#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bbq h LYS 2 N 0.00 -0.11 -0.69 0.03 3.64 -1.98 -2.38 116.57 115.08 2bbq h LYS 2 Ca 0.00 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.50 2bbq h LYS 2 Cb 0.00 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 31.77 2bbq h LYS 2 CO 0.00 -0.07 0.30 1.96 -2.27 0.00 0.00 179.45 179.37 2bbq h GLN 3 N -0.11 0.48 0.07 1.90 7.50 -1.99 -1.38 115.11 121.58 2bbq h GLN 3 Ca 0.05 -0.03 -0.00 0.00 0.50 0.00 0.00 58.65 59.16 2bbq h GLN 3 Cb 0.18 -0.11 0.00 0.00 0.05 0.00 0.00 27.48 27.60 2bbq h GLN 3 CO -0.11 0.32 -0.03 -0.92 -1.50 0.00 0.00 178.83 176.58 2bbq h TYR 4 N 0.50 -0.08 0.00 2.96 3.20 -1.96 -1.98 116.97 119.61 2bbq h TYR 4 Ca 0.36 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.15 2bbq h TYR 4 Cb 0.45 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 2bbq h TYR 4 CO -0.14 0.18 -0.38 -0.07 -1.64 0.00 0.00 178.16 176.11 2bbq h LEU 5 N -0.34 0.00 -0.53 2.82 -0.00 -1.16 -0.52 115.31 115.58 2bbq h LEU 5 Ca -0.01 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.72 2bbq h LEU 5 Cb 0.30 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.95 2bbq h LEU 5 CO 0.01 0.38 -0.49 -0.33 -0.00 0.00 0.00 178.44 178.01 2bbq h GLU 6 N 0.00 0.63 -0.58 1.13 5.08 -1.18 -0.47 114.58 119.20 2bbq h GLU 6 Ca -0.00 -0.37 -0.11 0.00 -1.00 0.00 0.00 59.36 57.88 2bbq h GLU 6 Cb 0.69 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 2bbq h GLU 6 CO 0.05 0.98 -0.05 1.25 -1.00 0.00 0.00 179.01 180.23 2bbq h LEU 7 N 0.50 1.05 -0.17 1.33 5.85 -0.92 -0.76 115.31 122.19 2bbq h LEU 7 Ca 0.02 -0.32 -0.00 0.00 0.84 0.00 0.00 57.88 58.42 2bbq h LEU 7 Cb 1.03 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2bbq h LEU 7 CO 0.10 1.12 0.10 -0.03 -0.34 0.00 0.00 178.44 179.39 2bbq h MET 8 N 0.95 0.23 -0.82 1.25 4.05 -0.80 -1.99 114.93 117.80 2bbq h MET 8 Ca 0.16 -0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.59 2bbq h MET 8 Cb 0.62 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 31.32 2bbq h MET 8 CO 0.04 0.19 0.52 0.37 0.23 0.00 0.00 176.91 178.27 2bbq h GLN 9 N 0.19 0.98 -0.65 0.39 5.75 -1.04 -2.66 115.11 118.08 2bbq h GLN 9 Ca 0.06 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 2bbq h GLN 9 Cb 0.03 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.32 2bbq h GLN 9 CO -0.01 0.65 0.36 -0.22 -2.65 0.00 0.00 178.83 176.96 2bbq h LYS 10 N 1.01 0.89 -0.02 1.69 3.64 -0.88 -0.23 116.57 122.67 2bbq h LYS 10 Ca 0.33 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2bbq h LYS 10 Cb 0.01 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.65 2bbq h LYS 10 CO -0.11 0.64 -0.00 0.28 -2.27 0.00 0.00 179.45 177.99 2bbq h VAL 11 N 0.90 1.26 -0.72 2.00 2.07 -1.03 0.11 116.25 120.84 2bbq h VAL 11 Ca 0.23 -0.77 0.02 0.00 0.82 0.00 0.00 66.70 67.00 2bbq h VAL 11 Cb 0.01 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 2bbq h VAL 11 CO -0.04 0.21 0.47 -0.07 0.02 0.00 0.00 177.57 178.15 2bbq h LEU 12 N -0.28 0.79 -0.46 2.57 3.38 -1.31 0.14 115.31 120.13 2bbq h LEU 12 Ca 0.01 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2bbq h LEU 12 Cb 0.33 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2bbq h LEU 12 CO 0.00 0.56 -0.46 0.44 0.09 0.00 0.00 178.44 179.07 2bbq h ASP 13 N 0.93 0.00 0.00 -0.43 3.32 -0.79 -3.37 116.42 116.09 2bbq h ASP 13 Ca 0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 2bbq h ASP 13 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2bbq h ASP 13 CO -0.08 0.46 0.00 -0.62 -1.72 0.00 0.00 179.24 177.27 2bbq n GLU 14 N -3.37 3.39 -2.40 3.56 1.02 0.38 -5.07 120.64 118.15 2bbq n GLU 14 Ca 0.01 -0.16 -0.39 0.00 -0.02 0.00 0.00 57.16 56.60 2bbq n GLU 14 Cb 0.63 -0.62 -0.03 0.00 -0.02 0.00 0.00 31.44 31.40 2bbq n GLU 14 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2bbq s GLY 15 N -0.53 2.93 0.11 0.62 0.00 0.47 -4.88 107.32 106.03 2bbq s GLY 15 Ca 0.00 0.91 -0.24 0.00 0.00 0.00 0.00 44.72 45.39 2bbq s GLY 15 CO 0.00 1.45 0.74 -1.59 0.00 0.00 0.00 173.10 173.70 2bbq s THR 16 N -1.34 4.56 0.10 0.90 2.01 -0.38 -4.71 115.64 116.78 2bbq s THR 16 Ca 0.51 1.59 -0.31 0.00 0.31 0.00 0.00 61.69 63.80 2bbq s THR 16 Cb -0.30 -4.09 -0.07 0.00 0.01 0.00 0.00 72.50 68.05 2bbq s THR 16 CO 0.38 0.47 1.33 -1.10 -0.69 0.00 0.00 174.62 175.01 2bbq s GLN 17 N -0.74 4.36 0.05 4.92 -1.52 -1.26 -1.33 119.66 124.15 2bbq s GLN 17 Ca 0.36 1.98 0.05 0.00 -1.95 0.00 0.00 55.36 55.79 2bbq s GLN 17 Cb -0.22 -3.28 -0.02 0.00 -0.22 0.00 0.00 33.01 29.27 2bbq s GLN 17 CO 0.24 -0.37 -0.14 0.15 -0.25 0.00 0.00 175.29 174.92 2bbq s LYS 18 N 1.03 0.86 -0.19 2.91 -0.14 -0.66 -4.96 119.74 118.59 2bbq s LYS 18 Ca 0.62 -0.84 -0.18 0.00 -1.36 0.00 0.00 55.97 54.21 2bbq s LYS 18 Cb -0.34 -0.86 -0.03 0.00 -1.68 0.00 0.00 37.83 34.92 2bbq s LYS 18 CO 0.30 0.20 0.51 1.21 -0.76 0.00 0.00 175.35 176.82 2bbq s ASN 19 N -1.41 6.58 0.57 2.83 3.84 -1.26 -2.21 114.94 123.88 2bbq s ASN 19 Ca -0.00 0.69 0.06 0.00 0.21 0.00 0.00 52.86 53.81 2bbq s ASN 19 Cb -0.09 -2.29 0.06 0.00 -0.55 0.00 0.00 41.25 38.38 2bbq s ASN 19 CO 0.02 -0.16 0.48 1.51 -2.79 0.00 0.00 177.10 176.16 2bbq s ASP 20 N 1.10 4.67 0.36 -4.21 -4.77 -1.26 -4.98 116.67 107.57 2bbq s ASP 20 Ca 0.24 -1.24 0.06 0.00 -3.30 0.00 0.00 52.55 48.31 2bbq s ASP 20 Cb -0.15 0.55 0.68 0.00 -1.09 0.00 0.00 42.92 42.91 2bbq s ASP 20 CO 0.10 -1.22 1.91 0.08 0.70 0.00 0.00 175.17 176.73 2bbq h ARG 21 N 0.59 0.46 -0.05 2.11 0.11 -1.98 0.15 114.38 115.77 2bbq h ARG 21 Ca -0.35 -0.09 0.01 0.00 0.10 0.00 0.00 59.98 59.66 2bbq h ARG 21 Cb 1.31 -0.07 -0.00 0.00 1.11 0.00 0.00 29.97 32.31 2bbq h ARG 21 CO 0.54 0.49 0.05 1.15 0.10 0.00 0.00 179.97 182.30 2bbq h THR 22 N 0.45 0.59 -0.01 0.08 2.02 -1.96 -3.47 112.91 110.61 2bbq h THR 22 Ca 0.10 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 2bbq h THR 22 Cb 0.29 0.96 -0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2bbq h THR 22 CO 0.01 0.00 -0.00 0.61 0.37 0.00 0.00 175.52 176.50 2bbq n GLY 23 N -1.38 0.36 0.09 2.16 0.00 0.04 -4.91 105.19 101.54 2bbq n GLY 23 Ca -0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 46.02 45.94 2bbq n GLY 23 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2bbq h THR 24 N 0.00 1.32 0.00 2.61 2.02 -1.91 -3.47 112.91 113.49 2bbq h THR 24 Ca -0.01 -2.93 0.00 0.00 0.77 0.00 0.00 66.41 64.24 2bbq h THR 24 Cb 0.33 2.64 0.00 0.00 -1.74 0.00 0.00 68.15 69.38 2bbq h THR 24 CO 0.01 0.75 0.00 0.61 0.37 0.00 0.00 175.52 177.26 2bbq n GLY 25 N 1.34 1.83 3.27 2.16 0.00 -1.26 -4.43 105.19 108.09 2bbq n GLY 25 Ca -0.02 -1.64 -0.13 0.00 0.00 0.00 0.00 46.02 44.23 2bbq n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bbq s THR 26 N -1.68 0.06 -0.22 2.61 2.01 -0.94 -1.75 115.64 115.72 2bbq s THR 26 Ca 0.00 -0.47 -0.06 0.00 0.31 0.00 0.00 61.69 61.48 2bbq s THR 26 Cb 0.00 -0.73 -0.02 0.00 0.01 0.00 0.00 72.50 71.76 2bbq s THR 26 CO 0.00 -0.26 0.02 -0.76 -0.69 0.00 0.00 174.62 172.93 2bbq s LEU 27 N -1.49 3.23 0.16 4.42 1.43 -0.38 -1.65 118.68 124.39 2bbq s LEU 27 Ca -0.11 -0.25 0.11 0.00 -1.03 0.00 0.00 54.13 52.85 2bbq s LEU 27 Cb -0.04 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 2bbq s LEU 27 CO 0.03 0.00 -0.25 -0.44 0.23 0.00 0.00 176.35 175.92 2bbq s SER 28 N 1.37 3.36 0.34 2.29 0.01 -0.44 -1.40 113.70 119.23 2bbq s SER 28 Ca 0.05 -0.81 0.07 0.00 1.31 0.00 0.00 55.95 56.57 2bbq s SER 28 Cb -0.15 -0.24 -0.07 0.00 0.21 0.00 0.00 66.02 65.78 2bbq s SER 28 CO 0.01 0.15 -0.02 0.27 0.41 0.00 0.00 173.24 174.06 2bbq s ILE 29 N -1.37 1.78 -0.10 1.44 -4.36 -0.75 -1.26 121.20 116.58 2bbq s ILE 29 Ca 0.17 -2.08 0.00 0.00 -0.26 0.00 0.00 60.65 58.48 2bbq s ILE 29 Cb -0.09 -2.73 0.02 0.00 1.25 0.00 0.00 42.46 40.92 2bbq s ILE 29 CO 0.08 -0.13 -0.08 0.12 0.24 0.00 0.00 174.94 175.17 2bbq s PHE 30 N -2.90 1.46 0.00 1.37 5.36 -1.26 -1.38 117.98 120.63 2bbq s PHE 30 Ca 0.33 -0.69 0.00 0.00 -0.96 0.00 0.00 56.93 55.61 2bbq s PHE 30 Cb 0.06 -1.19 0.00 0.00 -0.34 0.00 0.00 43.02 41.56 2bbq s PHE 30 CO 0.15 -0.46 0.00 0.41 -1.46 0.00 0.00 175.22 173.86 2bbq n GLY 31 N 4.72 -0.83 3.20 13.12 0.00 -0.85 -5.02 105.19 119.53 2bbq n GLY 31 Ca -0.15 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.06 2bbq n GLY 31 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2bbq s HIS 32 N 0.00 -0.12 -0.00 1.61 2.46 -1.20 -4.96 115.29 113.08 2bbq s HIS 32 Ca 0.00 0.16 0.02 0.00 0.47 0.00 0.00 55.06 55.70 2bbq s HIS 32 Cb 0.00 0.05 -0.00 0.00 -0.13 0.00 0.00 32.58 32.50 2bbq s HIS 32 CO 0.00 -0.36 -0.06 -1.14 -2.47 0.00 0.00 174.74 170.72 2bbq s GLN 33 N -1.32 0.45 -0.00 2.88 0.74 -1.26 -1.42 119.66 119.73 2bbq s GLN 33 Ca -0.14 -0.20 0.02 0.00 0.05 0.00 0.00 55.36 55.09 2bbq s GLN 33 Cb -0.06 -0.43 -0.01 0.00 1.10 0.00 0.00 33.01 33.61 2bbq s GLN 33 CO 0.03 0.12 -0.06 -1.64 -0.55 0.00 0.00 175.29 173.19 2bbq s MET 34 N -0.14 0.48 0.01 1.67 -1.94 -0.67 -4.97 119.30 113.75 2bbq s MET 34 Ca 0.02 -0.25 0.07 0.00 -1.71 0.00 0.00 55.69 53.82 