#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bdu h LYS 2 N 0.00 -0.11 -0.90 0.03 3.64 -1.98 0.28 116.57 117.52 1bdu h LYS 2 Ca 0.00 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1bdu h LYS 2 Cb 0.00 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 1bdu h LYS 2 CO 0.00 -0.08 0.53 1.96 -2.27 0.00 0.00 179.45 179.60 1bdu h GLN 3 N -0.12 1.22 -0.13 1.90 7.50 -1.99 -1.03 115.11 122.47 1bdu h GLN 3 Ca 0.25 -0.11 -0.05 0.00 0.50 0.00 0.00 58.65 59.23 1bdu h GLN 3 Cb 0.52 -0.25 -0.00 0.00 0.05 0.00 0.00 27.48 27.79 1bdu h GLN 3 CO -0.64 0.86 -0.12 -0.92 -1.50 0.00 0.00 178.83 176.51 1bdu h TYR 4 N 1.24 0.37 -0.60 2.96 3.20 -1.78 -1.36 116.97 121.01 1bdu h TYR 4 Ca 0.32 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 1bdu h TYR 4 Cb -0.04 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.12 1bdu h TYR 4 CO 0.01 0.71 0.24 -0.07 -1.64 0.00 0.00 178.16 177.40 1bdu h LEU 5 N -0.07 0.80 -0.81 2.82 3.38 -0.75 -0.38 115.31 120.29 1bdu h LEU 5 Ca 0.02 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1bdu h LEU 5 Cb 0.64 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1bdu h LEU 5 CO 0.03 0.72 0.14 -0.33 0.09 0.00 0.00 178.44 179.09 1bdu h GLU 6 N 0.86 1.03 -0.41 1.13 5.08 -1.14 -0.72 114.58 120.41 1bdu h GLU 6 Ca 0.20 -0.25 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 1bdu h GLU 6 Cb 0.17 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1bdu h GLU 6 CO -0.02 0.93 -0.05 1.25 -1.00 0.00 0.00 179.01 180.12 1bdu h LEU 7 N 0.98 0.75 -0.55 1.33 5.85 -0.82 -0.73 115.31 122.11 1bdu h LEU 7 Ca 0.20 -0.34 0.05 0.00 0.84 0.00 0.00 57.88 58.64 1bdu h LEU 7 Cb 0.37 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 1bdu h LEU 7 CO 0.00 0.91 0.28 0.24 -0.34 0.00 0.00 178.44 179.53 1bdu h MET 8 N 0.57 0.52 -0.73 1.25 2.86 -0.82 -1.12 114.93 117.47 1bdu h MET 8 Ca 0.11 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.74 1bdu h MET 8 Cb 0.55 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 32.06 1bdu h MET 8 CO 0.03 0.34 0.47 1.96 1.06 0.00 0.00 176.91 180.77 1bdu h GLN 9 N 0.53 0.91 -0.73 1.72 1.08 -1.09 -1.87 115.11 115.66 1bdu h GLN 9 Ca 0.25 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1bdu h GLN 9 Cb 0.16 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.35 1bdu h GLN 9 CO -0.17 0.60 0.38 -0.22 -0.95 0.00 0.00 178.83 178.47 1bdu h LYS 10 N 0.94 1.04 -0.50 1.46 3.64 -0.18 -0.41 116.57 122.55 1bdu h LYS 10 Ca 0.28 -0.14 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 1bdu h LYS 10 Cb -0.04 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.56 1bdu h LYS 10 CO -0.09 0.79 -0.02 0.28 -2.27 0.00 0.00 179.45 178.15 1bdu h VAL 11 N 1.02 1.26 0.33 2.00 2.07 -1.02 0.19 116.25 122.10 1bdu h VAL 11 Ca 0.25 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 1bdu h VAL 11 Cb 0.07 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1bdu h VAL 11 CO -0.04 0.39 -0.16 -0.07 0.02 0.00 0.00 177.57 177.71 1bdu h LEU 12 N 0.76 -0.37 -0.63 2.57 3.38 -1.07 0.69 115.31 120.64 1bdu h LEU 12 Ca 0.14 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.95 1bdu h LEU 12 Cb 0.54 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1bdu h LEU 12 CO 0.03 -0.24 -0.60 0.44 0.09 0.00 0.00 178.44 178.15 1bdu h ASP 13 N -0.47 0.32 0.00 -0.43 3.32 -1.07 -3.39 116.42 114.69 1bdu h ASP 13 Ca -0.05 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1bdu h ASP 13 Cb 0.36 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1bdu h ASP 13 CO 0.07 0.85 -1.33 -0.62 -1.72 0.00 0.00 179.24 176.49 1bdu n GLU 14 N -3.88 0.73 -1.78 3.56 1.02 0.68 -5.05 120.64 115.92 1bdu n GLU 14 Ca -0.03 -0.08 -0.41 0.00 -0.02 0.00 0.00 57.16 56.63 1bdu n GLU 14 Cb 0.62 -1.20 -0.00 0.00 -0.02 0.00 0.00 31.44 30.84 1bdu n GLU 14 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bdu n GLY 15 N 1.86 1.21 3.87 0.62 0.00 0.23 -4.88 105.19 108.11 1bdu n GLY 15 Ca -0.01 0.31 -0.32 0.00 0.00 0.00 0.00 46.02 46.00 1bdu n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bdu s THR 16 N -1.09 4.94 -0.30 2.61 2.01 -0.20 -4.52 115.64 119.09 1bdu s THR 16 Ca 0.53 0.50 -0.29 0.00 0.31 0.00 0.00 61.69 62.75 1bdu s THR 16 Cb -0.47 -3.63 -0.02 0.00 0.01 0.00 0.00 72.50 68.38 1bdu s THR 16 CO 0.63 -0.01 1.77 -1.10 -0.69 0.00 0.00 174.62 175.23 1bdu s GLN 17 N -2.65 3.43 -0.00 4.92 -0.21 -1.26 -0.58 119.66 123.30 1bdu s GLN 17 Ca 0.45 1.50 0.05 0.00 0.02 0.00 0.00 55.36 57.37 1bdu s GLN 17 Cb -0.12 -4.17 -0.01 0.00 1.00 0.00 0.00 33.01 29.71 1bdu s GLN 17 CO 0.21 -1.74 -0.14 0.21 -2.12 0.00 0.00 175.29 171.70 1bdu s LYS 18 N 5.47 1.12 0.14 2.91 2.20 -0.18 -4.97 119.74 126.44 1bdu s LYS 18 Ca 0.79 -0.55 -0.03 0.00 -0.36 0.00 0.00 55.97 55.81 1bdu s LYS 18 Cb -0.23 -1.10 -0.05 0.00 -1.51 0.00 0.00 37.83 34.94 1bdu s LYS 18 CO 0.33 0.30 0.36 -0.80 -0.36 0.00 0.00 175.35 175.18 1bdu s ASN 19 N -0.47 6.45 0.54 1.43 -0.87 -1.26 0.27 114.94 121.03 1bdu s ASN 19 Ca 0.05 0.50 -0.01 0.00 -1.57 0.00 0.00 52.86 51.83 1bdu s ASN 19 Cb -0.06 -2.05 0.02 0.00 -0.02 0.00 0.00 41.25 39.13 1bdu s ASN 19 CO -0.00 0.05 0.79 -0.62 -2.57 0.00 0.00 177.10 174.74 1bdu s ASP 20 N -2.61 5.50 -0.93 -1.22 -1.08 -0.29 -4.90 116.67 111.15 1bdu s ASP 20 Ca 0.40 0.30 -0.23 0.00 -0.52 0.00 0.00 52.55 52.50 1bdu s ASP 20 Cb -0.12 -1.32 -0.23 0.00 -1.46 0.00 0.00 42.92 39.78 1bdu s ASP 20 CO 0.26 -1.01 2.48 0.54 0.52 0.00 0.00 175.17 177.96 1bdu n ARG 21 N -2.36 0.16 -2.51 4.34 1.74 -1.26 -1.90 116.66 114.87 1bdu n ARG 21 Ca 0.05 -0.06 -0.10 0.00 -0.77 0.00 0.00 57.85 56.97 1bdu n ARG 21 Cb 0.59 -1.72 -0.00 0.00 -1.02 0.00 0.00 32.46 30.30 1bdu n ARG 21 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1bdu n THR 22 N 7.04 -0.46 0.00 0.55 -1.04 -1.26 -4.75 114.28 114.36 1bdu n THR 22 Ca 0.62 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.63 1bdu n THR 22 Cb 0.15 -1.32 0.00 0.00 -1.82 0.00 0.00 70.33 67.34 1bdu n THR 22 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bdu n GLY 23 N -0.75 3.82 3.76 3.41 0.00 -0.80 -5.14 105.19 109.50 1bdu n GLY 23 Ca -0.10 -0.34 -0.38 0.00 0.00 0.00 0.00 46.02 45.19 1bdu n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bdu s THR 24 N 2.76 2.64 0.43 2.61 2.01 -1.26 -4.59 115.64 120.24 1bdu s THR 24 Ca 0.00 0.50 -0.21 0.00 0.31 0.00 0.00 61.69 62.29 1bdu s THR 24 Cb 0.00 -3.26 -0.10 0.00 0.01 0.00 0.00 72.50 69.14 1bdu s THR 24 CO 0.00 0.01 0.97 -0.83 -0.69 0.00 0.00 174.62 174.09 1bdu s GLY 25 N -1.08 2.47 0.06 4.40 0.00 -1.26 -1.13 107.32 110.78 1bdu s GLY 25 Ca 0.65 0.47 0.03 0.00 0.00 0.00 0.00 44.72 45.87 1bdu s GLY 25 CO 0.42 0.78 -0.09 -0.51 0.00 0.00 0.00 173.10 173.70 1bdu s THR 26 N -2.06 0.73 -0.24 0.90 -4.23 0.14 -1.27 115.64 109.61 1bdu s THR 26 Ca 0.62 -1.29 -0.19 0.00 -1.18 0.00 0.00 61.69 59.64 1bdu s THR 26 Cb -0.12 -0.92 -0.02 0.00 1.34 0.00 0.00 72.50 72.78 1bdu s THR 26 CO 0.16 -0.42 0.58 -0.76 -0.54 0.00 0.00 174.62 173.63 1bdu s LEU 27 N -1.88 4.08 -0.05 4.79 1.43 0.28 -1.01 118.68 126.32 1bdu s LEU 27 Ca -0.04 0.66 0.04 0.00 -1.03 0.00 0.00 54.13 53.76 1bdu s LEU 27 Cb -0.07 -2.78 0.00 0.00 0.03 0.00 0.00 46.19 43.37 1bdu s LEU 27 CO 0.00 -0.30 -0.16 -0.55 0.23 0.00 0.00 176.35 175.57 1bdu s SER 28 N 1.40 2.09 0.17 2.29 0.15 0.25 -1.13 113.70 118.93 1bdu s SER 28 Ca 0.25 -0.35 0.11 0.00 0.70 0.00 0.00 55.95 56.65 1bdu s SER 28 Cb -0.16 -0.70 -0.04 0.00 -1.71 0.00 0.00 66.02 63.41 1bdu s SER 28 CO 0.09 0.12 -0.23 0.27 1.20 0.00 0.00 173.24 174.69 1bdu s ILE 29 N 0.21 2.19 -0.15 6.45 -4.36 -0.18 -1.03 121.20 124.34 1bdu s ILE 29 Ca -0.07 -1.95 0.01 0.00 -0.26 0.00 0.00 60.65 58.38 1bdu s ILE 29 Cb -0.13 -2.02 -0.00 0.00 1.25 0.00 0.00 42.46 41.56 1bdu s ILE 29 CO 0.03 -0.13 -0.16 0.12 0.24 0.00 0.00 174.94 175.04 1bdu s PHE 30 N -1.64 2.76 0.00 1.37 5.36 -1.26 -0.67 117.98 123.89 1bdu s PHE 30 Ca 0.18 -1.01 0.00 0.00 -0.96 0.00 0.00 56.93 55.14 1bdu s PHE 30 Cb -0.08 -1.86 0.00 0.00 -0.34 0.00 0.00 43.02 40.74 1bdu s PHE 30 CO 0.08 -0.44 0.00 0.41 -1.46 0.00 0.00 175.22 173.81 1bdu n GLY 31 N 3.95 -1.56 3.22 13.12 0.00 -0.95 -5.01 105.19 117.96 1bdu n GLY 31 Ca -0.19 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 1bdu n GLY 31 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1bdu s HIS 32 N 0.00 -0.27 -0.03 1.61 5.04 -0.80 -4.97 115.29 115.87 1bdu s HIS 32 Ca 0.00 0.58 0.02 0.00 -1.54 0.00 0.00 55.06 54.11 1bdu s HIS 32 Cb 0.00 0.11 0.01 0.00 0.04 0.00 0.00 32.58 32.74 1bdu s HIS 32 CO 0.00 -0.27 -0.06 -1.14 -2.34 0.00 0.00 174.74 170.93 1bdu s GLN 33 N -0.53 0.79 0.08 2.88 0.74 -1.26 -1.08 119.66 121.28 1bdu s GLN 33 Ca -0.06 -0.18 0.06 0.00 0.05 0.00 0.00 55.36 55.23 1bdu s GLN 33 Cb -0.04 -0.77 -0.03 0.00 1.10 0.00 0.00 33.01 33.27 1bdu s GLN 33 CO 0.02 0.02 -0.17 -1.64 -0.55 0.00 0.00 175.29 172.96 1bdu s MET 34 N 0.49 0.99 -0.08 1.67 -1.94 0.02 -4.97 119.30 115.48 1bdu s MET 34 Ca -0.07 -1.01 0.05 0.00 -1.71 0.00 0.00 55.69 52.95 1bdu s MET 34 Cb -0.10 -1.10 -0.00 0.00 2.01 0.00 