#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 3.56 -2.13 0.00 0.31 -0.67 -2.79 118.33 116.61 5bca n VAL 2 Ca 0.00 -0.50 -0.14 0.00 -0.01 0.00 0.00 64.34 63.69 5bca n VAL 2 Cb 0.00 -1.56 -0.02 0.00 -0.91 0.00 0.00 33.84 31.36 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 -0.71 -4.47 -0.09 4.52 4.13 -1.26 -3.79 115.26 113.58 5bca n ASN 3 Ca 0.10 0.05 -0.01 0.00 1.68 0.00 0.00 54.58 56.40 5bca n ASN 3 Cb 0.44 -3.56 -0.01 0.00 -1.54 0.00 0.00 39.78 35.11 5bca n ASN 3 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 5bca n GLY 4 N -1.05 0.40 3.88 7.41 0.00 -1.12 -4.97 105.19 109.74 5bca n GLY 4 Ca -0.17 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 5bca n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 5bca s LYS 5 N -1.10 2.23 0.67 1.61 3.01 -1.22 -1.43 119.74 123.50 5bca s LYS 5 Ca 0.00 -2.17 0.02 0.00 -1.01 0.00 0.00 55.97 52.81 5bca s LYS 5 Cb 0.00 -1.93 0.13 0.00 -1.01 0.00 0.00 37.83 35.02 5bca s LYS 5 CO 0.00 -0.60 0.91 0.41 0.51 0.00 0.00 175.35 176.59 5bca n GLY 6 N -1.67 0.93 3.59 -3.33 0.00 -1.26 -1.33 105.19 102.12 5bca n GLY 6 Ca -0.07 -2.07 -0.36 0.00 0.00 0.00 0.00 46.02 43.52 5bca n GLY 6 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 5bca n MET 7 N -2.64 0.56 -1.84 1.61 0.00 -1.25 -4.77 117.12 108.78 5bca n MET 7 Ca 0.16 0.24 -0.42 0.00 0.00 0.00 0.00 57.70 57.67 5bca n MET 7 Cb 0.56 -2.13 -0.03 0.00 0.00 0.00 0.00 33.22 31.62 5bca n MET 7 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 5bca s ASN 8 N -1.52 6.40 0.00 3.17 3.84 -1.26 -4.81 114.94 120.76 5bca s ASN 8 Ca 0.73 2.30 0.08 0.00 0.21 0.00 0.00 52.86 56.18 5bca s ASN 8 Cb -0.36 -2.53 0.39 0.00 -0.55 0.00 0.00 41.25 38.20 5bca s ASN 8 CO 0.51 -1.14 1.20 -0.81 -2.79 0.00 0.00 177.10 174.06 5bca n PRO 9 N 7.56 0.06 -0.06 0.43 -0.04 -1.26 -1.60 135.00 140.09 5bca n PRO 9 Ca 0.20 0.28 0.11 0.00 -0.04 0.00 0.00 63.50 64.05 5bca n PRO 9 Cb 0.43 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.52 5bca n PRO 9 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 5bca n ASP 10 N -1.39 3.08 -4.59 3.54 8.00 -1.26 -4.83 116.55 119.10 5bca n ASP 10 Ca 0.03 -1.96 -0.45 0.00 0.71 0.00 0.00 54.79 53.12 5bca n ASP 10 Cb 0.08 -0.08 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 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 1.34 1.29 -3.73 1.24 9.36 -0.63 -4.78 117.16 121.25 5bca n TYR 11 Ca 0.15 0.70 -0.12 0.00 3.32 0.00 0.00 57.90 61.95 5bca n TYR 11 Cb 0.58 -2.26 -0.07 0.00 -0.63 0.00 0.00 39.34 36.96 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 -1.48 0.81 0.10 2.98 1.02 -0.98 -4.74 119.74 117.45 5bca s LYS 12 Ca 0.59 -0.41 0.08 0.00 0.02 0.00 0.00 55.97 56.26 5bca s LYS 12 Cb -0.71 0.35 -0.04 0.00 -0.52 0.00 0.00 37.83 36.92 5bca s LYS 12 CO 0.59 -0.26 -0.16 0.00 -0.92 0.00 0.00 175.35 174.61 5bca s ALA 13 N -2.29 2.74 0.04 5.17 0.00 -1.26 -2.30 121.76 123.85 5bca s ALA 13 Ca -0.07 -1.30 -0.00 0.00 0.00 0.00 0.00 51.96 50.59 5bca s ALA 13 Cb -0.02 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 5bca s ALA 13 CO -0.02 0.60 -0.04 0.71 0.00 0.00 0.00 175.76 177.02 5bca s TYR 14 N -1.12 0.46 -0.05 0.00 2.02 0.18 -1.37 117.35 117.47 5bca s TYR 14 Ca 0.18 -0.80 0.06 0.00 -0.37 0.00 0.00 57.07 56.14 5bca s TYR 14 Cb -0.11 -0.32 -0.02 0.00 -0.40 0.00 0.00 41.96 41.11 5bca s TYR 14 CO 0.10 -0.26 -0.22 -1.17 -1.57 0.00 0.00 175.55 172.43 5bca s LEU 15 N -2.26 2.25 0.06 -1.29 2.96 -0.58 -0.47 118.68 119.35 5bca s LEU 15 Ca -0.03 -0.42 -0.22 0.00 -0.22 0.00 0.00 54.13 53.24 5bca s LEU 15 Cb -0.01 -1.42 -0.06 0.00 0.50 0.00 0.00 46.19 45.20 5bca s LEU 15 CO -0.05 0.28 0.64 -0.32 -1.32 0.00 0.00 176.35 175.58 5bca s MET 16 N -0.36 4.34 0.83 1.98 -2.45 -0.69 -0.33 119.30 122.62 5bca s MET 16 Ca 0.03 0.86 -0.12 0.00 -1.25 0.00 0.00 55.69 55.20 5bca s MET 16 Cb -0.12 -3.29 0.09 0.00 1.25 0.00 0.00 34.83 32.76 5bca s MET 16 CO 0.02 0.49 1.15 0.00 1.05 0.00 0.00 175.02 177.73 5bca s ALA 17 N -0.69 2.35 1.15 4.11 0.00 0.08 -1.33 121.76 127.44 5bca s ALA 17 Ca 0.32 -0.53 -0.13 0.00 0.00 0.00 0.00 51.96 51.62 5bca s ALA 17 Cb -0.20 -3.00 0.28 0.00 0.00 0.00 0.00 23.12 20.19 5bca s ALA 17 CO 0.20 -1.83 1.03 -2.14 0.00 0.00 0.00 175.76 173.03 5bca s PRO 18 N -5.42 -0.83 -0.05 0.00 0.02 -1.26 -4.66 135.00 122.81 5bca s PRO 18 Ca 0.62 0.70 -0.02 0.00 0.02 0.00 0.00 61.00 62.33 5bca s PRO 18 Cb -0.13 -1.58 -0.27 0.00 0.02 0.00 0.00 34.50 32.55 5bca s PRO 18 CO 0.51 -3.62 0.66 -0.07 -0.33 0.00 0.00 177.00 174.15 5bca h LEU 19 N -2.54 0.34-10.37 -5.54 4.07 -1.96 -3.46 115.31 95.83 5bca h LEU 19 Ca -0.61 -0.58 -0.49 0.00 0.08 0.00 0.00 57.88 56.28 5bca h LEU 19 Cb 1.34 -0.11 0.12 0.00 1.08 0.00 0.00 40.66 43.09 5bca h LEU 19 CO 0.52 1.50 0.32 -0.54 -1.08 0.00 0.00 178.44 179.17 5bca s LYS 20 N -2.59 2.09 0.58 1.13 1.02 -1.26 -4.90 119.74 115.79 5bca s LYS 20 Ca -0.12 0.78 -0.18 0.00 0.02 0.00 0.00 55.97 56.46 5bca s LYS 20 Cb 0.07 -1.91 -0.04 0.00 -0.52 0.00 0.00 37.83 35.43 5bca s LYS 20 CO 0.82 -1.65 1.11 0.15 -0.92 0.00 0.00 175.35 174.86 5bca s LYS 21 N -5.07 3.22 0.17 1.68 1.02 -1.26 -4.89 119.74 114.61 5bca s LYS 21 Ca 0.61 1.51 -0.15 0.00 0.02 0.00 0.00 55.97 57.95 5bca s LYS 21 Cb -0.15 -2.00 0.13 0.00 -0.52 0.00 0.00 37.83 35.29 5bca s LYS 21 CO 0.55 -0.94 1.70 0.82 -0.92 0.00 0.00 175.35 176.56 5bca h ILE 22 N 0.84 0.69 0.00 2.17 1.08 -1.95 0.15 117.51 120.49 5bca h ILE 22 Ca -0.49 -0.04 0.00 0.00 -0.39 0.00 0.00 64.86 63.94 5bca h ILE 22 Cb 1.25 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 35.56 5bca h ILE 22 CO 0.56 0.02 0.00 -0.65 -0.69 0.00 0.00 178.15 177.39 5bca h PRO 23 N 0.12 0.00 0.00 2.37 0.11 -1.93 0.82 132.00 133.49 5bca h PRO 23 Ca 0.21 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.14 5bca h PRO 23 Cb 0.29 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.38 5bca h PRO 23 CO -0.34 0.00 -0.92 0.93 -0.21 0.00 0.00 178.00 177.46 5bca h GLU 24 N 0.00 0.00 0.03 1.05 5.08 -1.06 -3.39 114.58 116.28 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 0.01 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.20 5bca h GLU 24 CO 0.00 0.69 -2.38 0.28 -1.00 0.00 0.00 179.01 176.60 5bca n VAL 25 N -3.23 1.55 0.00 3.13 0.31 0.24 -5.02 118.33 115.31 5bca n VAL 25 Ca -0.02 -0.59 0.00 0.00 -0.01 0.00 0.00 64.34 63.73 5bca n VAL 25 Cb 0.86 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.30 5bca n VAL 25 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 5bca n THR 26 N -3.32 0.00 -3.95 2.52 -1.04 0.14 -5.10 114.28 103.54 5bca n THR 26 Ca -0.43 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.49 5bca n THR 26 Cb 1.00 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 69.42 5bca n THR 26 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 5bca s ASN 27 N 1.40 0.24 0.37 8.00 2.20 -1.26 -4.28 114.94 121.61 5bca s ASN 27 Ca 0.00 -0.68 0.13 0.00 -0.94 0.00 0.00 52.86 51.38 5bca s ASN 27 Cb 0.00 0.25 0.96 0.00 -2.00 0.00 0.00 41.25 40.46 5bca s ASN 27 CO 0.00 -0.58 1.81 -0.50 -2.94 0.00 0.00 177.10 174.89 5bca h TRP 28 N 3.33 0.76 -0.13 1.54 4.06 -1.97 -2.00 115.95 121.53 5bca h TRP 28 Ca -0.33 0.02 -0.21 0.00 2.06 0.00 0.00 58.89 60.44 5bca h TRP 28 Cb 1.18 -0.23 0.00 0.00 -1.00 0.00 0.00 29.16 29.11 5bca h TRP 28 CO 0.51 0.17 -0.75 0.93 -3.56 0.00 0.00 178.44 175.74 5bca h GLU 29 N 0.54 0.66 0.00 0.49 3.07 -2.00 -1.83 114.58 115.50 5bca h GLU 29 Ca 0.53 -0.53 -0.10 0.00 -0.50 0.00 0.00 59.36 58.77 5bca h GLU 29 Cb 1.13 0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 29.13 5bca h GLU 29 CO -0.27 1.14 -0.46 1.15 -1.40 0.00 0.00 179.01 179.18 5bca h THR 30 N 0.45 1.28 -0.44 1.13 2.02 -1.86 -2.89 112.91 112.61 5bca h THR 30 Ca -0.04 -1.59 -0.03 0.00 0.77 0.00 0.00 66.41 65.51 5bca h THR 30 Cb 1.35 1.87 -0.02 0.00 -1.74 0.00 0.00 68.15 69.61 5bca h THR 30 CO 0.15 0.45 0.14 0.15 0.37 0.00 0.00 175.52 176.78 5bca h PHE 31 N 0.00 0.70 -0.55 3.16 3.57 -0.98 0.41 116.94 123.25 5bca h PHE 31 Ca -0.00 -0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.44 5bca h PHE 31 Cb 0.83 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.34 5bca h PHE 31 CO 0.00 0.63 0.36 0.93 -2.23 0.00 0.00 178.31 178.00 5bca h GLU 32 N 0.57 0.70 -0.05 1.11 5.08 -1.19 0.34 114.58 121.13 5bca h GLU 32 Ca 0.14 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.35 5bca h GLU 32 Cb 0.25 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.35 5bca h GLU 32 CO -0.01 0.46 -0.41 -0.91 -1.00 0.00 0.00 179.01 177.15 5bca h ASN 33 N 0.72 0.45 -0.99 1.42 2.35 -0.90 -2.40 115.58 116.23 5bca h ASN 33 Ca 0.21 -0.68 0.15 0.00 -0.55 0.00 0.00 56.30 55.42 5bca h ASN 33 Cb -0.05 -0.14 -0.09 0.00 0.05 0.00 0.00 38.32 38.09 5bca h ASN 33 CO -0.05 1.07 0.61 0.44 -1.65 0.00 0.00 177.43 177.85 5bca h ASP 34 N -0.12 0.84 -0.47 5.81 3.32 -0.65 0.07 116.42 125.22 5bca h ASP 34 Ca -0.04 0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.00 5bca h ASP 34 Cb 1.08 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.53 5bca h ASP 34 CO 0.08 0.38 -0.02 -0.07 -1.72 0.00 0.00 179.24 177.89 5bca h LEU 35 N 0.87 0.83 -0.68 1.55 3.38 -0.25 -0.85 115.31 120.15 5bca h LEU 35 Ca 0.53 -0.32 0.05 0.00 0.09 0.00 0.00 57.88 58.23 5bca h LEU 35 Cb 0.66 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 5bca h LEU 35 CO -0.32 0.95 0.39 0.03 0.09 0.00 0.00 178.44 179.58 5bca h ARG 36 N 0.69 0.71 0.48 1.13 3.08 -0.68 -1.85 114.38 117.93 5bca h ARG 36 Ca 0.13 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 5bca h ARG 36 Cb 0.54 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.44 5bca h ARG 36 CO 0.03 0.47 -0.23 2.35 -1.07 0.00 0.00 179.97 181.52 5bca h TRP 37 N 0.73 -0.60 -0.99 3.04 -0.00 -0.76 -2.22 115.95 115.15 5bca h TRP 37 Ca 0.30 -0.01 0.29 0.00 -0.00 0.00 0.00 58.89 59.46 5bca h TRP 37 Cb 0.16 0.20 -0.14 0.00 -0.00 0.00 0.00 29.16 29.37 5bca h TRP 37 CO -0.07 -0.32 0.54 0.00 -0.00 0.00 0.00 178.44 178.59 5bca h ALA 38 N -0.26 1.84 -0.16 2.65 0.00 -1.16 1.05 119.26 123.22 5bca h ALA 38 Ca -0.07 0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 5bca h ALA 38 Cb 0.54 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 5bca h ALA 38 CO 0.11 -0.47 -0.29 -0.22 0.00 0.00 0.00 179.25 178.38 5bca h LYS 39 N 0.39 0.30 -0.04 0.00 3.64 -1.03 -1.31 116.57 118.52 5bca h LYS 39 Ca 0.69 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.95 5bca h LYS 39 Cb 1.48 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.28 5bca h LYS 39 CO -0.57 0.57 -0.01 0.37 -2.27 0.00 0.00 179.45 177.54 5bca h GLN 40 N 0.27 0.06 -0.75 1.90 5.75 0.18 -2.37 115.11 120.14 5bca h GLN 40 Ca 0.04 -0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.44 5bca h GLN 40 Cb 0.66 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 29.13 5bca h GLN 40 CO 0.05 0.07 0.12 0.09 -2.65 0.00 0.00 178.83 176.52 5bca n ASN 41 N -4.49 4.50 0.00 -0.69 3.02 -0.79 -4.90 115.26 111.90 5bca n ASN 41 Ca -0.02 -2.87 0.00 0.00 -0.03 0.00 0.00 54.58 51.66 5bca n ASN 41 Cb 0.12 -0.68 0.00 0.00 -0.61 0.00 0.00 39.78 38.61 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 0.19 1.14 3.73 7.41 0.00 -0.89 -4.49 105.19 112.27 5bca n GLY 42 Ca 0.28 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.72 3.81 -0.14 1.61 0.08 -0.56 -4.44 117.98 114.62 5bca s PHE 43 Ca 0.00 1.79 0.15 0.00 0.12 0.00 0.00 56.93 58.99 5bca s PHE 43 Cb 0.00 -3.08 -0.24 0.00 -0.57 0.00 0.00 43.02 39.13 5bca s PHE 43 CO 0.00 0.12 0.29 0.98 -0.10 0.00 0.00 175.22 176.51 5bca n TYR 44 N 2.46 0.41 -3.65 0.36 9.36 -0.47 -4.08 117.16 121.54 5bca n TYR 44 Ca 0.02 0.14 -0.11 0.00 3.32 0.00 0.00 57.90 61.27 5bca n TYR 44 Cb 0.48 -1.07 -0.05 0.00 -0.63 0.00 0.00 39.34 38.06 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 -2.53 -0.94 -0.25 2.98 0.00 -1.24 -3.55 121.76 116.23 5bca s ALA 45 Ca -0.09 0.08 -0.08 0.00 0.00 0.00 0.00 51.96 51.87 5bca s ALA 45 Cb 0.07 0.54 -0.03 0.00 0.00 0.00 0.00 23.12 23.70 5bca s ALA 45 CO 0.82 -0.56 0.08 -1.50 0.00 0.00 0.00 175.76 174.60 5bca s ILE 46 N -3.25 4.43 -0.06 0.00 1.10 -1.10 -1.53 121.20 120.79 5bca s ILE 46 Ca -0.00 -0.13 -0.16 0.00 -0.51 0.00 0.00 60.65 59.84 5bca s ILE 46 Cb 0.01 -3.07 -0.05 0.00 0.15 0.00 0.00 42.46 39.50 5bca s ILE 46 CO -0.08 0.34 0.42 -0.89 -2.11 0.00 0.00 174.94 172.63 5bca s THR 47 N 1.52 5.11 -0.07 4.00 2.01 0.55 -1.03 115.64 127.72 5bca s THR 47 Ca 0.06 0.86 -0.07 0.00 0.31 0.00 0.00 61.69 62.85 5bca s THR 47 Cb -0.15 -3.75 0.02 0.00 0.01 0.00 0.00 72.50 68.63 5bca s THR 47 CO 0.04 0.47 0.19 0.54 -0.69 0.00 0.00 174.62 175.17 5bca s VAL 48 N -0.30 -0.00 -0.00 3.82 0.11 0.24 -0.74 120.40 123.52 5bca s VAL 48 Ca 0.24 0.01 -0.30 0.00 -2.93 0.00 0.00 61.98 58.99 5bca s VAL 48 Cb -0.16 -0.28 -0.04 0.00 -1.53 0.00 0.00 36.38 34.37 5bca s VAL 48 CO 0.11 0.00 1.16 -1.81 -3.33 0.00 0.00 175.10 171.23 5bca s ASP 49 N 0.15 7.12 -0.36 3.54 1.01 -1.26 -0.49 116.67 126.38 5bca s ASP 49 Ca -0.00 1.86 -0.08 0.00 0.71 0.00 0.00 52.55 55.03 5bca s ASP 49 Cb -0.02 -2.57 0.05 0.00 1.01 0.00 0.00 42.92 41.39 5bca s ASP 49 CO -0.00 -0.48 0.16 -0.36 0.21 0.00 0.00 175.17 174.70 5bca s PHE 50 N 1.58 3.28 0.12 4.23 0.08 -0.08 -4.91 117.98 122.28 5bca s PHE 50 Ca 0.56 -1.35 -0.31 0.00 0.12 0.00 0.00 56.93 55.95 5bca s PHE 50 Cb -0.26 -2.46 -0.08 0.00 -0.57 0.00 0.00 43.02 39.65 5bca s PHE 50 CO 0.25 -0.74 1.39 -1.58 -0.10 0.00 0.00 175.22 174.45 5bca s TRP 51 N 1.44 3.23 0.25 0.36 0.52 -1.26 -2.43 118.94 121.05 5bca s TRP 51 Ca 0.00 0.96 -0.03 0.00 0.02 0.00 0.00 56.10 57.05 5bca s TRP 51 Cb -0.20 -3.69 0.50 0.00 -1.15 0.00 0.00 33.47 28.93 5bca s TRP 51 CO 0.03 -2.40 1.72 2.35 0.02 0.00 0.00 176.95 178.67 5bca h TRP 52 N 6.68 0.49 0.00 -1.98 7.01 -1.63 0.40 115.95 126.93 5bca h TRP 52 Ca -0.42 0.04 0.00 0.00 2.11 0.00 0.00 58.89 60.61 5bca h TRP 52 Cb 1.21 -0.10 0.00 0.00 -2.10 0.00 0.00 29.16 28.17 5bca h TRP 52 CO 0.65 0.02 0.00 0.78 -2.79 0.00 0.00 178.44 177.11 5bca h GLY 53 N 0.41 0.00 0.17 2.65 0.00 -1.81 -1.86 103.07 102.63 5bca h GLY 53 Ca 0.44 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.38 5bca h GLY 53 CO -0.44 0.00 -2.34 1.22 0.00 0.00 0.00 176.54 174.98 5bca n ASP 54 N -2.85 1.88 0.23 0.19 8.00 0.12 -4.00 116.55 120.12 5bca n ASP 54 Ca -0.02 -0.03 0.14 0.00 0.71 0.00 0.00 54.79 55.58 5bca n ASP 54 Cb 0.07 -0.43 0.36 0.00 -0.02 0.00 0.00 41.12 41.09 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 0.00 -0.29 -1.24 2.86 -0.40 -3.36 114.93 112.52 5bca h MET 55 Ca -0.53 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 56.89 5bca h MET 55 Cb 1.96 0.00 -0.34 0.00 0.06 0.00 0.00 31.60 33.27 5bca h MET 55 CO -0.04 0.00 -0.92 -1.91 1.06 0.00 0.00 176.91 175.10 5bca n GLU 56 N -3.00 1.41 0.39 1.72 2.13 -0.77 -1.49 120.64 121.04 5bca n GLU 56 Ca 0.03 -2.82 -0.19 0.00 0.66 0.00 0.00 57.16 54.84 5bca n GLU 56 Cb 0.44 -0.97 -0.10 0.00 0.27 0.00 0.00 31.44 31.08 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 2.04 -1.09 0.00 5.31 3.64 -1.72 -3.33 116.57 121.42 5bca h LYS 57 Ca -0.22 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 5bca h LYS 57 Cb 1.35 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 33.42 5bca h LYS 57 CO 0.09 -0.73 0.00 -0.91 -2.27 0.00 0.00 179.45 175.63 5bca h ASN 58 N -1.13 0.00 0.00 4.20 4.21 -1.92 -3.43 115.58 117.51 5bca h ASN 58 Ca -0.09 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.42 5bca h ASN 58 Cb 0.93 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.13 5bca h ASN 58 CO 0.06 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.81 5bca n GLY 59 N 0.83 -0.76 3.68 2.83 0.00 -1.25 -4.98 105.19 105.53 5bca n GLY 59 Ca 0.04 -1.18 -0.45 0.00 0.00 0.00 0.00 46.02 44.43 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 3.67 -0.36 1.61 2.03 -1.26 -1.26 116.55 120.99 5bca n ASP 60 Ca 0.00 0.98 -0.05 0.00 0.52 0.00 0.00 54.79 56.24 5bca n ASP 60 Cb 0.00 -1.45 -0.02 0.00 -0.72 0.00 0.00 41.12 38.93 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 6.08 -0.80 -3.25 -0.67 1.13 -1.26 -4.93 117.38 113.67 5bca n GLN 61 Ca 0.20 0.52 -0.43 0.00 -1.94 0.00 0.00 57.00 55.35 5bca n GLN 61 Cb 0.33 -4.32 -0.00 0.00 0.11 0.00 0.00 30.24 26.36 5bca n GLN 61 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 5bca n GLN 62 N -1.91 3.77 -2.18 -1.09 6.02 -0.39 -5.02 117.38 116.58 5bca n GLN 62 Ca -0.05 -4.50 -0.32 0.00 -0.01 0.00 0.00 57.00 52.13 5bca n GLN 62 Cb 0.27 -2.52 -0.01 0.00 1.02 0.00 0.00 30.24 29.00 5bca n GLN 62 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 5bca s PHE 63 N -1.83 3.53 -0.41 1.08 0.08 -1.26 -4.27 117.98 114.90 5bca s PHE 63 Ca 0.31 1.38 0.06 0.00 0.12 0.00 0.00 56.93 58.80 5bca s PHE 63 Cb -0.04 -2.75 0.17 0.00 -0.57 0.00 0.00 43.02 39.83 5bca s PHE 63 CO -0.02 -0.50 0.55 0.34 -0.10 0.00 0.00 175.22 175.49 5bca s ASP 64 N -3.56 -0.58 -0.16 1.36 2.15 -0.55 -4.96 116.67 110.36 5bca s ASP 64 Ca 0.57 -1.25 0.11 0.00 0.43 0.00 0.00 52.55 52.41 5bca s ASP 64 Cb -0.10 1.43 0.62 0.00 -0.30 0.00 0.00 42.92 44.56 5bca s ASP 64 CO 0.41 -0.18 1.45 0.49 -0.17 0.00 0.00 175.17 177.17 5bca n PHE 65 N 4.10 1.51 0.06 -5.34 3.72 -1.26 -4.35 117.46 115.90 5bca n PHE 65 Ca 0.13 -0.53 -0.08 0.00 -0.05 0.00 0.00 57.45 56.92 5bca n PHE 65 Cb 0.53 -0.37 0.07 0.00 -0.94 0.00 0.00 39.48 38.76 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 3.08 0.39 -0.37 4.37 4.64 -1.97 -1.59 113.55 122.10 5bca h SER 66 Ca 0.00 -0.24 -0.15 0.00 -0.47 0.00 0.00 61.79 60.93 5bca h SER 66 Cb 1.54 