 -0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.12 5bca n TYR 454 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 5bca s PRO 455 N -1.06 2.15 -0.31 -0.72 0.04 -1.25 0.87 135.00 134.73 5bca s PRO 455 Ca 0.17 1.71 -0.11 0.00 0.04 0.00 0.00 61.00 62.81 5bca s PRO 455 Cb 0.11 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.79 5bca s PRO 455 CO 0.17 -1.81 0.18 0.42 0.04 0.00 0.00 177.00 175.99 5bca s ILE 456 N -2.06 4.95 0.05 0.56 1.01 0.55 -4.04 121.20 122.22 5bca s ILE 456 Ca 0.73 -0.19 -0.31 0.00 0.00 0.00 0.00 60.65 60.89 5bca s ILE 456 Cb -0.28 -3.47 -0.07 0.00 0.01 0.00 0.00 42.46 38.65 5bca s ILE 456 CO 0.46 0.12 1.58 -1.58 0.00 0.00 0.00 174.94 175.51 5bca s GLN 457 N 1.68 4.22 0.33 2.79 0.74 -0.56 -0.75 119.66 128.11 5bca s GLN 457 Ca 0.06 2.22 0.04 0.00 0.05 0.00 0.00 55.36 57.73 5bca s GLN 457 Cb -0.17 -3.59 -0.02 0.00 1.10 0.00 0.00 33.01 30.33 5bca s GLN 457 CO 0.08 -0.69 0.48 -0.51 -0.55 0.00 0.00 175.29 174.11 5bca s LEU 458 N 2.58 4.02 0.16 3.68 1.43 -0.94 -4.90 118.68 124.72 5bca s LEU 458 Ca 0.71 0.05 0.10 0.00 -1.03 0.00 0.00 54.13 53.96 5bca s LEU 458 Cb -0.37 -2.93 -0.04 0.00 0.03 0.00 0.00 46.19 42.88 5bca s LEU 458 CO 0.30 -0.36 -0.23 -0.31 0.23 0.00 0.00 176.35 175.99 5bca s TYR 459 N -2.20 2.10 -0.14 0.29 2.02 0.29 -4.53 117.35 115.17 5bca s TYR 459 Ca 0.42 -0.40 -0.25 0.00 -0.37 0.00 0.00 57.07 56.47 5bca s TYR 459 Cb -0.09 -1.07 -0.02 0.00 -0.40 0.00 0.00 41.96 40.37 5bca s TYR 459 CO 0.32 0.38 0.79 -0.47 -1.57 0.00 0.00 175.55 175.00 5bca s TYR 460 N -1.58 3.46 -0.88 2.71 5.04 -1.26 0.68 117.35 125.53 5bca s TYR 460 Ca 0.16 1.24 -0.09 0.00 -2.44 0.00 0.00 57.07 55.93 5bca s TYR 460 Cb -0.08 -2.95 0.23 0.00 0.35 0.00 0.00 41.96 39.51 5bca s TYR 460 CO 0.07 -0.15 0.80 0.34 -1.34 0.00 0.00 175.55 175.28 5bca s ASP 461 N 1.08 6.56 0.62 4.32 2.15 0.73 -4.89 116.67 127.24 5bca s ASP 461 Ca 0.38 -3.09 0.27 0.00 0.43 0.00 0.00 52.55 50.54 5bca s ASP 461 Cb -0.17 -2.11 1.39 0.00 -0.30 0.00 0.00 42.92 41.73 5bca s ASP 461 CO 0.14 -0.41 1.80 0.77 -0.17 0.00 0.00 175.17 177.30 5bca h SER 462 N 7.14 0.00 0.06 -0.34 4.64 -1.95 3.03 113.55 126.13 5bca h SER 462 Ca 0.11 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.31 5bca h SER 462 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 5bca h SER 462 CO 0.82 0.00 -0.62 -0.74 -0.87 0.00 0.00 176.83 175.42 5bca h HIS 463 N 0.00 0.22 0.00 4.77 -0.00 -1.95 -3.32 115.15 114.87 