0.00 34.83 35.63 1bdu s MET 34 CO 0.00 0.26 -0.24 0.50 -0.01 0.00 0.00 175.02 175.53 1bdu s ARG 35 N -1.70 2.75 -0.22 2.03 3.52 -1.26 -0.82 118.95 123.24 1bdu s ARG 35 Ca 0.02 -0.87 0.00 0.00 -0.13 0.00 0.00 55.73 54.75 1bdu s ARG 35 Cb -0.10 -2.19 0.03 0.00 -1.56 0.00 0.00 34.95 31.13 1bdu s ARG 35 CO 0.03 0.27 -0.13 -0.06 -0.81 0.00 0.00 175.30 174.60 1bdu s PHE 36 N 0.11 2.97 -0.44 5.12 0.08 0.15 -4.97 117.98 120.99 1bdu s PHE 36 Ca -0.11 -1.68 -0.27 0.00 0.12 0.00 0.00 56.93 54.99 1bdu s PHE 36 Cb -0.16 -1.98 0.03 0.00 -0.57 0.00 0.00 43.02 40.34 1bdu s PHE 36 CO 0.06 -0.78 1.00 1.21 -0.10 0.00 0.00 175.22 176.62 1bdu s ASN 37 N 1.28 6.60 0.15 1.36 3.84 -1.26 -0.76 114.94 126.15 1bdu s ASN 37 Ca 0.01 0.36 0.19 0.00 0.21 0.00 0.00 52.86 53.64 1bdu s ASN 37 Cb -0.15 -2.49 0.82 0.00 -0.55 0.00 0.00 41.25 38.87 1bdu s ASN 37 CO -0.08 -1.07 1.59 0.18 -2.79 0.00 0.00 177.10 174.93 1bdu n LEU 38 N 7.29 0.38 0.19 3.21 4.77 -0.02 -1.28 117.00 131.54 1bdu n LEU 38 Ca 0.08 0.60 0.04 0.00 -0.03 0.00 0.00 56.01 56.71 1bdu n LEU 38 Cb 0.48 -0.55 0.35 0.00 -2.33 0.00 0.00 43.42 41.37 1bdu n LEU 38 CO 0.65 -0.46 0.69 -0.61 -1.33 0.00 0.00 177.39 176.33 1bdu h GLN 39 N 0.00 0.00 0.00 3.23 5.75 -1.79 -3.18 115.11 119.12 1bdu h GLN 39 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1bdu h GLN 39 Cb 0.29 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.84 1bdu h GLN 39 CO 0.00 0.39 0.00 -0.25 -2.65 0.00 0.00 178.83 176.32 1bdu n ASP 40 N -3.71 0.00 0.00 -0.69 8.00 -0.41 -4.99 116.55 114.75 1bdu n ASP 40 Ca -0.01 -0.75 0.00 0.00 0.71 0.00 0.00 54.79 54.74 1bdu n ASP 40 Cb 0.48 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 1bdu n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bdu n GLY 41 N 0.84 3.56 3.66 0.44 0.00 -1.20 -4.77 105.19 107.73 1bdu n GLY 41 Ca 0.20 -1.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 1bdu n GLY 41 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1bdu s PHE 42 N -2.24 2.99 -0.87 1.61 5.36 0.84 -4.56 117.98 121.11 1bdu s PHE 42 Ca 0.00 1.12 -0.19 0.00 -0.96 0.00 0.00 56.93 56.91 1bdu s PHE 42 Cb 0.00 -3.45 -0.12 0.00 -0.34 0.00 0.00 43.02 39.11 1bdu s PHE 42 CO 0.00 -1.42 1.99 -0.35 -1.46 0.00 0.00 175.22 173.99 1bdu n PRO 43 N 6.35 1.74 -3.83 10.12 -0.04 -1.26 -3.96 135.00 144.12 1bdu n PRO 43 Ca 0.13 -1.86 -0.36 0.00 -0.04 0.00 0.00 63.50 61.37 1bdu n PRO 43 Cb 0.45 -2.88 -0.13 0.00 -0.04 0.00 0.00 33.50 30.90 1bdu n PRO 43 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1bdu s LEU 44 N 1.10 3.27 0.05 1.53 2.96 -1.26 -4.17 118.68 122.16 1bdu s LEU 44 Ca 0.54 -0.41 -0.36 0.00 -0.22 0.00 0.00 54.13 53.68 1bdu s LEU 44 Cb 0.14 -1.82 -0.15 0.00 0.50 0.00 0.00 46.19 44.86 1bdu s LEU 44 CO 0.07 -0.06 1.55 0.55 -1.32 0.00 0.00 176.35 177.14 1bdu n VAL 45 N 4.85 0.11 0.22 1.68 3.14 -1.26 -4.79 118.33 122.28 1bdu n VAL 45 Ca -0.17 -0.02 0.11 0.00 -2.96 0.00 0.00 64.34 61.30 1bdu n VAL 45 Cb 0.50 -1.28 -0.16 0.00 -1.06 0.00 0.00 33.84 31.84 1bdu n VAL 45 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1bdu n THR 46 N 3.45 0.00 1.11 1.55 -2.24 -1.26 -4.41 114.28 112.48 1bdu n THR 46 Ca 0.19 -0.38 0.09 0.00 -2.27 0.00 0.00 64.05 61.68 1bdu n THR 46 Cb 0.23 0.24 0.53 0.00 -2.10 0.00 0.00 70.33 69.24 1bdu n THR 46 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1bdu n THR 47 N -2.08 0.06 -3.64 4.28 -2.24 -1.26 -0.67 114.28 108.74 1bdu n THR 47 Ca -0.02 0.02 -0.14 0.00 -2.27 0.00 0.00 64.05 61.63 1bdu n THR 47 Cb 0.51 -0.73 -0.07 0.00 -2.10 0.00 0.00 70.33 67.94 1bdu n THR 47 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1bdu s LYS 48 N -2.08 0.80 -0.01 -0.78 -2.85 -1.26 -4.59 119.74 108.97 1bdu s LYS 48 Ca 0.26 0.85 -0.30 0.00 -1.00 0.00 0.00 55.97 55.78 1bdu s LYS 48 Cb 0.13 0.39 -0.06 0.00 -2.06 0.00 0.00 37.83 36.22 1bdu s LYS 48 CO 0.22 -0.11 1.52 0.50 0.10 0.00 0.00 175.35 177.58 1bdu s ARG 49 N 0.20 4.23 -0.12 1.78 3.52 -0.88 -4.75 118.95 122.93 1bdu s ARG 49 Ca -0.01 2.10 0.01 0.00 -0.13 0.00 0.00 55.73 57.69 1bdu s ARG 49 Cb -0.04 -3.70 -0.01 0.00 -1.56 0.00 0.00 34.95 29.63 1bdu s ARG 49 CO 0.02 -0.70 -0.15 0.00 -0.81 0.00 0.00 175.30 173.66 1bdu s HIS 51 N 0.23 2.97 0.16 0.00 3.76 -1.26 -4.94 115.29 116.22 1bdu s HIS 51 Ca -0.10 -0.17 0.28 0.00 -0.15 0.00 0.00 55.06 54.93 1bdu s HIS 51 Cb -0.16 -3.66 1.16 0.00 1.11 0.00 0.00 32.58 31.04 1bdu s HIS 51 CO 0.06 -1.07 1.92 1.25 -0.85 0.00 0.00 174.74 176.04 1bdu h LEU 52 N 10.12 0.00 -1.27 0.89 5.85 -2.01 -3.37 115.31 125.51 1bdu h LEU 52 Ca -0.26 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.47 1bdu h LEU 52 Cb 1.09 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 1bdu h LEU 52 CO 0.98 0.13 0.50 0.08 -0.34 0.00 0.00 178.44 179.79 1bdu h ARG 53 N 0.00 0.96 -0.21 1.25 0.11 -2.01 -0.00 114.38 114.48 1bdu h ARG 53 Ca -0.00 -0.06 -0.09 0.00 0.10 0.00 0.00 59.98 59.93 1bdu h ARG 53 Cb 0.61 -0.22 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 1bdu h ARG 53 CO 0.02 0.64 -0.27 0.77 0.10 0.00 0.00 179.97 181.22 1bdu h SER 54 N 0.99 0.41 -0.12 0.08 0.02 -1.99 -2.88 113.55 110.06 1bdu h SER 54 Ca 0.28 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1bdu h SER 54 Cb -0.07 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1bdu h SER 54 CO -0.07 0.67 0.05 0.40 -1.14 0.00 0.00 176.83 176.75 1bdu h ILE 55 N 0.36 1.14 0.34 3.27 2.04 -1.23 0.01 117.51 123.44 1bdu h ILE 55 Ca 0.05 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 1bdu h ILE 55 Cb 0.66 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 1bdu h ILE 55 CO 0.05 0.13 -0.16 0.40 0.00 0.00 0.00 178.15 178.56 1bdu h ILE 56 N 0.05 0.67 -0.59 -0.67 2.04 -1.42 -1.67 117.51 115.92 1bdu h ILE 56 Ca 0.04 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 65.93 1bdu h ILE 56 Cb 0.16 0.69 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 1bdu h ILE 56 CO -0.00 0.01 0.29 0.45 0.00 0.00 0.00 178.15 178.89 1bdu h HIS 57 N -0.48 0.53 -0.83 1.37 3.86 -1.46 -0.92 115.15 117.22 1bdu h HIS 57 Ca -0.05 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1bdu h HIS 57 Cb 0.36 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.65 1bdu h HIS 57 CO -0.05 0.23 0.46 1.49 0.86 0.00 0.00 177.93 180.92 1bdu h GLU 58 N 0.54 1.15 -0.28 2.45 4.81 -0.82 -1.95 114.58 120.48 1bdu h GLU 58 Ca 0.27 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.31 1bdu h GLU 58 Cb 0.22 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1bdu h GLU 58 CO -0.21 0.83 -0.08 1.25 -0.73 0.00 0.00 179.01 180.08 1bdu h LEU 59 N 1.16 0.55 -1.33 1.64 5.85 -0.51 -0.87 115.31 121.80 1bdu h LEU 59 Ca 0.29 -0.37 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 1bdu h LEU 59 Cb 0.01 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1bdu h LEU 59 CO -0.05 0.80 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.74 1bdu h LEU 60 N 0.30 0.37 -0.29 2.25 3.38 -1.18 -1.48 115.31 118.66 1bdu h LEU 60 Ca 0.07 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1bdu h LEU 60 Cb 0.56 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1bdu h LEU 60 CO 0.03 0.46 -0.01 -0.25 0.09 0.00 0.00 178.44 178.77 1bdu h TRP 61 N 0.38 0.56 -0.59 1.13 7.01 -1.12 -2.77 115.95 120.55 1bdu h TRP 61 Ca 0.08 -0.10 0.06 0.00 2.11 0.00 0.00 58.89 61.04 1bdu h TRP 61 Cb 0.32 -0.14 -0.05 0.00 -2.10 0.00 0.00 29.16 27.18 1bdu h TRP 61 CO 0.01 0.66 0.30 0.74 -2.79 0.00 0.00 178.44 177.36 1bdu h PHE 62 N 0.30 0.54 0.00 2.65 0.04 -0.77 -2.94 116.94 116.77 1bdu h PHE 62 Ca 0.08 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.86 1bdu h PHE 62 Cb 0.44 -0.16 -0.00 0.00 2.20 0.00 0.00 35.95 38.43 1bdu h PHE 62 CO 0.04 0.24 -0.05 -0.07 -0.60 0.00 0.00 178.31 177.87 1bdu h LEU 63 N 0.56 0.00 -0.09 1.54 3.38 -1.10 -1.66 115.31 117.94 1bdu h LEU 63 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1bdu h LEU 63 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1bdu h LEU 63 CO -0.20 0.05 -0.10 0.00 0.09 0.00 0.00 178.44 178.29 1bdu n GLN 64 N -3.42 0.38 -1.06 1.13 1.13 -1.06 -4.91 117.38 109.57 1bdu n GLN 64 Ca -0.02 -0.09 -0.01 0.00 -1.94 0.00 0.00 57.00 54.95 1bdu n GLN 64 Cb 0.18 -1.50 -0.00 0.00 0.11 0.00 0.00 30.24 29.03 1bdu n GLN 64 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1bdu n GLY 65 N 1.36 0.44 3.69 1.08 0.00 -0.62 -5.01 105.19 106.12 1bdu n GLY 65 Ca 0.12 -1.05 -0.40 0.00 0.00 0.00 0.00 46.02 44.69 1bdu n GLY 65 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bdu s ASP 66 N -2.99 6.86 0.00 1.61 -1.08 -1.16 -4.02 116.67 115.89 1bdu s ASP 66 Ca 0.00 1.04 0.06 0.00 -0.52 0.00 0.00 52.55 53.13 1bdu s ASP 66 Cb 0.00 -2.39 -0.04 0.00 -1.46 0.00 0.00 42.92 39.03 1bdu s ASP 66 CO 0.00 -0.23 0.36 0.41 0.52 0.00 0.00 175.17 176.22 1bdu n THR 67 N 4.32 0.00 -3.78 1.71 -1.04 -1.26 -4.55 114.28 109.68 1bdu n THR 67 Ca -0.00 -0.40 -0.36 0.00 -2.04 0.00 0.00 64.05 61.26 1bdu n THR 67 Cb 0.50 1.03 -0.06 0.00 -1.82 0.00 0.00 70.33 69.99 1bdu n THR 67 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1bdu