2bbq s MET 34 Cb -0.02 -0.45 -0.02 0.00 2.01 0.00 0.00 34.83 36.34 2bbq s MET 34 CO -0.00 0.12 -0.23 -0.98 -0.01 0.00 0.00 175.02 173.92 2bbq s ARG 35 N -0.24 1.68 -0.15 2.03 1.70 -1.26 -1.10 118.95 121.61 2bbq s ARG 35 Ca 0.01 -0.90 -0.01 0.00 -0.47 0.00 0.00 55.73 54.37 2bbq s ARG 35 Cb -0.03 -1.72 -0.01 0.00 -0.57 0.00 0.00 34.95 32.62 2bbq s ARG 35 CO -0.00 0.46 -0.11 -0.06 -1.08 0.00 0.00 175.30 174.51 2bbq s PHE 36 N -0.66 2.85 -0.35 5.89 0.08 -0.42 -4.97 117.98 120.41 2bbq s PHE 36 Ca 0.09 -0.72 -0.13 0.00 0.12 0.00 0.00 56.93 56.29 2bbq s PHE 36 Cb -0.09 -1.90 -0.01 0.00 -0.57 0.00 0.00 43.02 40.45 2bbq s PHE 36 CO 0.00 -0.29 0.23 1.21 -0.10 0.00 0.00 175.22 176.28 2bbq s ASN 37 N 0.60 5.96 0.52 1.36 3.84 -1.26 -1.04 114.94 124.91 2bbq s ASN 37 Ca -0.07 -0.57 0.30 0.00 0.21 0.00 0.00 52.86 52.74 2bbq s ASN 37 Cb -0.15 -2.11 1.10 0.00 -0.55 0.00 0.00 41.25 39.53 2bbq s ASN 37 CO 0.03 -0.28 1.89 -0.07 -2.79 0.00 0.00 177.10 175.88 2bbq h LEU 38 N 8.49 0.00 -1.53 3.21 4.07 -1.68 -1.57 115.31 126.30 2bbq h LEU 38 Ca -0.30 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.63 2bbq h LEU 38 Cb 1.15 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.87 2bbq h LEU 38 CO 0.65 0.02 -0.02 1.56 -1.08 0.00 0.00 178.44 179.57 2bbq h GLN 39 N 0.00 0.28 0.00 1.13 1.08 -1.82 -2.04 115.11 113.74 2bbq h GLN 39 Ca -0.00 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2bbq h GLN 39 Cb 0.65 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 2bbq h GLN 39 CO 0.00 0.32 0.00 -0.25 -0.95 0.00 0.00 178.83 177.95 2bbq n ASP 40 N -4.36 0.00 0.00 1.46 8.00 -0.59 -5.01 116.55 116.05 2bbq n ASP 40 Ca -0.00 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.66 2bbq n ASP 40 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.29 2bbq n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bbq n GLY 41 N 0.67 2.85 3.69 0.44 0.00 -0.77 -4.85 105.19 107.22 2bbq n GLY 41 Ca 0.20 -2.00 -0.41 0.00 0.00 0.00 0.00 46.02 43.80 2bbq n GLY 41 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2bbq s PHE 42 N -2.07 3.52 -1.44 1.61 5.36 -0.59 -4.58 117.98 119.79 2bbq s PHE 42 Ca 0.00 1.41 -0.12 0.00 -0.96 0.00 0.00 56.93 57.25 2bbq s PHE 42 Cb 0.00 -3.03 0.05 0.00 -0.34 0.00 0.00 43.02 39.71 2bbq s PHE 42 CO 0.00 -0.12 2.24 -0.35 -1.46 0.00 0.00 175.22 175.52 2bbq n PRO 43 N 4.63 3.13 -3.66 10.12 -0.04 -1.26 -4.18 135.00 143.74 2bbq n PRO 43 Ca 0.04 -2.76 -0.36 0.00 -0.04 0.00 0.00 63.50 60.38 2bbq n PRO 43 Cb 0.50 -3.15 -0.09 0.00 -0.04 0.00 0.00 33.50 30.71 2bbq n PRO 43 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2bbq s LEU 44 N 1.43 4.14 0.48 1.53 2.96 -1.26 -4.13 118.68 123.83 2bbq s LEU 44 Ca 0.48 0.16 -0.22 0.00 -0.22 0.00 0.00 54.13 54.33 2bbq s LEU 44 Cb 0.14 -2.12 -0.07 0.00 0.50 0.00 0.00 46.19 44.63 2bbq s LEU 44 CO -0.07 0.09 1.15 0.68 -1.32 0.00 0.00 176.35 176.88 2bbq s VAL 45 N 0.90 3.14 -0.70 1.68 -7.23 -1.26 -4.85 120.40 112.08 2bbq s VAL 45 Ca 0.08 0.82 0.11 0.00 -1.81 0.00 0.00 61.98 61.18 2bbq s VAL 45 Cb -0.13 -3.39 -0.09 0.00 0.56 0.00 0.00 36.38 33.33 2bbq s VAL 45 CO 0.03 -0.05 0.54 0.35 -0.31 0.00 0.00 175.10 175.66 2bbq n THR 46 N -0.70 0.00 1.93 5.32 -2.24 -1.26 -4.29 114.28 113.04 2bbq n THR 46 Ca 0.08 -0.28 0.14 0.00 -2.27 0.00 0.00 64.05 61.73 2bbq n THR 46 Cb 0.49 1.04 0.80 0.00 -2.10 0.00 0.00 70.33 70.56 2bbq n THR 46 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2bbq n THR 47 N -0.95 0.01 -3.65 4.28 -2.24 -1.26 -0.61 114.28 109.86 2bbq n THR 47 Ca 0.03 -0.03 -0.13 0.00 -2.27 0.00 0.00 64.05 61.64 2bbq n THR 47 Cb 0.20 -0.33 -0.07 0.00 -2.10 0.00 0.00 70.33 68.02 2bbq n THR 47 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2bbq s LYS 48 N -1.99 0.78 -0.09 -0.78 -2.85 -1.26 -4.69 119.74 108.85 2bbq s LYS 48 Ca 0.42 0.95 -0.29 0.00 -1.00 0.00 0.00 55.97 56.05 2bbq s LYS 48 Cb 0.20 0.36 -0.05 0.00 -2.06 0.00 0.00 37.83 36.28 2bbq s LYS 48 CO 0.33 -0.10 1.64 0.50 0.10 0.00 0.00 175.35 177.82 2bbq s ARG 49 N 0.45 4.10 0.08 1.78 3.52 0.00 -4.70 118.95 124.18 2bbq s ARG 49 Ca -0.01 2.07 -0.19 0.00 -0.13 0.00 0.00 55.73 57.48 2bbq s ARG 49 Cb -0.05 -3.99 -0.07 0.00 -1.56 0.00 0.00 34.95 29.28 2bbq s ARG 49 CO -0.00 -0.94 0.57 0.00 -0.81 0.00 0.00 175.30 174.12 2bbq s HIS 51 N -1.14 3.13 0.59 0.00 2.46 -1.26 -4.92 115.29 114.15 2bbq s HIS 51 Ca 0.30 -1.64 0.29 0.00 0.47 0.00 0.00 55.06 54.47 2bbq s HIS 51 Cb -0.19 -4.43 1.63 0.00 -0.13 0.00 0.00 32.58 29.46 2bbq s HIS 51 CO 0.19 -1.57 2.07 -0.07 -2.47 0.00 0.00 174.74 172.90 2bbq h LEU 52 N 10.83 0.00 -1.37 8.88 3.38 -1.99 -2.35 115.31 132.69 2bbq h LEU 52 Ca 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 2bbq h LEU 52 Cb 0.94 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 2bbq h LEU 52 CO 1.26 0.00 0.24 -0.09 0.09 0.00 0.00 178.44 179.94 2bbq h ARG 53 N 0.00 0.67 -0.03 1.13 2.43 -1.99 -0.87 114.38 115.72 2bbq h ARG 53 Ca 0.10 -0.07 -0.20 0.00 -0.81 0.00 0.00 59.98 59.00 2bbq h ARG 53 Cb 0.57 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2bbq h ARG 53 CO -0.00 0.51 -0.75 0.77 -1.51 0.00 0.00 179.97 178.99 2bbq h SER 54 N 0.67 0.71 -0.27 -3.80 0.02 -1.82 -1.82 113.55 107.24 2bbq h SER 54 Ca 0.17 -0.73 -0.02 0.00 -0.84 0.00 0.00 61.79 60.37 2bbq h SER 54 Cb 0.06 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 2bbq h SER 54 CO -0.02 1.34 0.09 0.40 -1.14 0.00 0.00 176.83 177.49 2bbq h ILE 55 N 0.14 1.19 0.11 3.27 2.04 -1.53 -1.69 117.51 121.04 2bbq h ILE 55 Ca -0.09 -0.61 -0.27 0.00 1.00 0.00 0.00 64.86 64.90 2bbq h ILE 55 Cb 1.43 1.09 0.01 0.00 -0.74 0.00 0.00 36.82 38.61 2bbq h ILE 55 CO 0.15 0.20 -1.19 0.16 0.00 0.00 0.00 178.15 177.47 2bbq h ILE 56 N 0.27 1.43 -0.06 -0.67 -0.00 -1.20 -2.86 117.51 114.42 2bbq h ILE 56 Ca 0.09 -2.82 -0.11 0.00 -0.00 0.00 0.00 64.86 62.02 2bbq h ILE 56 Cb 0.23 2.80 -0.01 0.00 -0.00 0.00 0.00 36.82 39.83 2bbq h ILE 56 CO -0.00 0.83 -0.46 0.45 -0.00 0.00 0.00 178.15 178.97 2bbq h HIS 57 N 0.14 0.17 -0.48 0.16 3.86 -1.29 -2.27 115.15 115.44 2bbq h HIS 57 Ca -0.14 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.01 2bbq h HIS 57 Cb 1.88 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 30.29 2bbq h HIS 57 CO 0.07 0.58 0.25 1.49 0.86 0.00 0.00 177.93 181.19 2bbq h GLU 58 N 0.12 0.68 -0.15 2.45 4.81 -1.32 -0.26 114.58 120.90 2bbq h GLU 58 Ca 0.01 -0.09 -0.11 0.00 -0.13 0.00 0.00 59.36 59.04 2bbq h GLU 58 Cb 0.86 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 2bbq h GLU 58 CO 0.07 0.54 -0.38 1.25 -0.73 0.00 0.00 179.01 179.76 2bbq h LEU 59 N 0.63 0.33 -0.28 1.64 5.85 -1.25 -1.17 115.31 121.06 2bbq h LEU 59 Ca 0.17 -0.13 -0.21 0.00 0.84 0.00 0.00 57.88 58.55 2bbq h LEU 59 Cb 0.07 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.01 2bbq h LEU 59 CO -0.03 0.68 -0.82 -0.07 -0.34 0.00 0.00 178.44 177.87 2bbq h LEU 60 N 0.27 0.57 -0.71 2.25 3.38 -1.23 -2.28 115.31 117.57 2bbq h LEU 60 Ca 0.03 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 2bbq h LEU 60 Cb 0.79 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 2bbq h LEU 60 CO 0.06 1.17 0.38 -0.25 0.09 0.00 0.00 178.44 179.90 2bbq h TRP 61 N 0.30 0.98 -0.01 1.13 7.01 -0.80 -2.50 115.95 122.05 2bbq h TRP 61 Ca -0.05 -0.03 -0.00 0.00 2.11 0.00 0.00 58.89 60.92 2bbq h TRP 61 Cb 1.42 -0.31 -0.00 0.00 -2.10 0.00 0.00 29.16 28.17 2bbq h TRP 61 CO 0.06 0.70 0.01 0.74 -2.79 0.00 0.00 178.44 177.15 2bbq h PHE 62 N 0.97 0.02 0.00 2.65 0.04 -1.16 -2.81 116.94 116.65 2bbq h PHE 62 Ca 0.25 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.02 2bbq h PHE 62 Cb 0.05 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.19 2bbq h PHE 62 CO -0.00 0.09 0.00 1.28 -0.60 0.00 0.00 178.31 179.08 2bbq n LEU 63 N -5.04 0.32 -0.06 1.54 4.77 -0.86 -1.48 117.00 116.19 2bbq n LEU 63 Ca -0.07 0.58 0.14 0.00 -0.03 0.00 0.00 56.01 56.63 2bbq n LEU 63 Cb 0.06 -0.53 0.59 0.00 -2.33 0.00 0.00 43.42 41.21 2bbq n LEU 63 CO 0.33 -0.38 0.86 0.00 -1.33 0.00 0.00 177.39 176.86 2bbq n GLN 64 N -1.85 0.40 -1.74 3.23 6.02 -0.95 -4.93 117.38 117.57 2bbq n GLN 64 Ca 0.03 -0.11 -0.04 0.00 -0.01 0.00 0.00 57.00 56.87 2bbq n GLN 64 Cb 0.20 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.96 2bbq n GLN 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2bbq n GLY 65 N 1.36 0.37 3.87 1.08 0.00 -0.55 -5.02 105.19 106.30 2bbq n GLY 65 Ca 0.12 -0.79 -0.37 0.00 0.00 0.00 0.00 46.02 44.97 2bbq n GLY 65 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bbq s ASP 66 N -2.88 6.49 0.00 1.61 2.15 -1.11 -4.32 116.67 118.62 2bbq s ASP 66 Ca 0.00 0.59 0.00 0.00 0.43 0.00 0.00 52.55 53.57 2bbq s ASP 66 Cb 0.00 -2.11 0.00 0.00 -0.30 0.00 0.00 42.92 40.51 2bbq s ASP 66 CO 0.00 0.39 0.75 0.35 -0.17 0.00 0.00 175.17 176.49 2bbq n THR 67 N 1.96 0.56 -3.93 1.71 -2.24 -1.26 -4.12 114.28 106.96 2bbq n THR 67 Ca -0.18 -0.69 -0.35 0.00 -2.27 0.00 0.00 64.05 60.55 2bbq n THR 67 Cb 0.54 0.78 -0.10 0.00 -2.10 0.00 0.00 70.33 69.45 2bbq