5bca h HIS 463 Ca 0.15 -0.16 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 5bca h HIS 463 Cb 1.19 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 5bca h HIS 463 CO 0.00 1.24 0.00 0.43 -0.00 0.00 0.00 177.93 179.60 5bca n SER 464 N -4.34 0.52 -3.51 3.26 7.64 0.12 -4.92 113.62 112.38 5bca n SER 464 Ca -0.16 0.56 -0.25 0.00 1.01 0.00 0.00 58.87 60.03 5bca n SER 464 Cb 0.67 -0.70 0.05 0.00 -1.01 0.00 0.00 64.21 63.23 5bca n SER 464 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 5bca n ASN 465 N -2.00 -5.86 -3.47 6.43 5.15 0.99 -4.97 115.26 111.53 5bca n ASN 465 Ca 0.05 -0.90 -0.08 0.00 -0.60 0.00 0.00 54.58 53.06 5bca n ASN 465 Cb 0.36 -4.08 -0.00 0.00 -0.53 0.00 0.00 39.78 35.53 5bca n ASN 465 CO 0.00 0.00 0.00 1.51 1.40 0.00 0.00 177.26 180.17 5bca s ASP 466 N -3.43 -0.15 -0.21 1.20 1.47 -0.73 -4.77 116.67 110.05 5bca s ASP 466 Ca 0.47 -0.83 -0.03 0.00 1.18 0.00 0.00 52.55 53.34 5bca s ASP 466 Cb -0.13 0.77 -0.01 0.00 -0.34 0.00 0.00 42.92 43.22 5bca s ASP 466 CO 0.82 -1.48 -0.06 0.26 0.68 0.00 0.00 175.17 175.39 5bca s TRP 467 N -3.24 2.94 0.17 2.11 0.52 -1.14 0.26 118.94 120.57 5bca s TRP 467 Ca 0.13 -0.94 -0.09 0.00 0.02 0.00 0.00 56.10 55.21 5bca s TRP 467 Cb -0.06 -2.07 -0.01 0.00 -1.15 0.00 0.00 33.47 30.18 5bca s TRP 467 CO 0.09 -0.53 0.31 -0.98 0.02 0.00 0.00 176.95 175.86 5bca s ARG 468 N 1.36 1.20 0.07 4.98 1.70 0.21 -0.37 118.95 128.11 5bca s ARG 468 Ca 0.04 -1.17 -0.26 0.00 -0.47 0.00 0.00 55.73 53.86 5bca s ARG 468 Cb -0.14 0.39 0.07 0.00 -0.57 0.00 0.00 34.95 34.70 5bca s ARG 468 CO -0.03 -0.45 0.65 0.20 -1.08 0.00 0.00 175.30 174.59 5bca s GLY 469 N -2.97 -0.59 -0.43 3.88 0.00 -0.76 0.10 107.32 106.55 5bca s GLY 469 Ca 0.18 0.86 -0.17 0.00 0.00 0.00 0.00 44.72 45.58 5bca s GLY 469 CO 0.01 0.49 0.45 -1.31 0.00 0.00 0.00 173.10 172.74 5bca s ASN 470 N -2.10 6.20 -0.14 1.64 0.02 -1.26 -1.58 114.94 117.71 5bca s ASN 470 Ca -0.04 -0.74 -0.01 0.00 -1.02 0.00 0.00 52.86 51.06 5bca s ASN 470 Cb -0.01 -2.23 -0.02 0.00 0.02 0.00 0.00 41.25 39.02 5bca s ASN 470 CO -0.04 -0.62 -0.11 -0.69 0.02 0.00 0.00 177.10 175.67 5bca s VAL 471 N 2.15 3.18 -0.34 1.60 1.01 0.14 -4.90 120.40 123.25 5bca s VAL 471 Ca 0.12 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.20 5bca s VAL 471 Cb -0.18 -2.35 0.01 0.00 0.00 0.00 0.00 36.38 33.86 5bca s VAL 471 CO 0.13 0.51 1.21 -0.69 0.00 0.00 0.00 175.10 176.26 5bca s VAL 472 N 0.44 4.26 0.25 2.92 1.01 -1.26 -1.35 120.40 126.67 5bca s VAL 472 Ca -0.09 1.41 0.12 0.00 0.00 0.00 0.00 61.98 63.42 5bca s VAL 472 Cb -0.16 -4.31 -0.05 0.00 0.00 0.00 0.00 36.38 31.87 5bca s VAL 472 CO 0.04 -0.57 -0.20 -0.76 0.00 0.00 0.00 175.10 173.62 5bca s LEU 473 N 4.20 2.59 0.00 3.92 1.02 -0.02 -4.29 118.68 126.10 5bca s LEU 473 Ca 0.52 -0.94 -0.30 0.00 0.02 0.00 0.00 54.13 53.42 5bca s LEU 473 Cb -0.14 -1.18 -0.06 0.00 0.02 0.00 0.00 46.19 44.83 5bca s LEU 473 CO 0.22 0.07 1.52 -2.16 0.02 0.00 0.00 176.35 176.02 5bca s PRO 474 N -3.23 4.24 0.39 1.29 0.04 -1.26 -1.68 135.00 134.79 5bca s PRO 474 Ca 0.27 2.10 -0.25 0.00 0.04 0.00 0.00 61.00 63.17 5bca s PRO 474 Cb -0.06 -3.66 -0.09 0.00 0.04 0.00 0.00 34.50 30.73 5bca s PRO 474 CO 0.14 -0.68 1.08 0.00 0.04 0.00 0.00 177.00 177.58 5bca s ALA 475 N 2.82 3.11 -1.90 8.56 0.00 0.72 -3.50 121.76 131.58 5bca s ALA 475 Ca 0.68 0.78 0.00 0.00 0.00 0.00 0.00 51.96 53.42 5bca s ALA 475 Cb -0.34 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.48 5bca s ALA 475 CO 0.28 -0.30 0.00 0.39 0.00 0.00 0.00 175.76 176.13 5bca n GLU 476 N 0.03 -1.58 -4.33 0.00 1.02 -0.34 -4.60 120.64 110.84 5bca n GLU 476 Ca 0.05 1.07 -0.28 0.00 -0.02 0.00 0.00 57.16 57.98 5bca n GLU 476 Cb 0.48 -5.64 -0.11 0.00 -0.02 0.00 0.00 31.44 26.16 5bca n GLU 476 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 5bca s ARG 477 N -4.62 1.77 0.01 3.49 1.81 -1.23 -4.78 118.95 115.40 5bca s ARG 477 Ca 0.00 -1.31 -0.21 0.00 -1.72 0.00 0.00 55.73 52.50 5bca s ARG 477 Cb 0.00 -2.05 -0.06 0.00 -0.45 0.00 0.00 34.95 32.40 5bca s ARG 477 CO 0.00 0.44 0.60 -0.80 -0.68 0.00 0.00 175.30 174.87 5bca s ASN 478 N -2.48 7.00 0.11 0.23 0.01 -1.26 -0.52 114.94 118.04 5bca s ASN 478 Ca 0.20 1.19 0.06 0.00 -0.71 0.00 0.00 52.86 53.60 5bca s ASN 478 Cb -0.09 -2.37 -0.04 0.00 0.41 0.00 0.00 41.25 39.16 5bca s ASN 478 CO 0.11 0.12 -0.14 0.27 -1.51 0.00 0.00 177.10 175.95 5bca s ILE 479 N -0.29 1.27 -0.01 0.60 -4.36 -0.33 -4.97 121.20 113.11 5bca s ILE 479 Ca 0.31 -1.66 0.04 0.00 -0.26 0.00 0.00 60.65 59.08 5bca s ILE 479 Cb -0.18 -1.46 -0.01 0.00 1.25 0.00 0.00 42.46 42.05 5bca s ILE 479 CO 0.18 -0.40 -0.13 -1.61 0.24 0.00 0.00 174.94 173.21 5bca s GLU 480 N -2.56 1.13 0.25 0.37 0.41 -1.26 -1.23 118.70 115.80 5bca s GLU 480 Ca 0.07 -0.47 -0.16 0.00 -0.41 0.00 0.00 54.97 54.00 5bca s GLU 480 Cb -0.05 -1.08 0.01 0.00 -1.78 0.00 0.00 34.13 31.23 5bca s GLU 480 CO 0.03 0.27 0.54 -0.59 -0.49 0.00 0.00 175.26 175.02 5bca s PHE 481 N -0.24 0.15 -0.05 1.61 -0.71 -1.06 -1.58 117.98 116.10 5bca s PHE 481 Ca 0.04 -0.54 -0.21 0.00 -1.04 0.00 0.00 56.93 55.18 5bca s PHE 481 Cb -0.06 0.35 0.04 0.00 -1.21 0.00 0.00 43.02 42.14 5bca s PHE 481 CO -0.00 -1.04 0.47 0.15 -1.34 0.00 0.00 175.22 173.45 5bca s LYS 482 N -3.97 0.80 0.62 1.99 1.02 -0.93 0.17 119.74 119.44 5bca s LYS 482 Ca 0.18 0.08 -0.03 0.00 0.02 0.00 0.00 55.97 56.21 5bca s LYS 482 Cb -0.02 0.37 0.04 0.00 -0.52 0.00 0.00 37.83 37.70 5bca s LYS 482 CO 0.07 -0.22 0.89 0.00 -0.92 0.00 0.00 175.35 175.17 5bca s ALA 483 N -1.08 3.47 0.11 5.17 0.00 -1.26 -2.60 121.76 125.57 5bca s ALA 483 Ca -0.11 -1.03 -0.25 0.00 0.00 0.00 0.00 51.96 50.57 5bca s ALA 483 Cb -0.03 -2.39 0.07 0.00 0.00 0.00 0.00 23.12 20.76 5bca s ALA 483 CO 0.06 -0.98 0.61 -0.59 0.00 0.00 0.00 175.76 174.87 5bca s PHE 484 N -3.00 -0.56 0.06 0.00 -0.71 -0.35 -1.88 117.98 111.54 5bca s PHE 484 Ca 0.57 0.49 0.02 0.00 -1.04 0.00 0.00 56.93 56.98 5bca s PHE 484 Cb -0.11 0.52 -0.04 0.00 -1.21 0.00 0.00 43.02 42.19 5bca s PHE 484 CO 0.42 -0.80 0.08 0.42 -1.34 0.00 0.00 175.22 174.00 5bca s ILE 485 N -3.20 4.57 -0.14 -4.49 1.01 -0.68 -1.71 121.20 116.56 5bca s ILE 485 Ca -0.02 -0.68 -0.01 0.00 0.00 0.00 0.00 60.65 59.94 5bca s ILE 485 Cb -0.01 -3.18 0.04 0.00 0.01 0.00 0.00 42.46 39.33 5bca s ILE 485 CO -0.08 0.18 -0.02 -0.54 0.00 0.00 0.00 174.94 174.48 5bca s LYS 486 N -2.24 0.99 0.87 2.79 1.02 -0.46 -1.14 119.74 121.58 5bca s LYS 486 Ca 0.28 -0.27 -0.12 0.00 0.02 0.00 0.00 55.97 55.87 5bca s LYS 486 Cb -0.12 -1.67 0.15 0.00 -0.52 0.00 0.00 37.83 35.67 5bca s LYS 486 CO 0.20 -0.43 1.22 -1.54 -0.92 0.00 0.00 175.35 173.88 5bca s SER 487 N 1.80 3.75 0.14 2.83 1.04 -0.89 -0.38 113.70 121.98 5bca s SER 487 Ca 0.02 0.33 -0.29 0.00 0.48 0.00 0.00 55.95 56.49 5bca s SER 487 Cb -0.14 -0.57 -0.04 0.00 0.10 0.00 0.00 66.02 65.36 5bca s SER 487 CO -0.07 -2.33 1.58 0.50 0.98 0.00 0.00 173.24 173.90 5bca h LYS 488 N -1.27 -0.41 -0.54 4.02 3.11 -1.90 0.56 116.57 120.13 5bca h LYS 488 Ca -0.44 0.03 0.17 0.00 -2.81 0.00 0.00 60.65 57.61 5bca h LYS 488 Cb 1.27 0.09 -0.10 0.00 -1.00 0.00 0.00 32.23 32.49 5bca h LYS 488 CO 0.47 -0.28 0.10 -0.40 -2.81 0.00 0.00 179.45 176.54 5bca n ASP 489 N -5.43 0.02 0.00 4.20 5.68 -1.26 -4.69 116.55 115.07 5bca n ASP 489 Ca -0.03 0.91 0.00 0.00 -0.50 0.00 0.00 54.79 55.17 5bca n ASP 489 Cb 0.36 -0.37 