s ASN 68 N -1.31 6.48 0.58 8.00 3.84 -1.26 -1.80 114.94 129.48 1bdu s ASN 68 Ca 0.03 0.55 0.38 0.00 0.21 0.00 0.00 52.86 54.04 1bdu s ASN 68 Cb 0.05 -2.09 1.88 0.00 -0.55 0.00 0.00 41.25 40.53 1bdu s ASN 68 CO 0.20 0.31 2.15 -0.29 -2.79 0.00 0.00 177.10 176.68 1bdu h ILE 69 N 3.38 0.00 -0.86 -5.21 6.09 -1.06 -3.39 117.51 116.47 1bdu h ILE 69 Ca -0.52 -0.21 0.19 0.00 -1.37 0.00 0.00 64.86 62.95 1bdu h ILE 69 Cb 1.21 1.16 -0.16 0.00 0.47 0.00 0.00 36.82 39.50 1bdu h ILE 69 CO 0.63 0.00 -0.13 0.00 -3.07 0.00 0.00 178.15 175.58 1bdu h ALA 70 N 2.01 0.70 -0.82 0.18 0.00 -1.91 -0.85 119.26 118.58 1bdu h ALA 70 Ca 0.00 0.32 0.01 0.00 0.00 0.00 0.00 54.91 55.23 1bdu h ALA 70 Cb 0.22 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1bdu h ALA 70 CO 0.00 -0.43 0.53 -0.92 0.00 0.00 0.00 179.25 178.43 1bdu h TYR 71 N 0.02 1.04 -0.57 0.00 3.20 -2.00 0.09 116.97 118.75 1bdu h TYR 71 Ca 0.44 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 62.22 1bdu h TYR 71 Cb 0.74 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 1bdu h TYR 71 CO -0.59 0.66 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.46 1bdu h LEU 72 N 1.11 1.03 -0.86 2.82 3.38 -1.57 -3.12 115.31 118.09 1bdu h LEU 72 Ca 0.30 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1bdu h LEU 72 Cb -0.11 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.33 1bdu h LEU 72 CO -0.06 1.11 0.18 0.45 0.09 0.00 0.00 178.44 180.21 1bdu h HIS 73 N 0.92 1.06 -0.02 1.13 3.86 -0.53 0.11 115.15 121.67 1bdu h HIS 73 Ca 0.15 -0.11 0.01 0.00 -1.16 0.00 0.00 60.37 59.26 1bdu h HIS 73 Cb 0.62 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.78 1bdu h HIS 73 CO 0.04 0.86 0.04 0.93 0.86 0.00 0.00 177.93 180.66 1bdu h GLU 74 N 0.98 0.00 -0.40 2.45 5.08 -0.94 -1.10 114.58 120.65 1bdu h GLU 74 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1bdu h GLU 74 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1bdu h GLU 74 CO -0.00 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.10 1bdu n ASN 75 N -3.50 3.08 -3.98 1.42 3.02 -0.90 -5.00 115.26 109.40 1bdu n ASN 75 Ca -0.02 -1.95 -0.28 0.00 -0.03 0.00 0.00 54.58 52.30 1bdu n ASN 75 Cb 0.12 -0.26 -0.01 0.00 -0.61 0.00 0.00 39.78 39.01 1bdu n ASN 75 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1bdu n ASN 76 N 0.82 -1.37 -4.39 6.41 5.15 -0.42 -4.96 115.26 116.51 1bdu n ASN 76 Ca 0.14 -0.97 -0.39 0.00 -0.60 0.00 0.00 54.58 52.77 1bdu n ASN 76 Cb 0.46 -3.15 -0.12 0.00 -0.53 0.00 0.00 39.78 36.44 1bdu n ASN 76 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1bdu s VAL 77 N -3.75 4.37 -0.60 3.44 1.01 0.28 -4.96 120.40 120.18 1bdu s VAL 77 Ca 0.21 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 61.62 1bdu s VAL 77 Cb -0.11 -3.29 0.20 0.00 0.00 0.00 0.00 36.38 33.18 1bdu s VAL 77 CO 0.88 -0.01 1.17 1.07 0.00 0.00 0.00 175.10 178.21 1bdu n THR 78 N 4.94 1.00 0.30 3.92 5.66 -1.26 -3.85 114.28 125.00 1bdu n THR 78 Ca -0.13 -1.00 0.15 0.00 -3.05 0.00 0.00 64.05 60.01 1bdu n THR 78 Cb 0.48 0.50 0.67 0.00 -1.55 0.00 0.00 70.33 70.43 1bdu n THR 78 CO 0.00 0.00 0.00 0.16 -3.05 0.00 0.00 175.07 172.18 1bdu h ILE 79 N 1.32 0.00 -0.04 1.09 3.07 -1.98 -2.59 117.51 118.39 1bdu h ILE 79 Ca 0.00 -0.19 0.00 0.00 1.55 0.00 0.00 64.86 66.22 1bdu h ILE 79 Cb 0.65 0.96 0.00 0.00 -0.27 0.00 0.00 36.82 38.16 1bdu h ILE 79 CO 0.00 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 177.89 1bdu n TRP 80 N -2.56 0.02 -0.29 0.16 7.02 -1.26 -4.63 117.44 115.90 1bdu n TRP 80 Ca 0.00 -0.01 0.09 0.00 -1.02 0.00 0.00 57.50 56.55 1bdu n TRP 80 Cb 0.17 -0.00 0.24 0.00 -2.42 0.00 0.00 31.31 29.30 1bdu n TRP 80 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1bdu h ASP 81 N 3.61 0.37 -0.79 -0.99 5.19 -1.80 -2.31 116.42 119.70 1bdu h ASP 81 Ca 0.00 0.12 0.23 0.00 -0.62 0.00 0.00 57.03 56.76 1bdu h ASP 81 Cb 0.77 0.08 -0.03 0.00 0.18 0.00 0.00 39.33 40.33 1bdu h ASP 81 CO 0.00 0.10 0.57 -0.08 -3.12 0.00 0.00 179.24 176.71 1bdu h GLU 82 N 0.48 0.00 0.00 3.56 4.81 -1.82 -2.85 114.58 118.76 1bdu h GLU 82 Ca 0.48 -0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 59.42 1bdu h GLU 82 Cb 0.79 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.11 1bdu h GLU 82 CO -0.44 0.00 -2.10 0.91 -0.73 0.00 0.00 179.01 176.66 1bdu n TRP 83 N -4.30 0.00 -1.78 0.92 7.02 -0.91 -5.02 117.44 113.37 1bdu n TRP 83 Ca 0.16 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 56.23 1bdu n TRP 83 Cb 0.85 -0.79 -0.00 0.00 -2.42 0.00 0.00 31.31 28.95 1bdu n TRP 83 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1bdu n ALA 84 N -2.59 2.41 -1.28 6.99 0.00 -0.97 -4.85 120.51 120.22 1bdu n ALA 84 Ca -0.26 0.34 -0.10 0.00 0.00 0.00 0.00 53.44 53.43 1bdu n ALA 84 Cb 1.02 -2.43 0.10 0.00 0.00 0.00 0.00 19.45 18.14 1bdu n ALA 84 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1bdu n ASP 85 N 0.50 -0.51 -0.28 0.00 5.75 -0.61 -4.84 116.55 116.56 1bdu n ASP 85 Ca 0.01 -1.07 0.21 0.00 -0.01 0.00 0.00 54.79 53.93 1bdu n ASP 85 Cb 0.39 -0.46 0.51 0.00 -1.03 0.00 0.00 41.12 40.53 1bdu n ASP 85 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1bdu h GLU 86 N 0.00 0.39 -0.34 0.11 3.07 -1.96 0.12 114.58 115.97 1bdu h GLU 86 Ca -0.19 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 1bdu h GLU 86 Cb 0.55 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 1bdu h GLU 86 CO 0.13 0.26 0.00 0.09 -1.40 0.00 0.00 179.01 178.09 1bdu n ASN 87 N -4.55 2.06 0.00 1.42 4.13 -1.26 -4.92 115.26 112.14 1bdu n ASN 87 Ca 0.22 -1.92 0.00 0.00 1.68 0.00 0.00 54.58 54.56 1bdu n ASN 87 Cb 0.78 -0.22 0.00 0.00 -1.54 0.00 0.00 39.78 38.80 1bdu n ASN 87 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1bdu n GLY 88 N 1.15 0.54 3.77 7.41 0.00 0.41 -4.83 105.19 113.64 1bdu n GLY 88 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1bdu n GLY 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bdu s ASP 89 N -2.06 7.06 0.00 1.61 1.01 -1.26 -0.42 116.67 122.62 1bdu s ASP 89 Ca 0.00 1.27 0.20 0.00 0.71 0.00 0.00 52.55 54.72 1bdu s ASP 89 Cb 0.00 -2.39 0.20 0.00 1.01 0.00 0.00 42.92 41.74 1bdu s ASP 89 CO 0.00 0.12 1.16 0.18 0.21 0.00 0.00 175.17 176.85 1bdu n LEU 90 N 2.49 2.76 0.00 1.23 4.77 -0.74 -1.57 117.00 125.94 1bdu n LEU 90 Ca -0.07 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 54.80 1bdu n LEU 90 Cb 0.51 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1bdu n LEU 90 CO 0.44 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 1bdu n GLY 91 N 1.14 -2.13 2.25 -0.72 0.00 -1.26 -0.86 105.19 103.60 1bdu n GLY 91 Ca 0.13 -1.47 -0.30 0.00 0.00 0.00 0.00 46.02 44.37 1bdu n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1bdu n PRO 92 N -0.15 3.11 0.00 1.61 -0.04 -1.26 -4.85 135.00 133.42 1bdu n PRO 92 Ca 0.00 -1.81 0.00 0.00 -0.04 0.00 0.00 63.50 61.65 1bdu n PRO 92 Cb 0.00 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 30.91 1bdu n PRO 92 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1bdu n VAL 93 N 3.32 0.00 0.00 0.52 0.24 -1.26 -4.46 118.33 116.69 1bdu n VAL 93 Ca 0.66 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.96 1bdu n VAL 93 Cb 0.41 -1.58 0.00 0.00 -1.47 0.00 0.00 33.84 31.19 1bdu n VAL 93 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1bdu n TYR 94 N -1.55 0.00 -0.21 6.34 4.01 -1.26 -2.08 117.16 122.41 1bdu n TYR 94 Ca 0.00 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.76 1bdu n TYR 94 Cb 0.00 -0.08 0.27 0.00 -0.31 0.00 0.00 39.34 39.21 1bdu n TYR 94 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1bdu h GLY 95 N 0.00 1.05 0.96 2.72 0.00 -1.80 0.10 103.07 106.11 1bdu h GLY 95 Ca 0.00 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1bdu h GLY 95 CO 0.00 0.35 0.20 1.70 0.00 0.00 0.00 176.54 178.78 1bdu h LYS 96 N 0.97 0.71 -0.28 4.80 1.63 -1.55 -0.84 116.57 122.00 1bdu h LYS 96 Ca 0.29 -0.13 -0.15 0.00 -0.85 0.00 0.00 60.65 59.81 1bdu h LYS 96 Cb -0.03 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.48 1bdu h LYS 96 CO -0.07 0.64 -0.43 1.96 -3.45 0.00 0.00 179.45 178.09 1bdu h GLN 97 N 0.63 0.70 -0.74 1.90 1.08 -1.07 0.15 115.11 117.76 1bdu h GLN 97 Ca 0.16 -0.38 -0.02 0.00 -1.45 0.00 0.00 58.65 56.97 1bdu h GLN 97 Cb 0.19 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.60 1bdu h GLN 97 CO -0.01 1.00 0.40 -1.49 -0.95 0.00 0.00 178.83 177.77 1bdu h TRP 98 N 0.57 1.02 0.00 2.96 4.06 -0.71 -3.25 115.95 120.60 1bdu h TRP 98 Ca 0.04 -0.03 -0.12 0.00 2.06 0.00 0.00 58.89 60.85 1bdu h TRP 98 Cb 0.98 -0.33 -0.02 0.00 -1.00 0.00 0.00 29.16 28.79 1bdu h TRP 98 CO 0.05 0.72 -1.90 0.54 -3.56 0.00 0.00 178.44 174.29 1bdu n ARG 99 N -4.46 0.88 -2.96 0.49 5.12 -0.33 -1.02 116.66 114.38 1bdu n ARG 99 Ca 0.07 -0.10 -0.13 0.00 -1.93 0.00 0.00 57.85 55.76 1bdu n ARG 99 Cb 0.09 -1.40 0.03 0.00 -1.16 0.00 0.00 32.46 30.02 1bdu n ARG 99 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1bdu n ALA 100 N -2.29 0.61 -1.68 7.54 0.00 0.50 -3.52 120.51 121.67 1bdu n ALA 100 Ca -0.12 -2.42 -0.43 0.00 0.00 