n THR 67 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2bbq s ASN 68 N -0.56 5.55 0.00 3.42 3.84 -1.26 -2.04 114.94 123.90 2bbq s ASN 68 Ca 0.00 0.02 0.06 0.00 0.21 0.00 0.00 52.86 53.15 2bbq s ASN 68 Cb 0.00 -1.97 0.31 0.00 -0.55 0.00 0.00 41.25 39.05 2bbq s ASN 68 CO 0.00 0.12 1.02 0.00 -2.79 0.00 0.00 177.10 175.44 2bbq n ILE 69 N 3.92 0.81 0.21 -5.21 0.00 -0.38 -3.81 119.36 114.90 2bbq n ILE 69 Ca -0.16 0.20 -0.17 0.00 0.00 0.00 0.00 62.75 62.62 2bbq n ILE 69 Cb 0.52 -1.10 -0.09 0.00 0.00 0.00 0.00 39.64 38.96 2bbq n ILE 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2bbq h ALA 70 N 2.30 -1.07 -0.99 1.51 0.00 -1.93 -2.02 119.26 117.05 2bbq h ALA 70 Ca 0.00 -0.15 0.25 0.00 0.00 0.00 0.00 54.91 55.01 2bbq h ALA 70 Cb 0.05 0.78 -0.13 0.00 0.00 0.00 0.00 17.79 18.50 2bbq h ALA 70 CO 0.00 -1.14 0.58 -0.92 0.00 0.00 0.00 179.25 177.77 2bbq h TYR 71 N -0.86 0.98 -0.28 0.00 3.20 -2.00 0.81 116.97 118.81 2bbq h TYR 71 Ca -0.04 0.04 -0.14 0.00 3.14 0.00 0.00 58.73 61.73 2bbq h TYR 71 Cb 0.78 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 2bbq h TYR 71 CO -0.33 0.04 -0.40 -0.07 -1.64 0.00 0.00 178.16 175.76 2bbq h LEU 72 N 0.55 0.71 -0.84 2.82 3.38 -1.72 -3.07 115.31 117.13 2bbq h LEU 72 Ca 0.64 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 58.22 2bbq h LEU 72 Cb 1.23 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 2bbq h LEU 72 CO -0.49 1.02 0.04 0.45 0.09 0.00 0.00 178.44 179.56 2bbq h HIS 73 N 0.55 0.96 -0.11 1.13 3.86 -0.14 0.18 115.15 121.57 2bbq h HIS 73 Ca 0.05 -0.13 0.03 0.00 -1.16 0.00 0.00 60.37 59.16 2bbq h HIS 73 Cb 0.92 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 29.12 2bbq h HIS 73 CO 0.04 0.85 0.11 0.93 0.86 0.00 0.00 177.93 180.73 2bbq h GLU 74 N 0.85 0.00 -0.29 2.45 5.08 -1.31 0.53 114.58 121.89 2bbq h GLU 74 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2bbq h GLU 74 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 2bbq h GLU 74 CO 0.02 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.12 2bbq n ASN 75 N -3.93 3.27 -3.56 1.42 3.02 -0.53 -4.99 115.26 109.96 2bbq n ASN 75 Ca -0.00 -2.45 -0.23 0.00 -0.03 0.00 0.00 54.58 51.87 2bbq n ASN 75 Cb 0.22 -0.36 0.05 0.00 -0.61 0.00 0.00 39.78 39.08 2bbq n ASN 75 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2bbq n ASN 76 N -0.00 -4.07 -4.00 6.41 3.02 0.18 -5.00 115.26 111.79 2bbq n ASN 76 Ca 0.15 -0.85 -0.29 0.00 -0.03 0.00 0.00 54.58 53.56 2bbq n ASN 76 Cb 0.62 -4.20 -0.17 0.00 -0.61 0.00 0.00 39.78 35.43 2bbq n ASN 76 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2bbq s VAL 77 N -3.51 1.45 -1.76 2.41 1.01 -0.06 -5.00 120.40 114.94 2bbq s VAL 77 Ca 0.28 -0.56 0.20 0.00 0.00 0.00 0.00 61.98 61.90 2bbq s VAL 77 Cb -0.07 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.92 2bbq s VAL 77 CO 0.81 0.44 0.98 0.41 0.00 0.00 0.00 175.10 177.73 2bbq n THR 78 N 4.74 0.00 0.15 3.92 -1.04 -1.26 -3.82 114.28 116.97 2bbq n THR 78 Ca -0.16 -0.28 0.08 0.00 -2.04 0.00 0.00 64.05 61.64 2bbq n THR 78 Cb 0.50 1.22 0.57 0.00 -1.82 0.00 0.00 70.33 70.81 2bbq n THR 78 CO 0.00 0.00 0.00 0.16 -0.64 0.00 0.00 175.07 174.59 2bbq h ILE 79 N 2.08 1.01 -0.48 12.58 3.07 -1.98 -2.36 117.51 131.42 2bbq h ILE 79 Ca 0.00 -0.06 0.00 0.00 1.55 0.00 0.00 64.86 66.35 2bbq h ILE 79 Cb 0.66 0.81 0.00 0.00 -0.27 0.00 0.00 36.82 38.02 2bbq h ILE 79 CO 0.00 0.03 0.00 0.79 -1.05 0.00 0.00 178.15 177.92 2bbq n TRP 80 N -4.51 1.29 0.07 0.16 7.02 -1.26 -4.69 117.44 115.52 2bbq n TRP 80 Ca 0.00 -0.69 -0.01 0.00 -1.02 0.00 0.00 57.50 55.79 2bbq n TRP 80 Cb 0.13 -0.28 0.28 0.00 -2.42 0.00 0.00 31.31 29.03 2bbq n TRP 80 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 2bbq h ASP 81 N 3.12 0.32 -0.17 -0.99 5.19 -1.77 -3.30 116.42 118.82 2bbq h ASP 81 Ca 0.00 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 2bbq h ASP 81 Cb 1.44 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.86 2bbq h ASP 81 CO 0.24 0.56 0.00 -1.84 -3.12 0.00 0.00 179.24 175.08 2bbq n GLU 82 N -4.16 1.82 0.00 3.56 0.00 -1.26 -3.50 120.64 117.10 2bbq n GLU 82 Ca -0.01 -1.23 0.04 0.00 0.00 0.00 0.00 57.16 55.96 2bbq n GLU 82 Cb 0.36 -1.42 -0.00 0.00 0.00 0.00 0.00 31.44 30.38 2bbq n GLU 82 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 2bbq n TRP 83 N 0.46 0.00 -2.77 -1.84 8.01 -1.24 -5.03 117.44 115.02 2bbq n TRP 83 Ca 0.17 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.98 2bbq n TRP 83 Cb 0.37 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.60 2bbq n TRP 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2bbq s ALA 84 N -1.23 3.23 0.99 6.99 0.00 -1.23 -4.79 121.76 125.72 2bbq s ALA 84 Ca 0.07 0.54 -0.09 0.00 0.00 0.00 0.00 51.96 52.47 2bbq s ALA 84 Cb 0.07 -3.19 0.13 0.00 0.00 0.00 0.00 23.12 20.13 2bbq s ALA 84 CO 0.21 0.18 0.76 -0.40 0.00 0.00 0.00 175.76 176.51 2bbq n ASP 85 N 0.69 0.07 -0.11 0.00 5.75 -0.62 -4.83 116.55 117.50 2bbq n ASP 85 Ca 0.01 -1.28 0.22 0.00 -0.01 0.00 0.00 54.79 53.73 2bbq n ASP 85 Cb 0.50 -0.58 0.65 0.00 -1.03 0.00 0.00 41.12 40.66 2bbq n ASP 85 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 2bbq h GLU 86 N 0.00 0.11 -0.17 0.11 4.81 -1.98 0.43 114.58 117.90 2bbq h GLU 86 Ca -0.25 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 2bbq h GLU 86 Cb 0.68 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.03 2bbq h GLU 86 CO 0.17 0.07 0.00 0.09 -0.73 0.00 0.00 179.01 178.62 2bbq n ASN 87 N -4.38 1.55 0.00 1.04 4.13 -1.26 -4.94 115.26 111.41 2bbq n ASN 87 Ca 0.14 -1.71 0.00 0.00 1.68 0.00 0.00 54.58 54.69 2bbq n ASN 87 Cb 0.72 -0.11 0.00 0.00 -1.54 0.00 0.00 39.78 38.85 2bbq n ASN 87 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2bbq n GLY 88 N 1.10 0.84 3.83 7.41 0.00 0.14 -4.92 105.19 113.59 2bbq n GLY 88 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2bbq n GLY 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bbq s ASP 89 N -2.81 6.92 0.00 1.61 1.01 -1.26 -1.25 116.67 120.88 2bbq s ASP 89 Ca 0.00 1.19 0.15 0.00 0.71 0.00 0.00 52.55 54.60 2bbq s ASP 89 Cb 0.00 -2.33 -0.02 0.00 1.01 0.00 0.00 42.92 41.58 2bbq s ASP 89 CO 0.00 0.11 0.80 0.18 0.21 0.00 0.00 175.17 176.47 2bbq n LEU 90 N 0.91 1.47 0.00 1.23 4.77 -0.86 -1.59 117.00 122.93 2bbq n LEU 90 Ca -0.05 -0.74 0.00 0.00 -0.03 0.00 0.00 56.01 55.19 2bbq n LEU 90 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2bbq n LEU 90 CO 0.42 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 2bbq n GLY 91 N 1.13 -2.98 2.78 -0.72 0.00 -1.26 -0.38 105.19 103.77 2bbq n GLY 91 Ca 0.06 -1.87 -0.39 0.00 0.00 0.00 0.00 46.02 43.82 2bbq n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2bbq n PRO 92 N -0.25 2.37 -0.00 1.61 -0.04 -1.26 -4.81 135.00 132.61 2bbq n PRO 92 Ca 0.00 -2.10 0.00 0.00 -0.04 0.00 0.00 63.50 61.36 2bbq n PRO 92 Cb 0.00 -2.96 0.00 0.00 -0.04 0.00 0.00 33.50 30.50 2bbq n PRO 92 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2bbq n VAL 93 N 5.07 0.00 -0.25 0.52 0.24 -1.26 -4.50 118.33 118.15 2bbq n VAL 93 Ca 0.54 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.77 2bbq n VAL 93 Cb 0.33 -1.92 -0.06 0.00 -1.47 0.00 0.00 33.84 30.72 2bbq n VAL 93 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2bbq n TYR 94 N -0.06 -0.26 -0.23 6.34 4.01 -1.26 -0.80 117.16 124.89 2bbq n TYR 94 Ca 0.00 0.74 0.07 0.00 -0.16 0.00 0.00 57.90 58.56 2bbq n TYR 94 Cb 0.00 -0.54 0.33 0.00 -0.31 0.00 0.00 39.34 38.82 2bbq n TYR 94 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2bbq h GLY 95 N 0.00 1.11 0.94 2.72 0.00 -1.77 -1.71 103.07 104.36 2bbq h GLY 95 Ca 0.10 -0.33 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 2bbq h GLY 95 CO -0.56 0.20 -0.34 1.70 0.00 0.00 0.00 176.54 177.54 2bbq h LYS 96 N 0.80 0.64 0.00 4.80 3.11 -1.16 -2.69 116.57 122.08 2bbq h LYS 96 Ca 0.37 -0.38 -0.11 0.00 -2.81 0.00 0.00 60.65 57.72 2bbq h LYS 96 Cb 0.38 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.63 2bbq h LYS 96 CO -0.14 0.99 -0.52 1.96 -2.81 0.00 0.00 179.45 178.93 2bbq h GLN 97 N 0.35 0.00 -0.14 1.90 1.08 -1.32 0.22 115.11 117.21 2bbq h GLN 97 Ca 0.02 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.11 2bbq h GLN 97 Cb 0.93 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.36 2bbq h GLN 97 CO 0.08 0.52 -0.37 -1.49 -0.95 0.00 0.00 178.83 176.62 2bbq h TRP 98 N 0.00 0.63 0.00 2.96 4.06 -1.22 -3.27 115.95 119.12 2bbq h TRP 98 Ca -0.01 -0.25 0.00 0.00 2.06 0.00 0.00 58.89 60.70 2bbq h TRP 98 Cb 0.97 -0.11 0.00 0.00 -1.00 0.00 0.00 29.16 29.02 2bbq h TRP 98 CO 0.00 0.99 -1.77 0.54 -3.56 0.00 0.00 178.44 174.64 2bbq n ARG 99 N -4.33 0.55 -2.68 0.49 5.12 -1.02 -0.86 116.66 113.92 2bbq n ARG 99 Ca -0.07 -0.15 -0.08 0.00 -1.93 0.00 0.00 57.85 55.61 2bbq n ARG 99 Cb 0.52 -1.50 0.07 0.00 -1.16 0.00 0.00 32.46 30.39 2bbq n ARG 99 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2bbq n ALA 100 N -2.08 2.33 -1.64 7.54 0.00 0.06 -3.97 120.51 122.75 2bbq n ALA 100 Ca -0.02 -2.24 -0.45 0.00 