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.51 5bca h SER 66 CO 0.34 0.94 -0.34 0.22 -0.87 0.00 0.00 176.83 177.12 5bca h TYR 67 N 0.24 1.08 -0.34 4.77 3.20 -1.99 -2.25 116.97 121.66 5bca h TYR 67 Ca -0.02 -0.30 -0.04 0.00 3.14 0.00 0.00 58.73 61.51 5bca h TYR 67 Cb 1.21 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 5bca h TYR 67 CO 0.03 1.12 0.06 0.00 -1.64 0.00 0.00 178.16 177.73 5bca h ALA 68 N 0.85 0.45 -0.70 1.82 0.00 -1.82 -1.13 119.26 118.73 5bca h ALA 68 Ca 0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 5bca h ALA 68 Cb 0.92 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 5bca h ALA 68 CO 0.09 0.15 0.34 1.96 0.00 0.00 0.00 179.25 181.79 5bca h GLN 69 N 0.40 1.00 0.47 0.00 4.20 -1.26 -2.07 115.11 117.86 5bca h GLN 69 Ca 0.10 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 5bca h GLN 69 Cb 0.34 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.94 5bca h GLN 69 CO 0.01 0.79 -0.23 -0.09 -0.67 0.00 0.00 178.83 178.63 5bca h ARG 70 N 0.97 -0.61 -0.59 1.46 9.65 -0.97 -2.00 114.38 122.30 5bca h ARG 70 Ca 0.24 0.04 0.12 0.00 -1.10 0.00 0.00 59.98 59.28 5bca h ARG 70 Cb 0.11 0.14 -0.11 0.00 -1.39 0.00 0.00 29.97 28.71 5bca h ARG 70 CO -0.03 -0.35 -0.20 0.35 2.80 0.00 0.00 179.97 182.54 5bca h PHE 71 N -0.76 -0.47 -0.71 2.20 3.04 -1.25 -1.42 116.94 117.57 5bca h PHE 71 Ca -0.06 0.06 0.00 0.00 3.98 0.00 0.00 57.97 61.95 5bca h PHE 71 Cb 0.54 0.30 -0.04 0.00 2.56 0.00 0.00 35.95 39.32 5bca h PHE 71 CO -0.02 -0.30 0.46 0.00 -2.02 0.00 0.00 178.31 176.44 5bca h ALA 72 N 1.44 0.91 -0.69 2.41 0.00 -1.25 -1.64 119.26 120.44 5bca h ALA 72 Ca 0.27 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.14 5bca h ALA 72 Cb 0.48 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 5bca h ALA 72 CO -0.63 0.34 0.45 0.37 0.00 0.00 0.00 179.25 179.79 5bca h GLN 73 N 0.97 0.88 -0.33 0.00 5.75 -0.50 0.10 115.11 121.97 5bca h GLN 73 Ca 0.26 -0.05 -0.10 0.00 -0.15 0.00 0.00 58.65 58.61 5bca h GLN 73 Cb -0.09 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.25 5bca h GLN 73 CO -0.05 0.58 -0.18 0.77 -2.65 0.00 0.00 178.83 177.30 5bca h SER 74 N 0.91 0.73 -0.62 -0.69 0.02 -0.79 0.60 113.55 113.70 5bca h SER 74 Ca 0.26 -0.41 0.12 0.00 -0.84 0.00 0.00 61.79 60.91 5bca h SER 74 Cb -0.07 -0.20 -0.09 0.00 0.14 0.00 0.00 62.40 62.18 5bca h SER 74 CO -0.06 0.98 0.15 0.58 -1.14 0.00 0.00 176.83 177.34 5bca h VAL 75 N 0.48 0.64 -0.16 2.27 2.07 -1.05 0.28 116.25 120.78 5bca h VAL 75 Ca 0.07 -0.10 -0.12 0.00 0.82 0.00 0.00 66.70 67.38 5bca h VAL 75 Cb 0.72 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 5bca h VAL 75 CO 0.05 0.05 -0.40 0.50 0.02 0.00 0.00 177.57 177.79 5bca h LYS 76 N 0.28 0.36 -0.57 1.57 3.64 -0.00 -2.35 116.57 119.50 5bca h LYS 76 Ca 0.33 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 5bca h LYS 76 Cb 0.49 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.28 5bca h LYS 76 CO -0.41 0.71 0.35 -0.91 -2.27 0.00 0.00 179.45 176.92 5bca h ASN 77 N 0.30 0.68 0.05 4.20 2.35 0.35 -2.93 115.58 120.59 5bca h ASN 77 Ca 0.03 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 5bca h ASN 77 Cb 0.84 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.04 5bca h ASN 77 CO 0.07 0.52 -0.05 0.00 -1.65 0.00 0.00 177.43 176.31 5bca n ALA 78 N -2.45 2.69 -1.07 -0.83 0.00 0.14 -4.93 120.51 114.05 5bca n ALA 78 Ca 0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 53.44 53.06 5bca n ALA 78 Cb 0.07 -1.19 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 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 1.20 0.58 3.12 0.00 0.00 -1.09 -4.57 105.19 104.43 5bca n GLY 79 Ca 0.18 -0.59 -0.16 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.68 0.48 -4.48 1.61 2.81 -1.10 -5.06 117.12 108.70 5bca n MET 80 Ca -0.02 -2.40 -0.23 0.00 -1.81 0.00 0.00 57.70 53.24 5bca n MET 80 Cb 0.11 -0.30 -0.11 0.00 -0.71 0.00 0.00 33.22 32.22 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 -4.25 1.68 0.04 0.03 1.02 -1.23 -4.62 119.74 112.42 5bca s LYS 81 Ca 0.50 -1.90 -0.01 0.00 0.02 0.00 0.00 55.97 54.58 5bca s LYS 81 Cb -0.04 -1.18 -0.03 0.00 -0.52 0.00 0.00 37.83 36.06 5bca s LYS 81 CO 0.32 -0.05 -0.03 0.00 -0.92 0.00 0.00 175.35 174.68 5bca s MET 82 N -3.77 0.53 -0.26 1.68 0.23 0.15 -2.71 119.30 115.14 5bca s MET 82 Ca 0.33 -1.05 0.01 0.00 -1.03 0.00 0.00 55.69 53.96 5bca s MET 82 Cb 0.07 0.19 0.07 0.00 -1.53 0.00 0.00 34.83 33.62 5bca s MET 82 CO 0.15 -0.10 -0.03 0.42 -2.03 0.00 0.00 175.02 173.43 5bca s ILE 83 N -3.25 1.67 0.38 3.16 1.01 -0.20 -1.99 121.20 121.98 5bca s ILE 83 Ca 0.01 -1.48 -0.24 0.00 0.00 0.00 0.00 60.65 58.94 5bca s ILE 83 Cb 0.03 -1.99 -0.10 0.00 0.01 0.00 0.00 42.46 40.40 5bca s ILE 83 CO -0.08 -0.23 0.95 -2.16 0.00 0.00 0.00 174.94 173.42 5bca s PRO 84 N 1.30 4.40 -0.21 2.79 0.04 -1.25 -0.59 135.00 141.48 5bca s PRO 84 Ca -0.02 1.24 -0.02 0.00 0.04 0.00 0.00 61.00 62.23 5bca s PRO 84 Cb -0.19 -2.49 -0.00 0.00 0.04 0.00 0.00 34.50 31.85 5bca s PRO 84 CO -0.08 0.11 -0.08 0.42 0.04 0.00 0.00 177.00 177.41 5bca s ILE 85 N -1.88 3.05 -0.92 0.56 1.01 0.36 0.18 121.20 123.55 5bca s ILE 85 Ca 0.56 -0.61 -0.24 0.00 0.00 0.00 0.00 60.65 60.36 5bca s ILE 85 Cb -0.14 -2.36 0.04 0.00 0.01 0.00 0.00 42.46 40.01 5bca s ILE 85 CO 0.19 0.46 1.40 -0.63 0.00 0.00 0.00 174.94 176.35 5bca s ILE 86 N 1.36 3.84 -1.09 2.92 1.01 -0.64 -0.90 121.20 127.70 5bca s ILE 86 Ca 0.05 -0.35 -0.19 0.00 0.00 0.00 0.00 60.65 60.16 5bca s ILE 86 Cb -0.14 -5.00 0.10 0.00 0.01 0.00 0.00 42.46 37.44 5bca s ILE 86 CO -0.05 -1.90 1.41 -0.44 0.00 0.00 0.00 174.94 173.96 5bca s SER 87 N 4.59 6.73 0.00 3.58 0.01 -1.02 -2.87 113.70 124.72 5bca s SER 87 Ca 0.42 -2.16 0.00 0.00 1.31 0.00 0.00 55.95 55.52 5bca s SER 87 Cb -0.03 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.72 5bca s SER 87 CO -0.01 -1.14 0.54 0.35 0.41 0.00 0.00 173.24 173.38 5bca n THR 88 N 5.88 0.17 -4.52 1.44 -2.24 -1.26 -1.66 114.28 112.09 5bca n THR 88 Ca 0.34 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.88 5bca n THR 88 Cb 0.48 -0.55 -0.10 0.00 -2.10 0.00 0.00 70.33 68.06 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 -0.79 2.03 0.24 4.78 -3.43 -1.26 -4.60 115.29 112.26 5bca s HIS 89 Ca 0.00 -0.96 -0.30 0.00 -0.80 0.00 0.00 55.06 53.00 5bca s HIS 89 Cb 0.00 -1.39 -0.09 0.00 -1.43 0.00 0.00 32.58 29.67 5bca s HIS 89 CO 0.00 0.06 0.95 -1.14 -2.00 0.00 0.00 174.74 172.61 5bca s GLN 90 N -3.83 4.85 -0.23 -0.38 0.74 0.46 -4.77 119.66 116.50 5bca s GLN 90 Ca 0.31 1.51 -0.11 0.00 0.05 0.00 0.00 55.36 57.11 5bca s GLN 90 Cb 0.07 -3.28 -0.05 0.00 1.10 0.00 0.00 33.01 30.86 5bca s GLN 90 CO 0.15 0.50 0.20 0.00 -0.55 0.00 0.00 175.29 175.59 5bca n GLY 92 N 4.15 2.08 0.00 0.00 0.00 -1.26 -1.52 105.19 108.64 5bca n GLY 92 Ca -0.14 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 1.00 2.94 -0.02 0.00 -1.07 -4.82 105.19 103.22 5bca n GLY 93 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.36 1.82 0.67 1.61 0.02 -1.26 -5.08 114.94 112.36 5bca s ASN 94 Ca 0.00 -0.27 -0.17 0.00 -1.02 0.00 0.00 52.86 51.40 5bca s ASN 94 Cb 0.00 -0.76 -0.00 0.00 0.02 0.00 0.00 41.25 40.51 5bca s ASN 94 CO 0.00 -0.05 1.27 0.52 0.02 0.00 0.00 177.10 178.86 5bca n VAL 95 N 4.39 4.60 0.00 1.60 0.31 -1.26 -1.26 118.33 126.70 5bca n VAL 95 Ca -0.18 -0.46 0.00 0.00 -0.01 0.00 0.00 64.34 63.69 5bca n VAL 95 Cb 0.51 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 5bca n VAL 95 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 5bca n GLY 96 N 0.89 2.84 3.79 2.92 0.00 -1.26 -5.05 105.19 109.32 5bca n GLY 96 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 5bca n GLY 96 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 5bca s ASP 97 N -1.07 6.41 0.21 1.61 1.01 -0.39 -4.95 116.67 119.50 5bca s ASP 97 Ca 0.00 2.03 0.24 0.00 0.71 0.00 0.00 52.55 55.53 5bca s ASP 97 Cb 0.00 -2.58 0.42 0.00 1.01 0.00 0.00 42.92 41.77 5bca s ASP 97 CO 0.00 -0.73 1.45 0.44 0.21 0.00 0.00 175.17 176.54 5bca h ASP 98 N 1.90 0.00 -4.51 0.27 5.19 -1.97 -3.47 116.42 113.83 5bca h ASP 98 Ca -0.49 -0.08 -0.42 0.00 -0.62 0.00 0.00 57.03 55.41 5bca h ASP 98 Cb 1.22 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 40.60 5bca h ASP 98 CO 0.60 0.04 -0.56 0.00 -3.12 0.00 0.00 179.24 176.20 5bca s ASN 100 N -3.39 -1.35 -0.46 0.00 3.84 -1.15 -2.60 114.94 109.83 5bca s ASN 100 Ca 0.35 -0.76 0.05 0.00 0.21 0.00 0.00 52.86 52.71 5bca s ASN 100 Cb 0.05 1.73 0.18 0.00 -0.55 0.00 0.00 41.25 42.66 5bca s ASN 100 CO 0.17 -0.14 0.39 0.52 -2.79 0.00 0.00 177.10 175.25 5bca n VAL 101 N 4.19 -0.62 -0.57 -5.21 0.31 -0.58 -4.97 118.33 110.88 5bca n VAL 101 Ca 0.11 -3.75 -0.30 0.00 -0.01 0.00 0.00 64.34 60.39 5bca n VAL 101 Cb 0.58 -1.78 0.22 0.00 -0.91 0.00 0.00 33.84 31.95 5bca n VAL 101 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 5bca n PRO 102 N 2.53 -1.65 -1.51 5.55 -0.04 -1.26 -2.33 135.00 136.29 5bca n PRO 102 Ca 0.28 -0.44 -0.29 0.00 -0.04 0.00 0.00 63.50 63.01 5bca n PRO 102 Cb 0.46 -2.21 0.13 0.00 -0.04 0.00 0.00 33.50 31.84 5bca n PRO 102 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 5bca s ILE 103 N -2.48 2.22 -0.13 0.52 -4.36 -1.26 -4.13 121.20 111.57 5bca s ILE 103 Ca 0.67 0.07 -0.35 0.00 -0.26 0.00 0.00 60.65 60.78 5bca s ILE 103 Cb -0.24 -2.80 -0.13 0.00 1.25 0.00 0.00 42.46 40.54 5bca s ILE 103 CO 0.63 -0.09 1.86 -2.65 0.24 0.00 0.00 174.94 174.92 5bca n PRO 104 N -3.72 1.96 0.18 0.37 -0.02 -1.26 -4.85 135.00 127.65 5bca n PRO 104 Ca 0.07 0.72 0.18 0.00 -2.02 0.00 0.00 63.50 62.44 5bca n PRO 104 Cb 0.58 -2.53 0.80 0.00 -0.02 0.00 0.00 33.50 32.33 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 8.85 0.00 1.54 2.55 4.64 -1.90 -2.60 113.55 126.64 5bca h SER 105 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 5bca h SER 105 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 5bca h SER 105 CO 0.95 0.00 0.00 4.11 -0.87 0.00 0.00 176.83 181.02 5bca h TRP 106 N 0.00 0.00 -0.08 4.77 5.08 -1.88 -3.27 115.95 120.56 5bca h TRP 106 Ca 0.11 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.07 5bca h TRP 106 Cb 0.64 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.79 5bca h TRP 106 CO 0.00 0.00 -0.03 0.28 -1.28 0.00 0.00 178.44 177.41 5bca h VAL 107 N 0.00 1.08 -0.74 0.12 2.07 -1.84 -2.58 116.25 114.36 5bca h VAL 107 Ca 0.00 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 67.14 5bca h VAL 107 Cb 0.77 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 5bca h VAL 107 CO 0.00 0.10 0.25 -0.50 0.02 0.00 0.00 177.57 177.44 5bca h TRP 108 N 0.11 1.16 0.00 1.57 4.06 -1.77 -1.90 115.95 119.18 5bca h TRP 108 Ca 0.03 -0.10 0.00 0.00 2.06 0.00 0.00 58.89 60.87 5bca h TRP 108 Cb 0.14 -0.34 0.00 0.00 -1.00 0.00 0.00 29.16 27.96 5bca h TRP 108 CO 0.00 0.90 0.00 0.09 -3.56 0.00 0.00 178.44 175.87 5bca n ASN 109 N -4.26 0.00 0.13 -3.49 3.02 -0.97 -2.30 115.26 107.39 5bca n ASN 109 Ca 0.06 0.17 0.10 0.00 -0.03 0.00 0.00 54.58 54.89 5bca n ASN 109 Cb 0.21 -0.31 0.50 0.00 -0.61 0.00 0.00 39.78 39.57 5bca n ASN 109 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 5bca n GLN 110 N -1.31 0.14 -3.95 3.52 6.02 -0.72 -4.70 117.38 116.39 5bca n GLN 110 Ca 0.05 0.54 -0.10 0.00 -0.01 0.00 0.00 57.00 57.48 5bca n GLN 110 Cb 0.09 -1.88 -0.10 0.00 1.02 0.00 0.00 30.24 29.37 5bca n GLN 110 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 5bca s LYS 111 N -3.41 0.44 0.00 -1.09 -0.14 -0.97 -5.03 119.74 109.53 5bca s LYS 111 Ca 0.00 -0.62 0.08 0.00 -1.36 0.00 0.00 55.97 54.07 5bca s LYS 111 Cb 0.07 0.17 0.16 0.00 -1.68 0.00 0.00 37.83 36.55 5bca s LYS 111 CO 0.25 -0.09 1.02 -1.13 -0.76 0.00 0.00 175.35 174.63 5bca n SER 112 N 1.28 2.29 -1.69 2.83 3.41 -1.26 -4.98 113.62 115.50 5bca n SER 112 Ca -0.22 -1.74 0.00 0.00 -0.26 0.00 0.00 58.87 56.65 5bca n SER 112 Cb 0.56 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 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 0.33 0.07 -1.38 4.04 5.68 -1.26 -5.03 116.55 119.01 5bca n ASP 113 Ca 0.07 -0.84 -0.09 0.00 -0.50 0.00 0.00 54.79 53.42 5bca n ASP 113 Cb 0.31 0.00 0.17 0.00 -1.14 0.00 0.00 41.12 40.46 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 -2.47 3.05 0.00 -1.12 5.75 -1.26 -4.58 116.55 115.92 5bca n ASP 114 Ca 0.00 -3.79 0.13 0.00 -0.01 0.00 0.00 54.79 51.12 5bca n ASP 114 Cb 0.00 -0.64 0.57 0.00 -1.03 0.00 0.00 41.12 40.02 5bca n ASP 114 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 5bca n SER 115 N -1.08 0.00 0.00 -1.12 3.41 -1.26 -3.68 113.62 109.89 5bca n SER 115 Ca 0.38 0.44 0.11 0.00 -0.26 0.00 0.00 58.87 59.53 5bca n SER 115 Cb 1.04 -0.48 -0.10 0.00 -0.26 0.00 0.00 64.21 64.42 5bca n SER 115 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 5bca n LEU 116 N -1.48 0.61 0.00 1.04 4.77 -1.26 -4.11 117.00 116.58 5bca n LEU 116 Ca 0.07 -0.24 -0.23 0.00 -0.03 0.00 0.00 56.01 55.57 5bca n LEU 116 Cb 0.30 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.33 5bca n LEU 116 CO 0.24 0.13 -0.11 0.00 -1.33 0.00 0.00 177.39 176.33 5bca n TYR 117 N -1.82 0.33 -4.25 -1.77 0.18 -1.24 -1.72 117.16 106.87 5bca n TYR 117 Ca 0.01 -1.87 -0.31 0.00 1.88 0.00 0.00 57.90 57.61 5bca n TYR 117 Cb 0.42 -0.29 -0.09 0.00 -0.38 0.00 0.00 39.34 39.00 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 -2.29 2.88 -0.02 -3.48 0.08 -1.05 -4.73 117.98 109.37 5bca s PHE 118 Ca 0.08 -0.07 0.01 0.00 0.12 0.00 0.00 56.93 57.07 5bca s PHE 118 Cb -0.01 -1.53 0.01 0.00 -0.57 0.00 0.00 43.02 40.93 5bca s PHE 118 CO 0.05 0.43 -0.01 0.21 -0.10 0.00 0.00 175.22 175.80 5bca s LYS 119 N -2.02 0.27 0.82 0.44 2.20 -1.26 -0.61 119.74 119.58 5bca s LYS 119 Ca 0.22 -0.00 -0.09 0.00 -0.36 0.00 0.00 55.97 55.74 5bca s LYS 119 Cb -0.11 -0.37 0.18 0.00 -1.51 0.00 0.00 37.83 36.02 5bca s LYS 119 CO 0.14 -0.05 1.11 -1.13 -0.36 0.00 0.00 175.35 175.06 5bca n SER 120 N 3.65 0.59 -0.01 1.43 3.41 -0.26 -1.72 113.62 120.70 5bca n SER 120 Ca -0.21 -1.71 0.11 0.00 -0.26 0.00 0.00 58.87 56.80 5bca n SER 120 Cb 0.54 -0.80 0.52 0.00 -0.26 0.00 0.00 64.21 64.21 5bca n SER 120 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 5bca h GLU 121 N 0.00 0.33 -0.54 4.33 5.08 -1.77 -1.33 114.58 120.68 5bca h GLU 121 Ca -0.36 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 5bca h GLU 121 Cb 1.12 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.30 5bca h GLU 121 CO 0.30 0.22 0.00 0.25 -1.00 0.00 0.00 179.01 178.78 5bca n THR 122 N -4.47 2.43 -0.92 1.13 -2.24 -1.26 -4.95 114.28 103.99 5bca n THR 122 Ca 0.07 -1.43 0.00 0.00 -2.27 0.00 0.00 64.05 60.42 5bca n THR 122 Cb 0.29 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 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 0.56 0.57 3.74 3.38 0.00 -0.50 -5.03 105.19 107.91 5bca n GLY 123 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.12 2.93 -0.04 2.61 2.01 -1.26 -4.66 115.64 115.11 5bca s THR 124 Ca 0.00 0.75 -0.13 0.00 0.31 0.00 0.00 61.69 62.62 5bca s THR 124 Cb 0.00 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 68.98 5bca s THR 124 CO 0.00 0.10 0.35 -0.69 -0.69 0.00 0.00 174.62 173.69 5bca s VAL 125 N 0.29 5.15 -0.06 3.82 1.01 -1.26 -1.10 120.40 128.25 5bca s VAL 125 Ca 0.60 0.70 0.05 0.00 0.00 0.00 0.00 61.98 63.33 5bca s VAL 125 Cb -0.39 -3.65 -0.00 0.00 0.00 0.00 0.00 36.38 32.33 5bca s VAL 125 CO 0.39 0.57 -0.22 0.21 0.00 0.00 0.00 175.10 176.05 5bca s ASN 126 N -0.93 2.75 -0.32 3.32 3.84 0.22 -4.98 114.94 118.84 5bca s ASN 126 Ca 0.22 -0.47 0.16 0.00 0.21 0.00 0.00 52.86 52.98 5bca s ASN 126 Cb -0.15 -0.90 0.47 0.00 -0.55 0.00 0.00 41.25 40.11 5bca s ASN 126 CO 0.11 0.19 1.07 0.29 -2.79 0.00 0.00 177.10 175.96 5bca n LYS 127 N 3.18 2.11 0.00 0.43 5.02 -1.26 -2.53 118.16 125.11 5bca n LYS 127 Ca -0.18 -3.69 0.13 0.00 -2.02 0.00 0.00 58.31 52.54 5bca n LYS 127 Cb 0.52 -1.69 0.33 0.00 -0.02 0.00 0.00 35.03 34.17 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 -0.41 0.51 -3.67 1.97 0.28 -1.26 -4.78 120.64 113.28 5bca n GLU 128 Ca 0.19 -0.30 -0.06 0.00 -0.16 0.00 0.00 57.16 56.83 5bca n GLU 128 Cb 0.81 -1.49 -0.02 0.00 1.43 0.00 0.00 31.44 32.17 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 -2.70 0.00 0.21 3.84 -1.32 -1.26 -0.40 115.64 114.01 5bca s THR 129 Ca 0.19 -0.49 -0.24 0.00 -1.21 0.00 0.00 61.69 59.94 5bca s THR 129 Cb 0.19 -1.63 -0.08 0.00 -1.51 0.00 0.00 72.50 69.46 5bca s THR 129 CO 0.59 0.00 0.80 -0.76 -2.21 0.00 0.00 174.62 173.04 5bca s LEU 130 N -2.81 4.49 0.04 9.08 1.43 -1.26 -4.87 118.68 124.78 5bca s LEU 130 Ca 0.09 1.64 -0.30 0.00 -1.03 0.00 0.00 54.13 54.53 5bca s LEU 130 Cb -0.02 -3.52 -0.08 0.00 0.03 0.00 0.00 46.19 42.60 5bca s LEU 130 CO -0.01 0.11 1.72 0.21 0.23 0.00 0.00 176.35 178.60 5bca s ASN 131 N -1.36 6.58 0.00 2.29 3.84 -0.70 -4.79 114.94 120.80 5bca s ASN 131 Ca 0.40 2.48 0.02 0.00 0.21 0.00 0.00 52.86 55.97 5bca s ASN 131 Cb -0.21 -2.55 0.08 0.00 -0.55 0.00 0.00 41.25 38.02 5bca s ASN 131 CO 0.25 -0.93 1.04 -0.81 -2.79 0.00 0.00 177.10 173.86 5bca n PRO 132 N 6.26 0.00 -0.02 0.43 -0.04 -1.26 -1.21 135.00 139.17 5bca n PRO 132 Ca 0.17 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 5bca n PRO 132 Cb 0.41 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.67 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 0.52 -6.94 1.53 3.38 -1.86 -3.33 115.31 108.60 5bca h LEU 133 Ca 0.00 -0.08 -0.74 0.00 0.09 0.00 0.00 57.88 57.15 5bca h LEU 133 Cb 0.03 -0.14 -0.15 0.00 0.09 0.00 0.00 40.66 40.50 5bca h LEU 133 CO 0.00 0.55 1.89 0.00 0.09 0.00 0.00 178.44 180.97 5bca