0.00 0.00 53.44 50.47 1bdu n ALA 100 Cb 0.67 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 19.05 1bdu n ALA 100 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1bdu n TRP 101 N 0.32 2.57 -2.95 0.00 -0.00 0.09 -4.51 117.44 112.96 1bdu n TRP 101 Ca 0.15 -0.20 -0.40 0.00 -0.00 0.00 0.00 57.50 57.05 1bdu n TRP 101 Cb 0.68 -2.74 -0.04 0.00 -0.00 0.00 0.00 31.31 29.20 1bdu n TRP 101 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 1bdu s PRO 102 N 3.24 4.45 0.47 5.87 0.04 -1.26 -0.27 135.00 147.54 1bdu s PRO 102 Ca 0.84 1.02 -0.02 0.00 0.04 0.00 0.00 61.00 62.88 1bdu s PRO 102 Cb -0.49 -3.47 -0.01 0.00 0.04 0.00 0.00 34.50 30.58 1bdu s PRO 102 CO 0.39 -0.01 0.72 0.95 0.04 0.00 0.00 177.00 179.09 1bdu s THR 103 N 1.02 4.25 0.58 1.26 -4.23 -0.64 -4.98 115.64 112.89 1bdu s THR 103 Ca 0.41 -0.26 0.27 0.00 -1.18 0.00 0.00 61.69 60.92 1bdu s THR 103 Cb -0.18 -3.60 0.34 0.00 1.34 0.00 0.00 72.50 70.40 1bdu s THR 103 CO 0.20 -0.49 2.22 -0.65 -0.54 0.00 0.00 174.62 175.36 1bdu h PRO 104 N 0.30 0.00 -0.64 3.99 0.11 -1.98 -2.91 132.00 130.87 1bdu h PRO 104 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1bdu h PRO 104 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1bdu h PRO 104 CO 0.59 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.98 1bdu n ASP 105 N -3.99 5.05 0.00 -2.05 5.75 -1.26 -4.94 116.55 115.10 1bdu n ASP 105 Ca -0.02 -2.78 0.00 0.00 -0.01 0.00 0.00 54.79 51.98 1bdu n ASP 105 Cb 0.11 -0.65 0.00 0.00 -1.03 0.00 0.00 41.12 39.55 1bdu n ASP 105 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bdu n GLY 106 N 0.57 0.72 3.89 6.12 0.00 -1.10 -5.06 105.19 110.34 1bdu n GLY 106 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 1bdu n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bdu s ARG 107 N -0.73 2.79 -0.14 1.61 0.52 -1.26 -4.88 118.95 116.85 1bdu s ARG 107 Ca 0.00 0.30 -0.00 0.00 -0.52 0.00 0.00 55.73 55.51 1bdu s ARG 107 Cb 0.00 -2.08 0.03 0.00 0.52 0.00 0.00 34.95 33.42 1bdu s ARG 107 CO 0.00 -1.00 -0.07 -1.01 0.02 0.00 0.00 175.30 173.24 1bdu s HIS 108 N -3.28 1.59 -0.21 -0.53 3.76 -1.26 -1.63 115.29 113.73 1bdu s HIS 108 Ca 0.57 -0.90 -0.13 0.00 -0.15 0.00 0.00 55.06 54.45 1bdu s HIS 108 Cb -0.11 -1.27 -0.05 0.00 1.11 0.00 0.00 32.58 32.26 1bdu s HIS 108 CO 0.50 -0.56 0.27 0.42 -0.85 0.00 0.00 174.74 174.52 1bdu s ILE 109 N 1.67 5.29 -0.91 0.60 -1.09 0.63 -4.74 121.20 122.65 1bdu s ILE 109 Ca 0.03 0.45 -0.19 0.00 -2.23 0.00 0.00 60.65 58.71 1bdu s ILE 109 Cb -0.14 -3.61 0.13 0.00 -1.58 0.00 0.00 42.46 37.26 1bdu s ILE 109 CO -0.08 0.32 1.10 -0.62 -1.23 0.00 0.00 174.94 174.43 1bdu s ASP 110 N 0.91 6.61 0.51 3.58 -1.08 -1.23 -0.73 116.67 125.24 1bdu s ASP 110 Ca 0.14 -2.01 0.28 0.00 -0.52 0.00 0.00 52.55 50.43 1bdu s ASP 110 Cb -0.14 -2.39 1.36 0.00 -1.46 0.00 0.00 42.92 40.29 1bdu s ASP 110 CO 0.05 -1.06 2.02 1.56 0.52 0.00 0.00 175.17 178.26 1bdu h GLN 111 N 8.84 0.00 -0.09 4.34 4.20 -1.33 -2.53 115.11 128.54 1bdu h GLN 111 Ca 0.13 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.68 1bdu h GLN 111 Cb 1.03 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.82 1bdu h GLN 111 CO 1.10 0.14 -0.55 0.82 -0.67 0.00 0.00 178.83 179.66 1bdu h ILE 112 N 0.00 1.36 -0.43 2.54 1.08 -1.85 -2.03 117.51 118.19 1bdu h ILE 112 Ca -0.00 -1.88 -0.11 0.00 -0.39 0.00 0.00 64.86 62.47 1bdu h ILE 112 Cb 0.43 2.24 -0.02 0.00 -3.07 0.00 0.00 36.82 36.40 1bdu h ILE 112 CO 0.02 0.57 -0.18 0.74 -0.69 0.00 0.00 178.15 178.60 1bdu h THR 113 N 0.13 1.27 0.13 -0.27 2.02 -1.85 -2.62 112.91 111.72 1bdu h THR 113 Ca -0.04 -1.30 0.01 0.00 0.77 0.00 0.00 66.41 65.85 1bdu h THR 113 Cb 1.21 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 1bdu h THR 113 CO 0.11 0.44 -0.21 0.74 0.37 0.00 0.00 175.52 176.97 1bdu h THR 114 N 0.73 0.53 -0.49 3.16 2.02 -1.39 -0.86 112.91 116.61 1bdu h THR 114 Ca 0.11 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.37 1bdu h THR 114 Cb 0.70 0.53 -0.07 0.00 -1.74 0.00 0.00 68.15 67.57 1bdu h THR 114 CO 0.05 0.00 0.08 0.58 0.37 0.00 0.00 175.52 176.60 1bdu h VAL 115 N -0.41 0.70 -0.84 3.16 2.07 -1.36 0.12 116.25 119.68 1bdu h VAL 115 Ca 0.02 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1bdu h VAL 115 Cb 0.42 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 1bdu h VAL 115 CO -0.10 0.04 0.51 -0.07 0.02 0.00 0.00 177.57 177.97 1bdu h LEU 116 N 0.20 1.00 -0.46 2.57 3.38 -1.23 -0.42 115.31 120.36 1bdu h LEU 116 Ca 0.25 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.19 1bdu h LEU 116 Cb 0.35 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1bdu h LEU 116 CO -0.34 0.77 0.24 0.78 0.09 0.00 0.00 178.44 179.97 1bdu h ASN 117 N 1.15 0.35 -0.48 -0.43 2.35 -0.28 -1.17 115.58 117.07 1bdu h ASN 117 Ca 0.30 0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 56.01 1bdu h ASN 117 Cb -0.06 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1bdu h ASN 117 CO -0.06 0.25 0.07 1.56 -1.65 0.00 0.00 177.43 177.60 1bdu h GLN 118 N 0.48 0.80 0.00 0.81 4.20 -0.69 0.14 115.11 120.85 1bdu h GLN 118 Ca 0.20 -0.22 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1bdu h GLN 118 Cb 0.09 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1bdu h GLN 118 CO -0.13 0.81 -0.21 -0.07 -0.67 0.00 0.00 178.83 178.56 1bdu h LEU 119 N 0.67 0.00 0.12 1.46 3.38 -0.70 0.11 115.31 120.35 1bdu h LEU 119 Ca 0.14 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.83 1bdu h LEU 119 Cb 0.40 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1bdu h LEU 119 CO 0.01 0.21 -1.49 0.11 0.09 0.00 0.00 178.44 177.38 1bdu h LYS 120 N 0.00 0.25 0.00 1.13 1.57 -1.08 -3.38 116.57 115.07 1bdu h LYS 120 Ca -0.00 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1bdu h LYS 120 Cb 0.38 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1bdu h LYS 120 CO 0.03 1.20 -1.08 0.09 -0.57 0.00 0.00 179.45 179.12 1bdu n ASN 121 N -3.87 1.01 -2.97 0.86 3.02 0.03 -4.70 115.26 108.64 1bdu n ASN 121 Ca -0.26 -0.52 -0.14 0.00 -0.03 0.00 0.00 54.58 53.63 1bdu n ASN 121 Cb 0.92 1.27 0.01 0.00 -0.61 0.00 0.00 39.78 41.37 1bdu n ASN 121 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1bdu n ASP 122 N -1.61 0.31 0.31 6.41 2.03 0.34 -5.02 116.55 119.33 1bdu n ASP 122 Ca 0.01 -3.01 0.18 0.00 0.52 0.00 0.00 54.79 52.48 1bdu n ASP 122 Cb 0.30 -0.11 1.01 0.00 -0.72 0.00 0.00 41.12 41.60 1bdu n ASP 122 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1bdu h PRO 123 N 2.94 0.00 -0.01 -0.67 0.13 -1.65 -2.14 132.00 130.60 1bdu h PRO 123 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1bdu h PRO 123 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1bdu h PRO 123 CO 0.41 0.02 -0.04 -0.25 -0.23 0.00 0.00 178.00 177.90 1bdu n ASP 124 N -3.45 0.57 -4.64 1.44 8.00 -1.26 -3.80 116.55 113.40 1bdu n ASP 124 Ca -0.03 -0.94 -0.45 0.00 0.71 0.00 0.00 54.79 54.08 1bdu n ASP 124 Cb 0.11 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 1bdu n ASP 124 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1bdu n SER 125 N -0.69 2.15 -1.18 -2.24 2.88 -0.81 -4.91 113.62 108.82 1bdu n SER 125 Ca 0.19 1.16 0.07 0.00 -1.33 0.00 0.00 58.87 58.95 1bdu n SER 125 Cb 0.24 -1.36 0.25 0.00 -0.75 0.00 0.00 64.21 62.60 1bdu n SER 125 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1bdu n ARG 126 N 1.57 2.86 -0.11 -1.46 1.74 -1.26 -4.33 116.66 115.67 1bdu n ARG 126 Ca 0.11 -2.03 0.08 0.00 -0.77 0.00 0.00 57.85 55.25 1bdu n ARG 126 Cb 0.30 -1.67 0.12 0.00 -1.02 0.00 0.00 32.46 30.19 1bdu n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1bdu n ARG 127 N 0.79 1.25 -2.96 5.56 1.74 -1.26 -4.96 116.66 116.82 1bdu n ARG 127 Ca 0.18 -2.33 -0.44 0.00 -0.77 0.00 0.00 57.85 54.49 1bdu n ARG 127 Cb 0.64 -1.36 -0.01 0.00 -1.02 0.00 0.00 32.46 30.72 1bdu n ARG 127 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1bdu s ILE 128 N -2.45 5.00 -0.01 0.55 1.01 -1.26 -4.93 121.20 119.11 1bdu s ILE 128 Ca 0.26 -2.45 0.08 0.00 0.00 0.00 0.00 60.65 58.55 1bdu s ILE 128 Cb 0.23 -4.87 -0.02 0.00 0.01 0.00 0.00 42.46 37.81 1bdu s ILE 128 CO 0.02 -1.58 -0.26 -0.63 0.00 0.00 0.00 174.94 172.50 1bdu s ILE 129 N 1.71 2.03 -0.04 2.92 1.01 -1.26 -0.59 121.20 126.98 1bdu s ILE 129 Ca 0.40 -1.12 0.05 0.00 0.00 0.00 0.00 60.65 59.98 1bdu s ILE 129 Cb -0.03 -1.69 -0.01 0.00 0.01 0.00 0.00 42.46 40.74 1bdu s ILE 129 CO -0.02 0.55 -0.20 0.54 0.00 0.00 0.00 174.94 175.81 1bdu s VAL 130 N -0.62 1.62 -0.03 2.92 0.11 -0.15 -4.87 120.40 119.38 1bdu s VAL 130 Ca 0.10 -0.84 0.07 0.00 -2.93 0.00 0.00 61.98 58.38 1bdu s VAL 130 Cb -0.10 -1.38 -0.02 0.00 -1.53 0.00 0.00 36.38 33.36 1bdu s VAL 130 CO -0.01 0.46 -0.24 -0.55 -3.33 0.00 0.00 175.10 171.43 1bdu s SER 131 N -0.14 3.19 0.00 3.54 0.15 -1.26 -1.01 113.70 118.16 1bdu s SER 131 Ca -0.01 -0.44 0.11 0.00 0.70 0.00 0.00 55.95 56.32 1bdu s SER 131 Cb -0.11 -0.48 -0.01 0.00 -1.71 0.00 0.00 66.02 63.71 1bdu s SER 131 CO 0.02 0.31 0.66 0.00 1.20 0.00 0.00 173.24 175.43 1bdu n ALA 132 N 2.50 2.94 -2.31 5.45 0.00 