0.00 0.00 0.00 53.44 50.73 2bbq n ALA 100 Cb 0.51 -0.97 -0.04 0.00 0.00 0.00 0.00 19.45 18.95 2bbq n ALA 100 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2bbq n TRP 101 N -0.31 2.28 -2.27 0.00 -0.00 -0.34 -4.59 117.44 112.21 2bbq n TRP 101 Ca 0.03 -0.16 -0.42 0.00 -0.00 0.00 0.00 57.50 56.95 2bbq n TRP 101 Cb 0.83 -2.73 -0.03 0.00 -0.00 0.00 0.00 31.31 29.39 2bbq n TRP 101 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2bbq s PRO 102 N 4.88 4.29 0.59 5.87 0.04 -1.26 -1.41 135.00 147.99 2bbq s PRO 102 Ca 0.94 1.91 -0.06 0.00 0.04 0.00 0.00 61.00 63.83 2bbq s PRO 102 Cb -0.53 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 30.43 2bbq s PRO 102 CO 0.44 -0.56 0.90 0.95 0.04 0.00 0.00 177.00 178.77 2bbq s THR 103 N 2.45 3.76 0.26 1.26 -4.23 -1.08 -4.98 115.64 113.08 2bbq s THR 103 Ca 0.62 0.05 0.36 0.00 -1.18 0.00 0.00 61.69 61.55 2bbq s THR 103 Cb -0.30 -3.49 0.38 0.00 1.34 0.00 0.00 72.50 70.43 2bbq s THR 103 CO 0.25 -0.51 2.09 1.55 -0.54 0.00 0.00 174.62 177.46 2bbq h PRO 104 N -0.17 0.00 -0.48 3.99 0.13 -1.96 -3.19 132.00 130.32 2bbq h PRO 104 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2bbq h PRO 104 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2bbq h PRO 104 CO 0.61 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.98 2bbq n ASP 105 N -2.89 4.86 0.00 1.44 5.68 -1.26 -4.96 116.55 119.42 2bbq n ASP 105 Ca -0.01 -2.84 0.00 0.00 -0.50 0.00 0.00 54.79 51.44 2bbq n ASP 105 Cb 0.15 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 39.53 2bbq n ASP 105 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2bbq n GLY 106 N 0.34 0.71 3.42 6.12 0.00 -1.21 -5.09 105.19 109.49 2bbq n GLY 106 Ca 0.25 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.05 2bbq n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bbq n ARG 107 N -2.01 -0.38 -3.79 1.61 1.74 -1.26 -4.92 116.66 107.66 2bbq n ARG 107 Ca 0.00 -2.22 -0.13 0.00 -0.77 0.00 0.00 57.85 54.74 2bbq n ARG 107 Cb 0.00 -0.78 -0.12 0.00 -1.02 0.00 0.00 32.46 30.54 2bbq n ARG 107 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2bbq s HIS 108 N -2.97 -0.24 -0.13 -1.55 3.76 -1.26 -2.65 115.29 110.25 2bbq s HIS 108 Ca 0.61 0.60 -0.02 0.00 -0.15 0.00 0.00 55.06 56.10 2bbq s HIS 108 Cb -0.03 0.08 -0.03 0.00 1.11 0.00 0.00 32.58 33.71 2bbq s HIS 108 CO 0.41 -0.12 -0.06 0.42 -0.85 0.00 0.00 174.74 174.53 2bbq s ILE 109 N 0.21 3.67 -0.40 0.60 -1.09 -0.50 -4.88 121.20 118.81 2bbq s ILE 109 Ca -0.01 -0.45 -0.12 0.00 -2.23 0.00 0.00 60.65 57.84 2bbq s ILE 109 Cb -0.02 -2.57 0.05 0.00 -1.58 0.00 0.00 42.46 38.33 2bbq s ILE 109 CO -0.00 0.53 0.26 -0.62 -1.23 0.00 0.00 174.94 173.87 2bbq s ASP 110 N 0.06 5.82 0.23 3.58 2.15 -1.25 -1.20 116.67 126.06 2bbq s ASP 110 Ca -0.01 -1.16 0.10 0.00 0.43 0.00 0.00 52.55 51.91 2bbq s ASP 110 Cb -0.14 -2.06 0.21 0.00 -0.30 0.00 0.00 42.92 40.64 2bbq s ASP 110 CO 0.03 -0.47 1.52 1.56 -0.17 0.00 0.00 175.17 177.65 2bbq h GLN 111 N 8.50 0.00 -0.23 4.34 4.20 -1.24 -2.14 115.11 128.54 2bbq h GLN 111 Ca -0.25 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.30 2bbq h GLN 111 Cb 1.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.88 2bbq h GLN 111 CO 0.73 0.71 -0.45 0.82 -0.67 0.00 0.00 178.83 179.97 2bbq h ILE 112 N 0.00 1.31 -0.48 2.54 1.08 -1.85 -1.51 117.51 118.59 2bbq h ILE 112 Ca -0.01 -1.66 -0.02 0.00 -0.39 0.00 0.00 64.86 62.78 2bbq h ILE 112 Cb 1.27 1.78 -0.02 0.00 -3.07 0.00 0.00 36.82 36.78 2bbq h ILE 112 CO 0.09 0.53 0.23 0.74 -0.69 0.00 0.00 178.15 179.05 2bbq h THR 113 N 0.44 1.19 -0.39 -0.27 2.02 -1.87 -1.38 112.91 112.64 2bbq h THR 113 Ca 0.01 -0.53 0.06 0.00 0.77 0.00 0.00 66.41 66.72 2bbq h THR 113 Cb 1.06 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 68.07 2bbq h THR 113 CO 0.10 0.21 0.07 0.74 0.37 0.00 0.00 175.52 177.01 2bbq h THR 114 N 0.64 0.79 -0.16 3.16 2.02 -1.33 -1.23 112.91 116.80 2bbq h THR 114 Ca 0.17 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.28 2bbq h THR 114 Cb 0.12 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2bbq h THR 114 CO -0.02 0.04 0.09 0.58 0.37 0.00 0.00 175.52 176.58 2bbq h VAL 115 N 0.19 1.09 -0.45 3.16 2.07 -1.11 0.15 116.25 121.35 2bbq h VAL 115 Ca 0.19 -0.23 0.09 0.00 0.82 0.00 0.00 66.70 67.57 2bbq h VAL 115 Cb 0.23 0.95 -0.09 0.00 -1.52 0.00 0.00 31.29 30.85 2bbq h VAL 115 CO -0.25 0.08 -0.19 -0.07 0.02 0.00 0.00 177.57 177.16 2bbq h LEU 116 N 0.17 -0.65 -1.27 2.57 -0.00 -0.92 -0.45 115.31 114.77 2bbq h LEU 116 Ca 0.06 0.16 -0.04 0.00 -0.00 0.00 0.00 57.88 58.06 2bbq h LEU 116 Cb 0.05 0.37 -0.01 0.00 -0.00 0.00 0.00 40.66 41.07 2bbq h LEU 116 CO -0.01 -0.22 -0.17 0.78 -0.00 0.00 0.00 178.44 178.82 2bbq h ASN 117 N -0.09 0.00 0.04 -0.43 -0.26 -1.00 -1.73 115.58 112.10 2bbq h ASN 117 Ca 0.22 0.00 -0.24 0.00 -0.56 0.00 0.00 56.30 55.72 2bbq h ASN 117 Cb 0.43 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.70 2bbq h ASN 117 CO -0.51 0.17 -0.92 1.56 -1.06 0.00 0.00 177.43 176.67 2bbq h GLN 118 N 0.00 0.66 0.00 0.81 4.20 0.06 -1.43 115.11 119.40 2bbq h GLN 118 Ca -0.00 -0.64 -0.10 0.00 0.06 0.00 0.00 58.65 57.97 2bbq h GLN 118 Cb 0.66 0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 2bbq h GLN 118 CO 0.02 1.24 -0.49 -0.07 -0.67 0.00 0.00 178.83 178.86 2bbq h LEU 119 N 0.40 0.00 0.00 1.46 3.38 -0.87 0.31 115.31 119.99 2bbq h LEU 119 Ca -0.09 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 2bbq h LEU 119 Cb 1.56 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.29 2bbq h LEU 119 CO 0.18 0.49 -1.10 0.11 0.09 0.00 0.00 178.44 178.21 2bbq h LYS 120 N 0.00 0.00 0.00 1.13 1.57 -1.32 -3.37 116.57 114.57 2bbq h LYS 120 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2bbq h LYS 120 Cb 1.14 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2bbq h LYS 120 CO 0.06 0.20 -1.19 0.09 -0.57 0.00 0.00 179.45 178.04 2bbq n ASN 121 N -2.87 4.19 -3.19 0.86 4.13 -0.54 -4.86 115.26 112.98 2bbq n ASN 121 Ca -0.04 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 55.99 2bbq n ASN 121 Cb 0.71 0.91 -0.06 0.00 -1.54 0.00 0.00 39.78 39.80 2bbq n ASN 121 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2bbq n ASP 122 N -1.84 0.77 0.23 6.41 2.03 0.11 -5.00 116.55 119.26 2bbq n ASP 122 Ca -0.03 -2.88 0.16 0.00 0.52 0.00 0.00 54.79 52.56 2bbq n ASP 122 Cb 0.32 -0.63 0.69 0.00 -0.72 0.00 0.00 41.12 40.78 2bbq n ASP 122 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2bbq h PRO 123 N 3.63 0.00 0.00 -0.67 0.13 -1.71 -1.90 132.00 131.48 2bbq h PRO 123 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2bbq h PRO 123 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2bbq h PRO 123 CO 0.51 0.00 -0.34 -0.25 -0.23 0.00 0.00 178.00 177.69 2bbq n ASP 124 N -2.73 0.40 -4.62 1.44 8.00 -1.26 -3.99 116.55 113.79 2bbq n ASP 124 Ca 0.00 0.08 -0.46 0.00 0.71 0.00 0.00 54.79 55.12 2bbq n ASP 124 Cb 0.22 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.25 2bbq n ASP 124 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2bbq n SER 125 N -1.64 1.86 -1.41 -2.24 2.88 -0.72 -4.88 113.62 107.48 2bbq n SER 125 Ca 0.06 1.16 0.05 0.00 -1.33 0.00 0.00 58.87 58.81 2bbq n SER 125 Cb 0.36 -1.33 0.27 0.00 -0.75 0.00 0.00 64.21 62.76 2bbq n SER 125 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2bbq n ARG 126 N 1.35 3.56 -0.59 -1.46 1.74 -1.26 -4.35 116.66 115.65 2bbq n ARG 126 Ca 0.11 -2.11 0.06 0.00 -0.77 0.00 0.00 57.85 55.14 2bbq n ARG 126 Cb 0.30 -1.98 0.12 0.00 -1.02 0.00 0.00 32.46 29.87 2bbq n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2bbq n ARG 127 N 0.46 0.92 -2.87 5.56 1.74 -1.26 -4.97 116.66 116.24 2bbq n ARG 127 Ca 0.19 -2.43 -0.44 0.00 -0.77 0.00 0.00 57.85 54.40 2bbq n ARG 127 Cb 0.86 -1.09 -0.01 0.00 -1.02 0.00 0.00 32.46 31.21 2bbq n ARG 127 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2bbq s ILE 128 N -1.96 4.74 -0.02 0.55 1.01 -1.26 -4.96 121.20 119.30 2bbq s ILE 128 Ca 0.29 -2.07 0.06 0.00 0.00 0.00 0.00 60.65 58.93 2bbq s ILE 128 Cb 0.28 -4.92 -0.02 0.00 0.01 0.00 0.00 42.46 37.82 2bbq s ILE 128 CO -0.05 -1.66 -0.21 -0.63 0.00 0.00 0.00 174.94 172.39 2bbq s ILE 129 N 2.51 1.70 -0.03 2.92 1.01 -1.26 -1.41 121.20 126.63 2bbq s ILE 129 Ca 0.41 -0.91 0.07 0.00 0.00 0.00 0.00 60.65 60.22 2bbq s ILE 129 Cb -0.02 -1.41 -0.02 0.00 0.01 0.00 0.00 42.46 41.01 2bbq s ILE 129 CO -0.03 0.48 -0.26 0.68 0.00 0.00 0.00 174.94 175.82 2bbq s VAL 130 N -0.45 2.03 -0.02 2.92 -7.23 -0.37 -4.93 120.40 112.35 2bbq s VAL 130 Ca 0.07 -1.09 0.07 0.00 -1.81 0.00 0.00 61.98 59.22 2bbq s VAL 130 Cb -0.09 -1.69 -0.02 0.00 0.56 0.00 0.00 36.38 35.14 2bbq s VAL 130 CO -0.00 0.57 -0.24 -0.55 -0.31 0.00 0.00 175.10 174.57 2bbq s SER 131 N -0.49 3.21 -0.01 4.85 0.15 -1.26 -1.53 113.70 118.62 2bbq s SER 131 Ca 0.06 -0.43 0.19 0.00 0.70 0.00 0.00 55.95 56.47 2bbq s SER 131 Cb -0.11 -0.42 -0.24 0.00 -1.71 0.00 0.00 66.02 63.54 2bbq s SER 131 CO 0.00 0.32 0.70 0.00 1.20 0.00 0.00 173.24 175.46 2bbq n