n ALA 134 N -2.47 4.75 0.40 1.53 0.00 -0.35 -4.77 120.51 119.60 5bca n ALA 134 Ca 0.02 -4.23 0.13 0.00 0.00 0.00 0.00 53.44 49.36 5bca n ALA 134 Cb 0.21 -3.09 0.34 0.00 0.00 0.00 0.00 19.45 16.91 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 6.36 0.00 -0.04 0.00 4.64 -1.83 -1.79 113.55 120.88 5bca h SER 135 Ca 0.39 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.69 5bca h SER 135 Cb 0.73 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 5bca h SER 135 CO 1.50 0.00 -0.02 -2.24 -0.87 0.00 0.00 176.83 175.20 5bca h ASP 136 N 0.00 0.09 0.00 4.97 2.03 -1.94 0.42 116.42 121.99 5bca h ASP 136 Ca 0.00 -0.43 -0.07 0.00 -0.73 0.00 0.00 57.03 55.79 5bca h ASP 136 Cb 0.80 -0.02 -0.01 0.00 -0.83 0.00 0.00 39.33 39.26 5bca h ASP 136 CO 0.00 0.50 -0.20 0.58 -1.03 0.00 0.00 179.24 179.10 5bca h VAL 137 N -0.33 1.23 0.13 4.15 2.07 -1.93 -2.35 116.25 119.22 5bca h VAL 137 Ca 0.01 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.45 5bca h VAL 137 Cb 0.47 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 5bca h VAL 137 CO 0.01 0.33 -0.06 0.40 0.02 0.00 0.00 177.57 178.27 5bca h ILE 138 N 0.32 1.03 -0.74 4.57 1.08 -1.25 -1.85 117.51 120.68 5bca h ILE 138 Ca 0.06 -0.76 -0.01 0.00 -0.39 0.00 0.00 64.86 63.76 5bca h ILE 138 Cb 0.54 1.50 -0.04 0.00 -3.07 0.00 0.00 36.82 35.75 5bca h ILE 138 CO 0.04 0.18 0.42 -0.09 -0.69 0.00 0.00 178.15 178.01 5bca h ARG 139 N -0.54 1.01 0.37 2.37 2.43 -0.77 -0.50 114.38 118.75 5bca h ARG 139 Ca -0.02 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 5bca h ARG 139 Cb 0.42 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 5bca h ARG 139 CO 0.03 0.72 -0.18 -0.22 -1.51 0.00 0.00 179.97 178.81 5bca h LYS 140 N 1.02 -0.48 -0.47 0.20 3.64 -1.41 -1.27 116.57 117.80 5bca h LYS 140 Ca 0.26 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.67 5bca h LYS 140 Cb -0.01 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 5bca h LYS 140 CO -0.05 -0.32 0.26 0.93 -2.27 0.00 0.00 179.45 178.01 5bca h GLU 141 N -0.70 0.63 0.10 1.90 4.39 -1.33 -0.15 114.58 119.42 5bca h GLU 141 Ca -0.05 -0.06 -0.31 0.00 0.34 0.00 0.00 59.36 59.28 5bca h GLU 141 Cb 0.38 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 5bca h GLU 141 CO 0.08 0.46 -1.64 1.88 -1.16 0.00 0.00 179.01 178.63 5bca h TYR 142 N 0.64 0.37 -0.55 4.33 -1.99 -1.22 -1.72 116.97 116.84 5bca h TYR 142 Ca 0.17 -0.27 -0.01 0.00 2.00 0.00 0.00 58.73 60.62 5bca h TYR 142 Cb 0.01 -0.01 -0.03 0.00 2.00 0.00 0.00 36.73 38.70 5bca h TYR 142 CO 0.00 1.38 0.31 0.78 -0.00 0.00 0.00 178.16 180.64 5bca h GLY 143 N 1.92 0.81 1.01 3.88 0.00 -1.04 0.15 103.07 109.81 5bca h GLY 143 Ca -0.28 -0.36 -0.04 0.00 0.00 0.00 0.00 47.33 46.65 5bca h GLY 143 CO 0.13 0.35 0.25 0.83 0.00 0.00 0.00 176.54 178.10 5bca h GLU 144 N 0.73 0.98 -0.27 4.80 5.08 -1.04 -1.42 114.58 123.45 5bca h GLU 144 Ca 0.19 -0.18 -0.12 0.00 -1.00 0.00 0.00 59.36 58.25 5bca h GLU 144 Cb 0.03 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 5bca h GLU 144 CO -0.03 0.83 -0.28 1.25 -1.00 0.00 0.00 179.01 179.78 5bca h LEU 145 N 0.93 0.71 0.38 1.33 5.85 -1.19 -1.48 115.31 121.85 5bca h LEU 145 Ca 0.22 -0.48 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 5bca h LEU 145 Cb 0.22 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 5bca h LEU 145 CO -0.02 1.05 -0.30 1.88 -0.34 0.00 0.00 178.44 180.71 5bca h TYR 146 N 0.40 -0.81 -0.63 1.25 0.05 -0.89 -1.06 116.97 115.29 5bca h TYR 146 Ca 0.04 -0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 5bca h TYR 146 Cb 0.85 0.30 -0.03 0.00 1.01 0.00 0.00 36.73 38.87 5bca h TYR 146 CO 0.07 -0.45 0.25 1.15 -1.05 0.00 0.00 178.16 178.13 5bca h THR 147 N -0.69 1.22 -0.32 -2.88 2.02 -1.26 -1.07 112.91 109.94 5bca h THR 147 Ca -0.03 -0.70 -0.15 0.00 0.77 0.00 0.00 66.41 66.31 5bca h THR 147 Cb 0.60 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 5bca h THR 147 CO -0.01 0.28 -0.39 0.00 0.37 0.00 0.00 175.52 175.77 5bca h ALA 148 N 1.37 0.72 -0.28 6.16 0.00 -0.88 -2.79 119.26 123.56 5bca h ALA 148 Ca 0.21 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 5bca h ALA 148 Cb 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 5bca h ALA 148 CO -0.02 0.66 0.17 0.35 0.00 0.00 0.00 179.25 180.41 5bca h PHE 149 N 0.62 0.36 -0.16 0.00 3.57 -0.83 0.39 116.94 120.89 5bca h PHE 149 Ca 0.05 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.60 5bca h PHE 149 Cb 0.93 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 5bca h PHE 149 CO 0.05 0.27 0.15 0.00 -2.23 0.00 0.00 178.31 176.55 5bca h ALA 150 N 1.06 1.84 0.03 2.41 0.00 -1.03 0.13 119.26 123.70 5bca h ALA 150 Ca 0.10 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 5bca h ALA 150 Cb 0.01 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 5bca h ALA 150 CO -0.02 -0.23 -0.70 0.00 0.00 0.00 0.00 179.25 178.29 5bca h ALA 151 N 1.84 0.10 -0.26 0.00 0.00 -0.17 -2.63 119.26 118.14 5bca h ALA 151 Ca 0.07 -0.84 -0.04 0.00 0.00 0.00 0.00 54.91 54.11 5bca h ALA 151 Cb 0.38 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 5bca h ALA 151 CO -0.00 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.64 5bca h ALA 152 N -0.15 1.52 -0.00 0.00 0.00 0.04 -3.13 119.26 117.55 5bca h ALA 152 Ca -0.17 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.58 5bca h ALA 152 Cb 1.29 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.96 5bca h ALA 152 CO -0.04 0.35 -0.21 -1.33 0.00 0.00 0.00 179.25 178.02 5bca n MET 153 N -4.33 0.03 -0.28 0.00 2.81 -0.02 -4.37 117.12 110.96 5bca n MET 153 Ca 0.01 -0.01 0.10 0.00 -1.81 0.00 0.00 57.70 55.99 5bca n MET 153 Cb 0.21 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.46 5bca n MET 153 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 5bca h LYS 154 N 0.02 0.28 0.00 0.03 3.64 -1.40 0.42 116.57 119.55 5bca h LYS 154 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 5bca h LYS 154 Cb 0.49 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 5bca h LYS 154 CO 0.00 0.18 0.00 -1.35 -2.27 0.00 0.00 179.45 176.01 5bca h PRO 155 N 0.29 0.00 -0.42 1.90 0.11 -1.83 -2.24 132.00 129.80 5bca h PRO 155 Ca 0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.60 5bca h PRO 155 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 5bca h PRO 155 CO -0.56 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 177.89 5bca n TYR 156 N -3.00 1.18 0.01 0.65 4.01 0.13 -4.70 117.16 115.44 5bca n TYR 156 Ca -0.02 -0.72 0.23 0.00 -0.16 0.00 0.00 57.90 57.22 5bca n TYR 156 Cb 0.10 -0.28 0.72 0.00 -0.31 0.00 0.00 39.34 39.57 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 2.77 0.00 0.00 -0.72 2.10 -1.27 -1.08 116.57 118.36 5bca h LYS 157 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 5bca h LYS 157 Cb 1.41 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.74 5bca h LYS 157 CO 0.23 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.28 5bca n ASP 158 N -3.83 0.34 -0.70 7.07 5.68 -1.26 -2.19 116.55 121.65 5bca n ASP 158 Ca 0.11 0.57 0.07 0.00 -0.50 0.00 0.00 54.79 55.04 5bca n ASP 158 Cb 0.75 -0.65 0.14 0.00 -1.14 0.00 0.00 41.12 40.22 5bca n ASP 158 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 5bca n VAL 159 N -1.87 0.65 -3.35 2.12 0.24 -0.41 -4.94 118.33 110.76 5bca n VAL 159 Ca 0.03 -0.82 -0.41 0.00 -2.04 0.00 0.00 64.34 61.10 5bca n VAL 159 Cb 0.23 0.78 -0.09 0.00 -1.47 0.00 0.00 33.84 33.29 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 -1.05 5.12 -0.12 1.34 1.01 -0.93 0.30 121.20 126.88 5bca s ILE 160 Ca 0.24 0.16 0.20 0.00 0.00 0.00 0.00 60.65 61.25 5bca s ILE 160 Cb 0.14 -3.86 -0.23 0.00 0.01 0.00 0.00 42.46 38.52 5bca s ILE 160 CO 0.19 -0.11 0.51 0.00 0.00 0.00 0.00 174.94 175.52 5bca n ALA 161 N 5.48 2.21 -3.61 9.38 0.00 -0.84 -4.95 120.51 128.18 5bca n ALA 161 Ca -0.08 -0.72 -0.05 0.00 0.00 0.00 0.00 53.44 52.60 5bca n ALA 161 Cb 0.49 -0.68 -0.02 0.00 0.00 0.00 0.00 19.45 19.24 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 -3.08 0.75 -0.03 0.00 2.20 -1.26 -4.48 119.74 113.84 5bca s LYS 162 Ca -0.07 -0.35 0.07 0.00 -0.36 0.00 0.00 55.97 55.27 5bca s LYS 162 Cb 0.10 0.30 -0.02 0.00 -1.51 0.00 0.00 37.83 36.70 5bca s LYS 162 CO 0.85 -0.34 -0.25 0.42 -0.36 0.00 0.00 175.35 175.67 5bca s ILE 163 N -2.91 2.02 0.08 5.43 1.01 -0.78 -3.81 121.20 122.23 5bca s ILE 163 Ca 0.09 -1.08 0.03 0.00 0.00 0.00 0.00 60.65 59.70 5bca s ILE 163 Cb -0.00 -1.69 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 5bca s ILE 163 CO -0.04 0.57 0.08 -0.31 0.00 0.00 0.00 174.94 175.23 5bca s TYR 164 N -0.44 3.19 0.17 3.97 2.02 0.13 -2.03 117.35 124.37 5bca s TYR 164 Ca 0.05 0.08 0.07 0.00 -0.37 0.00 0.00 57.07 56.90 5bca s TYR 164 Cb -0.11 -1.62 -0.04 0.00 -0.40 0.00 0.00 41.96 39.78 5bca s TYR 164 CO 0.01 0.52 0.01 -0.51 -1.57 0.00 0.00 175.55 174.01 5bca s LEU 165 N -2.36 3.35 -0.35 -1.29 1.43 -0.43 -1.62 118.68 117.41 5bca s LEU 165 Ca 0.29 -0.38 -0.14 0.00 -1.03 0.00 0.00 54.13 52.88 5bca s LEU 165 Cb -0.12 -2.00 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 5bca s LEU 165 CO 0.22 0.09 0.29 -0.55 0.23 0.00 0.00 176.35 176.62 5bca s SER 166 N -2.97 6.10 0.00 2.29 0.15 -1.14 -4.54 113.70 113.60 5bca s SER 166 Ca 0.28 -0.40 0.21 0.00 0.70 0.00 0.00 55.95 56.73 5bca s SER 166 Cb -0.09 -2.16 0.71 0.00 -1.71 0.00 0.00 66.02 62.77 5bca s SER 166 CO 0.19 -0.29 1.53 0.61 1.20 0.00 0.00 173.24 176.48 5bca n GLY 167 N 5.06 0.38 0.00 9.45 0.00 -1.25 -4.79 105.19 114.04 5bca n GLY 167 Ca -0.11 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 1.15 -0.82 3.75 -0.02 0.00 -0.70 -4.15 105.19 104.40 5bca n GLY 168 Ca 0.16 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.76 5bca n GLY 168 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 5bca s PRO 169 N -1.50 3.26 -2.00 1.61 0.04 -1.22 -2.20 135.00 132.98 5bca s PRO 169 Ca 0.00 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.33 5bca s PRO 169 Cb 0.00 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 32.19 5bca s PRO 169 CO 0.00 -1.11 0.00 0.00 0.04 0.00 0.00 177.00 175.93 5bca n ALA 170 N -0.84 -0.31 -1.09 8.56 0.00 -1.26 -0.62 120.51 124.95 5bca n ALA 170 Ca 0.09 0.30 -0.03 0.00 0.00 0.00 0.00 53.44 53.80 5bca n ALA 170 Cb 0.44 -1.91 -0.01 0.00 0.00 0.00 0.00 19.45 17.97 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 -0.39 0.60 3.73 0.00 0.00 -0.94 -5.04 105.19 103.15 5bca n GLY 171 Ca -0.19 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.55 2.80 -0.83 1.61 2.02 0.21 -3.83 118.70 119.13 5bca s GLU 172 Ca 0.00 -0.68 -0.26 0.00 0.02 0.00 0.00 54.97 54.05 5bca s GLU 172 Cb 0.00 -2.68 0.03 0.00 0.10 0.00 0.00 34.13 31.58 5bca s GLU 172 CO 0.00 0.58 1.41 -1.17 0.02 0.00 0.00 175.26 176.11 5bca s LEU 173 N -2.08 3.28 0.00 1.80 2.96 0.14 -1.72 118.68 123.07 5bca s LEU 173 Ca 0.25 -0.72 -0.18 0.00 -0.22 0.00 0.00 54.13 53.26 5bca s LEU 173 Cb -0.12 -2.56 0.07 0.00 0.50 0.00 0.00 46.19 44.08 5bca s LEU 173 CO 0.17 -1.82 0.88 -2.11 -1.32 0.00 0.00 176.35 172.15 5bca n ARG 174 N 9.18 0.64 -3.61 1.98 1.85 -1.26 -4.63 116.66 120.80 5bca n ARG 174 Ca 0.16 -1.41 -0.31 0.00 -1.00 0.00 0.00 57.85 55.29 5bca n ARG 174 Cb 0.50 1.88 -0.05 0.00 -1.05 0.00 0.00 32.46 33.74 5bca n ARG 174 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 5bca s TYR 175 N -2.62 3.47 -1.11 2.89 2.02 -0.92 -4.39 117.35 116.69 5bca s TYR 175 Ca 0.19 0.60 -0.08 0.00 -0.37 0.00 0.00 57.07 57.41 5bca s TYR 175 Cb -0.03 -2.04 -0.12 0.00 -0.40 0.00 0.00 41.96 39.37 5bca s TYR 175 CO 0.06 0.39 2.90 -0.35 -1.57 0.00 0.00 175.55 176.97 5bca n PRO 176 N -0.05 2.96 0.00 -1.71 -0.04 -1.26 -4.50 135.00 130.40 5bca n PRO 176 Ca -0.02 -1.75 0.15 0.00 -0.04 0.00 0.00 63.50 61.84 5bca n PRO 176 Cb 0.52 -2.53 0.83 0.00 -0.04 0.00 0.00 33.50 32.28 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 3.44 0.20 -3.69 3.54 3.41 -1.26 -4.55 113.62 114.70 5bca n SER 177 Ca 0.63 -0.82 -0.30 0.00 -0.26 0.00 0.00 58.87 58.13 5bca n SER 177 Cb 0.36 -0.07 -0.14 0.00 -0.26 0.00 0.00 64.21 64.10 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 -2.18 1.73 0.08 7.33 1.13 -1.26 -2.68 117.35 121.49 5bca s TYR 178 Ca 0.41 -2.04 0.02 0.00 -1.41 0.00 0.00 57.07 54.05 5bca s TYR 178 Cb 0.21 -1.71 -0.03 0.00 -1.10 0.00 0.00 41.96 39.33 5bca s TYR 178 CO 0.40 -0.83 -0.07 0.95 -2.51 0.00 0.00 175.55 173.48 5bca s THR 179 N 0.99 0.67 0.28 -3.49 -4.23 -1.26 -4.63 115.64 103.98 5bca s THR 179 Ca 0.14 -1.60 0.07 0.00 -1.18 0.00 0.00 61.69 59.12 5bca s THR 179 Cb -0.21 -1.27 0.01 0.00 1.34 0.00 0.00 72.50 72.37 5bca s THR 179 CO -0.11 -0.66 1.65 0.74 -0.54 0.00 0.00 174.62 175.71 5bca h THR 180 N 3.58 1.35 -0.36 3.99 2.02 -1.95 0.48 112.91 122.02 5bca h THR 180 Ca -0.36 -1.75 -0.17 0.00 0.77 0.00 0.00 66.41 64.91 5bca h THR 180 Cb 1.18 1.86 -0.00 0.00 -1.74 0.00 0.00 68.15 69.45 5bca h THR 180 CO 0.55 0.51 -0.42 0.28 0.37 0.00 0.00 175.52 176.81 5bca h SER 181 N 0.14 0.99 -0.12 4.18 0.02 -2.01 -3.08 113.55 113.68 5bca h SER 181 Ca 0.00 -0.48 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 5bca h SER 181 Cb 0.94 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.20 5bca h SER 181 CO 0.07 1.27 0.00 -0.67 -1.14 0.00 0.00 176.83 176.37 5bca n ASP 182 N -4.06 0.80 -2.66 3.07 2.03 -1.12 -4.89 116.55 109.73 5bca n ASP 182 Ca -0.03 -1.77 -0.21 0.00 0.52 0.00 0.00 54.79 53.30 5bca n ASP 182 Cb 0.57 -0.08 0.01 0.00 -0.72 0.00 0.00 41.12 40.90 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 0.85 -0.48 0.82 0.27 0.00 -1.00 -4.89 105.19 100.76 5bca n GLY 183 Ca 0.10 0.04 0.05 0.00 0.00 0.00 0.00 46.02 46.21 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 -4.28 0.87 -1.37 2.61 -2.24 0.13 -4.97 114.28 105.03 5bca n THR 184 Ca -0.17 -1.56 -0.31 0.00 -2.27 0.00 0.00 64.05 59.74 5bca n THR 184 Cb 0.65 0.37 0.09 0.00 -2.10 0.00 0.00 70.33 69.34 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 -2.24 1.65 0.31 3.38 0.00 -1.12 -3.99 107.32 105.31 5bca s GLY 185 Ca 0.27 0.09 -0.27 0.00 0.00 0.00 0.00 44.72 44.81 5bca s GLY 185 CO -0.07 0.46 0.83 2.98 0.00 0.00 0.00 173.10 177.30 5bca n TYR 186 N -3.48 0.62 -1.24 1.90 4.19 -1.26 -1.69 117.16 116.19 5bca n TYR 186 Ca 0.08 0.72 -0.09 0.00 3.31 0.00 0.00 57.90 61.92 5bca n TYR 186 Cb 0.54 -2.15 0.23 0.00 0.49 0.00 0.00 39.34 38.45 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 0.70 2.52 -1.52 2.98 -0.04 -1.26 -5.13 135.00 133.25 5bca n PRO 187 Ca 0.11 -3.07 -0.29 0.00 -0.04 0.00 0.00 63.50 60.21 5bca n PRO 187 Cb 0.33 -2.02 0.12 0.00 -0.04 0.00 0.00 33.50 31.89 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 -1.76 3.83 0.83 3.54 0.01 -0.68 -4.42 113.70 115.05 5bca s SER 188 Ca 0.50 1.11 -0.11 0.00 1.31 0.00 0.00 55.95 58.76 5bca s SER 188 Cb 0.43 -1.75 0.10 0.00 0.21 0.00 0.00 66.02 65.01 5bca s SER 188 CO 0.07 -2.36 1.15 0.00 0.41 0.00 0.00 173.24 172.51 5bca s ARG 189 N -5.22 1.59 0.14 12.44 1.70 -1.26 -4.70 118.95 123.65 5bca s ARG 189 Ca 0.63 1.50 -0.10 0.00 -0.47 0.00 0.00 55.73 57.29 5bca s ARG 189 Cb -0.15 -1.80 -0.06 0.00 -0.57 0.00 0.00 34.95 32.37 5bca s ARG 189 CO 0.54 -2.19 0.47 0.20 -1.08 0.00 0.00 175.30 173.23 5bca s GLY 190 N -2.71 2.34 0.01 3.88 0.00 0.11 -4.74 107.32 106.21 5bca s GLY 190 Ca 0.67 -0.32 -0.09 0.00 0.00 0.00 0.00 44.72 44.98 5bca s GLY 190 CO 0.54 -0.13 0.31 0.54 0.00 0.00 0.00 173.10 174.37 5bca s LYS 191 N -2.28 3.67 0.52 2.90 1.02 -1.09 -4.70 119.74 119.79 5bca s LYS 191 Ca 0.39 0.07 -0.20 0.00 0.02 0.00 0.00 55.97 56.25 5bca s LYS 191 Cb -0.13 -3.09 -0.07 0.00 -0.52 0.00 0.00 37.83 34.02 5bca s LYS 191 CO 0.20 0.64 1.11 -0.06 -0.92 0.00 0.00 175.35 176.33 5bca s PHE 192 N -1.26 2.76 -0.52 3.18 0.40 -1.26 -4.61 117.98 116.66 5bca s PHE 192 Ca 0.27 1.55 0.05 0.00 -0.60 0.00 0.00 56.93 58.21 5bca s PHE 192 Cb -0.14 -3.25 0.37 0.00 0.51 0.00 0.00 43.02 40.51 5bca s PHE 192 CO 0.15 -1.41 1.00 1.04 0.70 0.00 0.00 175.22 176.70 5bca n GLN 193 N -1.14 3.21 -2.50 0.44 1.13 -1.26 -2.18 117.38 115.07 5bca n GLN 193 Ca 0.11 -4.67 -0.12 0.00 -1.94 0.00 0.00 57.00 50.37 5bca n GLN 193 Cb 0.51 -2.21 0.03 0.00 0.11 0.00 0.00 30.24 28.68 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 -0.31 3.78 0.74 -1.58 0.00 -1.19 -4.46 120.51 117.50 5bca n ALA 194 Ca 0.33 -3.32 0.09 0.00 0.00 0.00 0.00 53.44 50.54 5bca n ALA 194 Cb 0.50 -0.66 0.06 0.00 0.00 0.00 0.00 19.45 19.34 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 -0.55 0.00 -0.66 0.00 4.01 -0.70 -4.10 117.16 115.16 5bca n TYR 195 Ca 0.23 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.66 5bca n TYR 195 Cb 0.84 0.00 0.18 0.00 -0.31 0.00 0.00 39.34 40.05 5bca n TYR 195 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 5bca n THR 196 N 0.73 0.00 -0.21 -0.72 -2.24 -1.26 -4.82 114.28 105.76 5bca n THR 196 Ca 0.10 -0.14 -0.07 0.00 -2.27 0.00 0.00 64.05 61.66 5bca n THR 196 Cb 0.42 -0.90 0.03 0.00 -2.10 0.00 0.00 70.33 67.79 5bca n THR 196 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 5bca h GLU 197 N -1.99 0.86 -0.05 -0.78 4.39 -1.92 -1.72 114.58 113.36 5bca h GLU 197 Ca -0.47 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.09 5bca h GLU 197 Cb 1.29 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.79 5bca h GLU 197 CO 0.41 0.72 0.03 0.35 -1.16 0.00 0.00 179.01 179.36 5bca h PHE 198 N 0.81 0.07 -0.71 4.33 3.57 -1.91 -1.37 116.94 121.74 5bca h PHE 198 Ca 0.20 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.78 5bca h PHE 198 Cb 0.16 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.81 