0.40 -4.64 120.51 124.85 1bdu n ALA 132 Ca -0.16 -0.45 -0.42 0.00 0.00 0.00 0.00 53.44 52.41 1bdu n ALA 132 Cb 0.51 -0.39 -0.00 0.00 0.00 0.00 0.00 19.45 19.57 1bdu n ALA 132 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1bdu n TRP 133 N -0.30 4.26 -2.88 0.00 -0.00 -1.12 -4.82 117.44 112.57 1bdu n TRP 133 Ca 0.04 -2.82 -0.43 0.00 -0.00 0.00 0.00 57.50 54.29 1bdu n TRP 133 Cb 0.23 -2.60 -0.03 0.00 -0.00 0.00 0.00 31.31 28.90 1bdu n TRP 133 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 1bdu s ASN 134 N 4.02 6.32 0.25 5.87 3.84 -1.26 -4.94 114.94 129.04 1bdu s ASN 134 Ca 0.53 -1.34 -0.03 0.00 0.21 0.00 0.00 52.86 52.22 1bdu s ASN 134 Cb 0.07 -2.41 0.50 0.00 -0.55 0.00 0.00 41.25 38.85 1bdu s ASN 134 CO 0.04 -1.31 1.74 0.58 -2.79 0.00 0.00 177.10 175.35 1bdu h VAL 135 N 5.95 0.67 0.00 -5.21 2.07 -2.01 -1.47 116.25 116.25 1bdu h VAL 135 Ca -0.14 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1bdu h VAL 135 Cb 1.06 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1bdu h VAL 135 CO 1.16 0.09 0.00 1.23 0.02 0.00 0.00 177.57 180.07 1bdu h GLY 136 N 0.50 0.00 -1.26 2.17 0.00 -2.00 -3.00 103.07 99.47 1bdu h GLY 136 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 1bdu h GLY 136 CO -0.40 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.32 1bdu n GLU 137 N -2.91 1.51 -0.25 4.80 1.02 -0.59 -4.71 120.64 119.51 1bdu n GLU 137 Ca 0.01 -1.59 -0.07 0.00 -0.02 0.00 0.00 57.16 55.49 1bdu n GLU 137 Cb 0.27 -1.29 0.05 0.00 -0.02 0.00 0.00 31.44 30.45 1bdu n GLU 137 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1bdu h LEU 138 N 2.67 1.01 -2.11 -4.62 3.38 -1.32 -2.33 115.31 111.99 1bdu h LEU 138 Ca 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1bdu h LEU 138 Cb 0.64 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1bdu h LEU 138 CO 0.00 0.94 0.03 0.44 0.09 0.00 0.00 178.44 179.94 1bdu h ASP 139 N 1.02 0.00 -0.00 -0.43 3.32 -1.84 -2.57 116.42 115.92 1bdu h ASP 139 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1bdu h ASP 139 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1bdu h ASP 139 CO -0.01 0.00 -0.76 0.29 -1.72 0.00 0.00 179.24 177.04 1bdu n LYS 140 N -2.63 0.88 -2.56 3.56 4.76 -0.89 -4.98 118.16 116.30 1bdu n LYS 140 Ca -0.02 -0.30 -0.39 0.00 -2.87 0.00 0.00 58.31 54.73 1bdu n LYS 140 Cb 0.08 -1.41 -0.05 0.00 -1.84 0.00 0.00 35.03 31.82 1bdu n LYS 140 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1bdu s MET 141 N -2.65 4.62 0.35 1.97 -1.94 -0.97 -4.20 119.30 116.47 1bdu s MET 141 Ca 0.10 1.66 0.06 0.00 -1.71 0.00 0.00 55.69 55.80 1bdu s MET 141 Cb 0.15 -3.09 0.72 0.00 2.01 0.00 0.00 34.83 34.62 1bdu s MET 141 CO 0.70 0.23 1.93 0.00 -0.01 0.00 0.00 175.02 177.87 1bdu h ALA 142 N 3.66 1.70 -2.94 3.03 0.00 -1.33 -3.42 119.26 119.95 1bdu h ALA 142 Ca -0.47 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.28 1bdu h ALA 142 Cb 1.21 -0.19 -0.24 0.00 0.00 0.00 0.00 17.79 18.56 1bdu h ALA 142 CO 0.66 0.15 -0.38 -0.48 0.00 0.00 0.00 179.25 179.21 1bdu s LEU 143 N -9.79 0.95 0.33 0.00 0.05 -1.26 -5.08 118.68 103.88 1bdu s LEU 143 Ca -0.10 0.44 -0.28 0.00 0.05 0.00 0.00 54.13 54.24 1bdu s LEU 143 Cb 0.20 1.00 -0.10 0.00 -2.05 0.00 0.00 46.19 45.24 1bdu s LEU 143 CO 0.78 -0.17 1.24 0.00 -0.55 0.00 0.00 176.35 177.65 1bdu s ALA 144 N -0.18 3.42 -0.00 1.48 0.00 -1.26 -4.92 121.76 120.29 1bdu s ALA 144 Ca -0.03 1.13 -0.37 0.00 0.00 0.00 0.00 51.96 52.68 1bdu s ALA 144 Cb -0.03 -3.43 -0.16 0.00 0.00 0.00 0.00 23.12 19.50 1bdu s ALA 144 CO 0.01 -0.51 1.46 -2.30 0.00 0.00 0.00 175.76 174.42 1bdu n PRO 145 N 0.78 1.21 -0.06 0.00 -0.02 -1.26 -4.94 135.00 130.71 1bdu n PRO 145 Ca 0.00 0.44 -0.21 0.00 -2.02 0.00 0.00 63.50 61.71 1bdu n PRO 145 Cb 0.43 -2.10 -0.13 0.00 -0.02 0.00 0.00 33.50 31.69 1bdu n PRO 145 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bdu s HIS 147 N -2.40 3.12 -0.11 0.00 0.00 -1.26 -1.11 115.29 113.53 1bdu s HIS 147 Ca -0.25 -1.38 0.16 0.00 -3.00 0.00 0.00 55.06 50.59 1bdu s HIS 147 Cb 0.05 -4.26 -0.11 0.00 -4.00 0.00 0.00 32.58 24.25 1bdu s HIS 147 CO 0.67 -1.48 0.95 0.00 -1.00 0.00 0.00 174.74 173.88 1bdu h ALA 148 N 8.83 0.65 -1.96 -1.38 0.00 -1.65 -3.45 119.26 120.30 1bdu h ALA 148 Ca 0.14 -0.82 0.01 0.00 0.00 0.00 0.00 54.91 54.24 1bdu h ALA 148 Cb 1.03 0.21 -0.22 0.00 0.00 0.00 0.00 17.79 18.81 1bdu h ALA 148 CO 1.10 0.92 0.08 0.12 0.00 0.00 0.00 179.25 181.47 1bdu s PHE 149 N -2.90 -0.96 -0.00 0.00 2.19 -1.24 -0.45 117.98 114.63 1bdu s PHE 149 Ca -0.02 2.00 -0.07 0.00 0.33 0.00 0.00 56.93 59.17 1bdu s PHE 149 Cb 0.08 0.53 0.00 0.00 -1.31 0.00 0.00 43.02 42.32 1bdu s PHE 149 CO 0.80 -0.47 0.14 -0.59 1.83 0.00 0.00 175.22 176.93 1bdu s PHE 150 N 1.28 0.03 -0.08 10.12 -0.71 -0.18 -1.29 117.98 127.15 1bdu s PHE 150 Ca -0.07 -0.11 0.03 0.00 -1.04 0.00 0.00 56.93 55.75 1bdu s PHE 150 Cb -0.05 -0.04 0.00 0.00 -1.21 0.00 0.00 43.02 41.72 1bdu s PHE 150 CO -0.14 -0.28 -0.19 -1.14 -1.34 0.00 0.00 175.22 172.13 1bdu s GLN 151 N -1.31 2.36 0.32 1.99 0.74 -0.41 -0.97 119.66 122.36 1bdu s GLN 151 Ca -0.14 -0.66 -0.06 0.00 0.05 0.00 0.00 55.36 54.55 1bdu s GLN 151 Cb -0.07 -1.86 -0.05 0.00 1.10 0.00 0.00 33.01 32.13 1bdu s GLN 151 CO 0.02 0.13 0.60 -0.06 -0.55 0.00 0.00 175.29 175.42 1bdu s PHE 152 N 0.42 3.48 -0.08 1.67 0.08 0.24 -1.12 117.98 122.67 1bdu s PHE 152 Ca -0.15 0.70 -0.04 0.00 0.12 0.00 0.00 56.93 57.56 1bdu s PHE 152 Cb -0.16 -2.16 0.04 0.00 -0.57 0.00 0.00 43.02 40.17 1bdu s PHE 152 CO 0.06 0.11 0.18 -0.47 -0.10 0.00 0.00 175.22 175.00 1bdu s TYR 153 N -2.17 -0.22 -0.19 0.36 5.04 -0.58 -4.52 117.35 115.08 1bdu s TYR 153 Ca 0.45 0.57 -0.01 0.00 -2.44 0.00 0.00 57.07 55.64 1bdu s TYR 153 Cb -0.11 -0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.19 1bdu s TYR 153 CO 0.31 -0.17 -0.12 0.08 -1.34 0.00 0.00 175.55 174.30 1bdu s VAL 154 N 0.99 2.77 -0.03 3.14 1.01 -1.25 -0.97 120.40 126.07 1bdu s VAL 154 Ca -0.07 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1bdu s VAL 154 Cb -0.09 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.09 1bdu s VAL 154 CO -0.06 0.49 0.07 0.00 0.00 0.00 0.00 175.10 175.60 1bdu s ALA 155 N 1.20 -0.15 -1.47 5.51 0.00 -1.06 -4.69 121.76 121.11 1bdu s ALA 155 Ca 0.02 0.25 -0.08 0.00 0.00 0.00 0.00 51.96 52.15 1bdu s ALA 155 Cb -0.14 -0.16 0.06 0.00 0.00 0.00 0.00 23.12 22.87 1bdu s ALA 155 CO -0.05 -0.05 0.81 -0.25 0.00 0.00 0.00 175.76 176.22 1bdu n ASP 156 N 3.28 -3.00 0.00 0.00 8.00 -1.26 -1.87 116.55 121.69 1bdu n ASP 156 Ca -0.15 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.51 1bdu n ASP 156 Cb 0.58 -3.73 0.00 0.00 -0.02 0.00 0.00 41.12 37.95 1bdu n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bdu n GLY 157 N -1.67 0.50 3.26 0.44 0.00 -1.26 -5.00 105.19 101.45 1bdu n GLY 157 Ca -0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 1bdu n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bdu s LYS 158 N -0.48 2.91 -0.29 1.61 1.02 -0.78 -1.04 119.74 122.68 1bdu s LYS 158 Ca 0.00 -0.86 -0.19 0.00 0.02 0.00 0.00 55.97 54.93 1bdu s LYS 158 Cb 0.00 -2.29 -0.01 0.00 -0.52 0.00 0.00 37.83 35.01 1bdu s LYS 158 CO 0.00 0.26 0.59 -1.17 -0.92 0.00 0.00 175.35 174.11 1bdu s LEU 159 N 0.15 4.13 0.29 3.17 2.96 -0.07 -2.55 118.68 126.77 1bdu s LEU 159 Ca -0.12 0.44 0.08 0.00 -0.22 0.00 0.00 54.13 54.30 1bdu s LEU 159 Cb -0.16 -2.76 -0.04 0.00 0.50 0.00 0.00 46.19 43.73 1bdu s LEU 159 CO 0.07 -0.42 0.12 -0.44 -1.32 0.00 0.00 176.35 174.36 1bdu s SER 160 N 1.61 4.90 -0.17 3.68 0.01 -0.15 0.10 113.70 123.68 1bdu s SER 160 Ca 0.24 -0.57 -0.10 0.00 1.31 0.00 0.00 55.95 56.82 1bdu s SER 160 Cb -0.15 -0.96 0.06 0.00 0.21 0.00 0.00 66.02 65.18 1bdu s SER 160 CO 0.11 -0.14 0.42 0.00 0.41 0.00 0.00 173.24 174.04 1bdu s GLN 162 N 1.29 3.15 -0.14 0.00 0.74 -0.28 -0.87 119.66 123.55 1bdu s GLN 162 Ca -0.09 -0.80 -0.06 0.00 0.05 0.00 0.00 55.36 54.46 1bdu s GLN 162 Cb -0.08 -2.51 -0.04 0.00 1.10 0.00 0.00 33.01 31.48 1bdu s GLN 162 CO -0.12 0.05 0.08 -1.17 -0.55 0.00 0.00 175.29 173.59 1bdu s LEU 163 N 0.69 4.01 -0.27 3.68 2.96 -0.52 -1.29 118.68 127.93 1bdu s LEU 163 Ca -0.09 0.24 -0.09 0.00 -0.22 0.00 0.00 54.13 53.98 1bdu s LEU 163 Cb -0.16 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 1bdu s LEU 163 CO 0.01 0.30 0.12 -0.47 -1.32 0.00 0.00 176.35 175.00 1bdu s TYR 164 N -0.37 3.14 -0.30 5.38 5.04 -0.41 -0.78 117.35 129.06 1bdu s TYR 164 Ca 0.10 -0.30 -0.02 0.00 -2.44 0.00 0.00 57.07 54.41 1bdu s TYR 164 Cb -0.12 -2.31 0.05 0.00 0.35 0.00 0.00 41.96 39.94 1bdu s TYR 164 CO 0.02 -0.33 0.00 -1.14 -1.34 0.00 0.00 175.55 172.76 1bdu s GLN 165 N 1.66 2.42 0.40 4.97 0.74 0.05 -2.26 119.66 127.63 1bdu s GLN 165 Ca 0.06 -1.28 0.06 0.00 0.05 0.00 0.00 55.36 54.25 1bdu s GLN 165 Cb -0.16 -3.19 0.81 0.00 1.10 0.00 0.00 33.01 31.58 1bdu s GLN 165 CO 0.06 -0.63 2.04 0.07 -0.55 0.00 0.00 175.29 176.28 1bdu h ARG 166 N 8.00 0.58 -3.03 1.67 0.11 -1.42 0.93 114.38 121.22 1bdu h ARG 166 Ca -0.21 -0.04 -0.18 0.00 0.10 0.00 0.00 