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 5bca n ASP 489 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 5bca n GLY 490 N -1.23 1.57 3.68 6.12 0.00 0.19 -5.11 105.19 110.40 5bca n GLY 490 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 5bca n GLY 490 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 5bca s THR 491 N -2.00 4.15 0.02 2.61 -4.23 -1.25 -4.89 115.64 110.05 5bca s THR 491 Ca 0.00 -0.54 -0.30 0.00 -1.18 0.00 0.00 61.69 59.67 5bca s THR 491 Cb 0.00 -2.83 -0.08 0.00 1.34 0.00 0.00 72.50 70.94 5bca s THR 491 CO 0.00 0.43 1.79 -0.69 -0.54 0.00 0.00 174.62 175.60 5bca s VAL 492 N -1.04 3.19 -0.13 2.29 1.01 -1.26 -2.11 120.40 122.36 5bca s VAL 492 Ca 0.18 0.35 0.04 0.00 0.00 0.00 0.00 61.98 62.56 5bca s VAL 492 Cb -0.11 -3.23 -0.24 0.00 0.00 0.00 0.00 36.38 32.80 5bca s VAL 492 CO 0.08 -0.02 0.32 1.17 0.00 0.00 0.00 175.10 176.65 5bca n LYS 493 N 6.92 0.69 -3.61 2.72 4.81 -0.30 -4.92 118.16 124.47 5bca n LYS 493 Ca 0.18 0.22 -0.01 0.00 -0.87 0.00 0.00 58.31 57.82 5bca n LYS 493 Cb 0.41 -1.68 -0.01 0.00 0.02 0.00 0.00 35.03 33.77 5bca n LYS 493 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 5bca s SER 494 N -6.44 -0.07 0.19 3.14 1.04 -1.24 -4.98 113.70 105.34 5bca s SER 494 Ca -0.17 -0.03 0.09 0.00 0.48 0.00 0.00 55.95 56.32 5bca s SER 494 Cb 0.07 0.10 -0.04 0.00 0.10 0.00 0.00 66.02 66.25 5bca s SER 494 CO 0.77 -0.16 -0.12 0.26 0.98 0.00 0.00 173.24 174.96 5bca s TRP 495 N -2.27 2.56 0.30 5.02 0.52 -1.26 -1.69 118.94 122.13 5bca s TRP 495 Ca 0.12 -0.25 -0.29 0.00 0.02 0.00 0.00 56.10 55.69 5bca s TRP 495 Cb 0.02 -1.25 -0.10 0.00 -1.15 0.00 0.00 33.47 30.98 5bca s TRP 495 CO -0.04 0.52 1.44 -1.14 0.02 0.00 0.00 176.95 177.75 5bca s GLN 496 N -2.83 4.23 0.20 4.98 0.74 -0.79 -4.89 119.66 121.31 5bca s GLN 496 Ca 0.24 2.38 -0.10 0.00 0.05 0.00 0.00 55.36 57.93 5bca s GLN 496 Cb -0.08 -3.06 0.21 0.00 1.10 0.00 0.00 33.01 31.18 5bca s GLN 496 CO 0.14 -0.42 1.80 1.15 -0.55 0.00 0.00 175.29 177.42 5bca h THR 497 N 3.28 0.97 -3.57 -0.34 2.02 -1.33 -3.42 112.91 110.52 5bca h THR 497 Ca -0.48 -0.22 -0.67 0.00 0.77 0.00 0.00 66.41 65.81 5bca h THR 497 Cb 1.22 0.27 -0.24 0.00 -1.74 0.00 0.00 68.15 67.66 5bca h THR 497 CO 0.72 0.12 -0.75 -0.63 0.37 0.00 0.00 175.52 175.35 5bca s ILE 498 N -6.11 3.20 -0.18 3.11 1.09 -1.26 -5.07 121.20 115.98 5bca s ILE 498 Ca -0.13 -0.63 -0.29 0.00 -1.10 0.00 0.00 60.65 58.50 5bca s ILE 498 Cb 0.15 -2.32 -0.03 0.00 -1.06 0.00 0.00 42.46 39.21 5bca s ILE 498 CO 0.75 0.55 1.50 -1.58 -0.10 0.00 0.00 174.94 176.06 5bca s GLN 499 N -0.10 4.00 1.14 2.79 0.74 -1.26 -4.87 119.66 122.10 5bca s GLN 499 Ca -0.01 1.72 -0.19 0.00 0.05 0.00 0.00 55.36 56.93 5bca s GLN 499 Cb -0.14 -3.94 0.27 0.00 1.10 0.00 0.00 33.01 30.31 5bca s GLN 499 CO 0.03 -1.03 1.20 -0.65 -0.55 0.00 0.00 175.29 174.29 5bca s GLN 500 N 4.18 -0.78 -0.29 1.67 -1.52 0.13 -4.83 119.66 118.21 5bca s GLN 500 Ca 0.66 -0.28 -0.26 0.00 -1.95 0.00 0.00 55.36 53.53 5bca s GLN 500 Cb -0.25 -1.67 0.19 0.00 -0.22 0.00 0.00 33.01 31.06 5bca s GLN 500 CO 0.25 -3.38 1.39 -1.54 -0.25 0.00 0.00 175.29 171.75 5bca s SER 501 N -4.32 -0.08 -0.25 5.90 1.04 -1.26 -2.57 113.70 112.16 5bca s SER 501 Ca 0.73 0.14 -0.00 0.00 0.48 0.00 0.00 55.95 57.30 5bca s SER 501 Cb -0.06 0.14 0.07 0.00 0.10 0.00 0.00 66.02 66.27 5bca s SER 501 CO 0.55 -0.04 0.01 0.86 0.98 0.00 0.00 173.24 175.60 5bca s TRP 502 N -0.26 2.01 -0.52 5.02 -0.11 -0.36 -4.97 118.94 119.76 5bca s TRP 502 Ca 0.07 -1.61 0.03 0.00 1.22 0.00 0.00 56.10 55.82 5bca s TRP 502 Cb -0.04 -1.56 0.15 0.00 -1.50 0.00 0.00 33.47 30.52 5bca s TRP 502 CO -0.13 -0.76 0.32 -0.80 -4.62 0.00 0.00 176.95 170.96 5bca s ASN 503 N 1.52 3.78 0.42 5.86 0.02 -1.26 -1.18 114.94 124.09 5bca s ASN 503 Ca -0.00 -3.05 0.05 0.00 -1.02 0.00 0.00 52.86 48.83 5bca s ASN 503 Cb -0.18 -1.21 0.05 0.00 0.02 0.00 0.00 41.25 39.92 5bca s ASN 503 CO -0.10 -0.20 0.39 -0.81 0.02 0.00 0.00 177.10 176.39 5bca n PRO 504 N 2.99 0.83 -1.91 -0.60 -0.04 -1.26 -5.03 135.00 129.98 5bca n PRO 504 Ca 0.13 -2.54 -0.42 0.00 -0.04 0.00 0.00 63.50 60.63 5bca n PRO 504 Cb 0.36 0.16 -0.03 0.00 -0.04 0.00 0.00 33.50 33.95 5bca n PRO 504 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 5bca s VAL 505 N -1.98 2.54 0.42 0.52 1.01 0.33 -4.86 120.40 118.38 5bca s VAL 505 Ca 0.29 0.39 -0.26 0.00 0.00 0.00 0.00 61.98 62.41 5bca s VAL 505 Cb -0.02 -3.25 -0.09 0.00 0.00 0.00 0.00 36.38 33.02 5bca s VAL 505 CO 0.19 0.03 1.33 -2.84 0.00 0.00 0.00 175.10 173.81 5bca s PRO 506 N 1.10 3.90 0.41 2.72 0.02 -1.26 -1.19 135.00 140.70 5bca s PRO 506 Ca 0.70 2.22 0.09 0.00 0.02 0.00 0.00 61.00 64.03 5bca s PRO 506 Cb -0.44 -2.73 0.86 0.00 0.02 0.00 0.00 34.50 32.20 5bca s PRO 506 CO 0.32 -0.57 2.00 1.25 -0.33 0.00 0.00 177.00 179.67 5bca h LEU 507 N 2.60 0.33 -9.24 -5.54 7.12 -1.96 -3.43 115.31 105.18 5bca h LEU 507 Ca -0.50 -0.03 -0.67 0.00 0.13 0.00 