5bca h PHE 198 CO 0.00 0.11 0.38 0.00 -2.23 0.00 0.00 178.31 176.57 5bca h ALA 199 N 0.96 0.98 -0.96 2.41 0.00 -1.81 -0.81 119.26 120.02 5bca h ALA 199 Ca 0.02 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.99 5bca h ALA 199 Cb 0.06 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 5bca h ALA 199 CO -0.00 0.02 0.63 0.87 0.00 0.00 0.00 179.25 180.77 5bca h LYS 200 N 0.67 1.23 -0.20 0.00 1.57 -1.08 0.31 116.57 119.06 5bca h LYS 200 Ca 0.34 -0.07 -0.15 0.00 -1.87 0.00 0.00 60.65 58.89 5bca h LYS 200 Cb 0.29 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 5bca h LYS 200 CO -0.23 0.81 -0.51 0.77 -0.57 0.00 0.00 179.45 179.72 5bca h SER 201 N 1.26 0.61 -0.50 0.86 0.02 -0.97 -1.30 113.55 113.53 5bca h SER 201 Ca 0.37 -0.31 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 5bca h SER 201 Cb -0.07 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 5bca h SER 201 CO -0.10 1.01 0.25 0.11 -1.14 0.00 0.00 176.83 176.96 5bca h LYS 202 N 0.43 0.71 -0.38 3.45 1.79 -0.63 0.62 116.57 122.56 5bca h LYS 202 Ca 0.02 -0.10 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 5bca h LYS 202 Cb 1.04 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.54 5bca h LYS 202 CO 0.10 0.58 0.22 0.35 -1.08 0.00 0.00 179.45 179.61 5bca h PHE 203 N 0.66 0.51 -0.35 -1.35 3.57 -0.71 -0.88 116.94 118.40 5bca h PHE 203 Ca 0.17 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.73 5bca h PHE 203 Cb 0.09 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 38.60 5bca h PHE 203 CO -0.01 0.39 -0.05 -0.09 -2.23 0.00 0.00 178.31 176.31 5bca h ARG 204 N 0.49 0.03 -0.02 1.11 2.43 -0.97 0.03 114.38 117.49 5bca h ARG 204 Ca 0.14 -0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.19 5bca h ARG 204 Cb 0.03 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 5bca h ARG 204 CO -0.02 0.02 -0.50 -0.07 -1.51 0.00 0.00 179.97 177.89 5bca h LEU 205 N 0.04 0.05 -0.42 3.80 3.38 -0.64 -0.05 115.31 121.46 5bca h LEU 205 Ca 0.17 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.94 5bca h LEU 205 Cb 0.25 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 5bca h LEU 205 CO -0.33 0.55 -0.50 -0.25 0.09 0.00 0.00 178.44 178.00 5bca h TRP 206 N 0.04 0.95 -0.78 1.13 7.01 -0.48 -2.11 115.95 121.72 5bca h TRP 206 Ca -0.00 -0.32 -0.05 0.00 2.11 0.00 0.00 58.89 60.63 5bca h TRP 206 Cb 0.90 -0.19 -0.03 0.00 -2.10 0.00 0.00 29.16 27.74 5bca h TRP 206 CO 0.00 1.11 0.28 0.28 -2.79 0.00 0.00 178.44 177.32 5bca h VAL 207 N 0.60 1.26 0.00 2.65 2.07 -0.51 -1.42 116.25 120.91 5bca h VAL 207 Ca 0.03 -0.88 -0.09 0.00 0.82 0.00 0.00 66.70 66.58 5bca h VAL 207 Cb 1.07 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 5bca h VAL 207 CO 0.11 0.35 -0.45 -0.07 0.02 0.00 0.00 177.57 177.53 5bca h LEU 208 N 1.14 0.00 -0.03 2.57 3.38 -0.92 0.01 115.31 121.47 5bca h LEU 208 Ca 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 5bca h LEU 208 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 5bca h LEU 208 CO -0.01 0.45 -0.05 -1.13 0.09 0.00 0.00 178.44 177.79 5bca h ASN 209 N 0.00 0.10 -0.34 -0.43 -0.73 -1.23 1.86 115.58 114.81 5bca h ASN 209 Ca -0.00 -0.52 0.05 0.00 1.87 0.00 0.00 56.30 57.69 5bca h ASN 209 Cb 0.86 -0.03 -0.04 0.00 0.27 0.00 0.00 38.32 39.37 5bca h ASN 209 CO 0.06 0.60 0.08 0.50 -0.37 0.00 0.00 177.43 178.31 5bca h LYS 210 N -0.40 0.20 -0.01 6.67 3.64 -0.26 -3.35 116.57 123.06 5bca h LYS 210 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 5bca h LYS 210 Cb 0.58 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 5bca h LYS 210 CO 0.01 0.13 -0.10 0.66 -2.27 0.00 0.00 179.45 177.88 5bca n TYR 211 N -5.07 0.00 0.00 1.91 4.01 -0.10 -5.04 117.16 112.87 5bca n TYR 211 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 5bca n TYR 211 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 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 0.69 2.79 3.41 2.72 0.00 0.63 -4.70 105.19 110.74 5bca n GLY 212 Ca 0.04 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.23 0.54 1.61 1.04 -1.26 -4.75 113.70 110.65 5bca s SER 213 Ca 0.00 -0.43 0.28 0.00 0.48 0.00 0.00 55.95 56.28 5bca s SER 213 Cb 0.00 0.52 1.45 0.00 0.10 0.00 0.00 66.02 68.09 5bca s SER 213 CO 0.00 -0.95 1.95 0.25 0.98 0.00 0.00 173.24 175.47 5bca h LEU 214 N 2.29 0.00 -0.59 2.42 5.85 -1.95 -0.66 115.31 122.68 5bca h LEU 214 Ca -0.31 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.25 5bca h LEU 214 Cb 1.26 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 5bca h LEU 214 CO 0.42 0.00 -0.58 0.78 -0.34 0.00 0.00 178.44 178.73 5bca h ASN 215 N 0.00 0.45 0.94 1.25 -0.26 -1.96 -1.35 115.58 114.65 5bca h ASN 215 Ca 0.30 -0.25 -0.17 0.00 -0.56 0.00 0.00 56.30 55.62 5bca h ASN 215 Cb 1.25 -0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 38.35 5bca h ASN 215 CO -0.00 0.93 -1.13 -0.33 -1.06 0.00 0.00 177.43 175.83 5bca h GLU 216 N 0.30 0.00 0.29 0.81 4.39 -1.45 -2.94 114.58 115.98 5bca h GLU 216 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 5bca h GLU 216 Cb 1.10 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.71 5bca h GLU 216 CO 0.10 0.46 -0.46 0.28 -1.16 0.00 0.00 179.01 178.23 5bca h VAL 217 N 0.00 0.10 -0.88 3.13 2.07 -0.93 0.12 116.25 119.86 5bca h VAL 217 Ca -0.11 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.49 5bca h VAL 217 Cb 1.60 0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 31.41 5bca h VAL 217 CO 0.07 0.00 0.57 0.78 0.02 0.00 0.00 177.57 179.01 5bca h ASN 218 N -0.80 0.83 -0.29 0.57 2.35 -1.34 0.25 115.58 117.16 5bca h ASN 218 Ca -0.02 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 5bca h ASN 218 Cb 0.76 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.95 5bca h ASN 218 CO -0.16 0.51 0.09 0.11 -1.65 0.00 0.00 177.43 176.33 5bca h LYS 219 N 0.93 0.45 -0.19 0.81 1.57 -1.25 0.26 116.57 119.15 5bca h LYS 219 Ca 0.39 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 59.07 5bca h LYS 219 Cb 0.31 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 5bca h LYS 219 CO -0.16 0.51 0.09 0.00 -0.57 0.00 0.00 179.45 179.32 5bca h ALA 220 N 0.92 0.24 0.00 3.86 0.00 0.61 -3.20 119.26 121.70 5bca h ALA 220 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.92 5bca h ALA 220 Cb 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.96 5bca h ALA 220 CO -0.00 -0.20 -0.49 -1.49 0.00 0.00 0.00 179.25 177.07 5bca h TRP 221 N 0.18 0.00 -1.44 0.00 6.55 -0.57 -3.46 115.95 117.21 5bca h TRP 221 Ca 0.07 0.00 -0.20 0.00 0.95 0.00 0.00 58.89 59.70 5bca h TRP 221 Cb 0.12 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.41 5bca h TRP 221 CO -0.03 0.00 -0.26 0.41 -1.05 0.00 0.00 178.44 177.51 5bca n GLY 222 N 1.28 -0.03 3.88 1.49 0.00 0.06 -4.76 105.19 107.11 5bca n GLY 222 Ca 0.03 -0.46 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.51 1.82 -0.43 2.61 -4.23 -1.05 -5.06 115.64 106.80 5bca s THR 223 Ca 0.00 -1.51 0.09 0.00 -1.18 0.00 0.00 61.69 59.09 5bca s THR 223 Cb 0.00 -2.33 0.40 0.00 1.34 0.00 0.00 72.50 71.91 5bca s THR 223 CO 0.00 0.00 0.98 0.29 -0.54 0.00 0.00 174.62 175.35 5bca n LYS 224 N -1.67 2.45 -1.90 3.99 4.76 -1.26 -4.72 118.16 119.80 5bca n LYS 224 Ca -0.01 -4.10 -0.42 0.00 -2.87 0.00 0.00 58.31 50.90 5bca n LYS 224 Cb 0.64 -1.91 -0.03 0.00 -1.84 0.00 0.00 35.03 31.89 5bca n LYS 224 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 5bca s LEU 225 N -3.26 4.37 0.09 -0.35 1.43 -1.26 -4.92 118.68 114.78 5bca s LEU 225 Ca 0.42 2.48 -0.09 0.00 -1.03 0.00 0.00 54.13 55.90 5bca s LEU 225 Cb 0.38 -3.56 -0.19 0.00 0.03 0.00 0.00 46.19 42.86 5bca s LEU 225 CO -0.10 -0.91 1.22 -0.29 0.23 0.00 0.00 176.35 176.49 5bca h ILE 226 N 4.99 1.34 -3.65 -0.59 6.09 -1.97 -3.48 117.51 120.25 5bca h ILE 226 Ca -0.43 -2.43 -0.10 0.00 -1.37 0.00 0.00 64.86 60.52 5bca h ILE 226 Cb 1.20 2.50 -0.16 0.00 0.47 0.00 0.00 36.82 40.83 5bca h ILE 226 CO 0.94 0.74 -0.39 -0.94 -3.07 0.00 0.00 178.15 175.42 5bca s SER 227 N -7.23 0.07 0.57 2.19 1.04 -1.26 -5.04 113.70 104.03 5bca s SER 227 Ca -0.08 -0.46 0.38 0.00 0.48 0.00 0.00 55.95 56.27 5bca s SER 227 Cb 0.07 0.30 1.48 0.00 0.10 0.00 0.00 66.02 67.98 5bca s SER 227 CO 0.90 -0.61 1.67 -0.33 0.98 0.00 0.00 173.24 175.85 5bca h GLU 228 N 3.23 0.00 0.00 4.02 3.07 -1.98 0.31 114.58 123.23 5bca h GLU 228 Ca -0.33 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.43 5bca h GLU 228 Cb 1.19 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.09 5bca h GLU 228 CO 0.51 0.00 -0.48 -0.07 -1.40 0.00 0.00 179.01 177.56 5bca h LEU 229 N 0.00 0.00 0.00 1.33 -0.00 -2.01 -1.38 115.31 113.25 5bca h LEU 229 Ca 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.48 5bca h LEU 229 Cb 2.64 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 43.30 5bca h LEU 229 CO -0.01 0.48 0.00 0.00 -0.00 0.00 0.00 178.44 178.92 5bca n ALA 230 N -2.35 1.83 -2.41 1.53 0.00 0.11 -4.60 120.51 114.62 5bca n ALA 230 Ca -0.01 -0.07 -0.43 0.00 0.00 0.00 0.00 53.44 52.94 5bca n ALA 230 Cb 0.56 -1.22 -0.02 0.00 0.00 0.00 0.00 19.45 18.76 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 -2.49 4.09 0.12 0.00 1.01 -0.52 -4.97 121.20 118.44 5bca s ILE 231 Ca 0.14 1.22 -0.05 0.00 0.00 0.00 0.00 60.65 61.95 5bca s ILE 231 Cb 0.09 -4.17 -0.02 0.00 0.01 0.00 0.00 42.46 38.38 5bca s ILE 231 CO 0.20 -0.53 0.15 -0.76 0.00 0.00 0.00 174.94 174.00 5bca s LEU 232 N 4.57 1.53 1.06 2.97 1.43 -1.26 -4.76 118.68 124.21 5bca s LEU 232 Ca 0.57 -0.94 -0.11 0.00 -1.03 0.00 0.00 54.13 52.62 5bca s LEU 232 Cb -0.16 0.75 0.22 0.00 0.03 0.00 0.00 46.19 47.03 5bca s LEU 232 CO 0.25 -0.76 1.08 -2.16 0.23 0.00 0.00 176.35 174.99 5bca s PRO 233 N -3.96 -0.09 0.23 1.29 0.04 -1.26 -4.90 135.00 126.35 5bca s PRO 233 Ca 0.15 1.20 -0.32 0.00 0.04 0.00 0.00 61.00 62.07 5bca s PRO 233 Cb 0.06 -1.62 -0.12 0.00 0.04 0.00 0.00 34.50 32.85 5bca s PRO 233 CO -0.03 -3.27 1.60 -2.30 0.04 0.00 0.00 177.00 173.03 5bca n PRO 234 N -4.64 2.50 0.16 0.56 -0.01 -1.26 -4.91 135.00 127.40 5bca n PRO 234 Ca 0.07 0.90 0.13 0.00 -0.01 0.00 0.00 63.50 64.59 5bca n PRO 234 Cb 0.53 -2.67 0.37 0.00 -0.01 0.00 0.00 33.50 31.72 5bca n PRO 234 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 175.50 176.15 5bca h SER 235 N 5.51 0.00 -2.59 2.55 4.64 -2.01 -3.42 113.55 118.23 5bca h SER 235 Ca -0.45 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.47 5bca h SER 235 Cb 1.23 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.95 5bca h SER 235 CO 0.85 0.00 -0.69 -0.62 -0.87 0.00 0.00 176.83 175.51 5bca s ASP 236 N -5.12 2.16 0.40 4.97 -1.08 -1.26 -5.02 116.67 111.72 5bca s ASP 236 Ca 0.08 -0.69 0.08 0.00 -0.52 0.00 0.00 52.55 51.51 5bca s ASP 236 Cb 0.09 0.13 0.84 0.00 -1.46 0.00 0.00 42.92 42.52 5bca s ASP 236 CO 0.59 -0.37 1.99 1.23 0.52 0.00 0.00 175.17 179.13 5bca h GLY 237 N 8.34 0.41 0.79 2.66 0.00 -1.98 -1.48 103.07 111.81 5bca h GLY 237 Ca -0.17 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 46.91 5bca h GLY 237 CO 0.34 0.18 -0.11 -2.09 0.00 0.00 0.00 176.54 174.87 5bca h GLU 238 N 0.38 0.40 -0.33 4.80 4.81 -1.95 -1.39 114.58 121.30 5bca h GLU 238 Ca 0.09 -0.18 -0.12 0.00 -0.13 0.00 0.00 59.36 59.02 5bca h GLU 238 Cb 0.15 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 5bca h GLU 238 CO -0.00 0.71 -0.27 1.96 -0.73 0.00 0.00 179.01 180.68 5bca h GLN 239 N 0.09 0.67 -0.68 1.92 1.08 -1.96 0.19 115.11 116.42 5bca h GLN 239 Ca 0.04 -0.28 0.01 0.00 -1.45 0.00 0.00 58.65 56.97 5bca h GLN 239 Cb 0.60 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.97 5bca h GLN 239 CO 0.03 0.87 0.45 0.35 -0.95 0.00 0.00 178.83 179.58 5bca h PHE 240 N 0.58 0.85 -0.01 2.96 3.57 -1.13 0.44 116.94 124.20 5bca h PHE 240 Ca 0.08 0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.43 5bca h PHE 240 Cb 0.76 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.19 5bca h PHE 240 CO 0.03 0.53 -0.77 -0.07 -2.23 0.00 0.00 178.31 175.80 5bca h LEU 241 N 0.91 0.12 -0.18 0.59 3.38 -0.81 0.96 115.31 120.28 5bca h LEU 241 Ca 0.25 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 5bca h LEU 241 Cb -0.09 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.62 5bca h LEU 241 CO -0.06 0.84 -0.34 0.24 0.09 0.00 0.00 178.44 179.21 5bca h MET 242 N 0.06 0.54 0.00 1.13 2.86 -0.22 -3.40 114.93 115.90 5bca h MET 242 Ca -0.02 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.28 5bca h MET 242 Cb 1.35 0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.06 5bca h MET 242 CO 0.11 0.95 0.00 0.27 1.06 0.00 0.00 176.91 179.30 5bca n ASN 243 N -4.32 0.00 -0.35 1.22 6.94 0.13 -4.89 115.26 113.99 5bca n ASN 243 Ca -0.06 0.00 0.17 0.00 -0.02 0.00 0.00 54.58 54.67 5bca n ASN 243 Cb 0.50 0.00 0.38 0.00 -2.36 0.00 0.00 39.78 38.30 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 1.86 1.76 4.83 0.00 0.03 -2.20 103.07 109.35 5bca h GLY 244 Ca 0.00 -0.32 0.03 0.00 0.00 0.00 0.00 47.33 47.04 5bca h GLY 244 CO 0.00 -0.20 0.10 0.10 0.00 0.00 0.00 176.54 176.53 5bca h TYR 245 N 0.61 0.00 0.00 5.60 -0.00 0.66 -2.82 116.97 121.01 5bca h TYR 245 Ca 0.63 0.00 -0.12 0.00 -0.00 0.00 0.00 58.73 59.24 5bca h TYR 245 Cb 1.18 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.89 5bca h TYR 245 CO -0.01 0.00 -0.56 -0.07 -0.00 0.00 0.00 178.16 177.53 5bca h LEU 246 N 0.00 0.00-10.28 0.10 3.38 -1.68 -3.24 115.31 103.59 5bca h LEU 246 Ca 0.04 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.54 5bca h LEU 246 Cb 0.23 0.00 0.17 0.00 0.09 0.00 0.00 40.66 41.16 5bca h LEU 246 CO -0.00 0.56 0.17 -0.94 0.09 0.00 0.00 178.44 178.32 5bca s SER 247 N -6.68 2.52 0.23 -0.43 1.04 -1.06 -4.77 113.70 104.55 5bca s SER 247 Ca -0.00 1.50 -0.05 0.00 0.48 0.00 0.00 55.95 57.88 5bca s SER 247 Cb 0.12 -2.18 0.23 0.00 0.10 0.00 0.00 66.02 64.28 5bca s SER 247 CO 0.74 -3.24 1.72 -0.03 0.98 0.00 0.00 173.24 173.41 5bca h MET 248 N -1.96 0.92 -0.10 4.02 4.05 -1.89 -1.42 114.93 118.55 5bca h MET 248 Ca -0.53 -0.26 0.04 0.00 -0.28 0.00 0.00 59.70 58.66 5bca h MET 248 Cb 1.31 -0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 31.97 5bca h MET 248 CO 0.53 0.90 -0.13 -0.92 0.23 0.00 0.00 176.91 177.51 5bca h TYR 249 N 0.85 -0.34 -0.57 1.39 3.20 -1.89 -1.58 116.97 118.03 5bca h TYR 249 Ca 0.16 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 5bca h TYR 249 Cb 0.48 0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.89 5bca h TYR 249 CO 0.03 -0.20 0.18 0.78 -1.64 0.00 0.00 178.16 177.31 5bca h GLY 250 N -0.18 0.91 1.24 1.82 0.00 -1.49 -0.25 103.07 105.12 5bca h GLY 250 Ca 0.08 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.83 5bca h GLY 250 CO -0.20 0.47 0.01 0.50 0.00 0.00 0.00 176.54 177.32 5bca h LYS 251 N 0.83 0.92 -0.31 4.80 1.57 -1.14 -2.28 116.57 120.96 5bca h LYS 251 Ca 0.19 -0.26 -0.12 0.00 -1.87 0.00 0.00 60.65 58.59 5bca h LYS 251 Cb 0.23 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 5bca h LYS 251 CO -0.01 0.90 -0.27 -0.44 -0.57 0.00 0.00 179.45 179.07 5bca h ASP 252 N 0.85 0.77 -0.05 0.86 3.32 -0.85 -0.19 116.42 121.13 5bca h ASP 252 Ca 0.16 -0.46 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 5bca h ASP 252 Cb 0.49 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 5bca h ASP 252 CO 0.02 1.07 0.00 0.22 -1.72 0.00 0.00 179.24 178.83 5bca h TYR 253 N 0.48 0.10 -1.00 4.55 3.20 -0.98 -1.44 116.97 121.88 5bca h TYR 253 Ca 0.05 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.97 5bca h TYR 253 Cb 0.83 -0.03 -0.07 0.00 1.54 0.00 0.00 36.73 39.01 5bca h TYR 253 CO 0.07 0.37 0.64 -0.07 -1.64 0.00 0.00 178.16 177.53 5bca h LEU 254 N -0.20 1.04 -1.27 2.82 3.38 -1.44 0.60 115.31 120.23 5bca h LEU 254 Ca 0.01 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 5bca h LEU 254 Cb 0.33 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 5bca h LEU 254 CO 0.00 0.66 -0.11 -0.08 0.09 0.00 0.00 178.44 179.01 5bca h GLU 255 N 1.18 0.36 0.08 1.13 4.81 -0.62 -1.49 114.58 120.03 5bca h GLU 255 Ca 0.43 -0.09 -0.28 0.00 -0.13 0.00 0.00 59.36 59.29 5bca h GLU 255 Cb 0.16 -0.05 0.03 0.00 0.63 0.00 0.00 28.75 29.52 5bca h GLU 255 CO -0.17 0.48 -1.14 2.35 -0.73 0.00 0.00 179.01 179.80 5bca h TRP 256 N 0.34 0.98 -0.66 0.92 7.01 -0.20 -0.94 115.95 123.41 5bca h TRP 256 Ca 0.07 -0.60 -0.05 0.00 2.11 0.00 0.00 58.89 60.42 5bca h TRP 256 Cb 0.40 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 27.35 5bca h TRP 256 CO 0.01 1.43 0.21 -0.92 -2.79 0.00 0.00 178.44 176.38 5bca h TYR 257 N 0.26 1.05 0.06 2.65 3.20 -0.64 -2.43 116.97 121.12 5bca h TYR 257 Ca -0.17 -0.10 -0.24 0.00 3.14 0.00 0.00 58.73 61.36 5bca h TYR 257 Cb 1.81 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 39.77 5bca h TYR 257 CO 0.12 0.85 -1.08 0.37 -1.64 0.00 0.00 178.16 176.78 5bca h GLN 258 N 0.95 0.21 -0.71 1.82 4.15 -1.36 -3.28 115.11 116.89 5bca h GLN 258 Ca 0.21 -0.31 0.10 0.00 0.77 0.00 0.00 58.65 59.42 5bca h GLN 258 Cb 0.29 0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.04 5bca h GLN 258 CO -0.01 1.10 0.47 0.78 -1.93 0.00 0.00 178.83 179.25 5bca h GLY 259 N 1.89 0.82 1.81 2.39 0.00 -0.84 0.22 103.07 109.37 5bca h GLY 259 Ca -0.08 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 5bca h GLY 259 CO 0.17 0.13 0.03 -2.22 0.00 0.00 0.00 176.54 174.65 5bca h ILE 260 N 0.57 1.10 0.00 2.60 1.08 -1.50 0.14 117.51 121.50 5bca h ILE 260 Ca 0.33 -0.36 -0.15 0.00 -0.39 0.00 0.00 64.86 64.30 5bca h ILE 260 Cb 0.53 0.94 -0.02 0.00 -3.07 0.00 0.00 36.82 35.20 5bca h ILE 260 CO -0.11 0.12 -1.11 -0.07 -0.69 0.00 0.00 178.15 176.29 5bca h LEU 261 N 0.24 0.00 -0.75 1.44 3.38 -0.73 -2.65 115.31 116.24 5bca h LEU 261 Ca 0.06 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 5bca h LEU 261 Cb 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 5bca h LEU 261 CO -0.00 0.58 0.17 -0.33 0.09 0.00 0.00 178.44 178.94 5bca h GLU 262 N 0.00 1.11 -0.40 1.13 5.08 -0.70 -1.49 114.58 119.31 5bca h GLU 262 Ca -0.11 -0.26 -0.08 0.00 -1.00 0.00 0.00 59.36 57.91 5bca h GLU 262 Cb 1.53 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 5bca h GLU 262 CO 0.06 0.98 -0.06 -0.91 -1.00 0.00 0.00 179.01 178.08 5bca h ASN 263 N 1.05 0.74 -0.55 1.42 2.35 -0.73 -2.16 115.58 117.70 5bca h ASN 263 Ca 0.22 -0.34 0.05 0.00 -0.55 0.00 0.00 56.30 55.68 5bca h ASN 263 Cb 0.37 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.49 5bca h ASN 263 CO 0.00 0.91 0.28 -0.74 -1.65 0.00 0.00 177.43 176.23 5bca h HIS 264 N 0.56 0.50 -0.60 1.19 2.76 -1.27 -1.49 115.15 116.81 5bca h HIS 264 Ca 0.11 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.32 5bca h HIS 264 Cb 0.56 -0.14 -0.04 0.00 1.55 0.00 0.00 27.41 29.34 5bca h HIS 264 CO 0.05 0.23 0.38 1.15 -1.30 0.00 0.00 177.93 178.44 5bca h THR 265 N 0.53 1.10 -0.02 6.26 2.02 -1.20 -0.37 112.91 121.23 5bca h THR 265 Ca 0.25 -0.26 -0.16 0.00 0.77 0.00 0.00 66.41 67.01 5bca h THR 265 Cb 0.17 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 5bca h THR 265 CO -0.18 0.14 -0.70 0.11 0.37 0.00 0.00 175.52 175.26 5bca h LYS 266 N 0.76 0.13 0.63 6.66 1.57 -0.70 -2.05 116.57 123.57 5bca h LYS 266 Ca 0.23 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 5bca h LYS 266 Cb -0.02 0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.32 5bca h LYS 266 CO -0.08 0.78 -0.30 1.25 -0.57 0.00 0.00 179.45 180.52 5bca h LEU 267 N 0.09 -0.72 -1.50 2.94 5.85 -0.54 -1.96 115.31 119.47 5bca h LEU 267 Ca -0.02 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 5bca h LEU 267 Cb 1.24 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 5bca h LEU 267 CO 0.10 -0.33 0.25 0.16 -0.34 0.00 0.00 178.44 178.27 5bca h ILE 268 N -1.20 1.13 -0.47 4.05 3.07 -1.16 0.12 117.51 123.04 5bca h ILE 268 Ca -0.09 -0.31 0.07 0.00 1.55 0.00 0.00 64.86 66.08 5bca h ILE 268 Cb 0.67 0.54 -0.06 0.00 -0.27 0.00 0.00 36.82 37.70 5bca h ILE 268 CO 0.14 0.14 0.13 1.23 -1.05 0.00 0.00 178.15 178.74 5bca h GLY 269 N 0.65 0.59 1.16 0.16 0.00 -1.38 0.17 103.07 104.42 5bca h GLY 269 Ca 0.15 -0.06 -0.22 0.00 0.00 0.00 0.00 47.33 47.21 5bca h GLY 269 CO -0.03 -0.02 -0.73 -2.09 0.00 0.00 0.00 176.54 173.67 5bca h GLU 270 N 0.29 0.81 -0.30 4.80 4.81 -0.03 -0.53 114.58 124.43 5bca h GLU 270 Ca 0.23 -0.63 -0.04 0.00 -0.13 0.00 0.00 59.36 58.78 5bca h GLU 270 Cb 0.26 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 5bca h GLU 270 CO -0.26 1.25 -0.00 -0.07 -0.73 0.00 0.00 179.01 179.19 5bca h LEU 271 N 0.56 0.42 0.21 1.64 3.38 -0.81 -2.24 115.31 118.47 5bca h LEU 271 Ca -0.04 -0.07 -0.34 0.00 0.09 0.00 0.00 57.88 57.51 5bca h LEU 271 Cb 1.36 -0.11 0.02 0.00 0.09 0.00 0.00 40.66 42.02 5bca h LEU 271 CO 0.15 0.49 -1.64 0.00 0.09 0.00 0.00 178.44 177.53 5bca h ALA 272 N 1.57 0.04 -0.67 1.53 0.00 -0.54 -2.19 119.26 118.99 5bca h ALA 272 Ca 0.10 -1.03 -0.01 0.00 0.00 0.00 0.00 54.91 53.96 5bca h ALA 272 Cb 0.30 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 5bca h ALA 272 CO 0.01 0.90 0.37 0.45 0.00 0.00 0.00 179.25 180.98 5bca h HIS 273 N 0.12 0.89 -0.05 0.00 3.86 -1.08 0.46 115.15 119.35 5bca h HIS 273 Ca -0.31 -0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 58.74 5bca h HIS 273 Cb 2.13 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 30.29 5bca h HIS 273 CO 0.11 0.62 -0.66 -0.91 0.86 0.00 0.00 177.93 177.95 5bca h ASN 274 N 0.92 0.23 0.20 2.45 2.35 -1.27 -1.24 115.58 119.22 5bca h ASN 274 Ca 0.24 -0.14 -0.28 0.00 -0.55 0.00 0.00 56.30 55.56 5bca h ASN 274 Cb 0.02 -0.07 0.03 0.00 0.05 0.00 0.00 38.32 38.34 5bca h ASN 274 CO -0.04 0.82 -1.28 0.00 -1.65 0.00 0.00 177.43 175.28 5bca h ALA 275 N 1.18 -0.07 0.00 -0.83 0.00 -0.72 -3.40 119.26 115.42 5bca h ALA 275 Ca -0.01 -0.86 -0.31 0.00 0.00 0.00 0.00 54.91 53.73 5bca h ALA 275 Cb 1.18 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 19.13 5bca h ALA 275 CO 0.10 0.64 -1.86 1.19 0.00 0.00 0.00 179.25 179.32 5bca n PHE 276 N -3.86 0.80 0.18 0.00 3.72 0.08 -4.72 117.46 113.66 5bca n PHE 276 Ca -0.18 0.28 -0.10 0.00 -0.05 0.00 0.00 57.45 57.41 5bca n PHE 276 Cb 0.99 -1.15 -0.05 0.00 -0.94 0.00 0.00 39.48 38.33 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 -0.73 -1.00 4.37 5.19 -1.37 0.48 116.42 123.37 5bca h ASP 277 Ca -0.34 0.05 0.13 0.00 -0.62 0.00 0.00 57.03 56.25 5bca h ASP 277 Cb 2.06 0.23 -0.09 0.00 0.18 0.00 0.00 39.33 41.72 5bca h ASP 277 CO 0.07 -0.37 0.63 0.71 -3.12 0.00 0.00 179.24 177.15 5bca h THR 278 N -0.57 0.88 0.00 0.35 1.35 -1.85 0.41 112.91 113.48 5bca h THR 278 Ca -0.04 -0.32 -0.05 0.00 -0.55 0.00 0.00 66.41 65.45 5bca h THR 278 Cb 0.48 -0.14 -0.01 0.00 -1.73 0.00 0.00 68.15 66.76 5bca h THR 278 CO -0.01 0.17 -0.28 0.74 -0.25 0.00 0.00 175.52 175.89 5bca h THR 279 N 0.94 1.37 0.05 6.82 2.02 -1.82 -3.42 112.91 118.86 5bca h THR 279 Ca 0.51 -2.13 -0.37 0.00 0.77 0.00 0.00 66.41 65.19 5bca h THR 279 Cb 0.57 2.68 -0.05 0.00 -1.74 0.00 0.00 68.15 69.61 5bca h THR 279 CO -0.28 0.46 -2.21 0.49 0.37 0.00 0.00 175.52 174.36 5bca n PHE 280 N -4.59 0.58 -3.47 3.16 3.01 0.15 -5.00 117.46 111.30 5bca n PHE 280 Ca -0.13 0.14 -0.21 0.00 1.01 0.00 0.00 57.45 58.25 5bca n PHE 280 Cb 0.46 -1.08 0.07 0.00 -0.01 0.00 0.00 39.48 38.92 5bca n PHE 280 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 5bca n GLN 281 N -3.26 -7.04 -4.32 -1.08 6.02 0.14 -5.00 117.38 102.84 5bca n GLN 281 Ca -0.36 0.73 -0.24 0.00 -0.01 0.00 0.00 57.00 57.12 5bca n GLN 281 Cb 1.04 -5.48 -0.08 0.00 1.02 0.00 0.00 30.24 26.74 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 -3.28 3.00 0.48 5.09 -7.23 -1.26 -5.11 120.40 112.09 5bca s VAL 282 Ca 0.52 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 58.47 5bca s VAL 282 Cb -0.23 -2.75 -0.07 0.00 0.56 0.00 0.00 36.38 33.89 5bca s VAL 282 CO 0.64 -0.31 1.12 -2.84 -0.31 0.00 0.00 175.10 173.40 5bca s PRO 283 N -3.67 3.71 -0.03 4.82 0.02 -1.26 -4.84 135.00 133.74 5bca s PRO 283 Ca 0.33 1.64 0.07 0.00 0.02 0.00 0.00 61.00 63.06 5bca s PRO 283 Cb -0.04 -2.27 -0.02 0.00 0.02 0.00 0.00 34.50 32.19 5bca s PRO 283 CO 0.19 -0.56 -0.24 0.42 -0.33 0.00 0.00 177.00 176.48 5bca s ILE 284 N -1.68 2.24 0.22 2.83 1.01 -1.26 -1.87 121.20 122.69 5bca s ILE 284 Ca 0.66 -1.03 -0.04 0.00 0.00 0.00 0.00 60.65 60.24 5bca s ILE 284 Cb -0.25 -1.80 -0.03 0.00 0.01 0.00 0.00 42.46 40.40 5bca s ILE 284 CO 0.30 0.58 0.24 -0.83 0.00 0.00 0.00 174.94 175.23 5bca s GLY 285 N -0.57 1.25 0.14 6.18 0.00 -0.86 -1.45 107.32 112.00 5bca s GLY 285 Ca 0.08 -1.49 -0.14 0.00 0.00 0.00 0.00 44.72 43.17 5bca s GLY 285 CO -0.00 -1.18 0.37 0.00 0.00 0.00 0.00 173.10 172.29 5bca s ALA 286 N -4.05 -0.71 0.13 3.20 0.00 -0.64 -1.31 121.76 118.38 5bca s ALA 286 Ca 0.34 -0.27 0.10 0.00 0.00 0.00 0.00 51.96 52.14 5bca s ALA 286 Cb 0.04 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.83 5bca s ALA 286 CO 0.12 -0.65 -0.24 0.15 0.00 0.00 0.00 175.76 175.15 5bca s LYS 287 N -3.84 1.54 -0.12 0.00 1.02 -1.26 -1.55 119.74 115.52 5bca s LYS 287 Ca 0.06 -1.30 0.00 0.00 0.02 0.00 0.00 55.97 54.75 5bca s LYS 287 Cb 0.02 -1.97 -0.01 0.00 -0.52 0.00 0.00 37.83 35.35 5bca s LYS 287 CO -0.09 0.46 -0.14 0.42 -0.92 0.00 0.00 175.35 175.07 5bca s ILE 288 N -1.13 2.93 0.71 2.17 1.01 -0.73 0.27 121.20 126.43 5bca s ILE 288 Ca 0.16 -0.71 -0.13 0.00 0.00 0.00 0.00 60.65 59.97 5bca s ILE 288 Cb -0.10 -2.21 0.03 0.00 0.01 0.00 0.00 42.46 40.18 5bca s ILE 288 CO 0.08 0.53 1.10 0.00 0.00 0.00 0.00 174.94 176.65 5bca s ALA 289 N 0.32 2.37 -0.81 9.38 0.00 -1.26 -4.21 121.76 127.55 5bca s ALA 289 Ca -0.11 0.41 -0.11 0.00 0.00 0.00 0.00 51.96 52.14 5bca s ALA 289 Cb -0.16 -3.29 0.21 0.00 0.00 0.00 0.00 23.12 19.88 5bca s ALA 289 CO 0.06 -1.50 0.73 0.20 0.00 0.00 0.00 175.76 175.25 5bca s GLY 290 N -2.98 2.69 -0.98 0.00 0.00 -1.26 -4.85 107.32 99.93 5bca s GLY 290 Ca 0.64 -3.36 -0.16 0.00 0.00 0.00 0.00 44.72 41.84 5bca s GLY 290 CO 0.48 1.23 1.11 0.14 0.00 0.00 0.00 173.10 176.06 5bca s VAL 291 N -0.01 5.13 -0.72 1.40 1.01 -1.26 -4.87 120.40 121.08 5bca s VAL 291 Ca 0.19 -2.19 0.22 0.00 0.00 0.00 0.00 61.98 60.19 5bca s VAL 291 Cb -0.12 -4.72 -0.23 0.00 0.00 0.00 0.00 36.38 31.31 5bca s VAL 291 CO -0.08 -1.39 0.84 0.00 0.00 0.00 0.00 175.10 174.47 5bca n HIS 292 N 5.37 0.03 -2.16 5.22 1.44 -1.26 -4.63 115.22 119.23 5bca n HIS 292 Ca 0.24 0.01 -0.30 0.00 -2.01 0.00 0.00 57.72 55.66 5bca n HIS 292 Cb 0.46 -0.18 0.00 0.00 0.12 0.00 0.00 29.99 30.39 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 -3.15 3.60 -1.33 -1.40 -2.14 -1.26 -1.27 118.94 111.99 5bca s TRP 293 Ca 0.04 1.13 0.00 0.00 2.66 0.00 0.00 56.10 59.92 5bca s TRP 293 Cb 0.15 -2.57 0.00 0.00 -3.10 0.00 0.00 33.47 27.95 5bca s TRP 293 CO 0.86 -0.53 0.00 1.04 -2.66 0.00 0.00 176.95 175.66 5bca n GLN 294 N -2.53 -1.33 0.39 3.25 1.13 -0.11 -4.21 117.38 113.97 5bca n GLN 294 Ca 0.04 0.74 -0.18 0.00 -1.94 0.00 0.00 57.00 55.66 5bca n GLN 294 Cb 0.54 -5.00 -0.09 0.00 0.11 0.00 0.00 30.24 25.81 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 -0.93 -0.62 1.08 3.20 -1.51 -2.02 116.97 116.17 5bca h TYR 295 Ca -0.26 -0.02 -0.27 0.00 3.14 0.00 0.00 58.73 61.32 5bca h TYR 295 Cb 0.85 0.31 -0.16 0.00 1.54 0.00 0.00 36.73 39.27 5bca h TYR 295 CO 0.37 -0.57 0.23 0.27 -1.64 0.00 0.00 178.16 176.82 5bca n ASN 296 N -5.52 3.53 -4.73 -2.11 6.94 -1.23 -3.10 115.26 109.04 5bca n ASN 296 Ca -0.14 -3.52 -0.42 0.00 -0.02 0.00 0.00 54.58 50.48 5bca n ASN 296 Cb 0.40 -0.71 -0.03 0.00 -2.36 0.00 0.00 39.78 37.08 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 -1.78 6.57 0.17 0.53 3.84 -1.25 -4.92 114.94 118.11 5bca s ASN 297 Ca 0.50 2.68 -0.01 0.00 0.21 0.00 0.00 52.86 56.24 5bca s ASN 297 Cb 0.43 -2.61 0.05 0.00 -0.55 0.00 0.00 41.25 38.57 5bca s ASN 297 CO 0.07 -0.81 1.43 1.55 -2.79 0.00 0.00 177.10 176.55 5bca h PRO 298 N 6.06 0.39 0.00 0.43 0.13 -1.95 -3.22 132.00 133.85 5bca h PRO 298 Ca -0.44 -0.33 0.00 0.00 -0.87 0.00 0.00 66.00 64.36 5bca h PRO 298 Cb 1.21 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.41 5bca h PRO 298 CO 0.86 0.97 -1.70 0.25 -0.23 0.00 0.00 178.00 178.16 5bca n THR 299 N -3.83 0.00 -3.49 1.56 -2.24 -1.26 -4.56 114.28 100.46 5bca n THR 299 Ca -0.04 -0.37 -0.27 0.00 -2.27 0.00 0.00 64.05 61.10 5bca n THR 299 Cb 0.71 0.25 -0.09 0.00 -2.10 0.00 0.00 70.33 69.10 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 -2.03 0.43 -1.96 2.28 -5.35 -1.26 -4.23 119.36 107.24 5bca n ILE 300 Ca -0.02 -4.33 -0.41 0.00 -0.27 0.00 0.00 62.75 57.72 5bca n ILE 300 Cb 0.47 -1.96 -0.01 0.00 -1.74 0.00 0.00 39.64 36.40 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 -1.17 4.24 -1.48 6.28 0.04 -1.22 -2.56 135.00 139.13 5bca s PRO 301 Ca 0.33 2.39 -0.11 0.00 0.04 0.00 0.00 61.00 63.64 5bca s PRO 301 Cb 0.07 -3.03 0.06 0.00 0.04 0.00 0.00 34.50 31.64 5bca s PRO 301 CO -0.13 -0.37 0.89 0.72 0.04 0.00 0.00 177.00 178.15 5bca n HIS 302 N 0.84 -2.27 0.31 0.56 8.25 -0.79 -4.87 115.22 117.25 5bca n HIS 302 Ca 0.01 0.80 0.21 0.00 -0.26 0.00 0.00 57.72 58.48 5bca n HIS 302 Cb 0.40 -4.05 1.07 0.00 1.12 0.00 0.00 29.99 28.53 5bca n HIS 302 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 5bca h GLY 303 N -1.92 0.00 0.03 -1.41 0.00 -1.19 -2.87 103.07 95.71 5bca h GLY 303 Ca -0.55 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.40 5bca h GLY 303 CO 0.62 0.00 -2.42 0.00 0.00 0.00 0.00 176.54 174.74 5bca n ALA 304 N -2.04 1.45 0.22 3.60 0.00 -1.26 0.07 120.51 122.54 5bca n ALA 304 Ca -0.02 -1.18 -0.14 0.00 0.00 0.00 0.00 53.44 52.10 5bca n ALA 304 Cb 0.10 -0.16 -0.08 0.00 0.00 0.00 0.00 19.45 19.32 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 -0.54 -0.45 0.00 5.08 -1.78 -3.04 114.58 113.85 5bca h GLU 305 Ca -0.56 0.04 0.09 0.00 -1.00 0.00 0.00 59.36 57.93 5bca h GLU 305 Cb 2.04 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 31.32 5bca h GLU 305 CO -0.04 -0.24 -0.13 0.87 -1.00 0.00 0.00 179.01 178.47 5bca h LYS 306 N -0.84 -0.02 -0.05 2.33 1.57 -1.55 0.69 116.57 118.72 5bca h LYS 306 Ca -0.06 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 5bca h LYS 306 Cb 0.55 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 5bca h LYS 306 CO 0.09 -0.01 -0.13 -1.35 -0.57 0.00 0.00 179.45 177.48 5bca h PRO 307 N -0.02 0.07 0.00 3.15 0.11 -1.82 0.50 132.00 133.99 5bca h PRO 307 Ca 0.22 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.31 5bca h PRO 307 Cb 0.35 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.45 5bca h PRO 307 CO -0.47 0.21 0.00 0.00 -0.21 0.00 0.00 178.00 177.52 5bca h ALA 308 N 1.80 1.00 0.00 -0.75 0.00 0.46 -3.43 119.26 118.35 5bca h ALA 308 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 5bca h ALA 308 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 5bca h ALA 308 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 5bca n GLY 309 N -0.16 0.80 3.33 0.00 0.00 0.17 -2.15 105.19 107.17 5bca n GLY 309 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 3.29 -0.08 1.61 2.02 -0.94 -4.50 117.35 116.76 5bca s TYR 310 Ca 0.00 -1.24 -0.01 0.00 -0.37 0.00 0.00 57.07 55.45 5bca s TYR 310 Cb 0.00 -2.95 -0.05 0.00 -0.40 0.00 0.00 41.96 38.56 5bca s TYR 310 CO 0.00 -0.80 -0.08 -1.71 -1.57 0.00 0.00 175.55 171.39 5bca n ASN 311 N 5.03 2.66 -3.79 2.29 2.85 -1.26 -3.49 115.26 119.54 5bca n ASN 311 Ca -0.11 -0.00 -0.30 0.00 -0.11 0.00 0.00 54.58 54.05 5bca n ASN 311 Cb 0.44 -0.15 -0.15 0.00 1.24 0.00 0.00 39.78 41.15 5bca n ASN 311 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 5bca s ASP 312 N -5.00 4.18 0.35 1.20 -1.08 -1.26 -4.98 116.67 110.08 5bca s ASP 312 Ca -0.11 -1.74 0.08 0.00 -0.52 0.00 0.00 52.55 50.26 5bca s ASP 312 Cb 0.03 -1.02 0.66 0.00 -1.46 0.00 0.00 42.92 41.14 5bca s ASP 312 CO 0.17 -0.41 1.85 1.88 0.52 0.00 0.00 175.17 179.18 5bca h TYR 313 N 7.99 0.30 -0.39 -5.34 0.05 -1.98 -1.45 116.97 116.15 5bca h TYR 313 Ca -0.12 -0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.60 5bca h TYR 313 Cb 1.02 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.65 5bca h TYR 313 CO 0.38 0.46 0.16 1.03 -1.05 0.00 0.00 178.16 179.15 5bca h SER 314 N 0.26 0.49 0.07 3.88 0.87 -1.99 0.15 113.55 117.28 5bca h SER 314 Ca 0.05 -0.04 -0.26 0.00 -1.23 0.00 0.00 61.79 60.30 5bca h SER 314 Cb 0.49 -0.12 0.02 0.00 -0.44 0.00 0.00 62.40 62.35 5bca h SER 314 CO 0.03 0.44 -1.06 0.45 -0.53 0.00 0.00 176.83 176.17 5bca h HIS 315 N 0.55 0.94 -0.38 2.24 3.86 -1.72 -2.28 115.15 118.36 5bca h HIS 315 Ca 0.14 -0.56 -0.01 0.00 -1.16 0.00 0.00 60.37 58.78 5bca h HIS 315 Cb 0.10 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 5bca h HIS 315 CO 0.00 1.40 0.21 1.25 0.86 0.00 0.00 177.93 181.65 5bca h LEU 316 N 0.22 0.47 -1.52 2.43 5.85 -1.04 -2.49 115.31 119.22 5bca h LEU 316 Ca -0.15 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 5bca h LEU 316 Cb 1.74 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.64 5bca h LEU 316 CO 0.20 0.41 -0.23 -0.07 -0.34 0.00 0.00 178.44 178.42 5bca h LEU 317 N 0.49 0.00 -1.19 2.25 3.38 -0.71 -0.80 115.31 118.73 5bca h LEU 317 Ca 0.13 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 5bca h LEU 317 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 5bca h LEU 317 CO -0.02 0.23 -0.27 0.44 0.09 0.00 0.00 178.44 178.90 5bca h ASP 318 N 0.00 0.21 0.31 -0.43 3.32 -0.95 -1.45 116.42 117.44 5bca h ASP 318 Ca -0.00 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 56.92 5bca h ASP 318 Cb 0.52 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 5bca h ASP 318 CO 0.03 0.49 -0.28 0.00 -1.72 0.00 0.00 179.24 177.76 5bca h ALA 319 N 1.53 1.49 -0.09 3.45 0.00 -0.95 -0.76 119.26 123.92 5bca h ALA 319 Ca 0.03 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.54 5bca h ALA 319 Cb 0.59 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.34 5bca h ALA 319 CO 0.04 0.36 -0.50 0.74 0.00 0.00 0.00 179.25 179.89 5bca h PHE 320 N 0.00 0.68 -0.73 0.00 -1.00 -1.32 -1.88 116.94 112.69 5bca h PHE 320 Ca -0.00 -0.31 0.01 0.00 2.81 0.00 0.00 57.97 60.48 5bca h PHE 320 Cb 0.52 -0.10 -0.04 0.00 3.61 0.00 0.00 35.95 39.94 5bca h PHE 320 CO 0.00 1.08 0.48 -0.22 -1.61 0.00 0.00 178.31 178.04 5bca h LYS 321 N 0.08 0.95 -0.07 1.51 1.63 -1.04 -1.23 116.57 118.40 5bca h LYS 321 Ca -0.04 -0.06 -0.11 0.00 -0.85 0.00 0.00 60.65 59.59 5bca h LYS 321 Cb 1.15 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 32.56 5bca h LYS 321 CO 0.10 0.63 -0.47 0.66 -3.45 0.00 0.00 179.45 176.92 5bca h SER 322 N 0.97 0.20 0.28 4.20 4.64 -0.94 -2.36 113.55 120.54 5bca h SER 322 Ca 0.27 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 5bca h SER 322 Cb -0.10 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 5bca h SER 322 CO -0.06 0.64 -0.04 0.00 -0.87 0.00 0.00 176.83 176.49 5bca n ALA 323 N -2.47 2.66 -3.70 5.18 0.00 -0.73 -4.91 120.51 116.54 5bca n ALA 323 Ca -0.02 -0.23 -0.23 0.00 0.00 0.00 0.00 53.44 52.96 5bca n ALA 323 Cb 0.51 -1.41 0.04 0.00 0.00 0.00 0.00 19.45 18.60 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 -0.95 -5.43 -4.66 0.00 5.02 -0.56 -4.72 118.16 106.85 5bca n LYS 324 Ca 0.17 0.66 -0.33 0.00 -2.02 0.00 0.00 58.31 56.79 5bca n LYS 324 Cb 0.23 -5.37 -0.13 0.00 -0.02 0.00 0.00 