59.98 59.65 1bdu h ARG 166 Cb 1.06 -0.13 -0.29 0.00 1.11 0.00 0.00 29.97 31.73 1bdu h ARG 166 CO 0.54 0.40 -0.46 0.45 0.10 0.00 0.00 179.97 180.99 1bdu s SER 167 N -6.66 -0.28 -0.07 0.08 0.15 -1.26 -1.14 113.70 104.52 1bdu s SER 167 Ca -0.08 0.54 -0.03 0.00 0.70 0.00 0.00 55.95 57.07 1bdu s SER 167 Cb 0.17 0.45 0.04 0.00 -1.71 0.00 0.00 66.02 64.97 1bdu s SER 167 CO 0.74 -0.15 0.13 0.00 1.20 0.00 0.00 173.24 175.16 1bdu s ASP 169 N 2.22 6.37 0.26 0.00 -1.08 -1.26 -1.38 116.67 121.80 1bdu s ASP 169 Ca 0.03 -0.24 -0.04 0.00 -0.52 0.00 0.00 52.55 51.78 1bdu s ASP 169 Cb -0.12 -2.46 0.30 0.00 -1.46 0.00 0.00 42.92 39.19 1bdu s ASP 169 CO -0.05 -1.27 1.86 0.58 0.52 0.00 0.00 175.17 176.81 1bdu h VAL 170 N 6.05 1.24 0.20 1.11 2.07 -1.33 -1.67 116.25 123.92 1bdu h VAL 170 Ca -0.26 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 1bdu h VAL 170 Cb 1.07 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1bdu h VAL 170 CO 1.10 0.28 -0.10 0.15 0.02 0.00 0.00 177.57 179.03 1bdu h PHE 171 N 1.09 -0.25 0.12 1.57 3.57 -1.93 -3.36 116.94 117.75 1bdu h PHE 171 Ca 0.27 -0.01 -0.31 0.00 3.53 0.00 0.00 57.97 61.45 1bdu h PHE 171 Cb 0.10 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1bdu h PHE 171 CO 0.01 0.09 -1.63 1.25 -2.23 0.00 0.00 178.31 175.80 1bdu h LEU 172 N -0.96 0.39 0.09 0.59 5.85 -1.95 -3.43 115.31 115.88 1bdu h LEU 172 Ca -0.03 -0.86 -0.32 0.00 0.84 0.00 0.00 57.88 57.51 1bdu h LEU 172 Cb 0.46 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1bdu h LEU 172 CO 0.05 1.71 -1.74 1.23 -0.34 0.00 0.00 178.44 179.35 1bdu h GLY 173 N 0.36 0.21 0.64 3.75 0.00 -1.56 -3.42 103.07 103.05 1bdu h GLY 173 Ca -0.35 -0.54 0.07 0.00 0.00 0.00 0.00 47.33 46.51 1bdu h GLY 173 CO 0.06 0.47 0.38 -2.00 0.00 0.00 0.00 176.54 175.45 1bdu h LEU 174 N -0.29 0.56 -1.83 3.11 5.85 -1.56 -0.96 115.31 120.19 1bdu h LEU 174 Ca -0.40 0.03 0.15 0.00 0.84 0.00 0.00 57.88 58.51 1bdu h LEU 174 Cb 1.79 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.71 1bdu h LEU 174 CO -0.01 0.35 0.43 1.55 -0.34 0.00 0.00 178.44 180.43 1bdu h PRO 175 N 0.69 0.16 -0.01 5.25 0.13 -1.80 -1.27 132.00 135.16 1bdu h PRO 175 Ca 0.32 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.38 1bdu h PRO 175 Cb 0.22 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.32 1bdu h PRO 175 CO -0.20 0.11 -0.20 0.35 -0.23 0.00 0.00 178.00 177.83 1bdu h PHE 176 N 0.17 0.22 -0.55 1.56 3.04 -1.66 -2.74 116.94 116.97 1bdu h PHE 176 Ca 0.30 -0.11 0.06 0.00 3.98 0.00 0.00 57.97 62.20 1bdu h PHE 176 Cb 0.95 -0.03 -0.05 0.00 2.56 0.00 0.00 35.95 39.38 1bdu h PHE 176 CO -0.00 0.89 0.25 -0.91 -2.02 0.00 0.00 178.31 176.52 1bdu h ASN 177 N -0.52 0.32 0.05 0.41 -0.26 -0.39 -1.75 115.58 113.45 1bdu h ASN 177 Ca -0.02 0.05 -0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1bdu h ASN 177 Cb 0.94 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 38.19 1bdu h ASN 177 CO 0.04 0.21 -0.02 0.40 -1.06 0.00 0.00 177.43 177.00 1bdu h ILE 178 N 0.47 1.12 -0.48 2.81 2.04 -1.34 -2.64 117.51 119.49 1bdu h ILE 178 Ca 0.26 -0.55 -0.03 0.00 1.00 0.00 0.00 64.86 65.53 1bdu h ILE 178 Cb 0.22 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1bdu h ILE 178 CO -0.21 0.14 0.17 0.00 0.00 0.00 0.00 178.15 178.25 1bdu h ALA 179 N 0.62 1.39 -0.31 1.87 0.00 -1.44 -0.95 119.26 120.43 1bdu h ALA 179 Ca -0.01 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.78 1bdu h ALA 179 Cb 0.28 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1bdu h ALA 179 CO 0.01 0.45 0.14 1.03 0.00 0.00 0.00 179.25 180.88 1bdu h SER 180 N 0.69 0.18 0.08 0.00 0.87 -1.23 -2.42 113.55 111.72 1bdu h SER 180 Ca 0.16 0.02 -0.29 0.00 -1.23 0.00 0.00 61.79 60.46 1bdu h SER 180 Cb 0.18 -0.01 0.03 0.00 -0.44 0.00 0.00 62.40 62.16 1bdu h SER 180 CO -0.01 0.14 -1.16 1.88 -0.53 0.00 0.00 176.83 177.15 1bdu h TYR 181 N 0.29 1.03 -0.60 2.24 0.05 -1.08 -2.91 116.97 115.99 1bdu h TYR 181 Ca 0.14 -0.61 0.07 0.00 0.05 0.00 0.00 58.73 58.38 1bdu h TYR 181 Cb 0.08 -0.10 -0.04 0.00 1.01 0.00 0.00 36.73 37.68 1bdu h TYR 181 CO -0.11 1.45 0.40 0.00 -1.05 0.00 0.00 178.16 178.84 1bdu h ALA 182 N 0.34 1.87 -0.28 3.88 0.00 -1.18 -1.72 119.26 122.17 1bdu h ALA 182 Ca -0.16 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1bdu h ALA 182 Cb 1.83 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 1bdu h ALA 182 CO 0.22 0.02 -0.02 1.25 0.00 0.00 0.00 179.25 180.73 1bdu h LEU 183 N 0.53 0.49 -0.74 0.00 5.85 -1.39 -2.68 115.31 117.38 1bdu h LEU 183 Ca 0.26 -0.32 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 1bdu h LEU 183 Cb 0.35 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1bdu h LEU 183 CO -0.08 0.70 0.34 0.25 -0.34 0.00 0.00 178.44 179.31 1bdu h LEU 184 N 0.28 0.99 -0.34 2.25 5.85 -1.25 -1.10 115.31 121.99 1bdu h LEU 184 Ca 0.08 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.70 1bdu h LEU 184 Cb 0.46 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 1bdu h LEU 184 CO 0.02 0.86 0.08 0.58 -0.34 0.00 0.00 178.44 179.63 1bdu h VAL 185 N 1.05 0.84 -0.72 1.05 2.07 -1.30 -0.07 116.25 119.17 1bdu h VAL 185 Ca 0.25 -0.07 0.04 0.00 0.82 0.00 0.00 66.70 67.74 1bdu h VAL 185 Cb 0.15 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.50 1bdu h VAL 185 CO -0.03 0.04 0.44 0.45 0.02 0.00 0.00 177.57 178.49 1bdu h HIS 186 N 0.20 0.82 -0.22 1.57 3.86 -1.32 -0.37 115.15 119.68 1bdu h HIS 186 Ca 0.16 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.36 1bdu h HIS 186 Cb 0.17 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 1bdu h HIS 186 CO -0.18 0.45 -0.01 0.52 0.86 0.00 0.00 177.93 179.57 1bdu h MET 187 N 0.85 0.40 -0.47 2.45 2.07 -0.48 -1.88 114.93 117.87 1bdu h MET 187 Ca 0.30 -0.13 0.05 0.00 -2.07 0.00 0.00 59.70 57.84 1bdu h MET 187 Cb 0.07 -0.03 -0.05 0.00 -1.87 0.00 0.00 31.60 29.72 1bdu h MET 187 CO -0.13 0.60 0.21 0.52 1.07 0.00 0.00 176.91 179.18 1bdu h MET 188 N 0.16 0.40 -0.14 1.72 2.86 -0.99 -1.75 114.93 117.20 1bdu h MET 188 Ca 0.06 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 1bdu h MET 188 Cb 0.42 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 1bdu h MET 188 CO 0.01 0.27 -0.01 0.00 1.06 0.00 0.00 176.91 178.24 1bdu h ALA 189 N 1.27 0.11 -0.44 6.32 0.00 -1.01 -1.13 119.26 124.38 1bdu h ALA 189 Ca 0.21 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.22 1bdu h ALA 189 Cb 0.16 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1bdu h ALA 189 CO -0.18 -0.46 0.15 0.37 0.00 0.00 0.00 179.25 179.13 1bdu h GLN 190 N 0.03 0.30 -0.22 0.00 4.15 -1.16 -1.72 115.11 116.50 1bdu h GLN 190 Ca 0.06 -0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.40 1bdu h GLN 190 Cb 0.08 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 1bdu h GLN 190 CO -0.12 0.20 -0.17 1.96 -1.93 0.00 0.00 178.83 178.78 1bdu h GLN 191 N 0.31 0.37 -0.46 1.69 1.08 -0.93 -3.01 115.11 114.16 1bdu h GLN 191 Ca 0.21 -0.11 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1bdu h GLN 191 Cb 0.21 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1bdu h GLN 191 CO -0.22 0.53 0.00 0.00 -0.95 0.00 0.00 178.83 178.19 1bdu n ASP 193 N 0.93 -4.78 -4.74 0.00 8.00 -0.77 -4.95 116.55 110.24 1bdu n ASP 193 Ca 0.17 -0.46 -0.26 0.00 0.71 0.00 0.00 54.79 54.95 1bdu n ASP 193 Cb 0.42 -3.88 -0.06 0.00 -0.02 0.00 0.00 41.12 37.58 1bdu n ASP 193 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1bdu s LEU 194 N -6.78 3.57 0.60 0.64 1.43 -0.72 -5.04 118.68 112.38 1bdu s LEU 194 Ca 0.45 -0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 53.15 1bdu s LEU 194 Cb -0.22 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.77 1bdu s LEU 194 CO 0.55 0.06 1.00 -1.61 0.23 0.00 0.00 176.35 176.58 1bdu s GLU 195 N -3.17 3.64 0.25 1.70 0.41 -0.21 -4.32 118.70 117.00 1bdu s GLU 195 Ca 0.30 0.73 -0.21 0.00 -0.41 0.00 0.00 54.97 55.38 1bdu s GLU 195 Cb -0.09 -2.11 -0.09 0.00 -1.78 0.00 0.00 34.13 30.06 1bdu s GLU 195 CO 0.21 -0.50 0.78 0.14 -0.49 0.00 0.00 175.26 175.40 1bdu s VAL 196 N -3.08 4.49 0.00 2.63 -7.23 -1.26 -0.89 120.40 115.06 1bdu s VAL 196 Ca 0.55 1.40 0.00 0.00 -1.81 0.00 0.00 61.98 62.12 1bdu s VAL 196 Cb -0.11 -3.88 0.00 0.00 0.56 0.00 0.00 36.38 32.95 1bdu s VAL 196 CO 0.51 0.17 0.00 0.61 -0.31 0.00 0.00 175.10 176.08 1bdu n GLY 197 N 0.63 1.42 3.71 2.32 0.00 0.11 -4.50 105.19 108.88 1bdu n GLY 197 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1bdu n GLY 197 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bdu s ASP 198 N 0.50 5.30 -0.28 1.61 1.01 -1.24 -0.84 116.67 122.73 1bdu s ASP 198 Ca 0.00 0.08 -0.09 0.00 0.71 0.00 0.00 52.55 53.25 1bdu s ASP 198 Cb 0.00 -1.45 -0.02 0.00 1.01 0.00 0.00 42.92 42.45 1bdu s ASP 198 CO 0.00 0.31 0.12 0.12 0.21 0.00 0.00 175.17 175.92 1bdu s PHE 199 N -1.06 3.14 -0.27 4.23 5.36 0.06 -1.26 117.98 128.19 1bdu s PHE 199 Ca 0.19 -0.40 -0.09 0.00 -0.96 0.00 0.00 56.93 55.66 1bdu s PHE 199 Cb -0.12 -2.30 -0.04 0.00 -0.34 0.00 0.00 43.02 40.22 1bdu s PHE 199 CO 0.09 -0.37 0.14 0.08 -1.46 