ALA 132 N 2.38 3.97 -2.53 5.45 0.00 -0.42 -4.69 120.51 124.67 2bbq n ALA 132 Ca -0.16 -0.52 -0.43 0.00 0.00 0.00 0.00 53.44 52.33 2bbq n ALA 132 Cb 0.51 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 19.27 2bbq n ALA 132 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2bbq n TRP 133 N -1.67 4.57 -2.99 0.00 -0.00 -1.18 -4.88 117.44 111.29 2bbq n TRP 133 Ca 0.01 -2.90 -0.44 0.00 -0.00 0.00 0.00 57.50 54.17 2bbq n TRP 133 Cb 0.36 -2.58 -0.03 0.00 -0.00 0.00 0.00 31.31 29.06 2bbq n TRP 133 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 2bbq s ASN 134 N 3.95 6.42 0.44 5.87 3.04 -1.26 -4.92 114.94 128.47 2bbq s ASN 134 Ca 0.52 -1.68 0.14 0.00 0.04 0.00 0.00 52.86 51.88 2bbq s ASN 134 Cb 0.04 -2.36 1.04 0.00 -1.54 0.00 0.00 41.25 38.43 2bbq s ASN 134 CO 0.06 -1.13 1.98 0.58 -3.04 0.00 0.00 177.10 175.55 2bbq h VAL 135 N 5.80 0.90 0.00 -5.21 2.07 -2.01 -1.38 116.25 116.41 2bbq h VAL 135 Ca -0.07 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2bbq h VAL 135 Cb 1.05 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 2bbq h VAL 135 CO 1.10 0.07 0.00 0.61 0.02 0.00 0.00 177.57 179.37 2bbq n GLY 136 N -1.52 -1.04 0.00 2.17 0.00 -1.26 -3.12 105.19 100.42 2bbq n GLY 136 Ca 0.10 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2bbq n GLY 136 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bbq n GLU 137 N -1.81 1.70 -0.37 1.61 1.02 -0.53 -4.82 120.64 117.44 2bbq n GLU 137 Ca 0.02 -1.08 -0.00 0.00 -0.02 0.00 0.00 57.16 56.08 2bbq n GLU 137 Cb 0.17 -0.86 0.14 0.00 -0.02 0.00 0.00 31.44 30.87 2bbq n GLU 137 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2bbq h LEU 138 N 0.00 1.08 0.00 -4.62 3.38 -1.47 -0.75 115.31 112.93 2bbq h LEU 138 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bbq h LEU 138 Cb 0.57 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2bbq h LEU 138 CO 0.00 0.74 0.00 -0.90 0.09 0.00 0.00 178.44 178.37 2bbq n ASP 139 N -4.46 0.00 -0.54 -0.43 5.75 -1.26 -1.87 116.55 113.75 2bbq n ASP 139 Ca 0.13 -0.04 0.12 0.00 -0.01 0.00 0.00 54.79 54.99 2bbq n ASP 139 Cb 0.09 -0.28 0.13 0.00 -1.03 0.00 0.00 41.12 40.03 2bbq n ASP 139 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2bbq n LYS 140 N -1.28 1.38 -3.69 0.11 5.02 -0.29 -4.95 118.16 114.45 2bbq n LYS 140 Ca 0.11 -1.08 -0.36 0.00 -2.02 0.00 0.00 58.31 54.96 2bbq n LYS 140 Cb 0.18 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.65 2bbq n LYS 140 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2bbq s MET 141 N -2.36 3.67 0.39 1.97 -1.94 -0.78 -4.30 119.30 115.94 2bbq s MET 141 Ca 0.23 0.09 0.09 0.00 -1.71 0.00 0.00 55.69 54.39 2bbq s MET 141 Cb 0.19 -3.15 0.85 0.00 2.01 0.00 0.00 34.83 34.72 2bbq s MET 141 CO 0.49 0.69 1.96 0.00 -0.01 0.00 0.00 175.02 178.16 2bbq h ALA 142 N 4.50 1.82 -2.88 3.03 0.00 -1.02 -3.41 119.26 121.31 2bbq h ALA 142 Ca -0.52 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.23 2bbq h ALA 142 Cb 1.21 -0.15 -0.26 0.00 0.00 0.00 0.00 17.79 18.60 2bbq h ALA 142 CO 0.62 0.05 -0.34 -1.17 0.00 0.00 0.00 179.25 178.41 2bbq s LEU 143 N -9.59 0.50 0.43 0.00 2.96 -1.26 -5.04 118.68 106.68 2bbq s LEU 143 Ca -0.09 0.70 -0.24 0.00 -0.22 0.00 0.00 54.13 54.28 2bbq s LEU 143 Cb 0.20 1.14 -0.08 0.00 0.50 0.00 0.00 46.19 47.95 2bbq s LEU 143 CO 0.76 -0.14 1.19 0.00 -1.32 0.00 0.00 176.35 176.85 2bbq s ALA 144 N 0.57 3.08 0.14 5.97 0.00 -1.26 -4.91 121.76 125.35 2bbq s ALA 144 Ca -0.03 1.00 -0.32 0.00 0.00 0.00 0.00 51.96 52.61 2bbq s ALA 144 Cb -0.05 -3.40 -0.11 0.00 0.00 0.00 0.00 23.12 19.56 2bbq s ALA 144 CO -0.03 -0.64 1.79 -2.30 0.00 0.00 0.00 175.76 174.57 2bbq n PRO 145 N -0.18 2.73 0.06 0.00 -0.02 -1.26 -4.88 135.00 131.45 2bbq n PRO 145 Ca 0.06 0.99 -0.22 0.00 -2.02 0.00 0.00 63.50 62.30 2bbq n PRO 145 Cb 0.47 -2.86 -0.15 0.00 -0.02 0.00 0.00 33.50 30.94 2bbq n PRO 145 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bbq s HIS 147 N -2.51 3.03 -0.13 0.00 0.00 -1.26 -1.87 115.29 112.55 2bbq s HIS 147 Ca -0.15 -0.76 0.18 0.00 -3.00 0.00 0.00 55.06 51.33 2bbq s HIS 147 Cb 0.04 -3.76 -0.24 0.00 -4.00 0.00 0.00 32.58 24.62 2bbq s HIS 147 CO 0.84 -1.16 0.41 0.00 -1.00 0.00 0.00 174.74 173.83 2bbq n ALA 148 N 6.22 1.95 -3.64 -1.38 0.00 -1.03 -4.83 120.51 117.81 2bbq n ALA 148 Ca -0.08 -0.88 -0.07 0.00 0.00 0.00 0.00 53.44 52.41 2bbq n ALA 148 Cb 0.44 -0.57 -0.07 0.00 0.00 0.00 0.00 19.45 19.25 2bbq n ALA 148 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2bbq s PHE 149 N -2.88 -0.89 0.10 0.00 2.19 -1.22 -1.30 117.98 113.98 2bbq s PHE 149 Ca -0.07 1.83 -0.05 0.00 0.33 0.00 0.00 56.93 58.96 2bbq s PHE 149 Cb 0.09 0.52 -0.02 0.00 -1.31 0.00 0.00 43.02 42.30 2bbq s PHE 149 CO 0.84 -0.44 0.13 -0.59 1.83 0.00 0.00 175.22 176.99 2bbq s PHE 150 N 1.38 0.41 0.00 10.12 -0.71 -0.58 -1.21 117.98 127.39 2bbq s PHE 150 Ca -0.08 -0.85 0.01 0.00 -1.04 0.00 0.00 56.93 54.97 2bbq s PHE 150 Cb -0.05 -0.21 -0.00 0.00 -1.21 0.00 0.00 43.02 41.55 2bbq s PHE 150 CO -0.16 -0.53 -0.03 -1.14 -1.34 0.00 0.00 175.22 172.02 2bbq s GLN 151 N -3.93 0.21 0.29 1.99 0.74 -0.04 -1.24 119.66 117.68 2bbq s GLN 151 Ca 0.11 -0.17 0.07 0.00 0.05 0.00 0.00 55.36 55.41 2bbq s GLN 151 Cb 0.06 -0.14 -0.03 0.00 1.10 0.00 0.00 33.01 34.00 2bbq s GLN 151 CO -0.07 0.04 0.28 -0.06 -0.55 0.00 0.00 175.29 174.93 2bbq s PHE 152 N -0.28 3.09 -0.05 1.67 0.08 -0.50 -1.00 117.98 120.99 2bbq s PHE 152 Ca -0.02 -0.17 -0.14 0.00 0.12 0.00 0.00 56.93 56.72 2bbq s PHE 152 Cb -0.02 -1.63 0.03 0.00 -0.57 0.00 0.00 43.02 40.83 2bbq s PHE 152 CO -0.00 0.33 0.32 -0.47 -0.10 0.00 0.00 175.22 175.30 2bbq s TYR 153 N -2.17 -0.24 -0.05 0.36 5.04 -0.21 -4.60 117.35 115.48 2bbq s TYR 153 Ca 0.37 0.46 0.03 0.00 -2.44 0.00 0.00 57.07 55.49 2bbq s TYR 153 Cb -0.08 0.11 0.01 0.00 0.35 0.00 0.00 41.96 42.35 2bbq s TYR 153 CO 0.27 -0.32 -0.12 0.08 -1.34 0.00 0.00 175.55 174.12 2bbq s VAL 154 N -0.86 1.06 0.13 3.14 1.01 -1.26 -0.73 120.40 122.89 2bbq s VAL 154 Ca -0.09 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.41 2bbq s VAL 154 Cb -0.04 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.38 2bbq s VAL 154 CO 0.03 0.33 0.00 0.00 0.00 0.00 0.00 175.10 175.46 2bbq n ALA 155 N 3.55 3.00 -3.23 5.51 0.00 -0.98 -4.80 120.51 123.57 2bbq n ALA 155 Ca -0.21 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 52.98 2bbq n ALA 155 Cb 0.53 0.13 -0.06 0.00 0.00 0.00 0.00 19.45 20.04 2bbq n ALA 155 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2bbq n ASP 156 N -3.26 2.93 -0.51 0.00 8.00 -1.26 -4.81 116.55 117.63 2bbq n ASP 156 Ca 0.00 -3.31 -0.07 0.00 0.71 0.00 0.00 54.79 52.12 2bbq n ASP 156 Cb 0.00 -0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 40.44 2bbq n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bbq n GLY 157 N 0.62 0.81 3.35 0.44 0.00 -1.26 -4.99 105.19 104.15 2bbq n GLY 157 Ca 0.28 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2bbq n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bbq s LYS 158 N -2.19 2.31 -0.33 1.61 1.02 -1.26 -1.20 119.74 119.70 2bbq s LYS 158 Ca 0.00 -0.86 -0.19 0.00 0.02 0.00 0.00 55.97 54.94 2bbq s LYS 158 Cb 0.00 -2.16 -0.01 0.00 -0.52 0.00 0.00 37.83 35.14 2bbq s LYS 158 CO 0.00 0.54 0.57 -1.17 -0.92 0.00 0.00 175.35 174.37 2bbq s LEU 159 N -0.55 4.23 0.41 3.17 2.96 -0.12 -2.31 118.68 126.47 2bbq s LEU 159 Ca 0.08 0.21 0.08 0.00 -0.22 0.00 0.00 54.13 54.27 2bbq s LEU 159 Cb -0.11 -2.70 -0.04 0.00 0.50 0.00 0.00 46.19 43.85 2bbq s LEU 159 CO 0.00 -0.48 0.26 -0.44 -1.32 0.00 0.00 176.35 174.38 2bbq s SER 160 N 1.71 4.73 -0.12 3.68 0.01 0.09 -0.73 113.70 123.06 2bbq s SER 160 Ca 0.22 -0.90 -0.08 0.00 1.31 0.00 0.00 55.95 56.50 2bbq s SER 160 Cb -0.15 -0.55 0.04 0.00 0.21 0.00 0.00 66.02 65.57 2bbq s SER 160 CO 0.13 -0.56 0.30 0.00 0.41 0.00 0.00 173.24 173.52 2bbq s GLN 162 N 0.86 3.06 -0.06 0.00 0.74 -0.17 -1.24 119.66 122.85 2bbq s GLN 162 Ca -0.06 -0.86 -0.11 0.00 0.05 0.00 0.00 55.36 54.39 2bbq s GLN 162 Cb -0.07 -2.37 -0.05 0.00 1.10 0.00 0.00 33.01 31.62 2bbq s GLN 162 CO -0.06 0.12 0.28 -1.17 -0.55 0.00 0.00 175.29 173.90 2bbq s LEU 163 N 0.51 4.43 -0.36 3.68 0.20 -0.74 -0.86 118.68 125.54 2bbq s LEU 163 Ca -0.14 0.72 -0.09 0.00 0.69 0.00 0.00 54.13 55.31 2bbq s LEU 163 Cb -0.17 -2.34 0.04 0.00 -0.43 0.00 0.00 46.19 43.29 2bbq s LEU 163 CO 0.05 0.37 0.16 -0.47 -0.29 0.00 0.00 176.35 176.17 2bbq s TYR 164 N -1.06 3.25 -0.39 5.38 5.04 -0.35 -1.21 117.35 128.03 2bbq s TYR 164 Ca 0.20 -1.20 -0.15 0.00 -2.44 0.00 0.00 57.07 53.48 2bbq s TYR 164 Cb -0.14 -2.38 0.01 0.00 0.35 0.00 0.00 41.96 39.79 2bbq s TYR 164 CO 0.09 -0.70 0.30 -1.14 -1.34 0.00 0.00 175.55 172.77 2bbq s GLN 165 N 1.48 3.19 0.45 4.97 0.74 0.68 -2.45 119.66 128.72 2bbq s GLN 165 Ca 0.00 -0.83 0.25 0.00 0.05 0.00 0.00 55.36 54.84 2bbq s GLN 165 Cb -0.19 -3.91 0.58 0.00 1.10 0.00 0.00 33.01 30.58 2bbq s GLN 165 CO 0.05 -0.65 1.69 0.07 -0.55 0.00 0.00 175.29 175.90 2bbq h ARG 166 N 8.59 0.00 -2.86 