35.03 29.74 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 -6.79 2.96 0.45 -0.35 1.43 -0.63 -4.71 118.68 111.03 5bca s LEU 325 Ca 0.16 -0.19 -0.21 0.00 -1.03 0.00 0.00 54.13 52.87 5bca s LEU 325 Cb -0.08 -1.66 -0.10 0.00 0.03 0.00 0.00 46.19 44.37 5bca s LEU 325 CO 0.80 0.24 0.97 -1.81 0.23 0.00 0.00 176.35 176.78 5bca s ASP 326 N -0.08 6.77 0.09 2.29 1.01 -0.53 -4.49 116.67 121.73 5bca s ASP 326 Ca -0.00 1.74 0.03 0.00 0.71 0.00 0.00 52.55 55.03 5bca s ASP 326 Cb -0.14 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.21 5bca s ASP 326 CO 0.03 -0.48 0.08 -0.69 0.21 0.00 0.00 175.17 174.32 5bca s VAL 327 N -2.16 4.48 -0.08 -1.27 1.01 -1.13 -1.62 120.40 119.63 5bca s VAL 327 Ca 0.63 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.82 5bca s VAL 327 Cb -0.11 -3.17 0.01 0.00 0.00 0.00 0.00 36.38 33.12 5bca s VAL 327 CO 0.16 0.11 -0.13 -0.89 0.00 0.00 0.00 175.10 174.34 5bca s THR 328 N -1.41 1.27 0.18 3.92 2.01 -0.60 -1.78 115.64 119.23 5bca s THR 328 Ca 0.29 -0.54 0.10 0.00 0.31 0.00 0.00 61.69 61.85 5bca s THR 328 Cb -0.12 -1.16 -0.04 0.00 0.01 0.00 0.00 72.50 71.19 5bca s THR 328 CO 0.22 0.39 -0.19 0.12 -0.69 0.00 0.00 174.62 174.46 5bca s PHE 329 N 0.76 2.42 0.01 4.92 5.36 -0.24 -1.77 117.98 129.44 5bca s PHE 329 Ca -0.12 -0.31 0.00 0.00 -0.96 0.00 0.00 56.93 55.53 5bca s PHE 329 Cb -0.16 -1.20 0.00 0.00 -0.34 0.00 0.00 43.02 41.32 5bca s PHE 329 CO 0.03 0.49 0.00 -2.37 -1.46 0.00 0.00 175.22 171.91 5bca n THR 330 N 0.26 0.00 -1.22 0.12 5.66 -1.26 -1.47 114.28 116.36 5bca n THR 330 Ca -0.12 -0.04 -0.08 0.00 -3.05 0.00 0.00 64.05 60.76 5bca n THR 330 Cb 0.55 -0.26 -0.03 0.00 -1.55 0.00 0.00 70.33 69.04 5bca n THR 330 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 5bca n LEU 332 N -0.86 0.29 -0.01 0.00 4.77 -1.12 -2.45 117.00 117.62 5bca n LEU 332 Ca -0.08 0.59 0.12 0.00 -0.03 0.00 0.00 56.01 56.62 5bca n LEU 332 Cb 0.30 -0.57 0.29 0.00 -2.33 0.00 0.00 43.42 41.10 5bca n LEU 332 CO 0.12 -0.50 0.51 -1.84 -1.33 0.00 0.00 177.39 174.35 5bca n GLU 333 N -1.84 0.05 -3.21 3.23 0.00 -1.26 -3.38 120.64 114.23 5bca n GLU 333 Ca 0.02 -0.03 -0.24 0.00 0.00 0.00 0.00 57.16 56.91 5bca n GLU 333 Cb 0.14 -1.50 -0.01 0.00 0.00 0.00 0.00 31.44 30.07 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 -2.97 3.41 0.20 3.44 -1.94 -1.02 -4.69 119.30 115.73 5bca s MET 334 Ca 0.12 -0.30 0.10 0.00 -1.71 0.00 0.00 55.69 53.90 5bca s MET 334 Cb 0.18 -2.61 -0.04 0.00 2.01 0.00 0.00 34.83 34.37 5bca s MET 334 CO 0.67 0.02 -0.15 0.95 -0.01 0.00 0.00 175.02 176.51 5bca s THR 335 N -2.42 2.85 0.50 2.05 -4.23 -1.26 -4.31 115.64 108.82 5bca s THR 335 Ca 0.42 -1.89 -0.22 0.00 -1.18 0.00 0.00 61.69 58.83 5bca s THR 335 Cb -0.10 -2.42 -0.06 0.00 1.34 0.00 0.00 72.50 71.26 5bca s THR 335 CO 0.37 -0.17 1.21 -1.81 -0.54 0.00 0.00 174.62 173.68 5bca s ASP 336 N -2.93 5.84 0.08 3.99 1.01 -1.26 -4.50 116.67 118.90 5bca s ASP 336 Ca 0.25 2.40 0.00 0.00 0.71 0.00 0.00 52.55 55.90 5bca s ASP 336 Cb -0.08 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.24 5bca s ASP 336 CO 0.14 -1.15 0.00 0.29 0.21 0.00 0.00 175.17 174.66 5bca n LYS 337 N -0.78 0.00 -2.19 8.23 5.02 -0.69 -4.98 118.16 122.77 5bca n LYS 337 Ca 0.09 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.31 5bca n LYS 337 Cb 0.48 -0.20 -0.00 0.00 -0.02 0.00 0.00 35.03 35.29 5bca n LYS 337 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 5bca n GLY 338 N 3.02 0.10 3.38 0.72 0.00 -0.18 -4.92 105.19 107.32 5bca n GLY 338 Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.71 2.96 0.46 1.61 1.04 -1.26 -4.77 113.70 111.03 5bca s SER 339 Ca 0.01 -0.96 -0.24 0.00 0.48 0.00 0.00 55.95 55.24 5bca s SER 339 Cb -0.01 -0.20 -0.07 0.00 0.10 0.00 0.00 66.02 65.84 5bca s SER 339 CO 0.02 -0.05 1.31 -0.47 0.98 0.00 0.00 173.24 175.02 5bca s TYR 340 N -2.47 2.64 -0.69 5.02 6.14 -1.26 -0.11 117.35 126.62 5bca s TYR 340 Ca 0.22 1.41 0.22 0.00 0.64 0.00 0.00 57.07 59.56 5bca s TYR 340 Cb -0.04 -3.68 -0.18 0.00 0.42 0.00 0.00 41.96 38.48 5bca s TYR 340 CO 0.09 -2.30 0.84 -0.35 0.64 0.00 0.00 175.55 174.47 5bca n PRO 341 N -0.36 0.21 0.24 4.97 -0.04 -1.26 -4.81 135.00 133.96 5bca n PRO 341 Ca 0.06 -0.05 0.15 0.00 -0.04 0.00 0.00 63.50 63.62 5bca n PRO 341 Cb 0.45 -1.52 0.45 0.00 -0.04 0.00 0.00 33.50 32.83 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 0.00 0.00 -6.98 0.54 3.07 -1.86 -3.46 114.58 105.89 5bca h GLU 342 Ca 0.00 0.00 -0.60 0.00 -0.50 0.00 0.00 59.36 58.26 5bca h GLU 342 Cb 0.66 0.00 -0.13 0.00 -0.84 0.00 0.00 28.75 28.44 5bca h GLU 342 CO 0.00 0.00 -0.98 0.66 -1.40 0.00 0.00 179.01 177.29 5bca n TYR 343 N -3.04 -1.34 -3.26 4.33 4.01 0.85 -0.93 117.16 117.78 5bca n TYR 343 Ca 0.02 0.44 -0.39 0.00 -0.16 0.00 0.00 57.90 57.82 5bca n TYR 343 Cb 0.40 -2.88 -0.06 0.00 -0.31 0.00 0.00 39.34 36.49 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 -4.10 6.61 -0.47 7.72 0.15 -1.26 -2.13 113.70 120.21 5bca s SER 344 Ca 0.17 0.73 0.08 0.00 0.70 0.00 0.00 55.95 57.62 5bca s SER 344 Cb -0.09 -2.29 0.28 0.00 -1.71 0.00 0.00 66.02 62.21 5bca s SER 344 CO 0.98 -0.13 0.68 0.23 1.20 0.00 0.00 173.24 176.21 5bca n MET 345 N 4.45 1.57 -0.16 5.44 2.81 -0.40 -1.01 117.12 129.83 5bca n MET 345 Ca -0.05 -3.85 -0.11 0.00 -1.81 0.00 0.00 57.70 51.88 5bca n MET 345 Cb 0.51 -1.72 -0.00 0.00 -0.71 0.00 0.00 33.22 31.29 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 3.68 0.90 -0.41 0.03 0.13 -1.79 -1.67 132.00 132.87 5bca h PRO 346 Ca 0.12 -0.35 -0.09 0.00 -0.87 0.00 0.00 66.00 64.81 5bca h PRO 346 Cb 0.79 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 5bca h PRO 346 CO 0.61 1.00 -0.09 -0.22 -0.23 0.00 0.00 178.00 179.07 5bca h LYS 347 N 0.75 0.79 -0.57 0.86 3.64 -1.81 -0.30 116.57 119.92 5bca h LYS 347 Ca 0.12 -0.30 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 5bca h LYS 347 Cb 0.66 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.41 5bca h LYS 347 CO 0.05 0.91 0.33 1.15 -2.27 0.00 0.00 179.45 179.62 5bca h THR 348 N 0.61 1.18 -0.17 1.00 2.02 -1.90 -1.04 112.91 114.60 5bca h THR 348 Ca 0.11 -0.41 0.01 0.00 0.77 0.00 0.00 66.41 66.88 5bca h THR 348 Cb 0.61 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 5bca h THR 348 CO 0.04 0.18 0.08 0.25 0.37 0.00 0.00 175.52 176.44 5bca h LEU 349 N 0.77 0.12 -0.45 2.58 5.85 -0.88 -1.25 115.31 122.04 5bca h LEU 349 Ca 0.20 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.99 5bca h LEU 349 Cb 0.00 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 5bca h LEU 349 CO -0.04 0.10 0.14 0.58 -0.34 0.00 0.00 178.44 178.88 5bca h VAL 350 N 0.18 0.83 -0.95 1.05 2.07 -0.82 0.49 116.25 119.10 5bca h VAL 350 Ca 0.07 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.53 5bca h VAL 350 Cb 0.02 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.23 5bca h VAL 350 CO -0.05 0.06 0.62 1.56 0.02 0.00 0.00 177.57 179.78 5bca h GLN 351 N 0.30 1.14 0.15 1.57 4.20 -0.78 -0.70 115.11 121.00 5bca h GLN 351 Ca 0.21 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 5bca h GLN 351 Cb 0.23 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.75 5bca h GLN 351 CO -0.23 0.75 -0.07 -0.91 -0.67 0.00 0.00 178.83 177.70 5bca h ASN 352 N 1.17 -0.18 -0.60 1.46 -0.26 -0.38 -2.23 115.58 114.57 5bca h ASN 352 Ca 0.39 -0.15 0.08 0.00 -0.56 0.00 0.00 56.30 56.05 5bca h ASN 352 Cb 0.05 0.05 -0.06 0.00 -1.06 0.00 0.00 38.32 37.29 5bca h ASN 352 CO -0.13 0.05 0.26 0.40 -1.06 0.00 0.00 177.43 176.95 5bca h ILE 353 N -0.40 0.83 -0.32 2.81 1.08 -0.60 -2.25 117.51 118.66 5bca h ILE 353 Ca -0.02 -0.16 0.03 0.00 -0.39 0.00 0.00 64.86 64.32 5bca h ILE 353 Cb 0.32 0.32 -0.03 0.00 -3.07 0.00 0.00 36.82 34.36 5bca h ILE 353 CO 0.03 0.09 0.13 0.00 -0.69 0.00 0.00 178.15 177.71 5bca h ALA 354 N 1.38 0.37 0.19 1.87 0.00 -1.03 0.56 119.26 122.60 5bca h ALA 354 Ca 0.29 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 5bca h ALA 354 Cb 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 5bca h ALA 354 CO -0.26 -0.27 -0.09 1.15 0.00 0.00 0.00 179.25 179.78 5bca h THR 355 N 0.27 0.82 -0.16 0.00 2.02 -0.97 0.35 112.91 115.25 5bca h THR 355 Ca 0.14 -0.02 0.02 0.00 0.77 0.00 0.00 66.41 67.32 5bca h THR 355 Cb 0.09 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 5bca h THR 355 CO -0.13 0.00 0.03 -0.07 0.37 0.00 0.00 175.52 175.72 5bca h LEU 356 N -0.26 0.01 -0.18 2.58 3.38 -1.29 -0.70 115.31 118.85 5bca h LEU 356 Ca -0.03 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.02 5bca h LEU 356 Cb 0.20 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 5bca h LEU 356 CO 0.04 0.03 -0.16 0.00 0.09 0.00 0.00 178.44 178.44 5bca h ALA 357 N 1.11 -0.05 -0.44 1.53 0.00 0.44 0.38 119.26 122.24 5bca h ALA 357 Ca 0.07 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 5bca h ALA 357 Cb 0.06 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 5bca h ALA 357 CO -0.09 -0.60 -0.05 -0.91 0.00 0.00 0.00 179.25 177.60 5bca h ASN 358 N -0.18 0.72 -0.06 0.00 2.35 -0.88 -0.56 115.58 116.97 5bca h ASN 358 Ca 0.11 -0.19 -0.10 0.00 -0.55 0.00 0.00 56.30 55.58 5bca h ASN 358 Cb 0.35 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 5bca h ASN 358 CO -0.29 0.82 -0.26 -0.08 -1.65 0.00 0.00 177.43 175.97 5bca h GLU 359 N 0.69 0.50 0.00 0.81 4.81 -0.59 -2.40 114.58 118.40 5bca h GLU 359 Ca 0.13 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 5bca h GLU 359 Cb 0.50 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.85 5bca h GLU 359 CO 0.03 0.72 -0.09 1.63 -0.73 0.00 0.00 179.01 180.57 5bca n LYS 360 N -4.11 0.08 -1.85 1.92 5.02 0.08 -4.91 118.16 114.39 5bca n LYS 360 Ca -0.00 0.06 -0.01 0.00 -2.02 0.00 0.00 58.31 56.33 5bca n LYS 360 Cb 0.42 -1.58 -0.00 0.00 -0.02 0.00 0.00 35.03 33.84 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 1.45 0.35 3.75 0.72 0.00 -0.32 -5.02 105.19 106.12 5bca n GLY 361 Ca 0.06 -0.89 -0.37 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.04 5.29 0.30 -0.61 1.01 -0.56 -5.03 121.20 119.56 5bca s ILE 362 Ca 0.00 0.56 -0.29 0.00 0.00 0.00 0.00 60.65 60.92 5bca s ILE 362 Cb 0.00 -3.62 -0.10 0.00 0.01 0.00 0.00 42.46 38.74 5bca s ILE 362 CO 0.00 0.43 1.41 -0.69 0.00 0.00 0.00 174.94 176.09 5bca s VAL 363 N 0.16 2.54 0.09 2.92 1.01 -1.26 -4.41 120.40 121.46 5bca s VAL 363 Ca 0.17 0.50 0.10 0.00 0.00 0.00 0.00 61.98 62.75 5bca s VAL 363 Cb -0.13 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 5bca s VAL 363 CO 0.05 0.10 -0.27 -0.22 0.00 0.00 0.00 175.10 174.76 5bca s LEU 364 N -1.22 2.25 0.03 3.92 2.96 -1.26 -2.83 118.68 122.54 5bca s LEU 364 Ca 0.54 -0.68 -0.03 0.00 -0.22 0.00 0.00 54.13 53.75 5bca s LEU 364 Cb -0.42 -1.25 -0.02 0.00 0.50 0.00 0.00 46.19 45.00 5bca s LEU 364 CO 0.51 0.22 0.03 0.20 -1.32 0.00 0.00 176.35 175.99 5bca s ASN 365 N -1.69 0.24 0.30 3.68 0.01 -0.74 0.03 114.94 116.77 5bca s ASN 365 Ca 0.13 -0.58 0.04 0.00 -0.71 0.00 0.00 52.86 51.74 5bca s ASN 365 Cb -0.10 0.18 -0.06 0.00 0.41 0.00 0.00 41.25 41.68 5bca s ASN 365 CO 0.04 -0.45 0.04 -0.83 -1.51 0.00 0.00 177.10 174.39 5bca s GLY 366 N -2.00 1.92 0.08 0.66 0.00 -0.61 -1.08 107.32 106.29 5bca s GLY 366 Ca -0.07 -1.97 -0.07 0.00 0.00 0.00 0.00 44.72 42.61 5bca s GLY 366 CO -0.04 -1.77 0.15 -0.54 0.00 0.00 0.00 173.10 170.90 5bca s GLU 367 N -3.88 0.79 0.47 2.90 2.02 -0.54 -0.41 118.70 120.04 5bca s GLU 367 Ca 0.34 -0.98 -0.10 0.00 0.02 0.00 0.00 54.97 54.25 5bca s GLU 367 Cb 0.07 0.31 -0.06 0.00 0.10 0.00 0.00 34.13 34.56 5bca s GLU 367 CO 0.14 -0.23 0.84 0.54 0.02 0.00 0.00 175.26 176.56 5bca s ASN 368 N -2.80 6.43 -0.15 -0.19 4.22 -1.25 -2.29 114.94 118.91 5bca s ASN 368 Ca 0.04 1.19 -0.11 0.00 -2.14 0.00 0.00 52.86 51.84 5bca s ASN 368 Cb 0.05 -2.35 -0.24 0.00 1.28 0.00 0.00 41.25 39.99 5bca s ASN 368 CO -0.10 -0.54 0.30 0.00 -2.04 0.00 0.00 177.10 174.72 5bca n ALA 369 N -1.77 0.87 -2.49 3.54 0.00 -1.26 -4.55 120.51 114.84 5bca n ALA 369 Ca 0.03 -0.58 -0.26 0.00 0.00 0.00 0.00 53.44 52.64 5bca n ALA 369 Cb 0.54 -0.63 -0.08 0.00 0.00 0.00 0.00 19.45 19.29 5bca n ALA 369 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 5bca s LEU 370 N -7.27 3.01 0.36 0.00 1.43 -1.26 -5.00 118.68 109.95 5bca s LEU 370 Ca -0.25 -1.18 -0.27 0.00 -1.03 0.00 0.00 54.13 51.40 5bca s LEU 370 Cb 0.07 -1.28 -0.09 0.00 0.03 0.00 0.00 46.19 44.91 5bca s LEU 370 CO 0.71 -0.56 1.25 -0.44 0.23 0.00 0.00 176.35 177.54 5bca s SER 371 N -3.88 6.66 -0.27 2.29 0.01 -1.26 -4.93 113.70 112.32 5bca s SER 371 Ca 0.38 2.55 -0.12 0.00 1.31 0.00 0.00 55.95 60.08 5bca s SER 371 Cb 0.05 -2.64 -0.05 0.00 0.21 0.00 0.00 66.02 63.59 5bca s SER 371 CO 0.21 -0.60 0.22 -0.63 0.41 0.00 0.00 173.24 172.85 5bca s ILE 372 N -1.23 5.29 -0.83 1.44 1.01 -1.26 -4.94 121.20 120.68 5bca s ILE 372 Ca 0.52 0.26 0.07 0.00 0.00 0.00 0.00 60.65 61.50 5bca s ILE 372 Cb -0.36 -3.56 0.07 0.00 0.01 0.00 0.00 42.46 38.61 5bca s ILE 372 CO 0.47 0.25 0.76 0.61 0.00 0.00 0.00 174.94 177.04 5bca n GLY 373 N 4.80 -0.44 3.16 6.18 0.00 -1.26 -4.94 105.19 112.69 5bca n GLY 373 Ca -0.13 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.61 0.08 0.55 1.61 2.20 -1.26 -5.04 114.94 112.47 5bca s ASN 374 Ca 0.09 -0.41 0.34 0.00 -0.94 0.00 0.00 52.86 51.93 5bca s ASN 374 Cb 0.06 0.27 1.47 0.00 -2.00 0.00 0.00 41.25 41.05 5bca s ASN 374 CO 0.09 -0.54 2.03 1.05 -2.94 0.00 0.00 177.10 176.78 5bca h GLU 375 N 3.53 0.00 -0.04 3.55 4.11 -1.98 -2.78 114.58 120.96 5bca h GLU 375 Ca -0.32 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.03 5bca h GLU 375 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 5bca h GLU 375 CO 0.49 0.04 -0.35 0.93 0.07 0.00 0.00 179.01 180.19 5bca h GLU 376 N 0.00 0.07 -0.06 1.06 4.39 -2.00 -0.96 114.58 117.09 5bca h GLU 376 Ca -0.00 -0.03 -0.10 0.00 0.34 0.00 0.00 59.36 59.57 5bca h GLU 376 Cb 0.45 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 5bca h GLU 376 CO 0.00 0.41 -0.45 0.93 -1.16 0.00 0.00 179.01 178.75 5bca h GLU 377 N 0.06 0.13 -0.30 2.33 5.08 -1.83 -2.12 114.58 117.93 5bca h GLU 377 Ca 0.01 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 5bca h GLU 377 Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 5bca h GLU 377 CO 0.05 0.55 -0.25 1.88 -1.00 0.00 0.00 179.01 180.24 5bca h TYR 378 N 0.11 0.65 -0.59 4.33 0.05 -1.27 -1.40 116.97 118.85 5bca h TYR 378 Ca 0.01 -0.14 0.01 0.00 0.05 0.00 0.00 58.73 58.65 5bca h TYR 378 Cb 0.83 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 38.38 5bca h TYR 378 CO 0.01 0.78 0.38 0.87 -1.05 0.00 0.00 178.16 179.15 5bca h LYS 379 N 0.51 0.76 -0.36 4.88 1.57 -0.67 -0.54 116.57 122.72 5bca h LYS 379 Ca 0.07 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 5bca h LYS 379 Cb 0.70 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 5bca h LYS 379 CO 0.05 0.50 0.15 0.00 -0.57 0.00 0.00 179.45 179.58 5bca h ARG 380 N 0.78 0.53 0.06 3.15 3.08 -1.28 0.53 114.38 121.23 5bca h ARG 380 Ca 0.22 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 60.19 5bca h ARG 380 Cb -0.07 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 5bca h ARG 380 CO -0.06 0.50 -0.15 0.28 -1.07 0.00 0.00 179.97 179.47 5bca h VAL 381 N 0.43 0.64 -0.93 2.04 2.07 -1.01 -1.95 116.25 117.54 5bca h VAL 381 Ca 0.12 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.73 5bca h VAL 381 Cb 0.17 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.50 5bca h VAL 381 CO -0.01 0.00 0.58 0.00 0.02 0.00 0.00 177.57 178.16 5bca h ALA 382 N 0.60 1.34 -0.04 1.67 0.00 -0.87 0.76 119.26 122.71 5bca h ALA 382 Ca 0.03 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.98 5bca h ALA 382 Cb 0.32 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 5bca h ALA 382 CO -0.10 0.26 -0.20 1.49 0.00 0.00 0.00 179.25 180.69 5bca h GLU 383 N 0.99 -0.29 -0.33 0.00 4.81 -0.41 -0.70 114.58 118.65 5bca h GLU 383 Ca 0.43 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.65 5bca h GLU 383 Cb 0.32 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 5bca h GLU 383 CO -0.22 -0.20 0.07 0.52 -0.73 0.00 0.00 179.01 178.45 5bca h MET 384 N -0.30 0.53 -0.31 1.92 2.86 -1.03 -1.83 114.93 116.77 5bca h MET 384 Ca 0.07 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 5bca h MET 384 Cb 0.40 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 5bca h MET 384 CO -0.22 0.60 0.19 0.00 1.06 0.00 0.00 176.91 178.54 5bca h ALA 385 N 0.90 0.39 0.00 6.32 0.00 -0.66 -1.24 119.26 124.98 5bca h ALA 385 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 5bca h ALA 385 Cb 0.32 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.99 5bca h ALA 385 CO 0.00 -0.11 -0.48 1.19 0.00 0.00 0.00 179.25 179.86 5bca n PHE 386 N -4.84 0.15 0.31 0.00 3.72 -0.29 -2.25 117.46 114.27 5bca n PHE 386 Ca -0.01 0.04 0.08 0.00 -0.05 0.00 0.00 57.45 57.51 5bca n PHE 386 Cb 0.05 -0.38 -0.11 0.00 -0.94 0.00 0.00 39.48 38.10 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 -1.66 1.09 -1.31 4.37 3.02 -0.69 -3.97 115.26 116.11 5bca n ASN 387 Ca 0.05 -0.38 -0.04 0.00 -0.03 0.00 0.00 54.58 54.18 5bca n ASN 387 Cb 0.36 1.41 0.22 0.00 -0.61 0.00 0.00 39.78 41.16 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 -1.75 1.44 -3.01 3.10 4.02 -0.47 -1.66 117.16 118.82 5bca n TYR 388 Ca -0.00 -1.41 -0.19 0.00 -0.01 0.00 0.00 57.90 56.29 5bca n TYR 388 Cb 0.34 -0.52 0.04 0.00 -0.02 0.00 0.00 39.34 39.17 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 -0.88 -5.47 -4.70 7.72 5.15 -1.25 -4.91 115.26 110.92 5bca n ASN 389 Ca 0.34 -0.29 -0.42 0.00 -0.60 0.00 0.00 