0.00 0.00 175.22 173.70 1bdu s VAL 200 N 1.64 4.90 -0.24 3.12 1.01 -0.05 -0.68 120.40 130.10 1bdu s VAL 200 Ca 0.06 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.99 1bdu s VAL 200 Cb -0.16 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1bdu s VAL 200 CO 0.06 0.29 0.08 0.86 0.00 0.00 0.00 175.10 176.39 1bdu s TRP 201 N 1.67 3.13 -0.15 5.22 -0.00 -0.00 -1.44 118.94 127.35 1bdu s TRP 201 Ca 0.07 -0.27 -0.01 0.00 -0.00 0.00 0.00 56.10 55.89 1bdu s TRP 201 Cb -0.16 -2.22 -0.01 0.00 -0.00 0.00 0.00 33.47 31.09 1bdu s TRP 201 CO 0.08 -0.24 -0.12 0.99 -0.00 0.00 0.00 176.95 177.66 1bdu s THR 202 N 1.38 3.00 0.15 5.86 2.01 0.04 -0.80 115.64 127.28 1bdu s THR 202 Ca 0.05 -0.66 0.11 0.00 0.31 0.00 0.00 61.69 61.50 1bdu s THR 202 Cb -0.15 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 70.04 1bdu s THR 202 CO 0.04 0.50 -0.24 -0.83 -0.69 0.00 0.00 174.62 173.40 1bdu s GLY 203 N 0.69 1.56 0.00 4.40 0.00 -0.24 -0.77 107.32 112.97 1bdu s GLY 203 Ca -0.06 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.16 1bdu s GLY 203 CO 0.02 -1.51 0.00 0.61 0.00 0.00 0.00 173.10 172.22 1bdu n GLY 204 N 0.66 1.08 3.55 0.20 0.00 0.32 -1.91 105.19 109.09 1bdu n GLY 204 Ca -0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 1bdu n GLY 204 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bdu s ASP 205 N -1.00 5.61 -0.28 1.61 -1.08 -0.29 -2.24 116.67 119.00 1bdu s ASP 205 Ca 0.00 -0.05 -0.09 0.00 -0.52 0.00 0.00 52.55 51.90 1bdu s ASP 205 Cb 0.00 -2.54 -0.02 0.00 -1.46 0.00 0.00 42.92 38.89 1bdu s ASP 205 CO 0.00 -2.19 0.12 -0.89 0.52 0.00 0.00 175.17 172.73 1bdu s THR 206 N 7.87 4.58 0.15 1.71 2.01 0.16 -1.73 115.64 130.38 1bdu s THR 206 Ca 0.56 -0.22 -0.03 0.00 0.31 0.00 0.00 61.69 62.31 1bdu s THR 206 Cb -0.10 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 1bdu s THR 206 CO 0.17 0.21 0.12 -1.38 -0.69 0.00 0.00 174.62 173.05 1bdu s HIS 207 N 1.64 0.80 -0.10 4.92 -3.43 -0.48 -1.01 115.29 117.64 1bdu s HIS 207 Ca 0.06 -1.15 0.01 0.00 -0.80 0.00 0.00 55.06 53.18 1bdu s HIS 207 Cb -0.16 -0.39 0.02 0.00 -1.43 0.00 0.00 32.58 30.62 1bdu s HIS 207 CO 0.06 -0.59 -0.12 -0.51 -2.00 0.00 0.00 174.74 171.58 1bdu s LEU 208 N -3.05 1.53 0.29 5.38 1.43 -0.28 -0.75 118.68 123.23 1bdu s LEU 208 Ca 0.25 -0.35 -0.29 0.00 -1.03 0.00 0.00 54.13 52.70 1bdu s LEU 208 Cb 0.06 -0.94 -0.10 0.00 0.03 0.00 0.00 46.19 45.25 1bdu s LEU 208 CO 0.03 -0.03 1.33 -0.31 0.23 0.00 0.00 176.35 177.60 1bdu s TYR 209 N 1.14 3.09 0.33 0.29 2.02 -1.26 -0.56 117.35 122.40 1bdu s TYR 209 Ca -0.05 1.32 0.05 0.00 -0.37 0.00 0.00 57.07 58.02 1bdu s TYR 209 Cb -0.14 -3.68 0.69 0.00 -0.40 0.00 0.00 41.96 38.42 1bdu s TYR 209 CO -0.03 -1.98 1.88 0.66 -1.57 0.00 0.00 175.55 174.51 1bdu h SER 210 N 4.05 0.77 -0.05 2.29 4.64 -1.54 -1.01 113.55 122.70 1bdu h SER 210 Ca -0.48 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1bdu h SER 210 Cb 1.22 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1bdu h SER 210 CO 0.70 0.43 0.00 -0.46 -0.87 0.00 0.00 176.83 176.63 1bdu n ASN 211 N -4.55 1.16 -0.35 4.97 6.94 -1.26 -2.93 115.26 119.24 1bdu n ASN 211 Ca 0.16 -2.06 0.03 0.00 -0.02 0.00 0.00 54.58 52.70 1bdu n ASN 211 Cb 0.36 -0.42 0.09 0.00 -2.36 0.00 0.00 39.78 37.45 1bdu n ASN 211 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1bdu n HIS 212 N -0.03 0.26 -0.31 -2.53 8.25 -0.38 -4.79 115.22 115.68 1bdu n HIS 212 Ca 0.02 -0.52 -0.04 0.00 -0.26 0.00 0.00 57.72 56.92 1bdu n HIS 212 Cb 0.27 -0.05 0.08 0.00 1.12 0.00 0.00 29.99 31.41 1bdu n HIS 212 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1bdu h MET 213 N 1.07 1.17 -0.53 -0.41 2.86 -1.65 -2.11 114.93 115.34 1bdu h MET 213 Ca 0.00 -0.12 -0.06 0.00 -2.06 0.00 0.00 59.70 57.45 1bdu h MET 213 Cb 0.66 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 1bdu h MET 213 CO 0.01 0.85 0.08 -0.44 1.06 0.00 0.00 176.91 178.47 1bdu h ASP 214 N 1.18 0.84 -0.63 1.22 3.32 -1.88 -2.44 116.42 118.03 1bdu h ASP 214 Ca 0.30 -0.26 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 1bdu h ASP 214 Cb -0.00 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 1bdu h ASP 214 CO -0.05 0.88 0.18 1.56 -1.72 0.00 0.00 179.24 180.09 1bdu h GLN 215 N 0.75 1.00 -0.44 3.56 7.50 -1.88 -0.89 115.11 124.71 1bdu h GLN 215 Ca 0.16 -0.23 -0.09 0.00 0.50 0.00 0.00 58.65 58.99 1bdu h GLN 215 Cb 0.40 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.78 1bdu h GLN 215 CO 0.01 0.89 -0.07 1.79 -1.50 0.00 0.00 178.83 179.95 1bdu h THR 216 N 0.92 1.27 -0.55 -0.54 1.35 -1.33 -0.83 112.91 113.19 1bdu h THR 216 Ca 0.20 -1.16 -0.01 0.00 -0.55 0.00 0.00 66.41 64.89 1bdu h THR 216 Cb 0.33 1.12 -0.03 0.00 -1.73 0.00 0.00 68.15 67.84 1bdu h THR 216 CO -0.00 0.40 0.32 0.45 -0.25 0.00 0.00 175.52 176.43 1bdu h HIS 217 N 0.67 0.74 -0.48 4.73 3.86 -1.38 -0.73 115.15 122.56 1bdu h HIS 217 Ca 0.12 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.37 1bdu h HIS 217 Cb 0.60 -0.24 -0.05 0.00 1.06 0.00 0.00 27.41 28.78 1bdu h HIS 217 CO 0.05 0.52 0.20 1.25 0.86 0.00 0.00 177.93 180.81 1bdu h LEU 218 N 0.74 0.24 -0.61 2.43 5.85 -0.88 -2.85 115.31 120.23 1bdu h LEU 218 Ca 0.20 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.90 1bdu h LEU 218 Cb 0.01 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 1bdu h LEU 218 CO -0.03 0.17 0.12 -0.61 -0.34 0.00 0.00 178.44 177.75 1bdu h GLN 219 N 0.39 0.99 0.00 1.25 4.15 -0.97 -2.52 115.11 118.41 1bdu h GLN 219 Ca 0.22 -0.25 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1bdu h GLN 219 Cb 0.19 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.76 1bdu h GLN 219 CO -0.20 0.92 0.00 -0.07 -1.93 0.00 0.00 178.83 177.55 1bdu h LEU 220 N 0.90 0.00 -1.30 -2.39 3.38 -1.05 -2.14 115.31 112.71 1bdu h LEU 220 Ca 0.19 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 1bdu h LEU 220 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1bdu h LEU 220 CO 0.01 0.00 -0.22 0.28 0.09 0.00 0.00 178.44 178.60 1bdu h SER 221 N 0.00 0.20 -3.45 -0.43 0.02 -1.21 -3.45 113.55 105.23 1bdu h SER 221 Ca 0.00 -0.05 -0.53 0.00 -0.84 0.00 0.00 61.79 60.37 1bdu h SER 221 Cb 0.13 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1bdu h SER 221 CO 0.00 0.43 0.41 -0.13 -1.14 0.00 0.00 176.83 176.40 1bdu s ARG 222 N -4.54 4.59 0.02 3.45 3.00 -0.81 -5.06 118.95 119.60 1bdu s ARG 222 Ca -0.05 1.52 -0.30 0.00 0.00 0.00 0.00 55.73 56.90 1bdu s ARG 222 Cb 0.15 -3.39 -0.05 0.00 0.00 0.00 0.00 34.95 31.66 1bdu s ARG 222 CO 0.74 0.02 1.16 -1.21 0.00 0.00 0.00 175.30 176.01 1bdu s GLU 223 N 0.51 4.43 0.48 3.54 0.41 -1.26 -5.01 118.70 121.80 1bdu s GLU 223 Ca 0.51 1.68 -0.24 0.00 -0.41 0.00 0.00 54.97 56.52 1bdu s GLU 223 Cb -0.24 -3.42 -0.08 0.00 -1.78 0.00 0.00 34.13 28.61 1bdu s GLU 223 CO 0.30 -0.27 1.26 -0.35 -0.49 0.00 0.00 175.26 175.71 1bdu n PRO 224 N 4.25 1.75 -3.72 0.39 -0.04 -1.26 -4.83 135.00 131.54 1bdu n PRO 224 Ca 0.09 0.63 -0.27 0.00 -0.04 0.00 0.00 63.50 63.91 1bdu n PRO 224 Cb 0.47 -2.42 -0.03 0.00 -0.04 0.00 0.00 33.50 31.48 1bdu n PRO 224 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1bdu s ARG 225 N -2.48 3.51 0.05 0.54 3.00 -1.26 -5.06 118.95 117.25 1bdu s ARG 225 Ca 0.66 -0.39 -0.38 0.00 0.00 0.00 0.00 55.73 55.62 1bdu s ARG 225 Cb -0.47 -2.84 -0.18 0.00 0.00 0.00 0.00 34.95 31.46 1bdu s ARG 225 CO 0.54 0.40 1.14 -0.35 0.00 0.00 0.00 175.30 177.03 1bdu n PRO 226 N -0.76 0.49 -2.10 3.54 -0.04 -1.26 -4.88 135.00 129.99 1bdu n PRO 226 Ca -0.05 0.18 -0.39 0.00 -0.04 0.00 0.00 63.50 63.20 1bdu n PRO 226 Cb 0.54 -1.70 -0.00 0.00 -0.04 0.00 0.00 33.50 32.30 1bdu n PRO 226 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1bdu s LEU 227 N 0.38 4.12 0.94 1.53 1.43 -1.26 -4.79 118.68 121.03 1bdu s LEU 227 Ca 0.86 2.54 -0.12 0.00 -1.03 0.00 0.00 54.13 56.37 1bdu s LEU 227 Cb -1.11 -4.05 0.16 0.00 0.03 0.00 0.00 46.19 41.22 1bdu s LEU 227 CO 0.53 -0.93 1.13 -2.16 0.23 0.00 0.00 176.35 175.15 1bdu s PRO 228 N -2.44 0.89 -0.19 1.29 0.04 -1.25 -4.69 135.00 128.65 1bdu s PRO 228 Ca 0.60 0.32 -0.03 0.00 0.04 0.00 0.00 61.00 61.93 1bdu s PRO 228 Cb -0.35 -1.81 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 1bdu s PRO 228 CO 0.44 -2.37 -0.05 0.21 0.04 0.00 0.00 177.00 175.27 1bdu s LYS 229 N -5.21 3.46 -0.23 4.56 2.20 0.18 -0.11 119.74 124.58 1bdu s LYS 229 Ca 0.64 -0.60 -0.22 0.00 -0.36 0.00 0.00 55.97 55.44 1bdu s LYS 229 Cb -0.16 -2.95 -0.02 0.00 -1.51 0.00 0.00 37.83 33.19 1bdu s LYS 229 CO 0.54 -0.04 0.69 -1.17 -0.36 0.00 0.00 175.35 175.01 1bdu s LEU 230 N 1.08 4.10 -0.15 5.43 1.98 -1.26 -0.41 118.68 129.45 1bdu s LEU 230 Ca 0.01 0.85 -0.02 0.00 -2.89 0.00 0.00 54.13 52.08 1bdu s LEU 230 Cb -0.15 -2.96 -0.02 0.00 0.66 0.00 0.00 46.19 43.72 1bdu s LEU 230 CO -0.00 -0.37 -0.07 -0.51 -1.89 0.00 0.00 176.35 173.51 1bdu s ILE 231 N 2.35 3.56 -0.34 6.68 1.10 -0.17 -4.99 121.20 129.39 1bdu s ILE 231 Ca 0.30 -0.47 -0.12 0.00 -0.51 0.00 0.00 60.65 59.84 1bdu s ILE 231 Cb -0.16 -2.54 -0.01 0.00 0.15 0.00 0.00 42.46 