1.67 -0.00 -1.65 0.42 114.38 120.54 2bbq h ARG 166 Ca -0.28 0.00 -0.18 0.00 -0.00 0.00 0.00 59.98 59.52 2bbq h ARG 166 Cb 1.13 0.00 -0.30 0.00 -0.00 0.00 0.00 29.97 30.80 2bbq h ARG 166 CO 0.71 0.00 -0.45 0.45 -0.00 0.00 0.00 179.97 180.67 2bbq s SER 167 N -6.01 -0.14 -0.10 0.08 0.15 -1.25 -1.75 113.70 104.69 2bbq s SER 167 Ca 0.06 0.65 -0.01 0.00 0.70 0.00 0.00 55.95 57.35 2bbq s SER 167 Cb 0.06 0.63 0.03 0.00 -1.71 0.00 0.00 66.02 65.04 2bbq s SER 167 CO 0.64 -0.20 -0.00 0.00 1.20 0.00 0.00 173.24 174.88 2bbq s ASP 169 N 1.92 6.35 0.08 0.00 -1.08 -1.26 -1.29 116.67 121.39 2bbq s ASP 169 Ca 0.04 -0.34 -0.22 0.00 -0.52 0.00 0.00 52.55 51.50 2bbq s ASP 169 Cb -0.13 -2.40 -0.13 0.00 -1.46 0.00 0.00 42.92 38.80 2bbq s ASP 169 CO -0.06 -1.07 1.68 0.58 0.52 0.00 0.00 175.17 176.82 2bbq h VAL 170 N 5.99 1.07 -0.36 1.11 2.07 -1.51 -1.19 116.25 123.43 2bbq h VAL 170 Ca -0.26 -0.20 -0.15 0.00 0.82 0.00 0.00 66.70 66.92 2bbq h VAL 170 Cb 1.08 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 2bbq h VAL 170 CO 1.03 0.06 -0.37 0.15 0.02 0.00 0.00 177.57 178.46 2bbq h PHE 171 N 0.02 1.02 0.00 1.57 3.57 -1.93 -3.35 116.94 117.84 2bbq h PHE 171 Ca 0.02 -0.29 -0.33 0.00 3.53 0.00 0.00 57.97 60.89 2bbq h PHE 171 Cb 0.07 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.54 2bbq h PHE 171 CO -0.05 1.09 -2.13 -0.11 -2.23 0.00 0.00 178.31 174.88 2bbq n LEU 172 N -4.06 1.68 0.07 0.59 7.94 -1.17 -4.72 117.00 117.34 2bbq n LEU 172 Ca -0.02 0.19 -0.22 0.00 -1.11 0.00 0.00 56.01 54.85 2bbq n LEU 172 Cb 0.53 -0.61 -0.15 0.00 0.53 0.00 0.00 43.42 43.72 2bbq n LEU 172 CO 0.47 0.49 -0.20 1.23 -1.11 0.00 0.00 177.39 178.28 2bbq h GLY 173 N -0.38 0.42 0.60 -3.96 0.00 -1.48 -3.40 103.07 94.88 2bbq h GLY 173 Ca -0.50 -1.07 0.10 0.00 0.00 0.00 0.00 47.33 45.86 2bbq h GLY 173 CO -0.27 0.93 0.64 -2.00 0.00 0.00 0.00 176.54 175.84 2bbq h LEU 174 N -0.17 0.97 -0.79 3.11 5.85 -1.44 -0.84 115.31 122.00 2bbq h LEU 174 Ca -0.23 0.03 0.15 0.00 0.84 0.00 0.00 57.88 58.67 2bbq h LEU 174 Cb 1.86 -0.17 -0.10 0.00 0.37 0.00 0.00 40.66 42.62 2bbq h LEU 174 CO 0.17 0.56 0.33 -0.65 -0.34 0.00 0.00 178.44 178.51 2bbq h PRO 175 N 1.06 0.44 -0.10 5.25 0.11 -1.77 -2.34 132.00 134.66 2bbq h PRO 175 Ca 0.46 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.48 2bbq h PRO 175 Cb 0.35 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.36 2bbq h PRO 175 CO -0.22 0.29 -0.22 0.74 -0.21 0.00 0.00 178.00 178.38 2bbq h PHE 176 N 0.46 0.41 -0.80 0.65 -1.00 -1.41 -3.02 116.94 112.24 2bbq h PHE 176 Ca 0.44 -0.15 -0.00 0.00 2.81 0.00 0.00 57.97 61.06 2bbq h PHE 176 Cb 0.69 -0.07 -0.04 0.00 3.61 0.00 0.00 35.95 40.14 2bbq h PHE 176 CO -0.16 0.83 0.49 -0.91 -1.61 0.00 0.00 178.31 176.95 2bbq h ASN 177 N -0.13 0.95 0.59 2.17 -0.26 -1.12 -2.07 115.58 115.72 2bbq h ASN 177 Ca -0.00 -0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 55.65 2bbq h ASN 177 Cb 0.82 -0.24 0.01 0.00 -1.06 0.00 0.00 38.32 37.85 2bbq h ASN 177 CO 0.05 0.73 -0.29 0.40 -1.06 0.00 0.00 177.43 177.26 2bbq h ILE 178 N 1.09 0.41 -0.15 2.81 2.04 -1.48 -2.74 117.51 119.48 2bbq h ILE 178 Ca 0.29 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 66.09 2bbq h ILE 178 Cb -0.05 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 2bbq h ILE 178 CO -0.05 0.01 -0.01 0.00 0.00 0.00 0.00 178.15 178.09 2bbq h ALA 179 N -0.42 1.70 0.06 1.87 0.00 -1.50 -1.50 119.26 119.47 2bbq h ALA 179 Ca -0.08 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2bbq h ALA 179 Cb 0.62 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2bbq h ALA 179 CO 0.13 0.23 -0.03 1.03 0.00 0.00 0.00 179.25 180.61 2bbq h SER 180 N 0.22 -0.06 0.91 0.00 0.87 -1.29 -0.78 113.55 113.41 2bbq h SER 180 Ca 0.05 -0.15 -0.10 0.00 -1.23 0.00 0.00 61.79 60.36 2bbq h SER 180 Cb 0.17 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 2bbq h SER 180 CO 0.00 0.11 -0.50 1.88 -0.53 0.00 0.00 176.83 177.80 2bbq h TYR 181 N -0.24 0.00 0.06 2.24 0.05 -1.21 -0.62 116.97 117.25 2bbq h TYR 181 Ca -0.01 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 2bbq h TYR 181 Cb 0.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.95 2bbq h TYR 181 CO -0.02 0.50 -0.03 0.00 -1.05 0.00 0.00 178.16 177.56 2bbq h ALA 182 N 1.50 -0.07 -0.19 3.88 0.00 -1.11 -2.23 119.26 121.04 2bbq h ALA 182 Ca -0.00 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2bbq h ALA 182 Cb 1.09 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 2bbq h ALA 182 CO 0.06 -0.46 -0.14 1.25 0.00 0.00 0.00 179.25 179.97 2bbq h LEU 183 N -0.25 -0.45 -0.69 0.00 6.46 -0.82 -2.19 115.31 117.37 2bbq h LEU 183 Ca -0.01 0.09 0.12 0.00 -0.12 0.00 0.00 57.88 57.97 2bbq h LEU 183 Cb 0.22 0.23 -0.09 0.00 -0.73 0.00 0.00 40.66 40.29 2bbq h LEU 183 CO 0.01 -0.18 0.25 0.25 -0.62 0.00 0.00 178.44 178.15 2bbq h LEU 184 N -0.14 0.22 -1.04 2.25 5.85 -0.95 0.68 115.31 122.18 2bbq h LEU 184 Ca 0.11 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.98 2bbq h LEU 184 Cb 0.31 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 2bbq h LEU 184 CO -0.28 0.10 0.64 0.58 -0.34 0.00 0.00 178.44 179.15 2bbq h VAL 185 N 0.41 1.15 -0.61 1.05 2.07 -0.93 0.04 116.25 119.43 2bbq h VAL 185 Ca 0.36 -0.42 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 2bbq h VAL 185 Cb 0.52 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 2bbq h VAL 185 CO -0.37 0.22 0.10 0.45 0.02 0.00 0.00 177.57 177.99 2bbq h HIS 186 N 1.22 1.07 -0.11 1.57 3.86 -0.29 0.25 115.15 122.71 2bbq h HIS 186 Ca 0.40 -0.15 -0.07 0.00 -1.16 0.00 0.00 60.37 59.40 2bbq h HIS 186 Cb 0.04 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.22 2bbq h HIS 186 CO -0.00 0.92 -0.19 0.52 0.86 0.00 0.00 177.93 180.04 2bbq h MET 187 N 0.91 0.32 -0.48 2.45 2.07 -0.88 -1.00 114.93 118.33 2bbq h MET 187 Ca 0.19 -0.20 0.03 0.00 -2.07 0.00 0.00 59.70 57.65 2bbq h MET 187 Cb 0.42 0.02 -0.04 0.00 -1.87 0.00 0.00 31.60 30.14 2bbq h MET 187 CO 0.01 0.78 0.26 0.52 1.07 0.00 0.00 176.91 179.55 2bbq h MET 188 N -0.11 0.50 -0.21 1.72 2.86 -0.94 -1.37 114.93 117.38 2bbq h MET 188 Ca 0.01 -0.03 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 2bbq h MET 188 Cb 0.76 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.30 2bbq h MET 188 CO 0.04 0.33 -0.34 0.00 1.06 0.00 0.00 176.91 178.00 2bbq h ALA 189 N 1.24 1.02 -0.24 6.32 0.00 -0.39 -2.34 119.26 124.88 2bbq h ALA 189 Ca 0.21 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 2bbq h ALA 189 Cb 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2bbq h ALA 189 CO -0.13 0.59 -0.17 0.37 0.00 0.00 0.00 179.25 179.92 2bbq h GLN 190 N 0.38 0.54 0.00 0.00 4.15 -0.94 -1.96 115.11 117.28 2bbq h GLN 190 Ca 0.04 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.20 2bbq h GLN 190 Cb 0.78 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.47 2bbq h GLN 190 CO 0.06 0.83 0.00 1.04 -1.93 0.00 0.00 178.83 178.83 2bbq n GLN 191 N -4.43 0.19 -0.10 1.69 1.13 -0.54 -3.35 117.38 111.97 2bbq n GLN 191 Ca -0.04 0.47 0.03 0.00 -1.94 0.00 0.00 57.00 55.52 2bbq n GLN 191 Cb 0.39 -1.90 0.08 0.00 0.11 0.00 0.00 30.24 28.92 2bbq n GLN 191 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2bbq n ASP 193 N -0.16 -4.22 -4.28 0.00 8.00 -0.82 -4.96 116.55 110.11 2bbq n ASP 193 Ca 0.07 -1.19 -0.18 0.00 0.71 0.00 0.00 54.79 54.19 2bbq n ASP 193 Cb 0.37 -2.32 -0.11 0.00 -0.02 0.00 0.00 41.12 39.04 2bbq n ASP 193 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2bbq s LEU 194 N -7.10 2.46 0.67 0.64 1.43 -0.80 -5.07 118.68 110.90 2bbq s LEU 194 Ca 0.45 -0.89 -0.08 0.00 -1.03 0.00 0.00 54.13 52.58 2bbq s LEU 194 Cb -0.22 -0.61 0.02 0.00 0.03 0.00 0.00 46.19 45.41 2bbq s LEU 194 CO 0.93 -0.15 1.01 -1.61 0.23 0.00 0.00 176.35 176.76 2bbq s GLU 195 N -3.02 2.70 0.07 1.70 0.41 -0.34 -4.51 118.70 115.71 2bbq s GLU 195 Ca 0.14 0.12 -0.06 0.00 -0.41 0.00 0.00 54.97 54.76 2bbq s GLU 195 Cb -0.03 -2.14 -0.05 0.00 -1.78 0.00 0.00 34.13 30.12 2bbq s GLU 195 CO 0.04 -0.98 0.32 0.14 -0.49 0.00 0.00 175.26 174.30 2bbq s VAL 196 N -3.21 5.22 0.00 2.63 -7.23 -1.26 -0.94 120.40 115.61 2bbq s VAL 196 Ca 0.57 0.15 0.00 0.00 -1.81 0.00 0.00 61.98 60.89 2bbq s VAL 196 Cb -0.11 -3.61 0.00 0.00 0.56 0.00 0.00 36.38 33.23 2bbq s VAL 196 CO 0.48 0.24 0.00 0.61 -0.31 0.00 0.00 175.10 176.11 2bbq n GLY 197 N 0.71 1.49 3.64 2.32 0.00 0.09 -4.61 105.19 108.84 2bbq n GLY 197 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 2bbq n GLY 197 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bbq s ASP 198 N 0.85 4.74 -0.29 1.61 1.01 -1.26 -2.15 116.67 121.18 2bbq s ASP 198 Ca 0.00 -0.32 -0.06 0.00 0.71 0.00 0.00 52.55 52.88 2bbq s ASP 198 Cb 0.00 -1.02 0.01 0.00 1.01 0.00 0.00 42.92 42.93 2bbq s ASP 198 CO 0.00 0.14 0.06 0.12 0.21 0.00 0.00 175.17 175.70 2bbq s PHE 199 N -1.44 3.14 -0.22 4.23 5.36 -0.21 -1.73 117.98 127.11 2bbq s PHE 199 Ca 0.25 -1.11 -0.08 0.00 -0.96 0.00 0.00 56.93 55.03 2bbq s PHE 199 Cb -0.11 -2.22 -0.04 