54.58 53.62 5bca n ASN 389 Cb 1.12 -4.26 -0.03 0.00 -0.53 0.00 0.00 39.78 36.08 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 -3.12 2.99 -0.26 1.20 0.40 -0.96 -4.67 117.98 113.56 5bca s PHE 390 Ca 0.31 0.79 0.27 0.00 -0.60 0.00 0.00 56.93 57.70 5bca s PHE 390 Cb -0.13 -3.74 0.78 0.00 0.51 0.00 0.00 43.02 40.43 5bca s PHE 390 CO 0.38 -2.71 1.76 0.00 0.70 0.00 0.00 175.22 175.35 5bca h ALA 391 N 7.33 1.00 -2.65 5.36 0.00 -0.74 -3.43 119.26 126.14 5bca h ALA 391 Ca -0.41 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.52 5bca h ALA 391 Cb 1.20 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.85 5bca h ALA 391 CO 0.89 0.00 0.30 0.20 0.00 0.00 0.00 179.25 180.64 5bca s GLY 392 N -4.13 -0.56 -0.02 0.00 0.00 -1.23 -2.33 107.32 99.05 5bca s GLY 392 Ca 0.05 0.77 -0.00 0.00 0.00 0.00 0.00 44.72 45.53 5bca s GLY 392 CO 0.61 0.31 0.04 -0.12 0.00 0.00 0.00 173.10 173.93 5bca s PHE 393 N -3.25 0.02 -0.07 1.90 5.36 -0.97 -1.57 117.98 119.38 5bca s PHE 393 Ca 0.01 0.15 0.03 0.00 -0.96 0.00 0.00 56.93 56.16 5bca s PHE 393 Cb -0.01 -0.22 -0.02 0.00 -0.34 0.00 0.00 43.02 42.43 5bca s PHE 393 CO -0.09 -0.09 -0.17 0.99 -1.46 0.00 0.00 175.22 174.40 5bca s THR 394 N 1.06 2.81 -0.24 0.12 2.01 0.45 -0.64 115.64 121.20 5bca s THR 394 Ca -0.09 -0.79 -0.15 0.00 0.31 0.00 0.00 61.69 60.97 5bca s THR 394 Cb -0.13 -2.10 -0.04 0.00 0.01 0.00 0.00 72.50 70.24 5bca s THR 394 CO -0.03 0.57 0.35 -0.22 -0.69 0.00 0.00 174.62 174.60 5bca s LEU 395 N -0.30 4.09 -0.30 4.42 2.96 0.38 -3.88 118.68 126.04 5bca s LEU 395 Ca 0.02 0.34 -0.16 0.00 -0.22 0.00 0.00 54.13 54.12 5bca s LEU 395 Cb -0.13 -2.41 -0.02 0.00 0.50 0.00 0.00 46.19 44.12 5bca s LEU 395 CO 0.03 -0.11 0.40 -0.76 -1.32 0.00 0.00 176.35 174.58 5bca s LEU 396 N 1.67 4.19 0.11 -0.68 1.02 -1.26 -1.70 118.68 122.03 5bca s LEU 396 Ca 0.15 0.12 -0.19 0.00 0.02 0.00 0.00 54.13 54.24 5bca s LEU 396 Cb -0.15 -2.44 0.05 0.00 0.02 0.00 0.00 46.19 43.66 5bca s LEU 396 CO 0.09 -0.28 0.47 -0.60 0.02 0.00 0.00 176.35 176.05 5bca s ARG 397 N 2.13 1.10 0.00 1.70 3.52 -1.26 -4.49 118.95 121.64 5bca s ARG 397 Ca 0.15 -0.55 0.00 0.00 -0.13 0.00 0.00 55.73 55.20 5bca s ARG 397 Cb -0.16 0.49 0.00 0.00 -1.56 0.00 0.00 34.95 33.73 5bca s ARG 397 CO 0.11 -0.44 0.00 0.98 -0.81 0.00 0.00 175.30 175.14 5bca n TYR 398 N -0.11 0.00 0.21 5.12 9.36 -0.44 -0.98 117.16 130.32 5bca n TYR 398 Ca -0.17 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.18 5bca n TYR 398 Cb 0.63 0.00 0.69 0.00 -0.63 0.00 0.00 39.34 40.03 5bca n TYR 398 CO 0.00 0.00 0.00 -0.56 0.22 0.00 0.00 176.86 176.52 5bca h GLN 399 N 0.00 0.00 -0.17 2.98 -0.00 -1.95 -1.69 115.11 114.28 5bca h GLN 399 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 58.65 58.47 5bca h GLN 399 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 27.49 5bca h GLN 399 CO 0.00 0.00 -0.60 -0.44 -0.00 0.00 0.00 178.83 177.79 5bca h ASP 400 N 0.00 0.82 0.14 0.06 3.32 -1.45 -3.25 116.42 116.06 5bca h ASP 400 Ca 0.00 -0.60 -0.36 0.00 0.02 0.00 0.00 57.03 56.08 5bca h ASP 400 Cb 0.14 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 5bca h ASP 400 CO 0.00 1.29 -2.07 1.33 -1.72 0.00 0.00 179.24 178.07 5bca n VAL 401 N -4.08 1.70 0.19 -1.35 0.24 -1.18 -4.27 118.33 109.58 5bca n VAL 401 Ca -0.07 -0.66 0.05 0.00 -2.04 0.00 0.00 64.34 61.62 5bca n VAL 401 Cb 0.65 -1.57 0.50 0.00 -1.47 0.00 0.00 33.84 31.95 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 0.05 0.10 -0.35 7.34 -1.53 -1.40 -2.18 114.93 116.96 5bca h MET 402 Ca -0.44 -0.02 -0.12 0.00 -3.44 0.00 0.00 59.70 55.68 5bca h MET 402 Cb 2.02 -0.02 -0.07 0.00 -0.55 0.00 0.00 31.60 32.98 5bca h MET 402 CO 0.06 0.21 0.00 0.66 0.14 0.00 0.00 176.91 177.97 5bca n TYR 403 N -4.37 1.14 -3.35 1.39 4.01 -1.23 -4.79 117.16 109.97 5bca n TYR 403 Ca -0.02 -1.29 -0.23 0.00 -0.16 0.00 0.00 57.90 56.20 5bca n TYR 403 Cb 0.21 -0.44 -0.09 0.00 -0.31 0.00 0.00 39.34 38.71 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 -2.20 1.54 0.53 7.72 3.84 -0.82 -5.02 114.94 120.53 5bca s ASN 404 Ca 0.44 -2.25 0.23 0.00 0.21 0.00 0.00 52.86 51.49 5bca s ASN 404 Cb 0.38 0.08 1.47 0.00 -0.55 0.00 0.00 41.25 42.64 5bca s ASN 404 CO 0.04 -0.23 2.15 0.78 -2.79 0.00 0.00 177.10 177.05 5bca h ASN 405 N 6.41 0.00 0.59 -4.21 4.21 -1.87 -1.73 115.58 118.98 5bca h ASN 405 Ca 0.13 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.61 5bca h ASN 405 Cb 0.99 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.19 5bca h ASN 405 CO 0.25 0.06 -0.29 0.28 -1.29 0.00 0.00 177.43 176.45 5bca h SER 406 N 0.00 -0.68 -0.73 5.81 0.02 -1.95 -1.99 113.55 114.03 5bca h SER 406 Ca -0.00 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 5bca h SER 406 Cb 0.13 0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 5bca h SER 406 CO 0.01 -0.42 0.34 -0.07 -1.14 0.00 0.00 176.83 175.54 5bca h LEU 407 N -0.89 0.98 -0.79 5.07 3.38 -1.84 -2.14 115.31 119.09 5bca h LEU 407 Ca -0.08 -0.12 0.11 0.00 0.09 0.00 0.00 57.88 57.87 5bca h LEU 407 Cb 0.64 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 41.06 5bca h LEU 407 CO 0.13 0.85 0.42 -0.03 0.09 0.00 0.00 178.44 179.90 5bca h MET 408 N 1.07 0.66 -0.58 1.13 4.05 -1.23 0.12 114.93 120.15 5bca h MET 408 Ca 0.26 -0.04 -0.08 0.00 -0.28 0.00 0.00 59.70 59.55 5bca h MET 408 Cb 0.14 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 30.77 5bca h MET 408 CO -0.03 0.44 0.04 0.78 0.23 0.00 0.00 176.91 178.36 5bca h GLY 409 N 0.68 1.04 1.25 1.39 0.00 -0.85 0.05 103.07 106.64 5bca h GLY 409 Ca 0.40 -0.71 -0.13 0.00 0.00 0.00 0.00 47.33 46.89 5bca h GLY 409 CO -0.29 0.66 -0.25 0.50 0.00 0.00 0.00 176.54 177.16 5bca h LYS 410 N 0.90 0.86 -0.13 4.80 1.79 -0.79 -2.32 116.57 121.67 5bca h LYS 410 Ca 0.17 -0.37 -0.01 0.00 -2.18 0.00 0.00 60.65 58.26 5bca h LYS 410 Cb 0.48 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.09 5bca h LYS 410 CO 0.02 1.01 0.04 0.35 -1.08 0.00 0.00 179.45 179.79 5bca h PHE 411 N 0.73 0.21 -0.71 -1.35 3.04 -0.58 -2.78 116.94 115.51 5bca h PHE 411 Ca 0.09 -0.02 0.04 0.00 3.98 0.00 0.00 57.97 62.07 5bca h PHE 411 Cb 0.80 -0.06 -0.05 0.00 2.56 0.00 0.00 35.95 39.20 5bca h PHE 411 CO 0.05 0.32 0.43 -0.22 -2.02 0.00 0.00 178.31 176.86 5bca h LYS 412 N 0.03 0.79 0.18 1.11 3.64 -0.86 0.18 116.57 121.65 5bca h LYS 412 Ca 0.04 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 5bca h LYS 412 Cb 0.21 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 5bca h LYS 412 CO -0.00 0.52 -0.09 0.22 -2.27 0.00 0.00 179.45 177.83 5bca h ASP 413 N 0.81 -0.21 0.61 4.20 3.58 -1.29 -2.96 116.42 121.15 5bca h ASP 413 Ca 0.30 -0.03 -0.28 0.00 0.42 0.00 0.00 57.03 57.44 5bca h ASP 413 Cb 0.10 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.18 5bca h ASP 413 CO -0.14 -0.10 -1.43 -0.07 -2.88 0.00 0.00 179.24 174.61 5bca h LEU 414 N -0.30 0.19 0.00 2.28 3.38 -1.42 -3.43 115.31 116.02 5bca h LEU 414 Ca -0.03 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.67 5bca h LEU 414 Cb 0.23 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.92 5bca h LEU 414 CO 0.04 1.23 -0.72 0.18 0.09 0.00 0.00 178.44 179.26 5bca n LEU 415 N -3.33 0.00 -1.82 1.67 4.77 0.53 -4.76 117.00 114.05 5bca n LEU 415 Ca -0.12 -0.03 -0.08 0.00 -0.03 0.00 0.00 56.01 55.75 5bca n LEU 415 Cb 1.02 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 42.00 5bca n LEU 415 CO 0.48 0.00 1.40 0.61 -1.33 0.00 0.00 177.39 178.55 5bca n GLY 416 N 1.85 2.82 3.86 -0.72 0.00 -0.52 -4.79 105.19 107.70 5bca n GLY 416 Ca 0.00 -0.78 -0.21 0.00 0.00 0.00 0.00 46.02 45.03 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 0.65 4.01 -0.23 1.61 -7.23 -1.26 -4.33 120.40 113.62 5bca s VAL 417 Ca 0.43 -1.32 -0.05 0.00 -1.81 0.00 0.00 61.98 59.23 5bca s VAL 417 Cb 0.21 -3.33 -0.02 0.00 0.56 0.00 0.00 36.38 33.81 5bca s VAL 417 CO 0.00 -0.24 -0.00 -0.89 -0.31 0.00 0.00 175.10 173.66 5bca s THR 418 N -2.21 3.71 0.28 5.32 2.01 -1.26 -4.85 115.64 118.63 5bca s THR 418 Ca 0.38 -0.38 -0.29 0.00 0.31 0.00 0.00 61.69 61.71 5bca s THR 418 Cb -0.07 -2.71 -0.09 0.00 0.01 0.00 0.00 72.50 69.64 5bca s THR 418 CO 0.27 0.39 1.04 -2.16 -0.69 0.00 0.00 174.62 173.47 5bca s PRO 419 N 1.53 4.65 -0.02 4.92 0.04 -1.26 0.04 135.00 144.90 5bca s PRO 419 Ca 0.06 1.67 0.01 0.00 0.04 0.00 0.00 61.00 62.78 5bca s PRO 419 Cb -0.15 -3.14 0.02 0.00 0.04 0.00 0.00 34.50 31.28 5bca s PRO 419 CO -0.01 0.26 -0.01 0.54 0.04 0.00 0.00 177.00 177.82 5bca s VAL 420 N -1.23 0.22 0.16 -0.36 0.11 0.03 -4.84 120.40 114.47 5bca s VAL 420 Ca 0.45 -0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 59.18 5bca s VAL 420 Cb -0.29 -0.26 -0.10 0.00 -1.53 0.00 0.00 36.38 34.20 5bca s VAL 420 CO 0.37 0.12 1.59 -0.32 -3.33 0.00 0.00 175.10 173.52 5bca s MET 421 N 0.62 4.21 0.13 1.54 1.75 -1.26 -1.90 119.30 124.37 5bca s MET 421 Ca -0.06 2.37 0.05 0.00 -1.25 0.00 0.00 55.69 56.80 5bca s MET 421 Cb -0.09 -3.20 -0.04 0.00 2.84 0.00 0.00 34.83 34.34 5bca s MET 421 CO -0.01 -0.63 -0.13 -0.65 -0.65 0.00 0.00 175.02 172.95 5bca s GLN 422 N 1.31 1.01 -0.27 4.11 -1.52 0.25 -4.34 119.66 120.22 5bca s GLN 422 Ca 0.71 -1.27 -0.07 0.00 -1.95 0.00 0.00 55.36 52.77 5bca s GLN 422 Cb -0.44 -0.82 -0.01 0.00 -0.22 0.00 0.00 33.01 31.52 5bca s GLN 422 CO 0.31 0.15 0.08 0.99 -0.25 0.00 0.00 175.29 176.57 5bca s THR 423 N -2.38 4.18 -0.20 -0.19 2.01 -0.63 -0.15 115.64 118.28 5bca s THR 423 Ca 0.10 -0.40 -0.09 0.00 0.31 0.00 0.00 61.69 61.62 5bca s THR 423 Cb -0.03 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 5bca s THR 423 CO 0.02 0.22 0.10 -0.63 -0.69 0.00 0.00 174.62 173.64 5bca s ILE 424 N 1.57 4.98 -0.03 1.82 -1.09 -0.60 0.63 121.20 128.48 5bca s ILE 424 Ca 0.05 0.04 0.03 0.00 -2.23 0.00 0.00 60.65 58.54 5bca s ILE 424 Cb -0.16 -3.28 -0.00 0.00 -1.58 0.00 0.00 42.46 37.44 5bca s ILE 424 CO 0.03 0.42 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.36 5bca s VAL 425 N 0.64 0.96 -0.13 2.92 1.01 0.24 -1.65 120.40 124.40 5bca s VAL 425 Ca 0.05 -0.47 -0.00 0.00 0.00 0.00 0.00 61.98 61.56 5bca s VAL 425 Cb -0.13 -0.83 0.03 0.00 0.00 0.00 0.00 36.38 35.45 5bca s VAL 425 CO 0.01 0.29 -0.09 -0.69 0.00 0.00 0.00 175.10 174.62 5bca s VAL 426 N 0.05 1.18 0.19 2.92 1.01 -0.75 -1.06 120.40 123.93 5bca s VAL 426 Ca -0.01 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 5bca s VAL 426 Cb -0.08 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 5bca s VAL 426 CO 0.01 0.37 0.37 -0.54 0.00 0.00 0.00 175.10 175.30 5bca s LYS 427 N 1.64 3.51 -1.15 2.72 -0.14 0.38 -2.39 119.74 124.32 5bca s LYS 427 Ca 0.05 -0.36 -0.01 0.00 -1.36 0.00 0.00 55.97 54.29 5bca s LYS 427 Cb -0.13 -2.86 0.00 0.00 -1.68 0.00 0.00 37.83 33.16 5bca s LYS 427 CO -0.09 0.43 0.96 0.09 -0.76 0.00 0.00 175.35 175.98 5bca n ASN 428 N -0.56 -2.35 -4.64 2.83 3.02 -1.26 -0.57 115.26 111.73 5bca n ASN 428 Ca -0.05 -0.58 -0.40 0.00 -0.03 0.00 0.00 54.58 53.52 5bca n ASN 428 Cb 0.54 -4.88 -0.06 0.00 -0.61 0.00 0.00 39.78 34.76 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 -3.34 5.02 -1.30 2.41 1.01 -1.26 -4.31 120.40 118.62 5bca s VAL 429 Ca 0.04 1.11 -0.16 0.00 0.00 0.00 0.00 61.98 62.98 5bca s VAL 429 Cb -0.02 -3.92 0.09 0.00 0.00 0.00 0.00 36.38 32.54 5bca s VAL 429 CO 0.69 0.08 1.76 -0.81 0.00 0.00 0.00 175.10 176.82 5bca n PRO 430 N 5.38 3.21 -3.79 2.72 -0.04 -1.26 -4.96 135.00 136.26 5bca n PRO 430 Ca -0.02 -3.32 -0.20 0.00 -0.04 0.00 0.00 63.50 59.92 5bca n PRO 430 Cb 0.49 -3.33 -0.02 0.00 -0.04 0.00 0.00 33.50 30.61 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 3.23 4.50 0.31 0.52 -4.23 -1.26 -5.12 115.64 113.60 5bca s THR 431 Ca 0.50 -1.10 0.05 0.00 -1.18 0.00 0.00 61.69 59.96 5bca s THR 431 Cb 0.04 -3.55 -0.06 0.00 1.34 0.00 0.00 72.50 70.27 5bca s THR 431 CO 0.03 -0.25 0.02 0.42 -0.54 0.00 0.00 174.62 174.30 5bca s THR 432 N -2.11 1.37 0.29 3.99 -4.23 -1.26 -5.06 115.64 108.63 5bca s THR 432 Ca 0.39 -2.03 -0.30 0.00 -1.18 0.00 0.00 61.69 58.57 5bca s THR 432 Cb -0.09 -2.70 -0.11 0.00 1.34 0.00 0.00 72.50 70.95 5bca s THR 432 CO 0.29 -0.10 1.52 -0.63 -0.54 0.00 0.00 174.62 175.16 5bca s ILE 433 N -3.18 2.28 0.00 2.99 1.01 -1.26 -2.29 121.20 120.74 5bca s ILE 433 Ca 0.34 0.24 0.00 0.00 0.00 0.00 0.00 60.65 61.23 5bca s ILE 433 Cb 0.07 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.39 5bca s ILE 433 CO 0.14 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.74 5bca n GLY 434 N 1.84 1.04 3.78 6.18 0.00 -1.26 -4.82 105.19 111.95 5bca n GLY 434 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 5bca n GLY 434 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 5bca s ASP 435 N -2.24 6.00 0.13 1.61 1.01 -0.97 -1.78 116.67 120.43 5bca s ASP 435 Ca 0.00 2.16 0.10 0.00 0.71 0.00 0.00 52.55 55.52 5bca s ASP 435 Cb 0.00 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 5bca s ASP 435 CO 0.00 -1.03 -0.24 0.42 0.21 0.00 0.00 175.17 174.53 5bca s THR 436 N -1.75 2.07 -0.15 -1.27 -4.23 0.15 -4.91 115.64 105.56 5bca s THR 436 Ca 0.69 -1.74 -0.03 0.00 -1.18 0.00 0.00 61.69 59.43 5bca s THR 436 Cb -0.24 -1.87 -0.02 0.00 1.34 0.00 0.00 72.50 71.71 5bca s THR 436 CO 0.27 -0.01 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.60 5bca s VAL 437 N -1.23 3.69 0.24 2.29 1.01 -1.26 -0.28 120.40 124.86 5bca s VAL 437 Ca 0.13 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.72 5bca s VAL 437 Cb -0.09 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.63 5bca s VAL 437 CO 0.06 0.50 -0.03 -0.31 0.00 0.00 0.00 175.10 175.32 5bca s TYR 438 N 0.35 1.68 0.25 5.22 1.51 -0.43 -0.05 117.35 125.88 5bca s TYR 438 Ca -0.06 -0.82 0.11 0.00 -1.01 0.00 0.00 57.07 55.29 5bca s TYR 438 Cb -0.15 -0.96 -0.05 0.00 -0.11 0.00 0.00 41.96 40.70 5bca s TYR 438 CO 0.04 0.09 -0.16 0.96 -1.11 0.00 0.00 175.55 175.36 5bca s ILE 439 N -3.26 2.70 0.03 2.71 -4.36 0.29 -1.23 121.20 118.08 5bca s ILE 439 Ca 0.28 -2.16 -0.16 0.00 -0.26 0.00 0.00 60.65 58.35 5bca s ILE 439 Cb 0.05 -2.39 0.03 0.00 1.25 0.00 0.00 42.46 41.39 5bca s ILE 439 CO 0.09 -0.30 0.35 0.28 0.24 0.00 0.00 174.94 175.60 5bca s THR 440 N -2.21 0.07 0.13 8.37 -1.32 -0.90 -0.70 115.64 119.09 5bca s THR 440 Ca 0.28 -0.55 -0.04 0.00 -1.21 0.00 0.00 61.69 60.16 5bca s THR 440 Cb -0.06 -0.88 0.02 0.00 -1.51 0.00 0.00 72.50 70.06 5bca s THR 440 CO 0.15 -0.31 0.24 0.61 -2.21 0.00 0.00 174.62 173.11 5bca n GLY 441 N 0.71 1.95 0.25 6.08 0.00 -1.05 -1.83 105.19 111.30 5bca n GLY 441 Ca -0.19 -1.19 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 5bca n GLY 441 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 5bca h ASN 442 N 0.68 0.84 -4.38 1.61 -1.07 -1.53 0.31 115.58 112.04 5bca h ASN 442 Ca -0.11 -0.38 -0.49 0.00 0.07 0.00 0.00 56.30 55.39 5bca h ASN 442 Cb 0.42 -0.24 0.10 0.00 -2.07 0.00 0.00 38.32 36.53 5bca h ASN 442 CO 0.14 1.14 0.37 -0.13 0.07 0.00 0.00 177.43 179.01 5bca s ARG 443 N -4.32 2.30 0.40 4.14 0.52 -1.26 -4.41 118.95 116.33 5bca s ARG 443 Ca -0.10 0.51 0.07 0.00 -0.52 0.00 0.00 55.73 55.70 5bca s ARG 443 Cb 0.12 -1.95 0.85 0.00 0.52 0.00 0.00 34.95 34.48 5bca s ARG 443 CO 0.86 -1.44 2.04 0.00 0.02 0.00 0.00 175.30 176.78 5bca h ALA 444 N -0.95 1.73 0.00 2.13 0.00 -1.90 0.35 119.26 120.61 5bca h ALA 444 Ca -0.46 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 5bca h ALA 444 Cb 1.27 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 5bca h ALA 444 CO 0.62 0.23 -0.03 0.93 0.00 0.00 0.00 179.25 180.99 5bca h GLU 445 N 0.58 0.00 -0.43 0.00 3.07 -1.88 -2.19 114.58 113.73 5bca h GLU 445 Ca 0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 5bca h GLU 445 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 5bca h GLU 445 CO -0.04 0.03 0.00 1.28 -1.40 0.00 0.00 179.01 178.88 5bca n LEU 446 N -3.63 3.47 0.00 1.33 4.77 0.11 -4.57 117.00 118.48 5bca n LEU 446 Ca -0.03 -1.60 0.00 0.00 -0.03 0.00 0.00 56.01 54.35 5bca n LEU 446 Cb 0.13 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 5bca n LEU 446 CO 0.27 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.71 5bca n GLY 447 N 1.43 0.68 4.20 -0.72 0.00 -0.82 -2.54 105.19 107.42 5bca n GLY 447 Ca 0.19 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 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 0.62 0.04 0.00 1.61 7.64 -0.71 -0.97 113.62 121.84 5bca n SER 448 Ca 0.00 -1.17 0.00 0.00 1.01 0.00 0.00 58.87 58.71 5bca n SER 448 Cb 0.00 -2.17 0.00 0.00 -1.01 0.00 0.00 64.21 61.03 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 -4.47 0.00 -2.39 1.43 5.03 0.10 -4.92 117.44 112.21 5bca n TRP 449 Ca -0.26 0.00 -0.42 0.00 3.03 0.00 0.00 57.50 59.85 5bca n TRP 449 Cb 0.66 -0.62 -0.03 0.00 -1.03 0.00 0.00 31.31 30.30 5bca n TRP 449 CO 0.00 0.00 0.00 0.34 -0.03 0.00 0.00 177.69 178.00 5bca s ASP 450 N -2.29 7.06 -0.00 -0.99 2.15 -0.15 -4.88 116.67 117.57 5bca s ASP 450 Ca 0.00 2.07 0.13 0.00 0.43 0.00 0.00 52.55 55.17 5bca s ASP 450 Cb 0.00 -2.58 -0.15 0.00 -0.30 0.00 0.00 42.92 39.89 5bca s ASP 450 CO 0.00 -0.47 0.48 0.35 -0.17 0.00 0.00 175.17 175.35 5bca n THR 451 N 3.77 0.00 -0.07 1.71 -2.24 -1.26 -3.86 114.28 112.33 5bca n THR 451 Ca 0.09 -0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.55 5bca n THR 451 Cb 0.46 0.82 -0.07 0.00 -2.10 0.00 0.00 70.33 69.44 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 0.00 0.00 0.00 -0.78 3.11 -1.96 -3.44 116.57 113.50 5bca h LYS 452 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 5bca h LYS 452 Cb 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.59 5bca h LYS 452 CO 0.00 0.56 -0.19 0.00 -2.81 0.00 0.00 179.45 177.02 5bca n GLN 453 N -4.64 4.80 0.00 1.90 10.64 -1.26 -4.83 117.38 123.99 5bca n GLN 453 Ca -0.10 0.00 0.06 0.00 -1.83 0.00 0.00 57.00 55.13 5bca n GLN 453 Cb 0.33 -0.53 0.05 0.00 -0.86 0.00 0.00 30.24 29.22 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 -0.94 0.00 -1.30 2.61 4.01 -1.26 -3.82 117.16 116.47 5bca n TYR 454 Ca 0.00 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.41 5bca n TYR 454 Cb 0.00 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.14 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 -0.98 1.96 -0.05 -0.72 0.04 -1.25 0.58 135.00 134.57 5bca s PRO 455 Ca 0.13 1.68 -0.11 0.00 0.04 0.00 0.00 61.00 62.74 5bca s PRO 455 Cb 0.10 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.77 5bca s PRO 455 CO 0.15 -1.96 0.28 0.42 0.04 0.00 0.00 177.00 175.94 5bca s ILE 456 N -2.17 5.26 0.05 0.56 1.01 0.12 -3.85 121.20 122.18 5bca s ILE 456 Ca 0.72 0.52 -0.11 0.00 0.00 0.00 0.00 60.65 61.78 5bca s ILE 456 Cb -0.27 -3.56 -0.06 0.00 0.01 0.00 0.00 42.46 38.58 5bca s ILE 456 CO 0.48 0.58 0.38 -1.58 0.00 0.00 0.00 174.94 174.81 5bca s GLN 457 N -1.11 3.77 0.52 2.79 0.74 -0.52 0.10 119.66 125.97 5bca s GLN 457 Ca 0.20 0.20 0.06 0.00 0.05 0.00 0.00 55.36 55.88 5bca s GLN 457 Cb -0.14 -3.06 0.03 0.00 1.10 0.00 0.00 33.01 30.93 5bca s GLN 457 CO 0.09 0.61 0.42 -0.51 -0.55 0.00 0.00 175.29 175.35 5bca s LEU 458 N -1.66 2.84 0.01 3.68 1.43 0.93 -4.87 118.68 121.03 5bca s LEU 458 Ca 0.30 -1.15 -0.07 0.00 -1.03 0.00 0.00 54.13 52.18 5bca s LEU 458 Cb -0.14 -1.34 -0.00 0.00 0.03 0.00 0.00 46.19 44.73 5bca s LEU 458 CO 0.16 -1.04 0.13 -0.31 0.23 0.00 0.00 176.35 175.52 5bca s TYR 459 N -2.72 0.06 -0.19 0.29 2.02 -0.14 -4.63 117.35 112.04 5bca s TYR 459 Ca 0.38 -0.19 -0.24 0.00 -0.37 0.00 0.00 57.07 56.66 5bca s TYR 459 Cb -0.02 -0.06 -0.02 0.00 -0.40 0.00 0.00 41.96 41.46 5bca s TYR 459 CO 0.23 -0.30 0.77 -0.47 -1.57 0.00 0.00 175.55 174.22 5bca s TYR 460 N -1.56 3.38 -0.66 2.71 5.04 -1.26 -0.20 117.35 124.80 5bca s TYR 460 Ca -0.14 1.13 -0.17 0.00 -2.44 0.00 0.00 57.07 55.46 5bca s TYR 460 Cb -0.07 -2.96 0.14 0.00 0.35 0.00 0.00 41.96 39.41 5bca s TYR 460 CO 0.01 -0.26 0.72 0.34 -1.34 0.00 0.00 175.55 175.01 5bca s ASP 461 N 1.22 6.35 0.02 4.32 -1.08 0.69 -4.92 116.67 123.27 5bca s ASP 461 Ca 0.35 -1.83 -0.09 0.00 -0.52 0.00 0.00 52.55 50.45 5bca s ASP 461 Cb -0.16 -2.27 -0.04 0.00 -1.46 0.00 0.00 42.92 38.98 5bca s ASP 461 CO 0.11 -0.95 1.15 0.77 0.52 0.00 0.00 175.17 176.77 5bca h SER 462 N 8.80 -0.39 -0.54 -0.34 4.64 -1.93 4.02 113.55 127.80 5bca h SER 462 Ca -0.17 0.03 0.05 0.00 -0.47 0.00 0.00 61.79 61.24 5bca h SER 462 Cb 1.07 0.13 -0.07 0.00 -0.31 0.00 0.00 62.40 63.23 5bca h SER 462 CO 1.02 -0.16 -0.32 1.57 -0.87 0.00 0.00 176.83 178.06 5bca n HIS 463 N -3.16 -0.24 0.52 4.77 -0.00 -1.26 0.44 115.22 116.29 5bca n HIS 463 Ca -0.03 0.68 0.13 0.00 -0.00 0.00 0.00 57.72 58.50 5bca n HIS 463 Cb 0.12 -0.51 0.40 0.00 -0.00 0.00 0.00 29.99 29.99 5bca n HIS 463 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.34 177.11 5bca h SER 464 N 0.00 0.00 -5.72 0.26 0.02 -1.92 -3.47 113.55 102.72 5bca h SER 464 Ca 0.09 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.91 5bca h SER 464 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 5bca h SER 464 CO -0.51 0.00 -0.46 -3.20 -1.14 0.00 0.00 176.83 171.52 5bca n ASN 465 N -2.41 -7.06 -3.72 3.07 5.15 1.54 -5.01 115.26 106.82 5bca n ASN 465 Ca 0.05 -0.09 -0.02 0.00 -0.60 0.00 0.00 54.58 53.92 5bca n ASN 465 Cb 0.41 -4.29 -0.01 0.00 -0.53 0.00 0.00 39.78 35.36 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 -2.74 -0.14 -0.15 1.20 1.47 -0.86 -4.75 116.67 110.69 5bca s ASP 466 Ca 0.11 -0.36 -0.07 0.00 1.18 0.00 0.00 52.55 53.41 5bca s ASP 466 Cb -0.02 0.42 -0.04 0.00 -0.34 0.00 0.00 42.92 42.93 5bca s ASP 466 CO 0.80 -0.78 0.10 0.26 0.68 0.00 0.00 175.17 176.23 5bca s TRP 467 N -3.06 3.39 0.14 2.11 0.52 -1.00 -0.22 118.94 120.81 5bca s TRP 467 Ca 0.13 0.30 -0.13 0.00 0.02 0.00 0.00 56.10 56.43 5bca s TRP 467 Cb -0.00 -2.02 0.01 0.00 -1.15 0.00 0.00 33.47 30.32 5bca s TRP 467 CO 0.01 0.42 0.34 -0.98 0.02 0.00 0.00 176.95 176.76 5bca s ARG 468 N -0.25 1.08 -0.14 4.98 1.70 0.73 -1.81 118.95 125.23 5bca s ARG 468 Ca 0.09 -0.90 -0.17 0.00 -0.47 0.00 0.00 55.73 54.28 5bca s ARG 468 Cb -0.12 0.42 0.04 0.00 -0.57 0.00 0.00 34.95 34.73 5bca s ARG 468 CO 0.01 -0.41 0.46 0.20 -1.08 0.00 0.00 175.30 174.48 5bca s GLY 469 N -2.87 -0.33 -0.60 3.88 0.00 -0.66 -0.96 107.32 105.78 5bca s GLY 469 Ca 0.08 1.17 -0.27 0.00 0.00 0.00 0.00 44.72 45.69 5bca s GLY 469 CO -0.08 0.97 1.16 -1.31 0.00 0.00 0.00 173.10 173.84 5bca s ASN 470 N -0.08 6.37 -0.04 1.64 -0.87 -1.26 -1.55 114.94 119.16 5bca s ASN 470 Ca -0.03 -0.09 0.03 0.00 -1.57 0.00 0.00 52.86 51.20 5bca s ASN 470 Cb -0.03 -2.53 -0.03 0.00 -0.02 0.00 0.00 41.25 38.64 5bca s ASN 470 CO 0.02 -1.50 -0.12 -0.69 -2.57 0.00 0.00 177.10 172.24 5bca s VAL 471 N 4.90 3.29 -0.18 1.60 1.01 0.79 -4.88 120.40 126.93 5bca s VAL 471 Ca 0.39 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.50 5bca s VAL 471 Cb -0.09 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 5bca s VAL 471 CO 0.22 0.54 0.39 -0.69 0.00 0.00 0.00 175.10 175.56 5bca s VAL 472 N -0.81 5.22 0.27 2.92 1.01 -1.26 0.86 120.40 128.60 5bca s VAL 472 Ca 0.13 0.72 0.07 0.00 0.00 0.00 0.00 61.98 62.90 5bca s VAL 472 Cb -0.11 -3.73 -0.06 0.00 0.00 0.00 0.00 36.38 32.49 5bca s VAL 472 CO 0.02 0.29 -0.08 -0.76 0.00 0.00 0.00 175.10 174.58 5bca s LEU 473 N 1.03 2.51 -0.27 3.92 1.43 -0.80 -4.42 118.68 122.08 5bca s LEU 473 Ca 0.20 -1.16 -0.29 0.00 -1.03 0.00 0.00 54.13 51.85 5bca s LEU 473 Cb -0.14 -0.69 -0.01 0.00 0.03 0.00 0.00 46.19 45.39 5bca s LEU 473 CO 0.07 -0.29 1.34 -2.16 0.23 0.00 0.00 176.35 175.55 5bca s PRO 474 N -3.70 3.94 0.48 1.29 0.04 -1.26 -0.79 135.00 135.00 5bca s PRO 474 Ca 0.29 1.37 -0.24 0.00 0.04 0.00 0.00 61.00 62.46 5bca s PRO 474 Cb 0.03 -3.89 -0.07 0.00 0.04 0.00 0.00 34.50 30.61 5bca s PRO 474 CO 0.12 -1.09 1.35 0.00 0.04 0.00 0.00 177.00 177.42 5bca n ALA 475 N 7.60 1.62 -3.38 8.56 0.00 0.11 -3.19 120.51 131.82 5bca n ALA 475 Ca 0.15 0.20 -0.24 0.00 0.00 0.00 0.00 53.44 53.55 5bca n ALA 475 Cb 0.46 -2.34 0.05 0.00 0.00 0.00 0.00 19.45 17.62 5bca n ALA 475 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 5bca n GLU 476 N -0.45 -6.01 -4.32 0.00 1.02 0.17 -4.64 120.64 106.41 5bca n GLU 476 Ca 0.08 0.81 -0.20 0.00 -0.02 0.00 0.00 57.16 57.82 5bca n GLU 476 Cb 0.42 -5.74 -0.13 0.00 -0.02 0.00 0.00 31.44 25.98 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 -6.08 0.96 0.02 3.49 1.81 -1.19 -4.80 118.95 113.16 5bca s ARG 477 Ca 0.46 -0.88 -0.30 0.00 -1.72 0.00 0.00 55.73 53.30 5bca s ARG 477 Cb -0.21 -1.01 -0.04 0.00 -0.45 0.00 0.00 34.95 33.24 5bca s ARG 477 CO 0.57 0.24 0.96 -0.80 -0.68 0.00 0.00 175.30 175.60 5bca s ASN 478 N -1.40 7.38 0.10 0.23 0.01 -1.26 -0.32 114.94 119.67 5bca s ASN 478 Ca 0.02 1.66 0.09 0.00 -0.71 0.00 0.00 52.86 53.92 5bca s ASN 478 Cb -0.09 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 38.97 5bca s ASN 478 CO 0.02 -0.21 -0.22 0.27 -1.51 0.00 0.00 177.10 175.44 5bca s ILE 479 N 0.78 1.85 -0.08 0.60 -4.36 0.34 -4.94 121.20 115.38 5bca s ILE 479 Ca 0.50 -1.56 0.03 0.00 -0.26 0.00 0.00 60.65 59.36 5bca s ILE 479 Cb -0.21 -1.66 -0.02 0.00 1.25 0.00 0.00 42.46 41.82 5bca s ILE 479 CO 0.28 0.01 -0.17 -1.61 0.24 0.00 0.00 174.94 173.69 5bca s GLU 480 N -1.86 2.83 0.15 0.37 0.41 -1.26 -0.79 118.70 118.55 5bca s GLU 480 Ca 0.08 -0.75 -0.13 0.00 -0.41 0.00 0.00 54.97 53.77 5bca s GLU 480 Cb -0.10 -2.41 0.01 0.00 -1.78 0.00 0.00 34.13 29.85 5bca s GLU 480 CO 0.04 0.42 0.36 -0.59 -0.49 0.00 0.00 175.26 175.00 5bca s PHE 481 N -0.21 0.10 -0.09 1.61 -0.71 -0.57 -1.30 117.98 116.81 5bca s PHE 481 Ca -0.00 -0.46 -0.08 0.00 -1.04 0.00 0.00 56.93 55.35 5bca s PHE 481 Cb -0.13 0.13 0.03 0.00 -1.21 0.00 0.00 43.02 41.83 5bca s PHE 481 CO 0.03 -0.74 0.24 0.21 -1.34 0.00 0.00 175.22 173.62 5bca s LYS 482 N -3.89 0.28 0.68 1.99 2.20 -0.76 -0.30 119.74 119.94 5bca s LYS 482 Ca 0.10 0.36 -0.10 0.00 -0.36 0.00 0.00 55.97 55.97 5bca s LYS 482 Cb 0.02 0.11 0.02 0.00 -1.51 0.00 0.00 37.83 36.48 5bca s LYS 482 CO -0.05 -0.05 1.04 0.00 -0.36 0.00 0.00 175.35 175.94 5bca s ALA 483 N 0.24 3.01 0.02 3.13 0.00 -1.26 -2.11 121.76 124.78 5bca s ALA 483 Ca -0.01 -0.52 -0.28 0.00 0.00 0.00 0.00 51.96 51.16 5bca s ALA 483 Cb -0.03 -2.87 0.09 0.00 0.00 0.00 0.00 23.12 20.32 5bca s ALA 483 CO -0.01 -1.10 0.75 -0.59 0.00 0.00 0.00 175.76 174.81 5bca s PHE 484 N -3.26 -0.51 -0.08 0.00 -0.71 -0.37 -1.31 117.98 111.75 5bca s PHE 484 Ca 0.57 0.58 -0.04 0.00 -1.04 0.00 0.00 56.93 57.00 5bca s PHE 484 Cb -0.11 0.50 -0.04 0.00 -1.21 0.00 0.00 43.02 42.16 5bca s PHE 484 CO 0.49 -0.64 0.09 0.42 -1.34 0.00 0.00 175.22 174.24 5bca s ILE 485 N -2.49 4.98 -0.18 -4.49 1.01 0.10 -1.31 121.20 118.82 5bca s ILE 485 Ca -0.02 -0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.56 5bca s ILE 485 Cb -0.01 -3.18 0.01 0.00 0.01 0.00 0.00 42.46 39.30 5bca s ILE 485 CO -0.03 0.54 -0.18 -0.75 0.00 0.00 0.00 174.94 174.52 5bca s LYS 486 N -1.18 3.05 0.69 2.79 2.20 0.61 -0.96 119.74 126.94 5bca s LYS 486 Ca 0.17 -0.81 -0.14 0.00 -0.36 0.00 0.00 55.97 54.83 5bca s LYS 486 Cb -0.12 -2.60 0.02 0.00 -1.51 0.00 0.00 37.83 33.62 5bca s LYS 486 CO 0.06 -0.17 1.13 -1.54 -0.36 0.00 0.00 175.35 174.48 5bca s SER 487 N 1.22 4.75 0.47 1.43 1.04 -0.14 0.30 113.70 122.76 5bca s SER 487 Ca 0.03 2.09 0.40 0.00 0.48 0.00 0.00 55.95 58.94 5bca s SER 487 Cb -0.14 -2.56 1.49 0.00 0.10 0.00 0.00 66.02 64.92 5bca s SER 487 CO -0.10 -1.87 1.41 1.17 0.98 0.00 0.00 173.24 174.83 5bca n LYS 488 N -2.63 -0.01 -0.00 4.02 0.00 -0.73 -0.07 118.16 118.73 5bca n LYS 488 Ca 0.11 1.04 0.13 0.00 0.00 0.00 0.00 58.31 59.59 5bca n LYS 488 Cb 0.52 -2.26 0.74 0.00 0.00 0.00 0.00 35.03 34.03 5bca n LYS 488 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 5bca n ASP 489 N -4.02 0.13 0.00 3.14 5.68 -1.26 -4.94 116.55 115.27 5bca n ASP 489 Ca 0.39 -1.22 0.00 0.00 -0.50 0.00 0.00 54.79 53.46 5bca n ASP 489 Cb 1.68 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 41.66 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 0.93 0.57 3.87 6.12 0.00 0.90 -5.06 105.19 112.51 5bca n GLY 490 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.26 5.28 -0.05 2.61 -4.23 -1.26 -4.86 115.64 110.87 5bca s THR 491 Ca 0.00 0.41 -0.30 0.00 -1.18 0.00 0.00 61.69 60.62 5bca s THR 491 Cb 0.00 -3.56 -0.05 0.00 1.34 0.00 0.00 72.50 70.24 5bca s THR 491 CO 0.00 0.52 1.50 -0.69 -0.54 0.00 0.00 174.62 175.41 5bca s VAL 492 N -1.14 3.73 -0.11 2.29 1.01 -1.26 -0.97 120.40 123.95 5bca s VAL 492 Ca 0.22 0.98 0.12 0.00 0.00 0.00 0.00 61.98 63.30 5bca s VAL 492 Cb -0.14 -3.63 -0.24 0.00 0.00 0.00 0.00 36.38 32.37 5bca s VAL 492 CO 0.11 -0.06 0.41 1.17 0.00 0.00 0.00 175.10 176.73 5bca n LYS 493 N 6.39 0.66 0.00 2.72 4.81 -0.14 -4.91 118.16 127.69 5bca n LYS 493 Ca 0.15 0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 5bca n LYS 493 Cb 0.43 -1.69 0.00 0.00 0.02 0.00 0.00 35.03 33.79 5bca n LYS 493 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 5bca n SER 494 N -3.01 0.00 -4.64 3.14 3.41 -1.24 -4.99 113.62 106.29 5bca n SER 494 Ca -0.25 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.13 5bca n SER 494 Cb 1.08 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.96 5bca n SER 494 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 5bca s TRP 495 N -2.00 2.65 0.47 7.33 0.52 -1.26 -0.72 118.94 125.93 5bca s TRP 495 Ca 0.00 -0.26 -0.23 0.00 0.02 0.00 0.00 56.10 55.63 5bca s TRP 495 Cb 0.00 -1.24 -0.07 0.00 -1.15 0.00 0.00 33.47 31.01 5bca s TRP 495 CO 0.00 0.59 1.20 -1.14 0.02 0.00 0.00 176.95 177.62 5bca s GLN 496 N -3.68 3.65 0.07 4.98 0.74 -0.42 -4.95 119.66 120.04 5bca s GLN 496 Ca 0.32 1.86 -0.36 0.00 0.05 0.00 0.00 55.36 57.23 5bca s GLN 496 Cb -0.05 -2.39 -0.20 0.00 1.10 0.00 0.00 33.01 31.47 5bca s GLN 496 CO 0.20 -0.67 1.59 1.15 -0.55 0.00 0.00 175.29 177.01 5bca h THR 497 N 1.80 0.10 -3.20 -0.34 2.02 -1.33 -3.44 112.91 108.52 5bca h THR 497 Ca -0.50 0.00 -0.66 0.00 0.77 0.00 0.00 66.41 66.02 5bca h THR 497 Cb 1.26 0.10 -0.12 0.00 -1.74 0.00 0.00 68.15 67.64 5bca h THR 497 CO 0.60 0.00 -0.60 -0.63 0.37 0.00 0.00 175.52 175.26 5bca s ILE 498 N -6.00 4.52 0.17 3.11 1.01 -1.26 -5.07 121.20 117.67 5bca s ILE 498 Ca -0.19 -0.39 -0.32 0.00 0.00 0.00 0.00 60.65 59.75 5bca s ILE 498 Cb 0.03 -3.01 -0.10 0.00 0.01 0.00 0.00 42.46 39.38 5bca s ILE 498 CO 0.61 0.43 1.62 -1.58 0.00 0.00 0.00 174.94 176.02 5bca s GLN 499 N -1.46 4.19 0.43 2.79 0.74 -1.26 -4.94 119.66 120.16 5bca s GLN 499 Ca 0.19 2.42 -0.01 0.00 0.05 0.00 0.00 55.36 58.02 5bca s GLN 499 Cb -0.12 -3.19 -0.02 0.00 1.10 0.00 0.00 33.01 30.78 5bca s GLN 499 CO 0.10 -0.66 0.67 -0.65 -0.55 0.00 0.00 175.29 174.20 5bca s GLN 500 N 1.34 3.30 0.12 1.67 -1.52 0.59 -4.92 119.66 120.24 5bca s GLN 500 Ca 0.72 -0.25 -0.09 0.00 -1.95 0.00 0.00 55.36 53.79 5bca s GLN 500 Cb -0.45 -2.53 -0.00 0.00 -0.22 0.00 0.00 33.01 29.80 5bca s GLN 500 CO 0.32 -0.14 0.23 -1.54 -0.25 0.00 0.00 175.29 173.90 5bca s SER 501 N -4.14 0.09 -0.26 5.90 1.04 -1.26 -1.51 113.70 113.56 5bca s SER 501 Ca 0.46 -0.73 -0.03 0.00 0.48 0.00 0.00 55.95 56.13 5bca s SER 501 Cb -0.10 0.38 0.11 0.00 0.10 0.00 0.00 66.02 66.50 5bca s SER 501 CO 0.39 -0.79 0.19 0.86 0.98 0.00 0.00 173.24 174.88 5bca s TRP 502 N -3.90 -0.05 -0.39 5.02 -0.11 0.03 -4.97 118.94 114.57 5bca s TRP 502 Ca 0.09 -0.39 0.02 0.00 1.22 0.00 0.00 56.10 57.04 5bca s TRP 502 Cb 0.04 -0.64 0.12 0.00 -1.50 0.00 0.00 33.47 31.49 5bca s TRP 502 CO -0.07 -0.78 0.16 -0.80 -4.62 0.00 0.00 176.95 170.84 5bca s ASN 503 N 2.23 4.06 0.46 5.86 0.02 -1.26 -0.51 114.94 125.80 5bca s ASN 503 Ca 0.08 -2.26 0.07 0.00 -1.02 0.00 0.00 52.86 49.73 5bca s ASN 503 Cb -0.15 -1.16 0.08 0.00 0.02 0.00 0.00 41.25 40.04 5bca s ASN 503 CO -0.28 -0.33 0.63 -0.81 0.02 0.00 0.00 177.10 176.33 5bca n PRO 504 N 4.06 0.63 -2.07 -0.60 -0.04 -1.26 -5.03 135.00 130.69 5bca n PRO 504 Ca 0.04 -2.35 -0.41 0.00 -0.04 0.00 0.00 63.50 60.74 5bca n PRO 504 Cb 0.38 -0.22 -0.02 0.00 -0.04 0.00 0.00 33.50 33.60 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 -1.80 2.67 0.40 0.52 1.01 0.56 -4.83 120.40 118.94 5bca s VAL 505 Ca 0.47 0.65 -0.23 0.00 0.00 0.00 0.00 61.98 62.87 5bca s VAL 505 Cb -0.04 -3.41 -0.10 0.00 0.00 0.00 0.00 36.38 32.83 5bca s VAL 505 CO 0.30 0.14 0.97 -2.16 0.00 0.00 0.00 175.10 174.35 5bca s PRO 506 N -1.45 4.27 0.49 2.72 0.05 -1.26 0.43 135.00 140.24 5bca s PRO 506 Ca 0.52 1.24 0.14 0.00 0.05 0.00 0.00 61.00 62.95 5bca s PRO 506 Cb -0.41 -2.37 1.15 0.00 0.05 0.00 0.00 34.50 32.92 5bca s PRO 506 CO 0.51 -0.01 2.11 1.25 0.05 0.00 0.00 177.00 180.91 5bca h LEU 507 N 2.26 0.09 -9.49 -3.56 5.85 -1.94 -3.43 115.31 105.10 5bca h LEU 507 Ca -0.48 -0.00 -0.67 0.00 0.84 0.00 0.00 57.88 57.56 5bca h LEU 507 Cb 1.19 -0.02 -0.11 0.00 0.37 0.00 0.00 40.66 42.09 5bca h LEU 507 CO 0.62 0.09 -0.56 -0.75 -0.34 0.00 0.00 178.44 177.50 5bca s LYS 508 N -5.08 3.17 0.25 1.25 2.47 -1.26 -4.98 119.74 115.56 5bca s LYS 508 Ca -0.05 -0.33 -0.31 0.00 -1.56 0.00 0.00 55.97 53.71 5bca s LYS 508 Cb 0.17 -2.95 -0.13 0.00 -1.46 0.00 0.00 37.83 33.46 5bca s LYS 508 CO 0.69 0.71 1.46 2.41 0.16 0.00 0.00 175.35 180.78 5bca n THR 509 N 1.82 0.96 -3.08 3.43 -1.04 -1.26 -4.97 114.28 110.13 5bca n THR 509 Ca -0.17 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 61.60 5bca n THR 509 Cb 0.54 -1.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.44 5bca n THR 509 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 5bca n THR 510 N 1.99 0.00 -4.32 12.58 5.66 -1.26 -5.05 114.28 123.88 5bca n THR 510 Ca 0.11 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.86 5bca n THR 510 Cb 0.33 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 68.98 5bca n THR 510 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 5bca s SER 511 N -0.46 2.76 -0.22 1.09 1.04 -1.26 -1.60 113.70 115.04 5bca s SER 511 Ca 0.00 -0.73 0.01 0.00 0.48 0.00 0.00 55.95 55.71 5bca s SER 511 Cb 0.00 -0.16 0.04 0.00 0.10 0.00 0.00 66.02 66.00 5bca s SER 511 CO 0.00 0.07 -0.14 -2.28 0.98 0.00 0.00 173.24 171.87 5bca s HIS 512 N -1.28 3.04 -0.06 5.02 2.46 0.20 -4.95 115.29 119.72 5bca s HIS 512 Ca 0.10 -1.93 0.00 0.00 0.47 0.00 0.00 55.06 53.70 5bca s HIS 512 Cb -0.09 -1.94 -0.03 0.00 -0.13 0.00 0.00 32.58 30.38 5bca s HIS 512 CO 0.05 -0.83 -0.03 0.99 -2.47 0.00 0.00 174.74 172.45 5bca s THR 513 N 1.21 4.02 0.21 0.89 2.01 -1.26 -0.59 115.64 122.12 5bca s THR 513 Ca -0.02 -0.44 -0.18 0.00 0.31 0.00 0.00 61.69 61.37 5bca s THR 513 Cb -0.17 -2.70 0.03 0.00 0.01 0.00 0.00 72.50 69.67 5bca s THR 513 CO -0.08 0.54 0.54 -0.94 -0.69 0.00 0.00 174.62 173.99 5bca s SER 514 N -1.03 -0.26 -0.02 3.53 1.04 -0.23 -4.98 113.70 111.76 5bca s SER 514 Ca 0.14 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 56.08 5bca s SER 514 Cb -0.11 0.60 -0.04 0.00 0.10 0.00 0.00 66.02 66.57 5bca s SER 514 CO 0.04 -1.09 0.02 -0.44 0.98 0.00 0.00 173.24 172.75 5bca s SER 515 N -2.88 5.29 0.00 7.02 0.01 -1.26 -0.47 113.70 121.40 5bca s SER 515 Ca 0.10 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.42 5bca s SER 515 Cb -0.01 -1.44 0.00 0.00 0.21 0.00 0.00 66.02 64.78 5bca s SER 515 CO -0.02 0.30 0.11 1.87 0.41 0.00 0.00 173.24 175.91