39.90 1bdu s ILE 231 CO 0.09 0.50 0.22 -0.63 -2.11 0.00 0.00 174.94 173.01 1bdu s ILE 232 N 0.43 5.07 -1.19 2.00 1.01 -1.26 -1.13 121.20 126.13 1bdu s ILE 232 Ca -0.06 -0.34 0.21 0.00 0.00 0.00 0.00 60.65 60.45 1bdu s ILE 232 Cb -0.15 -3.63 0.25 0.00 0.01 0.00 0.00 42.46 38.95 1bdu s ILE 232 CO 0.04 -0.03 1.66 0.29 0.00 0.00 0.00 174.94 176.90 1bdu n LYS 233 N 5.07 0.13 -3.70 2.79 5.02 0.64 -4.80 118.16 123.32 1bdu n LYS 233 Ca -0.13 0.12 -0.13 0.00 -2.02 0.00 0.00 58.31 56.15 1bdu n LYS 233 Cb 0.49 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.91 1bdu n LYS 233 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1bdu s ARG 234 N -2.81 0.61 -0.53 1.97 3.52 -1.26 -5.11 118.95 115.33 1bdu s ARG 234 Ca 0.14 0.72 -0.18 0.00 -0.13 0.00 0.00 55.73 56.29 1bdu s ARG 234 Cb 0.14 0.30 0.09 0.00 -1.56 0.00 0.00 34.95 33.91 1bdu s ARG 234 CO 0.35 -0.07 0.57 0.21 -0.81 0.00 0.00 175.30 175.54 1bdu s LYS 235 N 0.28 3.04 0.80 5.12 2.20 -1.26 -5.07 119.74 124.84 1bdu s LYS 235 Ca -0.00 -1.31 -0.13 0.00 -0.36 0.00 0.00 55.97 54.18 1bdu s LYS 235 Cb -0.04 -4.20 0.08 0.00 -1.51 0.00 0.00 37.83 32.16 1bdu s LYS 235 CO 0.01 -1.29 1.16 -2.14 -0.36 0.00 0.00 175.35 172.72 1bdu s PRO 236 N 2.19 1.81 0.25 4.03 0.02 -1.26 -4.94 135.00 137.09 1bdu s PRO 236 Ca 0.09 1.57 0.23 0.00 0.02 0.00 0.00 61.00 62.91 1bdu s PRO 236 Cb -0.24 -1.81 0.96 0.00 0.02 0.00 0.00 34.50 33.43 1bdu s PRO 236 CO 0.07 -2.05 1.70 -1.91 -0.33 0.00 0.00 177.00 174.48 1bdu n GLU 237 N -3.35 0.19 -3.75 5.54 2.13 -1.26 -4.81 120.64 115.32 1bdu n GLU 237 Ca 0.12 0.41 -0.08 0.00 0.66 0.00 0.00 57.16 58.27 1bdu n GLU 237 Cb 0.51 -1.86 -0.02 0.00 0.27 0.00 0.00 31.44 30.35 1bdu n GLU 237 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1bdu s SER 238 N -4.20 -0.33 0.64 4.31 1.04 -1.26 -5.03 113.70 108.87 1bdu s SER 238 Ca 0.04 -0.46 0.42 0.00 0.48 0.00 0.00 55.95 56.43 1bdu s SER 238 Cb 0.09 0.70 2.19 0.00 0.10 0.00 0.00 66.02 69.10 1bdu s SER 238 CO 0.39 -1.25 2.28 -0.29 0.98 0.00 0.00 173.24 175.35 1bdu h ILE 239 N 2.00 0.00 -0.04 -1.02 6.09 -1.94 -2.24 117.51 120.36 1bdu h ILE 239 Ca -0.23 -0.11 0.00 0.00 -1.37 0.00 0.00 64.86 63.15 1bdu h ILE 239 Cb 1.26 1.11 0.00 0.00 0.47 0.00 0.00 36.82 39.66 1bdu h ILE 239 CO 0.27 0.00 0.00 0.49 -3.07 0.00 0.00 178.15 175.84 1bdu n PHE 240 N -3.07 0.03 -0.97 2.19 3.72 -1.26 -4.32 117.46 113.78 1bdu n PHE 240 Ca -0.02 -0.01 0.07 0.00 -0.05 0.00 0.00 57.45 57.43 1bdu n PHE 240 Cb 0.12 0.00 0.33 0.00 -0.94 0.00 0.00 39.48 38.99 1bdu n PHE 240 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1bdu n ASP 241 N 0.67 4.74 -4.85 4.37 8.00 -0.84 -4.98 116.55 123.67 1bdu n ASP 241 Ca 0.17 -3.01 -0.32 0.00 0.71 0.00 0.00 54.79 52.34 1bdu n ASP 241 Cb 0.45 -0.62 -0.04 0.00 -0.02 0.00 0.00 41.12 40.90 1bdu n ASP 241 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1bdu s TYR 242 N -2.83 3.44 0.06 1.24 1.51 -1.26 -4.82 117.35 114.69 1bdu s TYR 242 Ca 0.49 1.39 0.05 0.00 -1.01 0.00 0.00 57.07 57.99 1bdu s TYR 242 Cb 0.38 -2.72 -0.03 0.00 -0.11 0.00 0.00 41.96 39.48 1bdu s TYR 242 CO 0.12 -0.28 -0.14 1.03 -1.11 0.00 0.00 175.55 175.17 1bdu s ARG 243 N -3.91 0.88 0.32 -0.62 0.52 -1.26 -5.05 118.95 109.82 1bdu s ARG 243 Ca 0.58 -0.87 0.09 0.00 -0.52 0.00 0.00 55.73 55.00 1bdu s ARG 243 Cb -0.10 -0.89 0.92 0.00 0.52 0.00 0.00 34.95 35.40 1bdu s ARG 243 CO 0.29 0.21 1.65 0.35 0.02 0.00 0.00 175.30 177.82 1bdu h PHE 244 N 4.57 0.65 0.00 -0.53 3.57 -1.97 0.07 116.94 123.29 1bdu h PHE 244 Ca -0.40 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.15 1bdu h PHE 244 Cb 1.19 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.80 1bdu h PHE 244 CO 0.59 -0.21 0.00 -0.85 -2.23 0.00 0.00 178.31 175.61 1bdu n GLU 245 N -5.15 0.79 0.13 1.11 0.00 -1.26 -3.09 120.64 113.17 1bdu n GLU 245 Ca 0.27 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.56 1bdu n GLU 245 Cb 0.86 -1.50 0.44 0.00 0.00 0.00 0.00 31.44 31.24 1bdu n GLU 245 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1bdu h ASP 246 N 0.00 0.00 -3.45 -1.84 3.32 -1.38 -3.46 116.42 109.62 1bdu h ASP 246 Ca 0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 1bdu h ASP 246 Cb 0.00 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 39.32 1bdu h ASP 246 CO 0.00 0.00 -0.72 -0.36 -1.72 0.00 0.00 179.24 176.44 1bdu s PHE 247 N -3.21 2.90 -0.01 4.55 0.08 -1.18 -0.26 117.98 120.86 1bdu s PHE 247 Ca 0.08 -0.34 0.02 0.00 0.12 0.00 0.00 56.93 56.81 1bdu s PHE 247 Cb 0.11 -1.84 -0.00 0.00 -0.57 0.00 0.00 43.02 40.72 1bdu s PHE 247 CO 0.52 0.00 -0.07 -1.21 -0.10 0.00 0.00 175.22 174.36 1bdu s GLU 248 N 0.01 0.60 -0.20 0.44 2.02 -0.29 -5.00 118.70 116.28 1bdu s GLU 248 Ca -0.02 -0.24 -0.05 0.00 0.02 0.00 0.00 54.97 54.68 1bdu s GLU 248 Cb -0.14 -0.58 -0.02 0.00 0.10 0.00 0.00 34.13 33.49 1bdu s GLU 248 CO 0.03 0.13 -0.00 0.42 0.02 0.00 0.00 175.26 175.87 1bdu s ILE 249 N -0.08 3.97 -0.08 -1.63 -1.09 -1.26 -1.00 121.20 120.03 1bdu s ILE 249 Ca 0.02 -0.31 0.02 0.00 -2.23 0.00 0.00 60.65 58.14 1bdu s ILE 249 Cb -0.04 -2.79 -0.02 0.00 -1.58 0.00 0.00 42.46 38.03 1bdu s ILE 249 CO -0.00 0.43 -0.13 -0.70 -1.23 0.00 0.00 174.94 173.31 1bdu s GLU 250 N 0.94 2.89 -0.07 2.79 2.12 0.45 -4.70 118.70 123.12 1bdu s GLU 250 Ca 0.01 -0.67 0.00 0.00 0.36 0.00 0.00 54.97 54.67 1bdu s GLU 250 Cb -0.14 -2.51 0.00 0.00 0.26 0.00 0.00 34.13 31.74 1bdu s GLU 250 CO 0.02 0.46 0.00 0.41 -0.54 0.00 0.00 175.26 175.61 1bdu n GLY 251 N 2.79 0.36 3.46 -1.50 0.00 -1.26 -0.65 105.19 108.39 1bdu n GLY 251 Ca -0.18 -0.89 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 1bdu n GLY 251 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1bdu s TYR 252 N -2.04 3.19 -0.58 1.61 5.04 -1.26 -4.28 117.35 119.03 1bdu s TYR 252 Ca 0.00 -0.52 0.05 0.00 -2.44 0.00 0.00 57.07 54.16 1bdu s TYR 252 Cb 0.00 -2.89 0.18 0.00 0.35 0.00 0.00 41.96 39.60 1bdu s TYR 252 CO 0.00 -0.71 0.45 -3.47 -1.34 0.00 0.00 175.55 170.48 1bdu n ASP 253 N 5.47 1.58 -4.80 4.32 2.03 -1.26 -5.10 116.55 118.79 1bdu n ASP 253 Ca -0.09 -2.88 -0.29 0.00 0.52 0.00 0.00 54.79 52.05 1bdu n ASP 253 Cb 0.47 -0.67 0.11 0.00 -0.72 0.00 0.00 41.12 40.31 1bdu n ASP 253 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1bdu s PRO 254 N -0.91 1.69 0.86 -0.67 0.04 -1.26 -4.89 135.00 129.85 1bdu s PRO 254 Ca 0.29 0.50 -0.12 0.00 0.04 0.00 0.00 61.00 61.71 1bdu s PRO 254 Cb 0.01 -1.88 0.11 0.00 0.04 0.00 0.00 34.50 32.77 1bdu s PRO 254 CO -0.17 -1.86 1.13 -1.01 0.04 0.00 0.00 177.00 175.13 1bdu s HIS 255 N -3.20 2.70 0.72 0.56 3.76 0.16 -4.90 115.29 115.10 1bdu s HIS 255 Ca 0.62 0.92 -0.16 0.00 -0.15 0.00 0.00 55.06 56.29 1bdu s HIS 255 Cb -0.15 -3.33 0.03 0.00 1.11 0.00 0.00 32.58 30.25 1bdu s HIS 255 CO 0.54 -2.07 1.24 -2.30 -0.85 0.00 0.00 174.74 171.30 1bdu n PRO 256 N -3.57 0.68 -1.93 8.40 -0.02 -1.26 -2.08 135.00 135.22 1bdu n PRO 256 Ca 0.07 0.30 -0.38 0.00 -2.02 0.00 0.00 63.50 61.47 1bdu n PRO 256 Cb 0.59 -2.48 0.02 0.00 -0.02 0.00 0.00 33.50 31.61 1bdu n PRO 256 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1bdu s GLY 257 N -1.71 2.86 -0.17 -1.23 0.00 -1.26 -3.26 107.32 102.55 1bdu s GLY 257 Ca 0.78 1.22 -0.01 0.00 0.00 0.00 0.00 44.72 46.71 1bdu s GLY 257 CO 0.45 1.72 -0.12 -0.42 0.00 0.00 0.00 173.10 174.73 1bdu s ILE 258 N -1.37 2.91 0.13 0.90 1.01 -1.26 -4.84 121.20 118.68 1bdu s ILE 258 Ca 0.69 -0.68 -0.30 0.00 0.00 0.00 0.00 60.65 60.36 1bdu s ILE 258 Cb -0.37 -2.25 -0.06 0.00 0.01 0.00 0.00 42.46 39.78 1bdu s ILE 258 CO 0.44 0.50 0.97 -0.54 0.00 0.00 0.00 174.94 176.31 1bdu s LYS 259 N 0.88 4.71 -0.29 2.79 -0.14 -1.26 -5.04 119.74 121.38 1bdu s LYS 259 Ca -0.03 1.48 0.03 0.00 -1.36 0.00 0.00 55.97 56.09 1bdu s LYS 259 Cb -0.15 -3.36 0.08 0.00 -1.68 0.00 0.00 37.83 32.72 1bdu s LYS 259 CO -0.00 0.23 -0.04 0.00 -0.76 0.00 0.00 175.35 174.78 1bdu s ALA 260 N -0.13 2.72 0.68 5.17 0.00 -1.26 -4.97 121.76 123.97 1bdu s ALA 260 Ca 0.47 -2.09 -0.11 0.00 0.00 0.00 0.00 51.96 50.23 1bdu s ALA 260 Cb -0.24 -1.76 0.00 0.00 0.00 0.00 0.00 23.12 21.12 1bdu s ALA 260 CO 0.30 -1.41 1.06 -1.25 0.00 0.00 0.00 175.76 174.46 1bdu s PRO 261 N 1.02 3.04 0.03 0.00 0.04 -1.26 -5.08 135.00 132.79 1bdu s PRO 261 Ca -0.01 0.83 0.04 0.00 0.04 0.00 0.00 61.00 61.91 1bdu s PRO 261 Cb -0.20 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.31 1bdu s PRO 261 CO -0.06 -0.99 -0.13 0.14 0.04 0.00 0.00 177.00 175.99 1bdu s VAL 262 N -3.12 1.03 0.69 -0.36 -7.23 -1.26 -4.92 120.40 105.24 1bdu s VAL 262 Ca 0.57 -0.87 -0.11 0.00 -1.81 0.00 0.00 61.98 59.77 1bdu s VAL 262 Cb -0.13 -0.93 0.01 0.00 0.56 0.00 0.00 36.38 35.89 1bdu s VAL 262 CO 0.54 0.06 1.06 0.00 -0.31 0.00 0.00 175.10 176.45 1bdu s ALA 263 N -0.72 2.69 0.00 1.32 0.00 -1.26 -5.23 121.76 118.56 1bdu s ALA 263 Ca 0.02 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.07 1bdu s ALA 263 Cb -0.07 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1bdu s ALA 263 CO 0.01 -1.20 0.44 1.51 0.00 0.00 0.00 175.76 176.52