0.00 -0.34 0.00 0.00 43.02 40.32 2bbq s PHE 199 CO 0.17 -0.61 0.10 0.08 -1.46 0.00 0.00 175.22 173.50 2bbq s VAL 200 N 1.46 4.82 -0.23 3.12 1.01 -0.37 -1.30 120.40 128.90 2bbq s VAL 200 Ca 0.02 -0.01 -0.07 0.00 0.00 0.00 0.00 61.98 61.92 2bbq s VAL 200 Cb -0.17 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 2bbq s VAL 200 CO 0.01 0.38 0.06 0.86 0.00 0.00 0.00 175.10 176.41 2bbq s TRP 201 N 1.00 3.09 -0.05 5.22 -0.00 -0.26 -1.79 118.94 126.15 2bbq s TRP 201 Ca 0.05 -0.39 0.06 0.00 -0.00 0.00 0.00 56.10 55.83 2bbq s TRP 201 Cb -0.14 -2.20 -0.01 0.00 -0.00 0.00 0.00 33.47 31.12 2bbq s TRP 201 CO 0.03 -0.29 -0.24 0.99 -0.00 0.00 0.00 176.95 177.43 2bbq s THR 202 N 1.40 2.12 0.21 5.86 2.01 -0.35 -1.67 115.64 125.22 2bbq s THR 202 Ca 0.05 -1.05 0.11 0.00 0.31 0.00 0.00 61.69 61.11 2bbq s THR 202 Cb -0.15 -1.76 -0.05 0.00 0.01 0.00 0.00 72.50 70.55 2bbq s THR 202 CO 0.03 0.57 -0.21 -0.83 -0.69 0.00 0.00 174.62 173.49 2bbq s GLY 203 N -0.22 1.74 0.00 4.40 0.00 -0.51 -0.23 107.32 112.51 2bbq s GLY 203 Ca -0.02 -1.67 0.00 0.00 0.00 0.00 0.00 44.72 43.03 2bbq s GLY 203 CO 0.03 -1.71 0.00 0.61 0.00 0.00 0.00 173.10 172.04 2bbq n GLY 204 N 0.05 0.50 3.59 0.20 0.00 0.15 -3.06 105.19 106.61 2bbq n GLY 204 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 2bbq n GLY 204 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bbq s ASP 205 N -1.00 6.30 -0.22 1.61 -1.08 -0.72 -2.01 116.67 119.56 2bbq s ASP 205 Ca 0.00 0.42 -0.07 0.00 -0.52 0.00 0.00 52.55 52.38 2bbq s ASP 205 Cb 0.00 -2.55 -0.03 0.00 -1.46 0.00 0.00 42.92 38.88 2bbq s ASP 205 CO 0.00 -1.54 0.05 -0.89 0.52 0.00 0.00 175.17 173.31 2bbq s THR 206 N 5.50 4.31 0.12 1.71 2.01 -0.48 -1.71 115.64 127.09 2bbq s THR 206 Ca 0.53 -0.18 -0.07 0.00 0.31 0.00 0.00 61.69 62.28 2bbq s THR 206 Cb -0.10 -2.98 -0.02 0.00 0.01 0.00 0.00 72.50 69.41 2bbq s THR 206 CO 0.28 0.38 0.17 -1.38 -0.69 0.00 0.00 174.62 173.39 2bbq s HIS 207 N 1.21 0.40 -0.24 4.92 -3.43 -0.42 -1.82 115.29 115.92 2bbq s HIS 207 Ca 0.04 -0.81 0.01 0.00 -0.80 0.00 0.00 55.06 53.50 2bbq s HIS 207 Cb -0.14 -0.17 0.06 0.00 -1.43 0.00 0.00 32.58 30.90 2bbq s HIS 207 CO 0.03 -0.58 -0.05 -1.17 -2.00 0.00 0.00 174.74 170.97 2bbq s LEU 208 N -2.94 2.71 0.53 5.38 2.96 -0.49 -1.12 118.68 125.71 2bbq s LEU 208 Ca 0.13 -1.24 -0.22 0.00 -0.22 0.00 0.00 54.13 52.57 2bbq s LEU 208 Cb 0.05 -1.22 -0.06 0.00 0.50 0.00 0.00 46.19 45.47 2bbq s LEU 208 CO -0.05 -0.24 1.29 -1.22 -1.32 0.00 0.00 176.35 174.81 2bbq n TYR 209 N 4.64 2.07 -0.33 5.38 4.01 -1.26 -1.25 117.16 130.42 2bbq n TYR 209 Ca -0.11 0.45 0.11 0.00 -0.16 0.00 0.00 57.90 58.18 2bbq n TYR 209 Cb 0.44 -2.34 0.28 0.00 -0.31 0.00 0.00 39.34 37.42 2bbq n TYR 209 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2bbq h SER 210 N 1.44 0.65 -0.21 7.72 0.02 -1.55 -1.63 113.55 119.99 2bbq h SER 210 Ca -0.50 0.10 -0.08 0.00 -0.84 0.00 0.00 61.79 60.47 2bbq h SER 210 Cb 1.31 -0.01 -0.05 0.00 0.14 0.00 0.00 62.40 63.79 2bbq h SER 210 CO 0.57 0.23 0.10 -0.46 -1.14 0.00 0.00 176.83 176.13 2bbq n ASN 211 N -4.83 2.80 0.00 3.07 6.94 -1.26 -3.25 115.26 118.73 2bbq n ASN 211 Ca 0.21 -2.33 0.00 0.00 -0.02 0.00 0.00 54.58 52.44 2bbq n ASN 211 Cb 0.53 -0.57 0.00 0.00 -2.36 0.00 0.00 39.78 37.38 2bbq n ASN 211 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2bbq n HIS 212 N 0.12 0.00 -0.30 -2.53 8.25 -0.61 -4.80 115.22 115.34 2bbq n HIS 212 Ca 0.12 -0.27 -0.02 0.00 -0.26 0.00 0.00 57.72 57.29 2bbq n HIS 212 Cb 0.67 -0.03 0.10 0.00 1.12 0.00 0.00 29.99 31.86 2bbq n HIS 212 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 2bbq h MET 213 N 0.00 1.00 -0.18 -0.41 2.86 -1.70 -0.49 114.93 116.01 2bbq h MET 213 Ca 0.00 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 2bbq h MET 213 Cb 0.46 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 2bbq h MET 213 CO 0.00 0.66 -0.05 -0.44 1.06 0.00 0.00 176.91 178.14 2bbq h ASP 214 N 1.03 0.36 -0.37 1.22 3.32 -1.88 -1.17 116.42 118.93 2bbq h ASP 214 Ca 0.33 -0.38 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 2bbq h ASP 214 Cb 0.00 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 2bbq h ASP 214 CO -0.11 0.66 0.13 1.56 -1.72 0.00 0.00 179.24 179.76 2bbq h GLN 215 N 0.07 0.63 0.16 3.56 7.50 -1.85 0.13 115.11 125.31 2bbq h GLN 215 Ca 0.05 -0.10 -0.01 0.00 0.50 0.00 0.00 58.65 59.09 2bbq h GLN 215 Cb 0.50 -0.11 0.00 0.00 0.05 0.00 0.00 27.48 27.92 2bbq h GLN 215 CO 0.02 0.55 -0.08 1.15 -1.50 0.00 0.00 178.83 178.98 2bbq h THR 216 N 0.62 0.97 -0.99 -0.54 2.02 -1.00 -0.03 112.91 113.96 2bbq h THR 216 Ca 0.15 -0.70 0.09 0.00 0.77 0.00 0.00 66.41 66.71 2bbq h THR 216 Cb 0.19 1.39 -0.07 0.00 -1.74 0.00 0.00 68.15 67.91 2bbq h THR 216 CO -0.01 0.16 0.63 0.45 0.37 0.00 0.00 175.52 177.12 2bbq h HIS 217 N -0.57 1.15 -0.51 3.16 3.86 -0.71 0.20 115.15 121.73 2bbq h HIS 217 Ca -0.02 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.15 2bbq h HIS 217 Cb 0.43 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 28.51 2bbq h HIS 217 CO 0.03 0.54 0.04 1.25 0.86 0.00 0.00 177.93 180.65 2bbq h LEU 218 N 1.08 0.85 -0.79 2.43 5.85 -0.71 -2.81 115.31 121.22 2bbq h LEU 218 Ca 0.45 -0.29 -0.12 0.00 0.84 0.00 0.00 57.88 58.76 2bbq h LEU 218 Cb 0.29 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2bbq h LEU 218 CO -0.21 0.93 -0.58 -0.61 -0.34 0.00 0.00 178.44 177.63 2bbq h GLN 219 N 0.75 0.00 0.00 1.25 4.15 0.11 -3.18 115.11 118.19 2bbq h GLN 219 Ca 0.15 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.57 2bbq h GLN 219 Cb 0.47 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.16 2bbq h GLN 219 CO 0.02 0.58 0.00 -0.11 -1.93 0.00 0.00 178.83 177.39 2bbq n LEU 220 N -3.76 0.00 -0.97 -2.39 7.94 0.48 -2.58 117.00 115.72 2bbq n LEU 220 Ca -0.01 0.26 0.08 0.00 -1.11 0.00 0.00 56.01 55.22 2bbq n LEU 220 Cb 0.60 -0.26 0.24 0.00 0.53 0.00 0.00 43.42 44.53 2bbq n LEU 220 CO 0.41 -0.07 0.70 -1.54 -1.11 0.00 0.00 177.39 175.79 2bbq n SER 221 N -1.26 3.70 -4.94 1.96 3.41 -1.20 -5.00 113.62 110.29 2bbq n SER 221 Ca 0.11 -2.42 -0.27 0.00 -0.26 0.00 0.00 58.87 56.03 2bbq n SER 221 Cb 0.17 -0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 2bbq n SER 221 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2bbq s ARG 222 N -1.76 3.45 -0.14 4.33 1.81 -1.07 -5.09 118.95 120.48 2bbq s ARG 222 Ca 0.36 -0.54 -0.17 0.00 -1.72 0.00 0.00 55.73 53.67 2bbq s ARG 222 Cb 0.24 -2.97 -0.04 0.00 -0.45 0.00 0.00 34.95 31.73 2bbq s ARG 222 CO 0.16 0.53 0.42 -1.21 -0.68 0.00 0.00 175.30 174.52 2bbq s GLU 223 N -3.09 4.29 0.38 3.54 0.41 -1.26 -5.03 118.70 117.93 2bbq s GLU 223 Ca 0.35 0.32 -0.27 0.00 -0.41 0.00 0.00 54.97 54.96 2bbq s GLU 223 Cb -0.11 -3.45 -0.10 0.00 -1.78 0.00 0.00 34.13 28.69 2bbq s GLU 223 CO 0.28 0.15 1.38 -1.25 -0.49 0.00 0.00 175.26 175.33 2bbq s PRO 224 N 0.70 4.10 0.50 0.39 0.04 -1.26 -4.79 135.00 134.68 2bbq s PRO 224 Ca 0.22 2.34 0.01 0.00 0.04 0.00 0.00 61.00 63.62 2bbq s PRO 224 Cb -0.14 -2.91 0.02 0.00 0.04 0.00 0.00 34.50 31.50 2bbq s PRO 224 CO 0.08 -0.45 0.72 1.03 0.04 0.00 0.00 177.00 178.42 2bbq s ARG 225 N -2.08 2.77 0.20 4.56 3.00 -1.26 -5.04 118.95 121.10 2bbq s ARG 225 Ca 0.54 -0.67 -0.28 0.00 0.00 0.00 0.00 55.73 55.31 2bbq s ARG 225 Cb -0.42 -2.53 -0.17 0.00 0.00 0.00 0.00 34.95 31.84 2bbq s ARG 225 CO 0.56 -0.51 0.57 -2.30 0.00 0.00 0.00 175.30 173.62 2bbq n PRO 226 N -2.22 0.12 -2.58 3.54 -0.02 -1.26 -4.92 135.00 127.66 2bbq n PRO 226 Ca 0.05 0.04 -0.40 0.00 -2.02 0.00 0.00 63.50 61.17 2bbq n PRO 226 Cb 0.59 -1.09 -0.05 0.00 -0.02 0.00 0.00 33.50 32.93 2bbq n PRO 226 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2bbq s LEU 227 N 2.72 4.58 0.00 2.45 1.02 -1.26 -4.74 118.68 123.46 2bbq s LEU 227 Ca 0.64 2.13 -0.11 0.00 0.02 0.00 0.00 54.13 56.81 2bbq s LEU 227 Cb -0.91 -3.62 0.17 0.00 0.02 0.00 0.00 46.19 41.85 2bbq s LEU 227 CO 0.56 -0.03 0.39 -0.81 0.02 0.00 0.00 176.35 176.48 2bbq n PRO 228 N 1.41 -3.18 -4.01 1.29 -0.04 -1.26 -4.73 135.00 124.48 2bbq n PRO 228 Ca -0.01 -0.66 -0.13 0.00 -0.04 0.00 0.00 63.50 62.66 2bbq n PRO 228 Cb 0.46 -0.87 -0.13 0.00 -0.04 0.00 0.00 33.50 32.91 2bbq n PRO 228 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2bbq s LYS 229 N -3.86 0.28 -0.18 0.54 2.47 -0.64 -1.54 119.74 116.80 2bbq s LYS 229 Ca 0.30 -0.29 -0.06 0.00 -1.56 0.00 0.00 55.97 54.36 2bbq s LYS 229 Cb -0.05 -0.16 -0.03 0.00 -1.46 0.00 0.00 37.83 36.13 2bbq s LYS 229 CO 0.25 0.04 0.02 -1.17 0.16 0.00 0.00 175.35 174.65 2bbq s LEU 230 N -0.56 3.51 -0.19 5.43 1.98 -1.26 -1.78 118.68 125.81 2bbq s LEU 230 Ca -0.04 -0.06 -0.03 0.00 -2.89 0.00 0.00 54.13 51.12 2bbq s LEU 230 Cb -0.04 -1.88 -0.01 0.00 0.66 0.00 0.00 46.19 44.92 2bbq s LEU 230 CO -0.00 0.13 -0.07 -0.63 -1.89 0.00 0.00 176.35 173.89 2bbq s ILE 231 N 0.60 3.28 -0.28 6.68 -1.09 -0.28 -4.96 121.20 125.15 2bbq s ILE 231 Ca 0.01 -0.54 -0.08 0.00 -2.23 0.00 0.00 60.65 57.81 2bbq s ILE 231 Cb -0.14 -2.46 -0.01 0.00 -1.58 0.00 