0.00 57.88 56.81 5bca h LEU 507 Cb 1.25 -0.08 -0.16 0.00 -0.53 0.00 0.00 40.66 41.13 5bca h LEU 507 CO 0.62 0.34 -0.70 -1.59 -0.13 0.00 0.00 178.44 176.98 5bca s LYS 508 N -5.11 2.53 -0.15 1.25 0.00 -1.26 -4.96 119.74 112.03 5bca s LYS 508 Ca -0.07 -0.75 -0.39 0.00 0.00 0.00 0.00 55.97 54.76 5bca s LYS 508 Cb 0.16 -2.50 -0.17 0.00 0.00 0.00 0.00 37.83 35.33 5bca s LYS 508 CO 0.73 0.59 1.56 2.41 0.00 0.00 0.00 175.35 180.64 5bca n THR 509 N 1.37 0.16 -2.21 3.79 -1.04 -1.26 -4.92 114.28 110.18 5bca n THR 509 Ca -0.15 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 5bca n THR 509 Cb 0.52 -0.97 0.00 0.00 -1.82 0.00 0.00 70.33 68.06 5bca n THR 509 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 5bca n THR 510 N 3.66 0.00 -3.82 12.58 -1.04 -1.26 -5.06 114.28 119.35 5bca n THR 510 Ca 0.24 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 62.12 5bca n THR 510 Cb 0.14 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 68.52 5bca n THR 510 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 5bca s SER 511 N 1.00 -0.16 -0.27 8.00 1.04 -1.26 -2.52 113.70 119.52 5bca s SER 511 Ca 0.00 0.31 -0.07 0.00 0.48 0.00 0.00 55.95 56.67 5bca s SER 511 Cb 0.00 0.33 -0.00 0.00 0.10 0.00 0.00 66.02 66.45 5bca s SER 511 CO 0.00 -0.07 0.06 -2.28 0.98 0.00 0.00 173.24 171.93 5bca s HIS 512 N 0.01 3.10 -0.07 5.02 2.46 0.32 -4.94 115.29 121.20 5bca s HIS 512 Ca -0.01 -0.82 0.05 0.00 0.47 0.00 0.00 55.06 54.75 5bca s HIS 512 Cb -0.02 -2.23 -0.01 0.00 -0.13 0.00 0.00 32.58 30.19 5bca s HIS 512 CO 0.00 -0.51 -0.21 0.99 -2.47 0.00 0.00 174.74 172.54 5bca s THR 513 N 1.53 2.45 0.15 0.89 2.01 -1.26 0.22 115.64 121.63 5bca s THR 513 Ca 0.04 -0.92 -0.17 0.00 0.31 0.00 0.00 61.69 60.95 5bca s THR 513 Cb -0.16 -1.93 0.03 0.00 0.01 0.00 0.00 72.50 70.45 5bca s THR 513 CO 0.02 0.57 0.44 -0.94 -0.69 0.00 0.00 174.62 174.02 5bca s SER 514 N -0.21 -0.25 0.02 3.53 1.04 0.31 -4.95 113.70 113.18 5bca s SER 514 Ca -0.01 -0.35 0.02 0.00 0.48 0.00 0.00 55.95 56.08 5bca s SER 514 Cb -0.13 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.45 5bca s SER 514 CO 0.03 -0.91 0.02 -0.44 0.98 0.00 0.00 173.24 172.92 5bca s SER 515 N -2.82 5.23 0.00 7.02 0.01 -1.24 0.45 113.70 122.34 5bca s SER 515 Ca 0.05 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.30 5bca s SER 515 Cb 0.01 -1.38 0.00 0.00 0.21 0.00 0.00 66.02 64.86 5bca s SER 515 CO -0.10 0.26 0.22 1.87 0.41 0.00 0.00 173.24 175.90