0.00 42.46 38.28 2bbq s ILE 231 CO 0.02 0.46 0.09 -0.63 -1.23 0.00 0.00 174.94 173.65 2bbq s ILE 232 N 1.10 4.21 0.12 2.92 1.01 -1.26 -0.60 121.20 128.70 2bbq s ILE 232 Ca 0.01 -0.43 -0.12 0.00 0.00 0.00 0.00 60.65 60.11 2bbq s ILE 232 Cb -0.15 -3.08 -0.10 0.00 0.01 0.00 0.00 42.46 39.15 2bbq s ILE 232 CO -0.01 0.19 1.39 0.11 0.00 0.00 0.00 174.94 176.62 2bbq h LYS 233 N 8.26 0.86 -5.32 2.79 1.57 -1.18 -3.46 116.57 120.10 2bbq h LYS 233 Ca -0.35 -0.55 -0.39 0.00 -1.87 0.00 0.00 60.65 57.50 2bbq h LYS 233 Cb 1.15 0.07 -0.16 0.00 0.08 0.00 0.00 32.23 33.37 2bbq h LYS 233 CO 0.60 1.18 -0.73 -0.98 -0.57 0.00 0.00 179.45 178.95 2bbq s ARG 234 N -4.11 1.13 -0.47 3.15 1.70 -1.26 -5.10 118.95 113.98 2bbq s ARG 234 Ca -0.11 -1.43 -0.16 0.00 -0.47 0.00 0.00 55.73 53.55 2bbq s ARG 234 Cb 0.10 -0.85 0.06 0.00 -0.57 0.00 0.00 34.95 33.68 2bbq s ARG 234 CO 0.89 0.14 0.44 0.21 -1.08 0.00 0.00 175.30 175.89 2bbq s LYS 235 N -3.41 3.02 1.01 3.89 2.20 -1.26 -5.07 119.74 120.11 2bbq s LYS 235 Ca 0.16 -1.17 -0.12 0.00 -0.36 0.00 0.00 55.97 54.49 2bbq s LYS 235 Cb -0.01 -4.10 0.16 0.00 -1.51 0.00 0.00 37.83 32.38 2bbq s LYS 235 CO 0.03 -1.03 0.89 -2.30 -0.36 0.00 0.00 175.35 172.59 2bbq n PRO 236 N 5.44 -1.04 0.09 4.03 -0.02 -1.26 -4.95 135.00 137.29 2bbq n PRO 236 Ca -0.11 -0.25 0.13 0.00 -2.02 0.00 0.00 63.50 61.25 2bbq n PRO 236 Cb 0.45 -2.18 0.45 0.00 -0.02 0.00 0.00 33.50 32.20 2bbq n PRO 236 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2bbq n GLU 237 N -3.81 0.20 -3.77 -0.52 -0.58 -1.26 -4.84 120.64 106.06 2bbq n GLU 237 Ca 0.08 0.24 -0.09 0.00 -0.42 0.00 0.00 57.16 56.97 2bbq n GLU 237 Cb 0.54 -1.77 -0.03 0.00 -0.57 0.00 0.00 31.44 29.60 2bbq n GLU 237 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2bbq s SER 238 N -4.22 -0.27 0.44 1.62 1.04 -1.26 -5.00 113.70 106.05 2bbq s SER 238 Ca 0.09 -0.53 0.29 0.00 0.48 0.00 0.00 55.95 56.29 2bbq s SER 238 Cb 0.12 0.62 1.58 0.00 0.10 0.00 0.00 66.02 68.45 2bbq s SER 238 CO 0.53 -1.14 1.89 -0.29 0.98 0.00 0.00 173.24 175.20 2bbq h ILE 239 N 2.13 0.00 -0.00 -1.02 6.09 -1.94 -1.05 117.51 121.72 2bbq h ILE 239 Ca -0.26 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.23 2bbq h ILE 239 Cb 1.26 0.65 0.00 0.00 0.47 0.00 0.00 36.82 39.20 2bbq h ILE 239 CO 0.33 0.00 -0.30 0.49 -3.07 0.00 0.00 178.15 175.60 2bbq n PHE 240 N -2.53 0.00 -1.29 2.19 3.72 -1.26 -4.23 117.46 114.06 2bbq n PHE 240 Ca -0.02 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.30 2bbq n PHE 240 Cb 0.06 -0.17 0.22 0.00 -0.94 0.00 0.00 39.48 38.65 2bbq n PHE 240 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2bbq n ASP 241 N -0.94 3.28 -4.91 4.37 8.00 -0.40 -5.00 116.55 120.95 2bbq n ASP 241 Ca 0.11 -3.57 -0.27 0.00 0.71 0.00 0.00 54.79 51.77 2bbq n ASP 241 Cb 0.34 -0.69 0.02 0.00 -0.02 0.00 0.00 41.12 40.77 2bbq n ASP 241 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2bbq s TYR 242 N -3.18 3.35 0.06 1.24 1.51 -1.26 -4.78 117.35 114.28 2bbq s TYR 242 Ca 0.49 0.71 -0.04 0.00 -1.01 0.00 0.00 57.07 57.22 2bbq s TYR 242 Cb 0.42 -2.62 -0.02 0.00 -0.11 0.00 0.00 41.96 39.63 2bbq s TYR 242 CO 0.05 -0.67 0.06 1.03 -1.11 0.00 0.00 175.55 174.91 2bbq s ARG 243 N -4.93 0.66 0.19 -0.62 1.81 -1.26 -5.05 118.95 109.75 2bbq s ARG 243 Ca 0.52 -1.02 -0.15 0.00 -1.72 0.00 0.00 55.73 53.36 2bbq s ARG 243 Cb -0.10 0.25 0.17 0.00 -0.45 0.00 0.00 34.95 34.81 2bbq s ARG 243 CO 0.45 -0.16 1.64 0.35 -0.68 0.00 0.00 175.30 176.90 2bbq h PHE 244 N 3.20 -0.31 0.00 -0.53 3.57 -1.98 -1.48 116.94 119.41 2bbq h PHE 244 Ca -0.34 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.21 2bbq h PHE 244 Cb 1.17 0.22 0.00 0.00 2.79 0.00 0.00 35.95 40.13 2bbq h PHE 244 CO 0.51 -0.24 0.00 -0.85 -2.23 0.00 0.00 178.31 175.50 2bbq n GLU 245 N -5.38 0.23 0.06 1.11 0.00 -1.26 -2.79 120.64 112.61 2bbq n GLU 245 Ca 0.05 0.09 0.13 0.00 0.00 0.00 0.00 57.16 57.42 2bbq n GLU 245 Cb 0.28 -1.50 0.49 0.00 0.00 0.00 0.00 31.44 30.71 2bbq n GLU 245 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2bbq n ASP 246 N -1.12 0.40 -4.37 -1.84 8.00 -0.56 -4.89 116.55 112.17 2bbq n ASP 246 Ca 0.06 0.55 -0.30 0.00 0.71 0.00 0.00 54.79 55.81 2bbq n ASP 246 Cb 0.05 -0.65 -0.14 0.00 -0.02 0.00 0.00 41.12 40.36 2bbq n ASP 246 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2bbq s PHE 247 N -3.08 2.36 0.04 1.24 0.08 -1.12 -0.56 117.98 116.94 2bbq s PHE 247 Ca 0.11 -0.38 0.03 0.00 0.12 0.00 0.00 56.93 56.80 2bbq s PHE 247 Cb 0.14 -1.40 -0.02 0.00 -0.57 0.00 0.00 43.02 41.17 2bbq s PHE 247 CO 0.51 0.15 -0.09 -1.21 -0.10 0.00 0.00 175.22 174.48 2bbq s GLU 248 N -1.30 0.64 -0.26 0.44 0.41 0.23 -4.97 118.70 113.89 2bbq s GLU 248 Ca 0.12 -0.67 -0.00 0.00 -0.41 0.00 0.00 54.97 54.01 2bbq s GLU 248 Cb -0.10 -0.53 0.08 0.00 -1.78 0.00 0.00 34.13 31.80 2bbq s GLU 248 CO 0.03 0.12 0.02 -1.50 -0.49 0.00 0.00 175.26 173.44 2bbq s ILE 249 N -1.00 1.17 -0.16 -1.63 1.10 -1.26 -1.13 121.20 118.29 2bbq s ILE 249 Ca -0.04 -1.23 -0.07 0.00 -0.51 0.00 0.00 60.65 58.80 2bbq s ILE 249 Cb -0.08 -1.66 -0.04 0.00 0.15 0.00 0.00 42.46 40.83 2bbq s ILE 249 CO 0.01 -0.34 0.07 -0.70 -2.11 0.00 0.00 174.94 171.87 2bbq s GLU 250 N 1.52 3.81 0.00 3.50 2.12 -0.73 -4.39 118.70 124.52 2bbq s GLU 250 Ca 0.01 -0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.04 2bbq s GLU 250 Cb -0.18 -3.18 0.00 0.00 0.26 0.00 0.00 34.13 31.03 2bbq s GLU 250 CO -0.12 0.40 0.00 0.41 -0.54 0.00 0.00 175.26 175.41 2bbq n GLY 251 N 3.14 0.78 3.48 -1.50 0.00 -1.26 -1.62 105.19 108.20 2bbq n GLY 251 Ca -0.17 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 2bbq n GLY 251 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2bbq s TYR 252 N -2.00 2.95 -0.56 1.61 5.04 -1.26 -4.25 117.35 118.89 2bbq s TYR 252 Ca 0.00 -0.30 0.04 0.00 -2.44 0.00 0.00 57.07 54.37 2bbq s TYR 252 Cb 0.00 -3.73 0.14 0.00 0.35 0.00 0.00 41.96 38.73 2bbq s TYR 252 CO 0.00 -1.14 0.33 0.34 -1.34 0.00 0.00 175.55 173.74 2bbq s ASP 253 N 2.69 4.26 0.52 4.32 2.15 -1.26 -5.07 116.67 124.28 2bbq s ASP 253 Ca 0.21 -3.21 -0.06 0.00 0.43 0.00 0.00 52.55 49.92 2bbq s ASP 253 Cb -0.16 -1.50 -0.03 0.00 -0.30 0.00 0.00 42.92 40.93 2bbq s ASP 253 CO 0.15 -0.19 0.84 -2.16 -0.17 0.00 0.00 175.17 173.65 2bbq s PRO 254 N -0.54 3.43 0.62 4.34 0.04 -1.26 -4.86 135.00 136.77 2bbq s PRO 254 Ca 0.20 0.24 -0.16 0.00 0.04 0.00 0.00 61.00 61.32 2bbq s PRO 254 Cb -0.18 -2.31 -0.02 0.00 0.04 0.00 0.00 34.50 32.03 2bbq s PRO 254 CO -0.06 -0.36 1.11 -1.01 0.04 0.00 0.00 177.00 176.73 2bbq s HIS 255 N -2.85 2.67 0.82 0.56 3.76 0.22 -4.85 115.29 115.62 2bbq s HIS 255 Ca 0.50 1.55 -0.15 0.00 -0.15 0.00 0.00 55.06 56.80 2bbq s HIS 255 Cb -0.10 -3.18 -0.02 0.00 1.11 0.00 0.00 32.58 30.39 2bbq s HIS 255 CO 0.46 -1.59 0.43 -0.35 -0.85 0.00 0.00 174.74 172.84 2bbq n PRO 256 N -2.09 0.07 -0.21 8.40 -0.04 -1.26 -0.82 135.00 139.06 2bbq n PRO 256 Ca 0.10 0.07 -0.05 0.00 -0.04 0.00 0.00 63.50 63.58 2bbq n PRO 256 Cb 0.52 -1.80 -0.05 0.00 -0.04 0.00 0.00 33.50 32.12 2bbq n PRO 256 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bbq n GLY 257 N 1.67 -1.80 2.35 0.55 0.00 -1.26 -3.46 105.19 103.24 2bbq n GLY 257 Ca 0.08 0.68 -0.04 0.00 0.00 0.00 0.00 46.02 46.74 2bbq n GLY 257 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2bbq n ILE 258 N -4.27-11.03 -3.18 -0.61 5.41 -1.26 -4.14 119.36 100.28 2bbq n ILE 258 Ca 0.01 2.28 -0.39 0.00 1.00 0.00 0.00 62.75 65.65 2bbq n ILE 258 Cb 0.13 -5.93 -0.05 0.00 -0.71 0.00 0.00 39.64 33.07 2bbq n ILE 258 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2bbq s LYS 259 N -0.75 4.34 -0.05 0.38 2.36 -1.26 -5.04 119.74 119.72 2bbq s LYS 259 Ca -0.22 0.74 -0.13 0.00 -2.55 0.00 0.00 55.97 53.81 2bbq s LYS 259 Cb 0.01 -3.37 0.02 0.00 -1.05 0.00 0.00 37.83 33.45 2bbq s LYS 259 CO 0.60 0.29 0.30 0.00 1.55 0.00 0.00 175.35 178.08 2bbq s ALA 260 N 0.08 -0.74 0.30 3.13 0.00 -1.26 -5.01 121.76 118.25 2bbq s ALA 260 Ca 0.32 0.47 -0.28 0.00 0.00 0.00 0.00 51.96 52.47 2bbq s ALA 260 Cb -0.18 -0.12 -0.09 0.00 0.00 0.00 0.00 23.12 22.73 2bbq s ALA 260 CO 0.17 -0.22 0.98 -1.25 0.00 0.00 0.00 175.76 175.44 2bbq s PRO 261 N -0.84 4.64 -0.17 0.00 0.04 -1.26 -5.05 135.00 132.36 2bbq s PRO 261 Ca -0.09 1.49 -0.07 0.00 0.04 0.00 0.00 61.00 62.37 2bbq s PRO 261 Cb -0.04 -3.01 -0.04 0.00 0.04 0.00 0.00 34.50 31.45 2bbq s PRO 261 CO 0.03 0.30 0.08 0.54 0.04 0.00 0.00 177.00 177.99 2bbq s VAL 262 N -1.39 4.94 -0.13 -0.36 0.11 -1.26 -5.00 120.40 117.31 2bbq s VAL 262 Ca 0.47 0.02 -0.29 0.00 -2.93 0.00 0.00 61.98 59.25 2bbq s VAL 262 Cb -0.24 -3.21 -0.01 0.00 -1.53 0.00 0.00 36.38 31.39 2bbq s VAL 262 CO 0.30 0.50 0.99 0.00 -3.33 0.00 0.00 175.10 173.55 2bbq s ALA 263 N 0.04 3.47 -2.88 1.54 0.00 -1.26 -5.22 121.76 117.44 2bbq s ALA 263 Ca 0.07 0.30 0.25 0.00 0.00 0.00 0.00 51.96 52.57 2bbq s ALA 263 Cb -0.12 -3.42 0.40 0.00 0.00 0.00 0.00 23.12 19.97 2bbq s ALA 263 CO 0.00 -0.68 1.38 -0.89 0.00 0.00 0.00 175.76 175.57